A0A087YIG3_POEFO Loading...

Kinesin family member 11

AlphaFold DB , UniProt , Accession A0A087YIG3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,048 aa.

						>A0A087YIG3_POEFO|A0A087YIG3
MASTNGTGGRREEKGRNIQVVVRCRPFNTMEHRASYGVIDCDQSRKEVLVRTGGVNDKSSRKTYTFDMVFGPAAKQIDVYRSVVCPILDEVIMGYNCTVFAYGQTGTGKTFTMEGERTPNAQFTWEEDPLAGIIPRTLHQIFEKLSENGTEFSVKVSLLEIYNEELFDLLSPTEDVNERLQLFDDPRNKRGVVVKGLEEVVVHNKDEVYQILERGAAKRRTASTLMNAYSSRSHSVFSVTIHMKEITLDGEELVKIGKLNLVDLAGSENIGRSGAVDKRAREAGNINQSLLTLGRVITALVEKRPHVPYRESKLTRILQDSLGGRTKTSIIATVSPSSSNLEETLSTLEYASRAKNIMNKPEVNQKLTKRTLIKEYTEEIERLKRDLAATRDKNGVYLSSENYESMMTQITAQEEQIAMMEEELKKVNDLFLDSKSRLEQCSMDLDEKQQRLEETSRHLEKTKEKLVEEEFICSELSSVHESLYSAAGQLLSAVGESTSDVSGLHAKLDRKTKVEQHNMQMQQSFSQRMDGAFSSMQRSVQQHGAAQARMLTGYAHAVDGLLVGNEATLRGALVAVETLVGGVQALVADGAARCREKVERHEALTREQREALLQLLEEHQQEVQDVLAVRTLPGLTAIRELGDTLQVSMETQRDLANQVEAMKETGVFLSGLVLDLAALRQEARTGLSALQEEQERLQQQIQRAQQQHQQGMNRAIQFLQDQLNLVTMETQQHYSELQAASRTLQGPVEALQQNLSSSRCDAVEQRSSSQAERLLSSSSSLASSLHQAAQQNRVLLEEMSGRCSDLHGAVSGLVDRDAEWTSRTREQAAHRAQDQLVLMEQLAEEAQSLHQGVETRGAERLRAAEADLSGRQEENRRVLTALQEQTGSDRAVLERQRAELQEQVEAGRQLVRSFLRDELQQDVPTGLTPQRREFVYPRVLKKSGSRSELHDKQSQVDQVSSLTVSWFSDPVCLQDSLEDDFSSCSESLAAEPPFVDENLVFNESKRLPFFKQKKGSRKETKVLSRSKMADSEGQASPMKSRLPLRCQN
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.3	Very low	32.7	Very low	244 Å²	244	144.5 Å²	144.5	100%	1.202	86%	0.858	S	S	*	*				0	169.2	0	-80.9	-172.3	170.8	0	0	109.1
2	A	29.8	Very low	33.3	Very low	98 Å²	98	146.8 Å²	146.8	81%	0.81	85%	0.853	S	S	*	*			trans	62.4	89	-177.1	0	0	0	0	0	114.9
3	S	33.5	Very low	34.7	Very low	107 Å²	107	143.8 Å²	143.8	75%	0.748	83%	0.827	S	S	*	*			trans	-89.7	140.5	156.2	171.7	0	0	0	0	108.8
4	T	31.4	Very low	36.3	Very low	133 Å²	133	147.5 Å²	147.5	82%	0.816	83%	0.828	S	S	*	*			trans	-131	93.3	174.9	39.3	0	0	0	0	110.5	G6	T4-G6 PolarHBondContact O-N 3.38Å
5	N	33.6	Very low	38.2	Very low	160 Å²	160	139.8 Å²	139.8	86%	0.856	80%	0.795	S	S	*	*			trans	-63.4	100.1	170.1	-79.9	-12.7	0	0	0	110.3
6	G	28.5	Very low	40.9	Very low	73 Å²	73	139.1 Å²	139.1	75%	0.753	78%	0.775	S	S	*	*			trans	-82.9	119.9	170.9	0	0	0	0	0	111.1	T4	T4-G6 PolarHBondContact O-N 3.38Å
7	T	31.3	Very low	43.5	Very low	142 Å²	142	136.1 Å²	136.1	87%	0.871	76%	0.758	S	S	*	*			trans	-67	143.1	175.8	42.3	0	0	0	0	111.7	G9	T7-G9 VanDerWaalsContact C-N 3.27Å; T7-G9 PolarHBondContact O-N 3.12Å
8	G	34.8	Very low	46.2	Very low	87 Å²	87	128.7 Å²	128.7	90%	0.897	72%	0.716	S	S	*	*			trans	-72.1	62.8	-170.1	0	0	0	0	0	115.8	R10	G8-R10 PolarHBondContact O-N 3.35Å
9	G	28.3	Very low	48.6	Very low	65 Å²	65	124.8 Å²	124.8	67%	0.67	69%	0.692	S	S	*	*			trans	-71.4	112.3	167.8	0	0	0	0	0	111.1	T7 R11	T7-G9 VanDerWaalsContact C-N 3.27Å; T7-G9 PolarHBondContact O-N 3.12Å; G9-R11 PolarHBondContact O-N 3.21Å
10	R	38.1	Very low	50.9	Low	247 Å²	247	118.6 Å²	118.6	93%	0.932	66%	0.657	S	S	*	*			trans	-61.5	99.1	168.5	-73.4	-176	179.4	175.2	0.1	109.3	G8 E12	G8-R10 PolarHBondContact O-N 3.35Å; R10-E12 PolarHBondContact O-N 3.46Å
11	R	37	Very low	53.1	Low	234 Å²	234	112.9 Å²	112.9	88%	0.883	63%	0.626	S	S	*	*			trans	-65.1	112.4	162.9	-75.5	-177.9	172.7	177.2	-1.4	107.5	G9 E13	G9-R11 PolarHBondContact O-N 3.21Å; R11-E13 PolarHBondContact O-N 3.33Å; R11-E13 VanDerWaalsContact O-N 3.12Å
12	E	40.2	Very low	56.1	Low	171 Å²	171	101.3 Å²	101.3	80%	0.799	57%	0.569	S	S	*	*			trans	-63	111.5	162.6	-67.4	-164.1	122.4	0	0	108	R10 K14	R10-E12 PolarHBondContact O-N 3.46Å; E12-K14 PolarHBondContact O-N 3.35Å
13	E	50.8	Low	59.3	Low	109 Å²	109	97.4 Å²	97.4	51%	0.509	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-63.8	127.8	171.5	-74	-147.3	114.8	0	0	109.5	R11 G15	R11-E13 PolarHBondContact O-N 3.33Å; R11-E13 VanDerWaalsContact O-N 3.12Å; E13-G15 PolarHBondContact O-N 3.24Å
14	K	57.4	Low	62.2	Low	195 Å²	195	92.4 Å²	92.4	85%	0.848	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-63	128.5	173.6	-66.4	-178.9	178.7	-179.6	0	108	E12 R16	E12-K14 PolarHBondContact O-N 3.35Å; K14-R16 PolarHBondContact O-N 3.43Å
15	G	64.8	Low	65.2	Low	32 Å²	32	87.7 Å²	87.7	33%	0.33	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-52.5	134.4	179.7	0	0	0	0	0	111.2	E13 N359	E13-G15 PolarHBondContact O-N 3.24Å; G15-N359 CarbonylContact C-O 3.47Å; G15-N359 WeakPolarHBondContact CA-O 3.31Å
16	R	81	Confident	67.9	Low	128 Å²	128	83.9 Å²	83.9	48%	0.483	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	143.3	178.9	-70.7	-173.3	178.5	-178.9	2.2	109.4	K14 E90 N359	K14-R16 PolarHBondContact O-N 3.43Å; R16-E90 IonicContact NH1-OE1 3.84Å; R16-E90 PolarHBondContact NH1-OE1 2.77Å; R16-N359 PolarHBondContact N-O 3.33Å; R16-N359 PolarHBondContact O-N 3.33Å
17	N	85.8	Confident	70.8	Confident	89 Å²	89	82.9 Å²	82.9	48%	0.476	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	151.5	169.6	-76.5	32.7	0	0	0	110.8	K355 I357	N17-K355 WeakPolarHBondContact CB-O 3.41Å; N17-K355 PolarHBondContact ND2-O 2.69Å; N17-I357 CarbonylContact C-O 3.51Å; N17-I357 VanDerWaalsContact CA-O 3.27Å; N17-I357 WeakPolarHBondContact CA-O 3.29Å
18	I	91	Very high	73.4	Confident	2 Å²	2	79 Å²	79	1%	0.01	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-63.4	130.5	168.7	-66.6	-168.9	0	0	0	109.5	V20 L322 T328 I330 I357	I18-V20 HydrophobicContact CG2-CG2 4.44Å; I18-L322 HydrophobicContact CD1-CD2 3.7Å; I18-T328 HydrophobicContact CD1-CG2 3.99Å; I18-T328 HydrophobicContact CG1-CG2 4.44Å; I18-T328 HydrophobicContact CG2-CG2 3.83Å; I18-I330 HydrophobicContact CG2-CD1 3.84Å; I18-I330 HydrophobicContact CG2-CG1 4.07Å; I18-I357 HydrophobicContact CB-CB 4.5Å; I18-I357 HydrophobicContact CD1-CB 3.77Å; I18-I357 HydrophobicContact CD1-CD1 4.05Å; I18-I357 HydrophobicContact CD1-CG2 3.57Å; I18-I357 HydrophobicContact CG1-CB 4.01Å; I18-I357 HydrophobicContact CG1-CG2 4.04Å; I18-I357 PolarHBondContact N-O 2.98Å
19	Q	92.9	Very high	75.7	Confident	55 Å²	55	80.3 Å²	80.3	26%	0.257	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	131.8	177	-178.2	-169.1	67	0	0	109.5	V21 D67 T328 S329 I330	Q19-V21 HydrophobicContact CG-CG2 4.31Å; Q19-D67 HydrophobicContact CG-CB 3.97Å; Q19-T328 PolarHBondContact N-O 3.02Å; Q19-T328 VanDerWaalsContact N-O 3.08Å; Q19-S329 WeakPolarHBondContact O-CA 3.43Å; Q19-S329 PolarHBondContact OE1-OG 3.29Å; Q19-I330 PolarHBondContact O-N 3.49Å
20	V	95	Very high	78.1	Confident	0 Å²	0	84.3 Å²	84.3	0%	0	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	127.2	178.2	-178.3	0	0	0	0	111.3	I18 F66 D67 A351 A354 K355	I18-V20 HydrophobicContact CG2-CG2 4.44Å; V20-F66 HydrophobicContact CB-CD1 4.26Å; V20-F66 HydrophobicContact CG1-CD1 3.6Å; V20-F66 HydrophobicContact CG1-CE1 3.97Å; V20-D67 PolarHBondContact N-OD2 3.02Å; V20-D67 WeakPolarHBondContact O-CB 3.4Å; V20-D67 PolarHBondContact O-N 3.43Å; V20-A351 HydrophobicContact CG1-CB 3.76Å; V20-A354 HydrophobicContact CG2-CB 4.34Å; V20-K355 HydrophobicContact CB-CB 4.15Å; V20-K355 HydrophobicContact CG2-CB 3.69Å; V20-K355 HydrophobicContact CG2-CG 4.36Å
21	V	96	Very high	80.3	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	136.9	-174.7	177.4	0	0	0	0	108.5	Q19 M68 F70 V83 I330 I331 A332	Q19-V21 HydrophobicContact CG-CG2 4.31Å; V21-M68 WeakPolarHBondContact CA-O 3.31Å; V21-M68 HydrophobicContact CG1-CB 4.16Å; V21-M68 HydrophobicContact CG2-CB 4.16Å; V21-M68 HydrophobicContact CG2-CG 4.5Å; V21-F70 HydrophobicContact CG1-CD2 3.59Å; V21-F70 HydrophobicContact CG1-CE2 3.55Å; V21-V83 HydrophobicContact CG1-CG2 4.09Å; V21-V83 HydrophobicContact CG2-CG1 4.31Å; V21-V83 HydrophobicContact CG2-CG2 3.93Å; V21-I330 PolarHBondContact N-O 3.14Å; V21-I331 HydrophobicContact CB-CG1 4.49Å; V21-I331 WeakPolarHBondContact O-CA 3.47Å; V21-A332 PolarHBondContact O-N 2.79Å
22	V	96.9	Very high	82.4	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	136.4	169.1	178.3	0	0	0	0	110.2	V48 F66 M68 F70 A332 V334 L348	V22-V48 HydrophobicContact CB-CG2 4.02Å; V22-V48 HydrophobicContact CG1-CG2 3.95Å; V22-V48 HydrophobicContact CG2-CG2 4.2Å; V22-F66 HydrophobicContact CB-CD2 4.35Å; V22-F66 HydrophobicContact CG2-CB 4.48Å; V22-F66 HydrophobicContact CG2-CD1 4.05Å; V22-F66 HydrophobicContact CG2-CD2 3.4Å; V22-F66 HydrophobicContact CG2-CE1 4.09Å; V22-F66 HydrophobicContact CG2-CE2 3.43Å; V22-F66 VanDerWaalsContact CG2-CE2 3.43Å; V22-F66 HydrophobicContact CG2-CG 3.7Å; V22-F66 HydrophobicContact CG2-CZ 3.79Å; V22-M68 PolarHBondContact N-O 3.38Å; V22-M68 VanDerWaalsContact N-O 3.09Å; V22-F70 PolarHBondContact O-N 3.25Å; V22-A332 WeakPolarHBondContact CA-O 3.19Å; V22-A332 HydrophobicContact CG2-CB 4.26Å; V22-V334 HydrophobicContact CG1-CG2 3.8Å; V22-L348 HydrophobicContact CG1-CD2 4.05Å; V22-L348 HydrophobicContact CG2-CD2 3.72Å
23	R	96.3	Very high	84.2	Confident	16 Å²	16	71.3 Å²	71.3	6%	0.06	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	110.2	169.7	-170.6	-176.2	-168.1	179.6	9.1	109.9	F70 A74 Q76 T112 I331 A332 T333 V334	R23-F70 HydrophobicContact CB-CB 4.47Å; R23-F70 HydrophobicContact CG-CB 4.25Å; R23-A74 PolarHBondContact NH2-O 3.22Å; R23-Q76 VanDerWaalsContact CZ-OE1 3.27Å; R23-T112 PolarHBondContact NH1-OG1 3.2Å; R23-I331 HydrophobicContact CB-CG2 4.11Å; R23-A332 PolarHBondContact N-O 3.05Å; R23-T333 HydrophobicContact CB-CG2 4.44Å; R23-T333 WeakPolarHBondContact O-CA 3.49Å; R23-V334 PolarHBondContact O-N 2.95Å
24	C	95.3	Very high	85.3	Confident	3 Å²	3	70 Å²	70	2%	0.02	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	122.9	170	-170.3	0	0	0	0	109	F70 G71 P72 V334	C24-F70 PolarHBondContact N-O 3.42Å; C24-G71 CarbonylContact O-C 3.53Å; C24-P72 HydrophobicContact CB-CG 4.48Å; C24-P72 WeakPolarHBondContact O-CA 3.24Å; C24-V334 HydrophobicContact CB-CG2 3.93Å
25	R	93.5	Very high	86.3	Confident	34 Å²	34	62.3 Å²	62.3	13%	0.128	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-80.8	160.9	178.2	68.1	146.8	172.1	74.7	-1.7	112	N28 E31 G106 T107 V334 S335 P336	R25-N28 PolarHBondContact NH2-ND2 3.42Å; R25-E31 IonicContact CZ-OE1 3.86Å; R25-E31 IonicContact CZ-OE2 2.69Å; R25-E31 IonicContact NH1-OE1 3.76Å; R25-E31 IonicContact NH1-OE2 2.71Å; R25-E31 PolarHBondContact NH1-OE2 3.29Å; R25-E31 IonicContact NH2-OE1 2.61Å; R25-E31 PolarHBondContact NH2-OE1 3.17Å; R25-E31 IonicContact NH2-OE2 3.68Å; R25-E31 PolarHBondContact NH2-OE2 3.22Å; R25-G106 PolarHBondContact NE-O 3.09Å; R25-G106 PolarHBondContact NH2-O 3.39Å; R25-T107 WeakPolarHBondContact CG-O 3.5Å; R25-V334 PolarHBondContact N-O 3.3Å; R25-V334 VanDerWaalsContact N-O 3.12Å; R25-S335 PolarHBondContact NH2-OG 3.23Å; R25-P336 WeakPolarHBondContact O-CD 3.45Å; R25-P336 WeakPolarHBondContact O-CG 3.38Å
26	P	91.8	Very high	87.2	Confident	80 Å²	80	65.9 Å²	65.9	52%	0.519	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-57.9	159.3	165	24.9	-35.1	0	0	0	112.8
27	F	88.8	Confident	87.4	Confident	52 Å²	52	61.4 Å²	61.4	23%	0.228	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-59.6	141.1	169	-93.1	-92.8	0	0	0	110.6	E31 H32 P336	F27-E31 HydrophobicContact CD1-CB 3.61Å; F27-E31 HydrophobicContact CE1-CB 4.08Å; F27-H32 VanDerWaalsContact CB-NE2 3.33Å; F27-H32 WeakPolarHBondContact CB-NE2 3.42Å; F27-P336 HydrophobicContact CD2-CB 4.06Å; F27-P336 HydrophobicContact CD2-CG 3.5Å; F27-P336 HydrophobicContact CE2-CB 3.58Å; F27-P336 HydrophobicContact CE2-CG 3.53Å; F27-P336 HydrophobicContact CG-CG 4.08Å; F27-P336 HydrophobicContact CZ-CB 4.12Å; F27-P336 HydrophobicContact CZ-CG 4.11Å
28	N	85.5	Confident	87.5	Confident	61 Å²	61	57.2 Å²	57.2	33%	0.326	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-88.8	166.3	170.8	77.1	40.7	0	0	0	111.6	R25 M30 E31 H32	R25-N28 PolarHBondContact NH2-ND2 3.42Å; N28-M30 PolarHBondContact O-N 3.41Å; N28-M30 WeakPolarHBondContact OD1-CB 3.44Å; N28-M30 PolarHBondContact OD1-N 3.45Å; N28-E31 PolarHBondContact N-OE2 3.18Å; N28-E31 PolarHBondContact ND2-OE1 3.29Å; N28-E31 PolarHBondContact ND2-OE2 3.42Å; N28-E31 PolarHBondContact O-N 3.44Å; N28-E31 WeakPolarHBondContact OD1-CG 3.4Å; N28-E31 PolarHBondContact OD1-N 3.45Å; N28-H32 PolarHBondContact O-CD2 3.26Å; N28-H32 PolarHBondContact O-N 3.23Å
29	T	83.5	Confident	87.5	Confident	114 Å²	114	58 Å²	58	70%	0.699	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-21.5	-174.8	51.2	0	0	0	0	114.6
30	M	78.7	Confident	87.3	Confident	148 Å²	148	59.3 Å²	59.3	73%	0.729	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-45.7	174.3	-62.2	179.8	68.1	0	0	111.2	N28 H32 R33 A34	N28-M30 PolarHBondContact O-N 3.41Å; N28-M30 WeakPolarHBondContact OD1-CB 3.44Å; N28-M30 PolarHBondContact OD1-N 3.45Å; M30-H32 VanDerWaalsContact C-N 3.32Å; M30-H32 PolarHBondContact O-N 3.33Å; M30-R33 PolarHBondContact O-N 3.42Å; M30-A34 PolarHBondContact O-N 3.34Å
31	E	84.7	Confident	87.2	Confident	13 Å²	13	60.5 Å²	60.5	6%	0.061	32%	0.317	C	S	.	.	H	α-helix	trans	-61.8	-39.3	178.4	-67.4	166	160.9	0	0	111.3	R25 F27 N28 R33 A34 S35 S335 N340	R25-E31 IonicContact CZ-OE1 3.86Å; R25-E31 IonicContact CZ-OE2 2.69Å; R25-E31 IonicContact NH1-OE1 3.76Å; R25-E31 IonicContact NH1-OE2 2.71Å; R25-E31 PolarHBondContact NH1-OE2 3.29Å; R25-E31 IonicContact NH2-OE1 2.61Å; R25-E31 PolarHBondContact NH2-OE1 3.17Å; R25-E31 IonicContact NH2-OE2 3.68Å; R25-E31 PolarHBondContact NH2-OE2 3.22Å; F27-E31 HydrophobicContact CD1-CB 3.61Å; F27-E31 HydrophobicContact CE1-CB 4.08Å; N28-E31 PolarHBondContact N-OE2 3.18Å; N28-E31 PolarHBondContact ND2-OE1 3.29Å; N28-E31 PolarHBondContact ND2-OE2 3.42Å; N28-E31 PolarHBondContact O-N 3.44Å; N28-E31 WeakPolarHBondContact OD1-CG 3.4Å; N28-E31 PolarHBondContact OD1-N 3.45Å; E31-R33 PolarHBondContact O-N 3.37Å; E31-A34 PolarHBondContact O-N 3.24Å; E31-S35 PolarHBondContact O-N 3.34Å; E31-S335 PolarHBondContact OE1-OG 3.22Å; E31-N340 PolarHBondContact OE1-ND2 3.35Å
32	H	81.1	Confident	87	Confident	135 Å²	135	63.3 Å²	63.3	63%	0.625	33%	0.332	S	S	*	.	H	α-helix	trans	-54.7	-22.9	172.6	-92.3	-62.7	0	0	0	114.4	F27 N28 M30	F27-H32 VanDerWaalsContact CB-NE2 3.33Å; F27-H32 WeakPolarHBondContact CB-NE2 3.42Å; N28-H32 PolarHBondContact O-CD2 3.26Å; N28-H32 PolarHBondContact O-N 3.23Å; M30-H32 VanDerWaalsContact C-N 3.32Å; M30-H32 PolarHBondContact O-N 3.33Å
33	R	76.6	Confident	86.6	Confident	231 Å²	231	68.5 Å²	68.5	87%	0.872	36%	0.356	S	S	*	.	H	α-helix	trans	-101.1	-14	179.5	-63.2	177.9	178.1	-177.7	-0.8	113.6	M30 E31	M30-R33 PolarHBondContact O-N 3.42Å; E31-R33 PolarHBondContact O-N 3.37Å
34	A	74.6	Confident	86.2	Confident	81 Å²	81	72.7 Å²	72.7	67%	0.669	39%	0.388	S	S	*	.	H	α-helix	trans	-139.4	3	-162.8	0	0	0	0	0	115	M30 E31	M30-A34 PolarHBondContact O-N 3.34Å; E31-A34 PolarHBondContact O-N 3.24Å
35	S	79.2	Confident	85.9	Confident	35 Å²	35	79.8 Å²	79.8	25%	0.245	41%	0.414	C	S	.	.			trans	-157.9	166	-176.5	-82.8	0	0	0	0	112.9	E31 S337 S338 S339	E31-S35 PolarHBondContact O-N 3.34Å; S35-S337 WeakPolarHBondContact CB-OG 3.29Å; S35-S337 PolarHBondContact OG-OG 2.91Å; S35-S338 WeakPolarHBondContact CA-OG 3.44Å; S35-S338 WeakPolarHBondContact CB-OG 3.48Å; S35-S338 PolarHBondContact OG-OG 2.98Å; S35-S338 VanDerWaalsContact OG-OG 3.12Å; S35-S339 PolarHBondContact OG-N 3.13Å
36	Y	83	Confident	85.9	Confident	107 Å²	107	82.5 Å²	82.5	42%	0.42	43%	0.427	S	S	.	.			trans	-123.4	163.9	-177.1	60.1	-90.3	0	0	0	112.1	V38 V55 S338	Y36-V38 HydrophobicContact CD2-CG1 4Å; Y36-V38 HydrophobicContact CE2-CG1 3.63Å; Y36-V38 PolarHBondContact O-N 3.36Å; Y36-V55 HydrophobicContact CD1-CG2 4.39Å; Y36-V55 HydrophobicContact CE1-CG2 3.72Å; Y36-V55 HydrophobicContact CE2-CG2 4.16Å; Y36-S338 WeakPolarHBondContact CD1-OG 3.39Å; Y36-S338 PolarHBondContact N-OG 3.48Å; Y36-S338 PolarHBondContact O-N 3.43Å
37	G	85.5	Confident	86	Confident	33 Å²	33	80.6 Å²	80.6	34%	0.34	41%	0.411	S	S	.	.	B	Isolated β-bridge	trans	-69.9	117.5	-179.1	0	0	0	0	0	113.2	P336	G37-P336 WeakPolarHBondContact CA-O 3.39Å
38	V	88	Confident	86.3	Confident	1 Å²	1	78.1 Å²	78.1	1%	0.006	40%	0.4	C	S	.	.			trans	-109.9	-18.5	174	-65.2	0	0	0	0	113.9	Y36 V50 R51 P336 L341	Y36-V38 HydrophobicContact CD2-CG1 4Å; Y36-V38 HydrophobicContact CE2-CG1 3.63Å; Y36-V38 PolarHBondContact O-N 3.36Å; V38-V50 WeakPolarHBondContact O-CA 3.47Å; V38-R51 PolarHBondContact O-N 3.45Å; V38-P336 PolarHBondContact N-O 3.46Å; V38-L341 HydrophobicContact CB-CD1 4.25Å; V38-L341 HydrophobicContact CG2-CB 4.44Å; V38-L341 HydrophobicContact CG2-CD1 4.06Å
39	I	90.4	Very high	86.6	Confident	20 Å²	20	77 Å²	77	10%	0.103	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	139	174.6	-50.4	-178.3	0	0	0	110.2	C41 V48 V334 S335 T344	I39-C41 VanDerWaalsContact CG2-SG 3.55Å; I39-V48 HydrophobicContact CG2-CG1 3.69Å; I39-V334 HydrophobicContact CD1-CB 3.94Å; I39-V334 HydrophobicContact CD1-CG2 3.66Å; I39-S335 WeakPolarHBondContact CD1-O 3.34Å; I39-T344 HydrophobicContact CD1-CG2 3.48Å; I39-T344 VanDerWaalsContact CD1-CG2 3.48Å; I39-T344 HydrophobicContact CG1-CG2 3.99Å
40	D	89.8	Confident	87	Confident	81 Å²	81	71.6 Å²	71.6	43%	0.433	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	142.5	164.3	-153.8	-20.8	0	0	0	108.5	L49 R51	D40-L49 HydrophobicContact CB-CB 4.18Å; D40-L49 HydrophobicContact CB-CD2 4.29Å; D40-L49 PolarHBondContact N-O 3.41Å; D40-L49 PolarHBondContact O-N 3.31Å; D40-R51 IonicContact OD2-NH2 3.16Å
41	C	92.5	Very high	87.5	Confident	25 Å²	25	69.8 Å²	69.8	17%	0.169	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	101.9	-167.4	-71.9	0	0	0	0	111.9	I39 Q43 V69	I39-C41 VanDerWaalsContact CG2-SG 3.55Å; C41-Q43 PolarHBondContact O-N 3.36Å; C41-V69 HydrophobicContact CB-CG1 3.93Å
42	D	91.3	Very high	87.4	Confident	59 Å²	59	71.2 Å²	71.2	32%	0.316	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	100.9	175.3	-169.2	-29.9	0	0	0	110.3	S44 R45 K46 E47	D42-S44 VanDerWaalsContact C-N 3.28Å; D42-S44 PolarHBondContact O-N 3.2Å; D42-S44 WeakPolarHBondContact OD1-CA 3.47Å; D42-S44 WeakPolarHBondContact OD1-CB 3.46Å; D42-S44 PolarHBondContact OD1-N 3.37Å; D42-S44 PolarHBondContact OD1-OG 3.3Å; D42-R45 HydrophobicContact CB-CB 4.15Å; D42-R45 PolarHBondContact OD1-N 3.03Å; D42-R45 WeakPolarHBondContact OD2-CD 3.44Å; D42-R45 WeakPolarHBondContact OD2-CG 3.48Å; D42-K46 WeakPolarHBondContact O-CA 3.48Å; D42-K46 PolarHBondContact O-N 3.36Å; D42-E47 PolarHBondContact N-O 3.23Å; D42-E47 PolarHBondContact O-N 3.45Å
43	Q	89.5	Confident	87.1	Confident	110 Å²	110	65.5 Å²	65.5	51%	0.514	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-26	176.9	-177.9	165.4	28.2	0	0	113	C41 V69	C41-Q43 PolarHBondContact O-N 3.36Å; Q43-V69 WeakPolarHBondContact CB-O 3.4Å; Q43-V69 VanDerWaalsContact CG-O 3.24Å; Q43-V69 WeakPolarHBondContact CG-O 3.25Å
44	S	87.9	Confident	86.7	Confident	104 Å²	104	56.8 Å²	56.8	73%	0.727	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-41.7	179.6	76.9	0	0	0	0	111.8	D42	D42-S44 VanDerWaalsContact C-N 3.28Å; D42-S44 PolarHBondContact O-N 3.2Å; D42-S44 WeakPolarHBondContact OD1-CA 3.47Å; D42-S44 WeakPolarHBondContact OD1-CB 3.46Å; D42-S44 PolarHBondContact OD1-N 3.37Å; D42-S44 PolarHBondContact OD1-OG 3.3Å
45	R	88.7	Confident	86.2	Confident	151 Å²	151	58.1 Å²	58.1	57%	0.57	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-13	175.7	-65.8	179.3	59.6	170.1	-7.4	113.5	D42 E47	D42-R45 HydrophobicContact CB-CB 4.15Å; D42-R45 PolarHBondContact OD1-N 3.03Å; D42-R45 WeakPolarHBondContact OD2-CD 3.44Å; D42-R45 WeakPolarHBondContact OD2-CG 3.48Å; R45-E47 HydrophobicContact CB-CB 4.21Å; R45-E47 HydrophobicContact CB-CG 4.04Å; R45-E47 IonicContact CZ-OE1 2.67Å; R45-E47 IonicContact CZ-OE2 2.71Å; R45-E47 VanDerWaalsContact NE-CD 3.35Å; R45-E47 IonicContact NE-OE1 3.83Å; R45-E47 PolarHBondContact NE-OE1 3.1Å; R45-E47 IonicContact NE-OE2 3.22Å; R45-E47 PolarHBondContact NE-OE2 3.43Å; R45-E47 IonicContact NH2-OE1 3.5Å; R45-E47 PolarHBondContact NH2-OE1 3.46Å; R45-E47 IonicContact NH2-OE2 2.71Å; R45-E47 PolarHBondContact NH2-OE2 2.91Å; R45-E47 PolarHBondContact O-N 3.16Å
46	K	93.2	Very high	85.4	Confident	92 Å²	92	63.9 Å²	63.9	40%	0.4	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.5	35.6	-173.2	-50	171.5	170.7	-152.8	0	112.1	D42 T65 F66 D67 V69	D42-K46 WeakPolarHBondContact O-CA 3.48Å; D42-K46 PolarHBondContact O-N 3.36Å; K46-T65 WeakPolarHBondContact O-CA 3.46Å; K46-F66 WeakPolarHBondContact CB-O 3.35Å; K46-F66 PolarHBondContact O-N 3.25Å; K46-D67 VanDerWaalsContact CD-O 3.29Å; K46-D67 WeakPolarHBondContact CD-O 3.34Å; K46-D67 VanDerWaalsContact CE-O 3.29Å; K46-D67 WeakPolarHBondContact CE-O 3.45Å; K46-D67 PolarHBondContact NZ-O 3.21Å; K46-V69 VanDerWaalsContact C-CG2 3.4Å; K46-V69 HydrophobicContact CB-CG2 4.47Å; K46-V69 WeakPolarHBondContact O-CG2 3.49Å
47	E	94.4	Very high	84.8	Confident	40 Å²	40	62 Å²	62	19%	0.187	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	137.6	-175.5	-76.7	175.1	-138.8	0	0	111.6	D42 R45 T63 Y64 T65	D42-E47 PolarHBondContact N-O 3.23Å; D42-E47 PolarHBondContact O-N 3.45Å; R45-E47 HydrophobicContact CB-CB 4.21Å; R45-E47 HydrophobicContact CB-CG 4.04Å; R45-E47 IonicContact CZ-OE1 2.67Å; R45-E47 IonicContact CZ-OE2 2.71Å; R45-E47 VanDerWaalsContact NE-CD 3.35Å; R45-E47 IonicContact NE-OE1 3.83Å; R45-E47 PolarHBondContact NE-OE1 3.1Å; R45-E47 IonicContact NE-OE2 3.22Å; R45-E47 PolarHBondContact NE-OE2 3.43Å; R45-E47 IonicContact NH2-OE1 3.5Å; R45-E47 PolarHBondContact NH2-OE1 3.46Å; R45-E47 IonicContact NH2-OE2 2.71Å; R45-E47 PolarHBondContact NH2-OE2 2.91Å; R45-E47 PolarHBondContact O-N 3.16Å; E47-T63 HydrophobicContact CB-CG2 4.03Å; E47-T63 HydrophobicContact CG-CG2 3.96Å; E47-T63 WeakPolarHBondContact OE2-CG2 3.5Å; E47-Y64 CarbonylContact C-O 3.57Å; E47-Y64 WeakPolarHBondContact CA-O 3.45Å; E47-T65 HydrophobicContact CG-CG2 4.36Å
48	V	94.1	Very high	83.8	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	114.3	169.3	-176.6	0	0	0	0	107.6	V22 I39 V50 T63 Y64 F66 V69 L348	V22-V48 HydrophobicContact CB-CG2 4.02Å; V22-V48 HydrophobicContact CG1-CG2 3.95Å; V22-V48 HydrophobicContact CG2-CG2 4.2Å; I39-V48 HydrophobicContact CG2-CG1 3.69Å; V48-V50 HydrophobicContact CG1-CG2 4.19Å; V48-T63 WeakPolarHBondContact O-CA 3.22Å; V48-Y64 PolarHBondContact N-O 3.37Å; V48-Y64 PolarHBondContact O-N 3.3Å; V48-F66 HydrophobicContact CB-CE2 4.3Å; V48-F66 HydrophobicContact CG2-CD2 3.93Å; V48-F66 HydrophobicContact CG2-CE2 3.99Å; V48-V69 HydrophobicContact CG2-CB 4.4Å; V48-V69 HydrophobicContact CG2-CG1 3.69Å; V48-V69 HydrophobicContact CG2-CG2 3.74Å; V48-L348 HydrophobicContact CG1-CD1 3.92Å; V48-L348 HydrophobicContact CG1-CD2 4.24Å
49	L	92.2	Very high	82.9	Confident	37 Å²	37	73.1 Å²	73.1	19%	0.194	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	116.9	179	177.2	73.7	0	0	0	108.8	D40 R61 T63	D40-L49 HydrophobicContact CB-CB 4.18Å; D40-L49 HydrophobicContact CB-CD2 4.29Å; D40-L49 PolarHBondContact N-O 3.41Å; D40-L49 PolarHBondContact O-N 3.31Å; L49-R61 HydrophobicContact CD1-CB 3.86Å; L49-T63 VanDerWaalsContact CD1-OG1 3.32Å; L49-T63 WeakPolarHBondContact CD1-OG1 3.49Å
50	V	92.3	Very high	82.5	Confident	0 Å²	0	74.2 Å²	74.2	0%	0	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	125.6	178.5	-174.5	0	0	0	0	109.7	V38 V48 T52 R61 K62 Y64 L341 T344 L345 L348	V38-V50 WeakPolarHBondContact O-CA 3.47Å; V48-V50 HydrophobicContact CG1-CG2 4.19Å; V50-T52 HydrophobicContact CG1-CG2 4.33Å; V50-T52 PolarHBondContact O-N 3.3Å; V50-R61 CarbonylContact O-C 3.57Å; V50-R61 VanDerWaalsContact O-CA 3.27Å; V50-R61 WeakPolarHBondContact O-CA 3.48Å; V50-K62 PolarHBondContact N-O 3.41Å; V50-K62 PolarHBondContact O-N 3.44Å; V50-Y64 HydrophobicContact CG2-CD2 4.49Å; V50-Y64 HydrophobicContact CG2-CE2 4.33Å; V50-L341 HydrophobicContact CG1-CD1 3.39Å; V50-T344 HydrophobicContact CG2-CG2 4.44Å; V50-L345 HydrophobicContact CB-CD2 4.17Å; V50-L345 HydrophobicContact CG1-CD2 3.82Å; V50-L345 HydrophobicContact CG1-CG 4.3Å; V50-L348 HydrophobicContact CG2-CD1 3.47Å; V50-L348 VanDerWaalsContact CG2-CD1 3.47Å
51	R	89.1	Confident	82.3	Confident	111 Å²	111	76.2 Å²	76.2	42%	0.419	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	112.4	174.7	-58.5	176.9	-170	-175.5	3.6	108.2	V38 D40 L341	V38-R51 PolarHBondContact O-N 3.45Å; D40-R51 IonicContact OD2-NH2 3.16Å; R51-L341 WeakPolarHBondContact O-CD1 3.48Å
52	T	83.1	Confident	82.2	Confident	42 Å²	42	79 Å²	79	26%	0.258	41%	0.412	S	S	.	.			trans	-103	-12	-174.6	47.1	0	0	0	0	113.3	V50 S60 R61 K62 L345	V50-T52 HydrophobicContact CG1-CG2 4.33Å; V50-T52 PolarHBondContact O-N 3.3Å; T52-S60 PolarHBondContact N-O 3.23Å; T52-S60 VanDerWaalsContact OG1-C 3.23Å; T52-S60 PolarHBondContact OG1-O 3.36Å; T52-S60 PolarHBondContact OG1-OG 3.36Å; T52-R61 PolarHBondContact OG1-N 3.06Å; T52-K62 HydrophobicContact CG2-CB 4.43Å; T52-K62 HydrophobicContact CG2-CD 4.34Å; T52-K62 HydrophobicContact CG2-CG 4.11Å; T52-L345 HydrophobicContact CG2-CD1 4.03Å; T52-L345 HydrophobicContact CG2-CD2 3.98Å
53	G	73.8	Confident	82.2	Confident	15 Å²	15	79.7 Å²	79.7	16%	0.155	42%	0.418	C	S	.	.	S	Bend	trans	-80.6	165.9	168.4	0	0	0	0	0	113	S60	G53-S60 PolarHBondContact N-O 3.19Å; G53-S60 VanDerWaalsContact N-O 3.12Å; G53-S60 PolarHBondContact N-OG 2.97Å
54	G	67.7	Low	82.5	Confident	49 Å²	49	75.5 Å²	75.5	51%	0.505	40%	0.398	S	S	.	.			trans	-69	171.9	167.9	0	0	0	0	0	112.2	N56 D57	G54-N56 PolarHBondContact O-N 3.42Å; G54-D57 PolarHBondContact O-N 3.17Å
55	V	64	Low	82.8	Confident	109 Å²	109	74.3 Å²	74.3	66%	0.661	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.1	-34.7	-171.5	-177.9	0	0	0	0	115.2	Y36	Y36-V55 HydrophobicContact CD1-CG2 4.39Å; Y36-V55 HydrophobicContact CE1-CG2 3.72Å; Y36-V55 HydrophobicContact CE2-CG2 4.16Å
56	N	63.5	Low	83.1	Confident	155 Å²	155	67.2 Å²	67.2	83%	0.829	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-16.4	-177.8	-65.8	-12.4	0	0	0	114.5	G54 K58	G54-N56 PolarHBondContact O-N 3.42Å; N56-K58 PolarHBondContact O-N 3.1Å
57	D	70	Confident	83.2	Confident	67 Å²	67	65 Å²	65	36%	0.358	35%	0.352	S	S	.	.			trans	-87	96.9	-179.5	177.6	11.4	0	0	0	110.8	G54 S59 S60	G54-D57 PolarHBondContact O-N 3.17Å; D57-S59 PolarHBondContact O-N 3.26Å; D57-S59 WeakPolarHBondContact OD1-CA 3.08Å; D57-S59 WeakPolarHBondContact OD1-CB 3.42Å; D57-S59 PolarHBondContact OD1-N 3.03Å; D57-S59 PolarHBondContact OD1-OG 3.35Å; D57-S60 PolarHBondContact OD1-N 3.35Å; D57-S60 WeakPolarHBondContact OD2-CB 3.38Å
58	K	64.8	Low	83.2	Confident	169 Å²	169	65.3 Å²	65.3	74%	0.735	35%	0.354	S	S	*	.	S	Bend	trans	-76.4	-8.1	177	-65.5	179.3	-180	176.4	0	113.6	N56 R61	N56-K58 PolarHBondContact O-N 3.1Å; K58-R61 PolarHBondContact O-NE 3.06Å; K58-R61 PolarHBondContact O-NH2 3.18Å
59	S	69.6	Low	83.3	Confident	100 Å²	100	65.4 Å²	65.4	70%	0.699	36%	0.355	S	S	*	.	S	Bend	trans	-95.7	-40.4	-171.2	74	0	0	0	0	113.7	D57 R61	D57-S59 PolarHBondContact O-N 3.26Å; D57-S59 WeakPolarHBondContact OD1-CA 3.08Å; D57-S59 WeakPolarHBondContact OD1-CB 3.42Å; D57-S59 PolarHBondContact OD1-N 3.03Å; D57-S59 PolarHBondContact OD1-OG 3.35Å; S59-R61 PolarHBondContact O-N 3.33Å
60	S	80.4	Confident	83.4	Confident	43 Å²	43	63.8 Å²	63.8	30%	0.301	35%	0.346	S	S	.	.			trans	-72.8	98.7	178.4	-179	0	0	0	0	111.4	T52 G53 D57	T52-S60 PolarHBondContact N-O 3.23Å; T52-S60 VanDerWaalsContact OG1-C 3.23Å; T52-S60 PolarHBondContact OG1-O 3.36Å; T52-S60 PolarHBondContact OG1-OG 3.36Å; G53-S60 PolarHBondContact N-O 3.19Å; G53-S60 VanDerWaalsContact N-O 3.12Å; G53-S60 PolarHBondContact N-OG 2.97Å; D57-S60 PolarHBondContact OD1-N 3.35Å; D57-S60 WeakPolarHBondContact OD2-CB 3.38Å
61	R	85.6	Confident	83.5	Confident	123 Å²	123	64.4 Å²	64.4	46%	0.464	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	144.9	174.8	-47.2	-176.8	-163.3	-171.1	4.9	110.4	L49 V50 T52 K58 S59	L49-R61 HydrophobicContact CD1-CB 3.86Å; V50-R61 CarbonylContact O-C 3.57Å; V50-R61 VanDerWaalsContact O-CA 3.27Å; V50-R61 WeakPolarHBondContact O-CA 3.48Å; T52-R61 PolarHBondContact OG1-N 3.06Å; K58-R61 PolarHBondContact O-NE 3.06Å; K58-R61 PolarHBondContact O-NH2 3.18Å; S59-R61 PolarHBondContact O-N 3.33Å
62	K	90.8	Very high	83.6	Confident	83 Å²	83	62.3 Å²	62.3	36%	0.361	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	140.1	165.1	-72	-174.9	177.8	174.8	0	109.6	V50 T52 Y64 L345 E349	V50-K62 PolarHBondContact N-O 3.41Å; V50-K62 PolarHBondContact O-N 3.44Å; T52-K62 HydrophobicContact CG2-CB 4.43Å; T52-K62 HydrophobicContact CG2-CD 4.34Å; T52-K62 HydrophobicContact CG2-CG 4.11Å; K62-Y64 HydrophobicContact CB-CE2 3.79Å; K62-Y64 HydrophobicContact CD-CE2 4.29Å; K62-Y64 VanDerWaalsContact CD-OH 3.23Å; K62-Y64 WeakPolarHBondContact CD-OH 3.31Å; K62-L345 HydrophobicContact CD-CD2 4.02Å; K62-E349 IonicContact NZ-OE1 3.23Å; K62-E349 PolarHBondContact NZ-OE1 3.4Å
63	T	92.7	Very high	83.9	Confident	73 Å²	73	64.8 Å²	64.8	45%	0.448	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	135.5	171.6	-53.3	0	0	0	0	109.5	E47 V48 L49	E47-T63 HydrophobicContact CB-CG2 4.03Å; E47-T63 HydrophobicContact CG-CG2 3.96Å; E47-T63 WeakPolarHBondContact OE2-CG2 3.5Å; V48-T63 WeakPolarHBondContact O-CA 3.22Å; L49-T63 VanDerWaalsContact CD1-OG1 3.32Å; L49-T63 WeakPolarHBondContact CD1-OG1 3.49Å
64	Y	94.4	Very high	84.8	Confident	22 Å²	22	65 Å²	65	9%	0.086	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	138.7	176	-58.7	-94.5	0	0	0	109.9	E47 V48 V50 K62 F66 L345 L348 E349	E47-Y64 CarbonylContact C-O 3.57Å; E47-Y64 WeakPolarHBondContact CA-O 3.45Å; V48-Y64 PolarHBondContact N-O 3.37Å; V48-Y64 PolarHBondContact O-N 3.3Å; V50-Y64 HydrophobicContact CG2-CD2 4.49Å; V50-Y64 HydrophobicContact CG2-CE2 4.33Å; K62-Y64 HydrophobicContact CB-CE2 3.79Å; K62-Y64 HydrophobicContact CD-CE2 4.29Å; K62-Y64 VanDerWaalsContact CD-OH 3.23Å; K62-Y64 WeakPolarHBondContact CD-OH 3.31Å; Y64-F66 HydrophobicContact CG-CE2 4.42Å; Y64-F66 HydrophobicContact CG-CZ 4.44Å; Y64-L345 HydrophobicContact CE2-CD2 4.19Å; Y64-L348 HydrophobicContact CD1-CB 4.29Å; Y64-L348 HydrophobicContact CD2-CB 4.11Å; Y64-L348 HydrophobicContact CD2-CD1 3.92Å; Y64-L348 HydrophobicContact CE1-CB 4.27Å; Y64-L348 HydrophobicContact CE2-CB 4.07Å; Y64-L348 HydrophobicContact CE2-CD1 4Å; Y64-L348 HydrophobicContact CG-CB 4.21Å; Y64-E349 HydrophobicContact CE1-CG 3.79Å; Y64-E349 WeakPolarHBondContact OH-CG 3.46Å; Y64-E349 PolarHBondContact OH-OE1 2.85Å; Y64-E349 VanDerWaalsContact OH-OE1 3.08Å
65	T	94.3	Very high	85.9	Confident	79 Å²	79	69.4 Å²	69.4	49%	0.485	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	126.1	-175.8	-48.4	0	0	0	0	111.4	K46 E47	K46-T65 WeakPolarHBondContact O-CA 3.46Å; E47-T65 HydrophobicContact CG-CG2 4.36Å
66	F	95.5	Very high	87.3	Confident	3 Å²	3	64.7 Å²	64.7	1%	0.013	36%	0.355	C	S	.	.			trans	-120.9	-179.4	-172.6	-63.9	-75.6	0	0	0	112.1	V20 V22 K46 V48 Y64 V69 L348 A351	V20-F66 HydrophobicContact CB-CD1 4.26Å; V20-F66 HydrophobicContact CG1-CD1 3.6Å; V20-F66 HydrophobicContact CG1-CE1 3.97Å; V22-F66 HydrophobicContact CB-CD2 4.35Å; V22-F66 HydrophobicContact CG2-CB 4.48Å; V22-F66 HydrophobicContact CG2-CD1 4.05Å; V22-F66 HydrophobicContact CG2-CD2 3.4Å; V22-F66 HydrophobicContact CG2-CE1 4.09Å; V22-F66 HydrophobicContact CG2-CE2 3.43Å; V22-F66 VanDerWaalsContact CG2-CE2 3.43Å; V22-F66 HydrophobicContact CG2-CG 3.7Å; V22-F66 HydrophobicContact CG2-CZ 3.79Å; K46-F66 WeakPolarHBondContact CB-O 3.35Å; K46-F66 PolarHBondContact O-N 3.25Å; V48-F66 HydrophobicContact CB-CE2 4.3Å; V48-F66 HydrophobicContact CG2-CD2 3.93Å; V48-F66 HydrophobicContact CG2-CE2 3.99Å; Y64-F66 HydrophobicContact CG-CE2 4.42Å; Y64-F66 HydrophobicContact CG-CZ 4.44Å; F66-V69 HydrophobicContact CB-CG2 4.09Å; F66-V69 HydrophobicContact CD2-CG2 4.2Å; F66-L348 HydrophobicContact CE2-CD2 3.8Å; F66-L348 HydrophobicContact CZ-CB 4.44Å; F66-L348 HydrophobicContact CZ-CD2 3.84Å; F66-A351 HydrophobicContact CE1-CB 3.76Å; F66-A351 HydrophobicContact CZ-CB 4.26Å
67	D	94.3	Very high	88.5	Confident	45 Å²	45	59.7 Å²	59.7	24%	0.241	33%	0.328	C	S	.	.	S	Bend	trans	-80.3	-29.9	177.6	-60.1	-58.9	0	0	0	112	Q19 V20 K46 K355	Q19-D67 HydrophobicContact CG-CB 3.97Å; V20-D67 PolarHBondContact N-OD2 3.02Å; V20-D67 WeakPolarHBondContact O-CB 3.4Å; V20-D67 PolarHBondContact O-N 3.43Å; K46-D67 VanDerWaalsContact CD-O 3.29Å; K46-D67 WeakPolarHBondContact CD-O 3.34Å; K46-D67 VanDerWaalsContact CE-O 3.29Å; K46-D67 WeakPolarHBondContact CE-O 3.45Å; K46-D67 PolarHBondContact NZ-O 3.21Å; D67-K355 VanDerWaalsContact CG-CE 3.48Å; D67-K355 WeakPolarHBondContact OD1-CE 3.45Å; D67-K355 IonicContact OD1-NZ 3.58Å; D67-K355 PolarHBondContact OD1-NZ 2.97Å; D67-K355 WeakPolarHBondContact OD2-CE 3.46Å; D67-K355 IonicContact OD2-NZ 3.99Å; D67-K355 PolarHBondContact OD2-NZ 2.85Å
68	M	94.8	Very high	89.5	Confident	47 Å²	47	59.5 Å²	59.5	23%	0.232	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	148.6	168.8	-56.3	-179.3	-177.9	0	0	109.6	V21 V22 F70 S82 V83	V21-M68 WeakPolarHBondContact CA-O 3.31Å; V21-M68 HydrophobicContact CG1-CB 4.16Å; V21-M68 HydrophobicContact CG2-CB 4.16Å; V21-M68 HydrophobicContact CG2-CG 4.5Å; V22-M68 PolarHBondContact N-O 3.38Å; V22-M68 VanDerWaalsContact N-O 3.09Å; M68-F70 HydrophobicContact CB-CE2 3.85Å; M68-F70 HydrophobicContact CB-CZ 4.35Å; M68-F70 HydrophobicContact SD-CE2 4.31Å; M68-F70 HydrophobicContact SD-CZ 4.24Å; M68-S82 WeakPolarHBondContact CE-O 3.37Å; M68-V83 HydrophobicContact SD-CG2 4.1Å
69	V	96	Very high	90.9	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.006	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	125.9	174.5	174.2	0	0	0	0	108.5	C41 Q43 K46 V48 F66	C41-V69 HydrophobicContact CB-CG1 3.93Å; Q43-V69 WeakPolarHBondContact CB-O 3.4Å; Q43-V69 VanDerWaalsContact CG-O 3.24Å; Q43-V69 WeakPolarHBondContact CG-O 3.25Å; K46-V69 VanDerWaalsContact C-CG2 3.4Å; K46-V69 HydrophobicContact CB-CG2 4.47Å; K46-V69 WeakPolarHBondContact O-CG2 3.49Å; V48-V69 HydrophobicContact CG2-CB 4.4Å; V48-V69 HydrophobicContact CG2-CG1 3.69Å; V48-V69 HydrophobicContact CG2-CG2 3.74Å; F66-V69 HydrophobicContact CB-CG2 4.09Å; F66-V69 HydrophobicContact CD2-CG2 4.2Å
70	F	95.9	Very high	92	Very high	3 Å²	3	47.2 Å²	47.2	1%	0.013	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	115.9	177.3	-66.7	-79.5	0	0	0	109.3	V21 V22 R23 C24 M68 A74 D78 V79 V83	V21-F70 HydrophobicContact CG1-CD2 3.59Å; V21-F70 HydrophobicContact CG1-CE2 3.55Å; V22-F70 PolarHBondContact O-N 3.25Å; R23-F70 HydrophobicContact CB-CB 4.47Å; R23-F70 HydrophobicContact CG-CB 4.25Å; C24-F70 PolarHBondContact N-O 3.42Å; M68-F70 HydrophobicContact CB-CE2 3.85Å; M68-F70 HydrophobicContact CB-CZ 4.35Å; M68-F70 HydrophobicContact SD-CE2 4.31Å; M68-F70 HydrophobicContact SD-CZ 4.24Å; F70-A74 HydrophobicContact CB-CB 3.72Å; F70-A74 HydrophobicContact CD1-CB 3.81Å; F70-A74 HydrophobicContact CG-CB 4.2Å; F70-D78 HydrophobicContact CE1-CB 4.47Å; F70-V79 HydrophobicContact CB-CG2 4.44Å; F70-V79 HydrophobicContact CD1-CG2 4.05Å; F70-V79 HydrophobicContact CD2-CG2 4.16Å; F70-V79 HydrophobicContact CE1-CG2 4.37Å; F70-V79 HydrophobicContact CE2-CG2 4.48Å; F70-V79 HydrophobicContact CG-CG2 3.94Å; F70-V83 HydrophobicContact CE2-CG2 3.98Å; F70-V83 HydrophobicContact CZ-CG2 4.4Å
71	G	93.2	Very high	92.5	Very high	14 Å²	14	53.6 Å²	53.6	14%	0.144	28%	0.278	C	S	.	.			trans	-78	175.9	175.1	0	0	0	0	0	113.1	C24 A73 A74	C24-G71 CarbonylContact O-C 3.53Å; G71-A73 PolarHBondContact O-N 3.28Å; G71-A74 WeakPolarHBondContact O-CB 3.39Å; G71-A74 PolarHBondContact O-N 3.3Å
72	P	91.1	Very high	92.7	Very high	66 Å²	66	50.2 Å²	50.2	43%	0.429	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-20.1	-177	-33.1	39.4	0	0	0	117.5	C24	C24-P72 HydrophobicContact CB-CG 4.48Å; C24-P72 WeakPolarHBondContact O-CA 3.24Å
73	A	90.4	Very high	92.8	Very high	94 Å²	94	46.3 Å²	46.3	78%	0.777	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-7.2	179.1	0	0	0	0	0	114.4	G71 K75	G71-A73 PolarHBondContact O-N 3.28Å; A73-K75 PolarHBondContact O-N 3.41Å
74	A	92.1	Very high	92.8	Very high	20 Å²	20	42.8 Å²	42.8	17%	0.165	24%	0.235	C	C	.	.			trans	-75.4	120.3	-173.5	0	0	0	0	0	113.2	R23 F70 G71	R23-A74 PolarHBondContact NH2-O 3.22Å; F70-A74 HydrophobicContact CB-CB 3.72Å; F70-A74 HydrophobicContact CD1-CB 3.81Å; F70-A74 HydrophobicContact CG-CB 4.2Å; G71-A74 WeakPolarHBondContact O-CB 3.39Å; G71-A74 PolarHBondContact O-N 3.3Å
75	K	91.6	Very high	92.5	Very high	141 Å²	141	43 Å²	43	61%	0.613	24%	0.239	S	C	*	.			trans	-77.5	166.9	-178.7	-58	-179.9	-178.9	-179.8	0	111.2	A73 I77 D78 V79	A73-K75 PolarHBondContact O-N 3.41Å; K75-I77 VanDerWaalsContact C-N 3.28Å; K75-I77 HydrophobicContact CB-CG2 4.11Å; K75-I77 PolarHBondContact O-N 3.26Å; K75-D78 WeakPolarHBondContact CB-OD2 3.32Å; K75-D78 PolarHBondContact N-OD2 3.31Å; K75-D78 PolarHBondContact O-N 2.7Å; K75-V79 PolarHBondContact O-N 3.19Å
76	Q	91.8	Very high	92.4	Very high	10 Å²	10	42.3 Å²	42.3	5%	0.047	24%	0.236	C	C	.	.	H	α-helix	trans	-56.2	-43.5	176.7	-58.3	-73	60.2	0	0	112	R23 D78 V79 Y80 F111 P129 L130 A131	R23-Q76 VanDerWaalsContact CZ-OE1 3.27Å; Q76-D78 VanDerWaalsContact C-N 3.3Å; Q76-D78 PolarHBondContact O-N 3.12Å; Q76-V79 PolarHBondContact O-N 3.07Å; Q76-Y80 VanDerWaalsContact O-CB 3.31Å; Q76-Y80 WeakPolarHBondContact O-CB 3.39Å; Q76-Y80 PolarHBondContact O-N 2.99Å; Q76-F111 HydrophobicContact CG-CE1 4.44Å; Q76-F111 HydrophobicContact CG-CZ 4.43Å; Q76-F111 PolarHBondContact NE2-O 3.47Å; Q76-P129 WeakPolarHBondContact CG-O 3.42Å; Q76-L130 PolarHBondContact NE2-O 2.96Å; Q76-A131 VanDerWaalsContact CB-O 3.27Å; Q76-A131 WeakPolarHBondContact CB-O 3.46Å; Q76-A131 WeakPolarHBondContact CG-O 3.42Å
77	I	90.2	Very high	92.2	Very high	51 Å²	51	42.6 Å²	42.6	26%	0.262	24%	0.237	S	C	.	.	H	α-helix	trans	-64.8	-31.3	-178.5	-170.5	59.8	0	0	0	113.1	K75 Y80 R81	K75-I77 VanDerWaalsContact C-N 3.28Å; K75-I77 HydrophobicContact CB-CG2 4.11Å; K75-I77 PolarHBondContact O-N 3.26Å; I77-Y80 HydrophobicContact CD1-CD1 4.45Å; I77-R81 HydrophobicContact CD1-CG 3.99Å; I77-R81 HydrophobicContact CG1-CG 4.25Å; I77-R81 VanDerWaalsContact O-CB 3.31Å; I77-R81 WeakPolarHBondContact O-CB 3.41Å; I77-R81 WeakPolarHBondContact O-CG 3.47Å; I77-R81 PolarHBondContact O-N 3.5Å
78	D	91.1	Very high	92.1	Very high	63 Å²	63	40.4 Å²	40.4	34%	0.337	23%	0.226	S	C	.	.	H	α-helix	trans	-69.9	-49.3	-179.8	-50.9	-35.6	0	0	0	110.1	F70 K75 Q76 Y80 R81 S82	F70-D78 HydrophobicContact CE1-CB 4.47Å; K75-D78 WeakPolarHBondContact CB-OD2 3.32Å; K75-D78 PolarHBondContact N-OD2 3.31Å; K75-D78 PolarHBondContact O-N 2.7Å; Q76-D78 VanDerWaalsContact C-N 3.3Å; Q76-D78 PolarHBondContact O-N 3.12Å; D78-Y80 VanDerWaalsContact C-N 3.33Å; D78-Y80 PolarHBondContact O-N 3.3Å; D78-R81 PolarHBondContact O-N 3.12Å; D78-S82 WeakPolarHBondContact O-CB 3.44Å; D78-S82 PolarHBondContact O-N 2.88Å; D78-S82 PolarHBondContact O-OG 2.48Å
79	V	92.3	Very high	91.9	Very high	2 Å²	2	41.5 Å²	41.5	1%	0.012	23%	0.232	C	C	.	.	H	α-helix	trans	-61.4	-43.6	175	-178.5	0	0	0	0	110.4	F70 K75 Q76 V83 I331	F70-V79 HydrophobicContact CB-CG2 4.44Å; F70-V79 HydrophobicContact CD1-CG2 4.05Å; F70-V79 HydrophobicContact CD2-CG2 4.16Å; F70-V79 HydrophobicContact CE1-CG2 4.37Å; F70-V79 HydrophobicContact CE2-CG2 4.48Å; F70-V79 HydrophobicContact CG-CG2 3.94Å; K75-V79 PolarHBondContact O-N 3.19Å; Q76-V79 PolarHBondContact O-N 3.07Å; V79-V83 HydrophobicContact CG1-CG2 4.24Å; V79-V83 VanDerWaalsContact O-CB 3.27Å; V79-V83 WeakPolarHBondContact O-CB 3.41Å; V79-V83 WeakPolarHBondContact O-CG2 3.34Å; V79-V83 PolarHBondContact O-N 3.42Å; V79-I331 HydrophobicContact CG1-CD1 4.23Å
80	Y	93.1	Very high	91.7	Very high	8 Å²	8	43.4 Å²	43.4	3%	0.031	24%	0.241	C	C	.	.	I	π-helix	trans	-61.6	-50.6	178.4	-178	-93.8	0	0	0	112.5	Q76 I77 D78 S82 V84 C85 R136 T137 Q140	Q76-Y80 VanDerWaalsContact O-CB 3.31Å; Q76-Y80 WeakPolarHBondContact O-CB 3.39Å; Q76-Y80 PolarHBondContact O-N 2.99Å; I77-Y80 HydrophobicContact CD1-CD1 4.45Å; D78-Y80 VanDerWaalsContact C-N 3.33Å; D78-Y80 PolarHBondContact O-N 3.3Å; Y80-S82 PolarHBondContact O-N 3.13Å; Y80-V84 HydrophobicContact CD2-CB 3.81Å; Y80-V84 HydrophobicContact CD2-CG1 4.12Å; Y80-V84 HydrophobicContact CD2-CG2 4.25Å; Y80-V84 HydrophobicContact CE2-CB 3.82Å; Y80-V84 HydrophobicContact CE2-CG1 3.66Å; Y80-V84 HydrophobicContact CG-CB 4.49Å; Y80-V84 WeakPolarHBondContact O-CA 3.42Å; Y80-V84 PolarHBondContact O-N 3.42Å; Y80-C85 HydrophobicContact CE1-CB 4.48Å; Y80-C85 PolarHBondContact O-N 3.3Å; Y80-R136 HydrophobicContact CD1-CB 4.34Å; Y80-R136 HydrophobicContact CD2-CB 3.67Å; Y80-R136 HydrophobicContact CE1-CB 4.27Å; Y80-R136 HydrophobicContact CE2-CB 3.57Å; Y80-R136 HydrophobicContact CG-CB 4.08Å; Y80-R136 PolarHBondContact OH-O 2.92Å; Y80-T137 WeakPolarHBondContact OH-CA 3.45Å; Y80-Q140 VanDerWaalsContact CE1-OE1 3.32Å; Y80-Q140 WeakPolarHBondContact OH-CB 3.4Å; Y80-Q140 PolarHBondContact OH-OE1 2.66Å
81	R	91.3	Very high	91.5	Very high	178 Å²	178	43.2 Å²	43.2	67%	0.672	24%	0.24	S	C	*	.	I	π-helix	trans	-65.9	-38.8	-178.2	-77	179.3	173	-179.5	-2.2	112.9	I77 D78	I77-R81 HydrophobicContact CD1-CG 3.99Å; I77-R81 HydrophobicContact CG1-CG 4.25Å; I77-R81 VanDerWaalsContact O-CB 3.31Å; I77-R81 WeakPolarHBondContact O-CB 3.41Å; I77-R81 WeakPolarHBondContact O-CG 3.47Å; I77-R81 PolarHBondContact O-N 3.5Å; D78-R81 PolarHBondContact O-N 3.12Å
82	S	90.4	Very high	91.3	Very high	51 Å²	51	43.5 Å²	43.5	36%	0.357	24%	0.238	S	C	.	.	I	π-helix	trans	-80.4	-36.3	-179.3	-64.2	0	0	0	0	113.9	M68 D78 Y80	M68-S82 WeakPolarHBondContact CE-O 3.37Å; D78-S82 WeakPolarHBondContact O-CB 3.44Å; D78-S82 PolarHBondContact O-N 2.88Å; D78-S82 PolarHBondContact O-OG 2.48Å; Y80-S82 PolarHBondContact O-N 3.13Å
83	V	91.9	Very high	91.1	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.006	25%	0.245	C	C	.	.	I	π-helix	trans	-98.6	-50.2	-174.3	-172.6	0	0	0	0	111.9	V21 M68 F70 V79 I87 I331	V21-V83 HydrophobicContact CG1-CG2 4.09Å; V21-V83 HydrophobicContact CG2-CG1 4.31Å; V21-V83 HydrophobicContact CG2-CG2 3.93Å; M68-V83 HydrophobicContact SD-CG2 4.1Å; F70-V83 HydrophobicContact CE2-CG2 3.98Å; F70-V83 HydrophobicContact CZ-CG2 4.4Å; V79-V83 HydrophobicContact CG1-CG2 4.24Å; V79-V83 VanDerWaalsContact O-CB 3.27Å; V79-V83 WeakPolarHBondContact O-CB 3.41Å; V79-V83 WeakPolarHBondContact O-CG2 3.34Å; V79-V83 PolarHBondContact O-N 3.42Å; V83-I87 HydrophobicContact CG1-CD1 4.35Å; V83-I87 WeakPolarHBondContact O-CD1 3.42Å; V83-I87 VanDerWaalsContact O-CG1 3.23Å; V83-I87 WeakPolarHBondContact O-CG1 3.48Å; V83-I331 HydrophobicContact CG1-CD1 4.31Å; V83-I331 HydrophobicContact CG1-CG1 4.4Å
84	V	92.8	Very high	90.9	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.208	C	C	.	.	I	π-helix	trans	-93.9	-39.4	-164.6	-174	0	0	0	0	113	Y80 I87 L88 I133	Y80-V84 HydrophobicContact CD2-CB 3.81Å; Y80-V84 HydrophobicContact CD2-CG1 4.12Å; Y80-V84 HydrophobicContact CD2-CG2 4.25Å; Y80-V84 HydrophobicContact CE2-CB 3.82Å; Y80-V84 HydrophobicContact CE2-CG1 3.66Å; Y80-V84 HydrophobicContact CG-CB 4.49Å; Y80-V84 WeakPolarHBondContact O-CA 3.42Å; Y80-V84 PolarHBondContact O-N 3.42Å; V84-I87 WeakPolarHBondContact O-CB 3.43Å; V84-I87 PolarHBondContact O-N 2.99Å; V84-L88 PolarHBondContact O-N 3.35Å; V84-I133 HydrophobicContact CG1-CG2 4.09Å; V84-I133 HydrophobicContact CG2-CB 4.49Å; V84-I133 HydrophobicContact CG2-CD1 3.79Å; V84-I133 HydrophobicContact CG2-CG1 3.91Å; V84-I133 HydrophobicContact CG2-CG2 3.78Å
85	C	89.4	Confident	90.8	Very high	25 Å²	25	41.7 Å²	41.7	17%	0.169	21%	0.205	C	C	.	.	H	α-helix	trans	-54	-45.7	179.3	-175.4	0	0	0	0	113.1	Y80 I87 L88 D89 K144	Y80-C85 HydrophobicContact CE1-CB 4.48Å; Y80-C85 PolarHBondContact O-N 3.3Å; C85-I87 VanDerWaalsContact C-N 3.33Å; C85-I87 PolarHBondContact O-N 3.15Å; C85-L88 PolarHBondContact O-N 3.39Å; C85-D89 PolarHBondContact O-N 3.33Å; C85-D89 VanDerWaalsContact O-OD2 3.04Å; C85-K144 PolarHBondContact SG-NZ 2.71Å
86	P	91.4	Very high	90.8	Very high	65 Å²	65	36.4 Å²	36.4	42%	0.422	18%	0.183	S	C	.	.	H	α-helix	trans	-66.8	-33.1	177.4	-19.5	33.4	0	0	0	113.2	D89 E90	P86-D89 PolarHBondContact O-N 2.71Å; P86-E90 PolarHBondContact O-N 3.08Å
87	I	92.1	Very high	90.9	Very high	9 Å²	9	35.9 Å²	35.9	5%	0.046	18%	0.181	C	C	.	.	H	α-helix	trans	-67.7	-40.5	176	-62.9	171.4	0	0	0	110	V83 V84 C85 D89 E90 V91 C97 V99 L259 S329	V83-I87 HydrophobicContact CG1-CD1 4.35Å; V83-I87 WeakPolarHBondContact O-CD1 3.42Å; V83-I87 VanDerWaalsContact O-CG1 3.23Å; V83-I87 WeakPolarHBondContact O-CG1 3.48Å; V84-I87 WeakPolarHBondContact O-CB 3.43Å; V84-I87 PolarHBondContact O-N 2.99Å; C85-I87 VanDerWaalsContact C-N 3.33Å; C85-I87 PolarHBondContact O-N 3.15Å; I87-D89 VanDerWaalsContact C-N 3.32Å; I87-D89 PolarHBondContact O-N 3.32Å; I87-E90 CarbonylContact O-C 3.56Å; I87-E90 WeakPolarHBondContact O-CA 3.49Å; I87-E90 PolarHBondContact O-N 3.3Å; I87-E90 VanDerWaalsContact O-N 3.11Å; I87-V91 WeakPolarHBondContact O-CG2 3.43Å; I87-V91 PolarHBondContact O-N 3.21Å; I87-C97 HydrophobicContact CG2-CB 3.39Å; I87-V99 HydrophobicContact CD1-CG2 3.74Å; I87-L259 HydrophobicContact CG2-CD1 4.08Å; I87-S329 VanDerWaalsContact CD1-OG 3.27Å; I87-S329 WeakPolarHBondContact CD1-OG 3.35Å
88	L	91.9	Very high	91	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-62.9	-38.5	177.7	176	57.9	0	0	0	112	V84 C85 E90 V91 I92 Q140 I141	V84-L88 PolarHBondContact O-N 3.35Å; C85-L88 PolarHBondContact O-N 3.39Å; L88-E90 VanDerWaalsContact C-N 3.31Å; L88-E90 PolarHBondContact O-N 3.18Å; L88-V91 WeakPolarHBondContact O-CB 3.38Å; L88-V91 PolarHBondContact O-N 3.29Å; L88-V91 VanDerWaalsContact O-N 3.14Å; L88-I92 HydrophobicContact CD1-CD1 4.15Å; L88-I92 HydrophobicContact CD1-CG1 4.29Å; L88-I92 HydrophobicContact CG-CD1 4.12Å; L88-I92 WeakPolarHBondContact O-CG1 3.4Å; L88-I92 PolarHBondContact O-N 3.48Å; L88-Q140 HydrophobicContact CD2-CB 3.9Å; L88-Q140 HydrophobicContact CD2-CG 3.88Å; L88-I141 HydrophobicContact CD1-CD1 4.04Å; L88-I141 HydrophobicContact CD1-CG1 3.42Å; L88-I141 VanDerWaalsContact CD1-CG1 3.42Å; L88-I141 HydrophobicContact CD2-CG1 4.15Å; L88-I141 HydrophobicContact CG-CG1 4.43Å
89	D	90.4	Very high	91.2	Very high	69 Å²	69	30.5 Å²	30.5	37%	0.369	15%	0.153	S	C	.	.	H	α-helix	trans	-60.5	-41.4	172.1	-68.9	-51.5	0	0	0	111.6	C85 P86 I87 V91 I92 M93 K144	C85-D89 PolarHBondContact O-N 3.33Å; C85-D89 VanDerWaalsContact O-OD2 3.04Å; P86-D89 PolarHBondContact O-N 2.71Å; I87-D89 VanDerWaalsContact C-N 3.32Å; I87-D89 PolarHBondContact O-N 3.32Å; D89-V91 VanDerWaalsContact C-N 3.35Å; D89-V91 PolarHBondContact O-N 3.43Å; D89-I92 PolarHBondContact O-N 3.27Å; D89-M93 WeakPolarHBondContact O-CG 3.27Å; D89-M93 PolarHBondContact O-N 3.07Å; D89-K144 IonicContact OD1-NZ 2.77Å; D89-K144 PolarHBondContact OD1-NZ 3.38Å; D89-K144 IonicContact OD2-NZ 2.76Å; D89-K144 PolarHBondContact OD2-NZ 3.43Å
90	E	90.6	Very high	91.1	Very high	41 Å²	41	30.7 Å²	30.7	19%	0.192	15%	0.154	C	C	.	.	H	α-helix	trans	-66.5	-32.7	173.9	-64.1	-176.5	127.1	0	0	112.4	R16 P86 I87 L88 M93 G94 Y95 K327	R16-E90 IonicContact NH1-OE1 3.84Å; R16-E90 PolarHBondContact NH1-OE1 2.77Å; P86-E90 PolarHBondContact O-N 3.08Å; I87-E90 CarbonylContact O-C 3.56Å; I87-E90 WeakPolarHBondContact O-CA 3.49Å; I87-E90 PolarHBondContact O-N 3.3Å; I87-E90 VanDerWaalsContact O-N 3.11Å; L88-E90 VanDerWaalsContact C-N 3.31Å; L88-E90 PolarHBondContact O-N 3.18Å; E90-M93 WeakPolarHBondContact O-CB 3.41Å; E90-M93 PolarHBondContact O-N 3.08Å; E90-G94 PolarHBondContact O-N 3.31Å; E90-Y95 HydrophobicContact CB-CD2 4.09Å; E90-Y95 WeakPolarHBondContact O-CB 3.49Å; E90-Y95 VanDerWaalsContact O-CD2 3.28Å; E90-Y95 WeakPolarHBondContact O-CD2 3.31Å; E90-Y95 PolarHBondContact O-N 3.33Å; E90-Y95 VanDerWaalsContact O-N 3.08Å; E90-K327 HydrophobicContact CB-CD 4.21Å; E90-K327 VanDerWaalsContact CD-CD 3.4Å; E90-K327 HydrophobicContact CG-CD 4.33Å; E90-K327 WeakPolarHBondContact OE1-CD 3.35Å; E90-K327 IonicContact OE1-NZ 2.95Å; E90-K327 PolarHBondContact OE1-NZ 3.23Å; E90-K327 WeakPolarHBondContact OE2-CD 3.4Å; E90-K327 IonicContact OE2-NZ 2.72Å
91	V	91.8	Very high	91.2	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-65.9	-42.1	172.3	177.2	0	0	0	0	111.3	I87 L88 D89 M93 G94 C97 I241 G257 L259	I87-V91 WeakPolarHBondContact O-CG2 3.43Å; I87-V91 PolarHBondContact O-N 3.21Å; L88-V91 WeakPolarHBondContact O-CB 3.38Å; L88-V91 PolarHBondContact O-N 3.29Å; L88-V91 VanDerWaalsContact O-N 3.14Å; D89-V91 VanDerWaalsContact C-N 3.35Å; D89-V91 PolarHBondContact O-N 3.43Å; V91-M93 VanDerWaalsContact C-N 3.26Å; V91-M93 PolarHBondContact O-N 2.99Å; V91-G94 WeakPolarHBondContact O-CA 3.45Å; V91-G94 PolarHBondContact O-N 3.44Å; V91-C97 HydrophobicContact CG2-CB 3.61Å; V91-I241 HydrophobicContact CG1-CD1 3.94Å; V91-G257 WeakPolarHBondContact O-CA 3.41Å; V91-L259 HydrophobicContact CG1-CB 4.26Å; V91-L259 HydrophobicContact CG2-CB 3.9Å; V91-L259 HydrophobicContact CG2-CD1 4.21Å; V91-L259 HydrophobicContact CG2-CD2 4.47Å; V91-L259 HydrophobicContact CG2-CG 4.41Å
92	I	88.9	Confident	91.3	Very high	19 Å²	19	22.9 Å²	22.9	10%	0.097	12%	0.124	C	C	.	.	H	α-helix	trans	-67.9	-26.6	177.2	-66	167.7	0	0	0	111.7	L88 D89 G94 K144 L145 M243 K255	L88-I92 HydrophobicContact CD1-CD1 4.15Å; L88-I92 HydrophobicContact CD1-CG1 4.29Å; L88-I92 HydrophobicContact CG-CD1 4.12Å; L88-I92 WeakPolarHBondContact O-CG1 3.4Å; L88-I92 PolarHBondContact O-N 3.48Å; D89-I92 PolarHBondContact O-N 3.27Å; I92-G94 PolarHBondContact O-N 3.48Å; I92-K144 HydrophobicContact CD1-CB 3.84Å; I92-K144 HydrophobicContact CD1-CD 3.91Å; I92-L145 HydrophobicContact CG1-CD2 4.29Å; I92-L145 HydrophobicContact CG2-CD2 4.3Å; I92-M243 HydrophobicContact CB-SD 4.41Å; I92-M243 HydrophobicContact CG2-SD 4.01Å; I92-M243 VanDerWaalsContact O-SD 3.35Å; I92-K255 PolarHBondContact O-NZ 2.9Å
93	M	86.6	Confident	91.3	Very high	116 Å²	116	20.4 Å²	20.4	57%	0.571	11%	0.107	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-11.2	167.4	-68.4	-179.7	78	0	0	114	D89 E90 V91 Y95	D89-M93 WeakPolarHBondContact O-CG 3.27Å; D89-M93 PolarHBondContact O-N 3.07Å; E90-M93 WeakPolarHBondContact O-CB 3.41Å; E90-M93 PolarHBondContact O-N 3.08Å; V91-M93 VanDerWaalsContact C-N 3.26Å; V91-M93 PolarHBondContact O-N 2.99Å; M93-Y95 HydrophobicContact CB-CD2 4.05Å; M93-Y95 HydrophobicContact CB-CE2 4.2Å
94	G	87.3	Confident	91.1	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.3	20.9	180	0	0	0	0	0	115.2	E90 V91 I92 N364	E90-G94 PolarHBondContact O-N 3.31Å; V91-G94 WeakPolarHBondContact O-CA 3.45Å; V91-G94 PolarHBondContact O-N 3.44Å; I92-G94 PolarHBondContact O-N 3.48Å; G94-N364 PolarHBondContact O-N 3.05Å; G94-N364 PolarHBondContact O-ND2 3.06Å
95	Y	90.1	Very high	90.8	Very high	26 Å²	26	23.8 Å²	23.8	10%	0.102	13%	0.126	C	C	.	.	B	Isolated β-bridge	trans	-81.8	151	167.7	-68.6	-87.3	0	0	0	111.2	E90 M93 K258 K327 P361 V363	E90-Y95 HydrophobicContact CB-CD2 4.09Å; E90-Y95 WeakPolarHBondContact O-CB 3.49Å; E90-Y95 VanDerWaalsContact O-CD2 3.28Å; E90-Y95 WeakPolarHBondContact O-CD2 3.31Å; E90-Y95 PolarHBondContact O-N 3.33Å; E90-Y95 VanDerWaalsContact O-N 3.08Å; M93-Y95 HydrophobicContact CB-CD2 4.05Å; M93-Y95 HydrophobicContact CB-CE2 4.2Å; Y95-K258 PolarHBondContact O-N 3.07Å; Y95-K327 HydrophobicContact CD1-CD 4.37Å; Y95-K327 VanDerWaalsContact CE1-CE 3.48Å; Y95-K327 HydrophobicContact CG-CD 4.34Å; Y95-P361 HydrophobicContact CD1-CB 4.21Å; Y95-P361 HydrophobicContact CE1-CB 4.35Å; Y95-V363 HydrophobicContact CD1-CG2 3.93Å; Y95-V363 HydrophobicContact CD2-CG2 4.19Å; Y95-V363 HydrophobicContact CE1-CB 4.48Å; Y95-V363 HydrophobicContact CE1-CG2 3.42Å; Y95-V363 VanDerWaalsContact CE1-CG2 3.42Å; Y95-V363 HydrophobicContact CE2-CG2 3.7Å; Y95-V363 HydrophobicContact CG-CG2 4.3Å
96	N	90.8	Very high	90.5	Very high	30 Å²	30	25.2 Å²	25.2	16%	0.16	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	136.1	157.1	-68.1	-13.4	0	0	0	108.8	K258 D320 T326 K327 N364	N96-K258 CarbonylContact C-O 3.57Å; N96-K258 WeakPolarHBondContact CA-O 3.33Å; N96-D320 PolarHBondContact ND2-OD2 2.98Å; N96-T326 VanDerWaalsContact CB-OG1 3.23Å; N96-T326 WeakPolarHBondContact CB-OG1 3.4Å; N96-T326 CarbonylContact O-C 3.43Å; N96-T326 VanDerWaalsContact O-CA 3.29Å; N96-T326 WeakPolarHBondContact O-CA 3.26Å; N96-T326 PolarHBondContact O-OG1 3.34Å; N96-K327 PolarHBondContact O-N 2.72Å; N96-N364 PolarHBondContact OD1-ND2 3.35Å
97	C	93.9	Very high	90.3	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	157	175.2	-59.9	0	0	0	0	112.1	I87 V91 K258 L259 N260 T326 K327	I87-C97 HydrophobicContact CG2-CB 3.39Å; V91-C97 HydrophobicContact CG2-CB 3.61Å; C97-K258 PolarHBondContact N-O 3.03Å; C97-L259 HydrophobicContact CB-CD1 3.98Å; C97-L259 WeakPolarHBondContact O-CA 3.49Å; C97-N260 PolarHBondContact O-N 3.5Å; C97-T326 WeakPolarHBondContact CA-OG1 3.3Å; C97-T326 PolarHBondContact N-OG1 3.35Å; C97-T326 VanDerWaalsContact N-OG1 3.12Å; C97-K327 CarbonylContact C-O 3.59Å; C97-K327 VanDerWaalsContact CA-O 3.22Å; C97-K327 WeakPolarHBondContact CA-O 3.44Å
98	T	93.6	Very high	90.2	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	135.1	178.5	-60.1	0	0	0	0	112.5	F100 N260 V262 S321 K327 T328 S329	T98-F100 HydrophobicContact CG2-CD1 4.38Å; T98-F100 HydrophobicContact CG2-CD2 4.09Å; T98-F100 HydrophobicContact CG2-CE1 3.75Å; T98-F100 HydrophobicContact CG2-CE2 3.48Å; T98-F100 VanDerWaalsContact CG2-CE2 3.48Å; T98-F100 HydrophobicContact CG2-CZ 3.28Å; T98-N260 CarbonylContact C-O 3.5Å; T98-N260 VanDerWaalsContact CA-O 3.29Å; T98-N260 WeakPolarHBondContact CA-O 3.3Å; T98-N260 HydrophobicContact CG2-CB 3.96Å; T98-N260 PolarHBondContact OG1-ND2 3.12Å; T98-V262 HydrophobicContact CG2-CG2 4.32Å; T98-S321 PolarHBondContact OG1-OG 2.6Å; T98-K327 PolarHBondContact N-O 2.8Å; T98-T328 WeakPolarHBondContact O-CA 3.34Å; T98-S329 PolarHBondContact O-N 3.44Å
99	V	95.1	Very high	90.2	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	124.7	176.8	-170.1	0	0	0	0	109.8	I87 M113 L259 N260 L261 V262 S329 I331	I87-V99 HydrophobicContact CD1-CG2 3.74Å; V99-M113 HydrophobicContact CB-CE 4.37Å; V99-M113 HydrophobicContact CG1-CE 4.03Å; V99-M113 WeakPolarHBondContact O-CE 3.17Å; V99-L259 HydrophobicContact CG2-CD1 4.37Å; V99-N260 PolarHBondContact N-O 3.33Å; V99-L261 HydrophobicContact CB-CD2 3.87Å; V99-L261 HydrophobicContact CG2-CD2 4Å; V99-V262 PolarHBondContact O-N 3.14Å; V99-S329 WeakPolarHBondContact CA-O 3.47Å; V99-I331 HydrophobicContact CG1-CD1 3.87Å; V99-I331 HydrophobicContact CG1-CG1 4.21Å
100	F	90.8	Very high	90.1	Very high	7 Å²	7	22.2 Å²	22.2	3%	0.031	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	138	179.4	-63.5	-73	0	0	0	111.9	T98 V262 L264 L318 L322 T328 S329 I330 I331	T98-F100 HydrophobicContact CG2-CD1 4.38Å; T98-F100 HydrophobicContact CG2-CD2 4.09Å; T98-F100 HydrophobicContact CG2-CE1 3.75Å; T98-F100 HydrophobicContact CG2-CE2 3.48Å; T98-F100 VanDerWaalsContact CG2-CE2 3.48Å; T98-F100 HydrophobicContact CG2-CZ 3.28Å; F100-V262 HydrophobicContact CD1-CB 3.56Å; F100-V262 HydrophobicContact CD1-CG1 3.73Å; F100-V262 HydrophobicContact CD1-CG2 4.1Å; F100-V262 HydrophobicContact CE1-CB 3.83Å; F100-V262 HydrophobicContact CE1-CG1 3.92Å; F100-V262 HydrophobicContact CE1-CG2 3.86Å; F100-L264 HydrophobicContact CD1-CD1 4.48Å; F100-L318 HydrophobicContact CD1-CD1 4.26Å; F100-L318 HydrophobicContact CE1-CD1 3.3Å; F100-L318 HydrophobicContact CE1-CD2 3.51Å; F100-L318 HydrophobicContact CE1-CG 3.94Å; F100-L318 HydrophobicContact CZ-CB 4.31Å; F100-L318 HydrophobicContact CZ-CD1 3.69Å; F100-L318 HydrophobicContact CZ-CD2 3.7Å; F100-L318 HydrophobicContact CZ-CG 4.07Å; F100-L322 HydrophobicContact CE2-CD2 4.34Å; F100-T328 HydrophobicContact CD2-CG2 3.64Å; F100-T328 HydrophobicContact CE2-CG2 3.51Å; F100-S329 PolarHBondContact N-O 3.07Å; F100-I330 HydrophobicContact CB-CG1 4.32Å; F100-I330 HydrophobicContact CD2-CG1 4Å; F100-I331 PolarHBondContact O-N 3.02Å
101	A	93.9	Very high	90.1	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	127.6	160.5	0	0	0	0	0	109.9	K109 M113 V262 L264 I331	A101-K109 HydrophobicContact CB-CB 3.87Å; A101-K109 HydrophobicContact CB-CG 4.23Å; A101-M113 HydrophobicContact CB-CE 3.9Å; A101-M113 HydrophobicContact CB-CG 4.02Å; A101-V262 PolarHBondContact N-O 3.12Å; A101-L264 VanDerWaalsContact O-CB 3.32Å; A101-L264 WeakPolarHBondContact O-CB 3.37Å; A101-L264 WeakPolarHBondContact O-CG 3.45Å; A101-L264 PolarHBondContact O-N 3.22Å; A101-I331 WeakPolarHBondContact CA-O 3.37Å
102	Y	92.6	Very high	90.1	Very high	21 Å²	21	23.2 Å²	23.2	8%	0.082	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	146.2	-177.2	178.9	-97.7	0	0	0	112.4	L264 L290 I331 A332 T333 T347 Y350	Y102-L264 HydrophobicContact CD2-CD1 3.9Å; Y102-L290 HydrophobicContact CD2-CD2 4.46Å; Y102-L290 HydrophobicContact CE2-CD1 4.49Å; Y102-L290 HydrophobicContact CE2-CD2 4.17Å; Y102-I331 PolarHBondContact N-O 2.87Å; Y102-A332 CarbonylContact O-C 3.42Å; Y102-A332 WeakPolarHBondContact O-CA 3.49Å; Y102-T333 PolarHBondContact O-N 3.16Å; Y102-T333 PolarHBondContact O-OG1 3.38Å; Y102-T347 HydrophobicContact CD1-CG2 4.1Å; Y102-T347 HydrophobicContact CE1-CG2 4.24Å; Y102-Y350 AromaticContact CD1-CD1 3.42Å; Y102-Y350 HydrophobicContact CD1-CD1 3.42Å; Y102-Y350 VanDerWaalsContact CD1-CD1 3.42Å; Y102-Y350 AromaticContact CD1-CE1 3.59Å; Y102-Y350 HydrophobicContact CD1-CE1 3.59Å; Y102-Y350 HydrophobicContact CD1-CG 4.14Å; Y102-Y350 HydrophobicContact CD2-CE1 4.03Å; Y102-Y350 AromaticContact CE1-CD1 3.24Å; Y102-Y350 HydrophobicContact CE1-CD1 3.24Å; Y102-Y350 HydrophobicContact CE1-CD2 4.08Å; Y102-Y350 AromaticContact CE1-CE1 3.68Å; Y102-Y350 HydrophobicContact CE1-CE1 3.68Å; Y102-Y350 HydrophobicContact CE1-CE2 4.44Å; Y102-Y350 AromaticContact CE1-CG 3.46Å; Y102-Y350 HydrophobicContact CE1-CG 3.46Å; Y102-Y350 VanDerWaalsContact CE1-CG 3.46Å; Y102-Y350 HydrophobicContact CE2-CD1 4.42Å; Y102-Y350 HydrophobicContact CE2-CE1 4.1Å; Y102-Y350 HydrophobicContact CE2-CE2 4.21Å; Y102-Y350 AromaticContact CE2-CZ 3.98Å; Y102-Y350 HydrophobicContact CG-CD1 4.1Å; Y102-Y350 AromaticContact CG-CE1 3.77Å; Y102-Y350 HydrophobicContact CG-CE1 3.77Å; Y102-Y350 AromaticContact CZ-CD1 3.79Å; Y102-Y350 AromaticContact CZ-CD2 3.85Å; Y102-Y350 AromaticContact CZ-CE1 3.93Å; Y102-Y350 AromaticContact CZ-CE2 3.99Å; Y102-Y350 AromaticContact CZ-CG 3.74Å
103	G	91.3	Very high	90.3	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	13%	0.13	C	C	.	.	S	Bend	trans	140	-176.5	178.9	0	0	0	0	0	113.1	K109 S267	G103-K109 WeakPolarHBondContact O-CE 3.33Å; G103-K109 PolarHBondContact O-NZ 3.13Å; G103-S267 PolarHBondContact O-N 3.1Å; G103-S267 PolarHBondContact O-OG 2.97Å
104	Q	87.4	Confident	90.3	Very high	24 Å²	24	20.3 Å²	20.3	11%	0.112	12%	0.12	C	C	.	.	S	Bend	trans	-62.7	153.2	-177.9	170.3	-177.7	41.2	0	0	113	T107 K109 S267 E268 E343	Q104-T107 HydrophobicContact CB-CG2 3.73Å; Q104-T107 HydrophobicContact CG-CG2 4.37Å; Q104-T107 WeakPolarHBondContact O-CB 3.4Å; Q104-T107 WeakPolarHBondContact O-CG2 3.28Å; Q104-T107 PolarHBondContact O-N 2.87Å; Q104-T107 PolarHBondContact O-OG1 3.28Å; Q104-K109 PolarHBondContact O-NZ 3.47Å; Q104-K109 VanDerWaalsContact O-NZ 3.16Å; Q104-S267 PolarHBondContact N-OG 3.01Å; Q104-E268 WeakPolarHBondContact CA-OE2 3.3Å; Q104-E268 HydrophobicContact CG-CB 4.15Å; Q104-E343 HydrophobicContact CB-CB 4.26Å; Q104-E343 HydrophobicContact CG-CB 4.49Å
105	T	86.3	Confident	90.3	Very high	48 Å²	48	21.2 Å²	21.2	29%	0.294	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	135	169	-69.2	0	0	0	0	111.7	T107 G266 E268	T105-T107 VanDerWaalsContact C-N 3.27Å; T105-T107 PolarHBondContact O-N 3.06Å; T105-G266 WeakPolarHBondContact OG1-CA 3.45Å; T105-E268 WeakPolarHBondContact CB-OE1 3.4Å; T105-E268 PolarHBondContact N-OE2 3.03Å; T105-E268 PolarHBondContact OG1-OE1 3.31Å; T105-E268 PolarHBondContact OG1-OE2 3.11Å
106	G	83.1	Confident	89.9	Confident	55 Å²	55	25.7 Å²	25.7	57%	0.567	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	72	14	-178.8	0	0	0	0	0	115.1	R25	R25-G106 PolarHBondContact NE-O 3.09Å; R25-G106 PolarHBondContact NH2-O 3.39Å
107	T	88.6	Confident	88.8	Confident	4 Å²	4	31 Å²	31	3%	0.025	17%	0.168	C	C	.	.	S	Bend	trans	-83.8	-11.9	166.4	56.5	0	0	0	0	113.7	R25 Q104 T105 T333	R25-T107 WeakPolarHBondContact CG-O 3.5Å; Q104-T107 HydrophobicContact CB-CG2 3.73Å; Q104-T107 HydrophobicContact CG-CG2 4.37Å; Q104-T107 WeakPolarHBondContact O-CB 3.4Å; Q104-T107 WeakPolarHBondContact O-CG2 3.28Å; Q104-T107 PolarHBondContact O-N 2.87Å; Q104-T107 PolarHBondContact O-OG1 3.28Å; T105-T107 VanDerWaalsContact C-N 3.27Å; T105-T107 PolarHBondContact O-N 3.06Å; T107-T333 WeakPolarHBondContact CB-O 3.27Å; T107-T333 PolarHBondContact OG1-O 3.46Å; T107-T333 PolarHBondContact OG1-OG1 2.9Å
108	G	89	Confident	87.4	Confident	17 Å²	17	32.6 Å²	32.6	18%	0.175	18%	0.178	C	C	.	.	S	Bend	trans	105.7	26.5	176.7	0	0	0	0	0	116.1	T112	G108-T112 WeakPolarHBondContact O-CB 3.49Å; G108-T112 PolarHBondContact O-N 3.24Å; G108-T112 PolarHBondContact O-OG1 3.32Å
109	K	91.4	Very high	85.5	Confident	11 Å²	11	37.5 Å²	37.5	5%	0.048	21%	0.21	C	C	.	.	H	α-helix	trans	-57.6	-63.1	173.7	-61.4	-171	-63.4	-75.2	0	112.3	A101 G103 Q104 F111 T112 M113 D263 L264 A265 T333	A101-K109 HydrophobicContact CB-CB 3.87Å; A101-K109 HydrophobicContact CB-CG 4.23Å; G103-K109 WeakPolarHBondContact O-CE 3.33Å; G103-K109 PolarHBondContact O-NZ 3.13Å; Q104-K109 PolarHBondContact O-NZ 3.47Å; Q104-K109 VanDerWaalsContact O-NZ 3.16Å; K109-F111 VanDerWaalsContact C-N 3.3Å; K109-F111 PolarHBondContact O-N 3.16Å; K109-T112 WeakPolarHBondContact O-CA 3.48Å; K109-T112 VanDerWaalsContact O-CB 3.32Å; K109-T112 WeakPolarHBondContact O-CB 3.48Å; K109-T112 PolarHBondContact O-N 3.43Å; K109-M113 PolarHBondContact O-N 3.25Å; K109-D263 WeakPolarHBondContact CB-OD1 3.42Å; K109-L264 WeakPolarHBondContact CE-O 3.25Å; K109-A265 WeakPolarHBondContact CE-O 3.42Å; K109-A265 PolarHBondContact NZ-O 3.2Å; K109-T333 WeakPolarHBondContact CG-OG1 3.4Å
110	T	89.1	Confident	83.3	Confident	47 Å²	47	46 Å²	46	29%	0.288	26%	0.255	S	S	.	.	H	α-helix	trans	-62	-35.3	177.4	-38.5	0	0	0	0	112.1	T112 M113 E114 G115 D263	T110-T112 VanDerWaalsContact C-N 3.25Å; T110-T112 PolarHBondContact O-N 3.26Å; T110-M113 PolarHBondContact O-N 3.46Å; T110-E114 HydrophobicContact CG2-CB 4.3Å; T110-E114 VanDerWaalsContact CG2-CD 3.47Å; T110-E114 HydrophobicContact CG2-CG 4Å; T110-E114 PolarHBondContact O-N 3.47Å; T110-G115 PolarHBondContact O-N 2.93Å; T110-D263 WeakPolarHBondContact CB-OD2 3.39Å; T110-D263 WeakPolarHBondContact CG2-OD2 3.46Å; T110-D263 PolarHBondContact N-OD1 3.24Å; T110-D263 VanDerWaalsContact N-OD1 3.08Å; T110-D263 PolarHBondContact OG1-OD1 3.24Å; T110-D263 PolarHBondContact OG1-OD2 3.44Å
111	F	90.2	Very high	81.2	Confident	61 Å²	61	47.4 Å²	47.4	27%	0.268	27%	0.268	S	S	.	.	H	α-helix	trans	-61.8	-31.1	170.1	179.6	-92.6	0	0	0	112.7	Q76 K109 G115 E116	Q76-F111 HydrophobicContact CG-CE1 4.44Å; Q76-F111 HydrophobicContact CG-CZ 4.43Å; Q76-F111 PolarHBondContact NE2-O 3.47Å; K109-F111 VanDerWaalsContact C-N 3.3Å; K109-F111 PolarHBondContact O-N 3.16Å; F111-G115 VanDerWaalsContact O-CA 3.27Å; F111-G115 WeakPolarHBondContact O-CA 3.42Å; F111-G115 PolarHBondContact O-N 2.79Å; F111-E116 HydrophobicContact CD2-CB 4.37Å; F111-E116 HydrophobicContact CD2-CG 3.87Å; F111-E116 WeakPolarHBondContact CD2-OE1 3.4Å; F111-E116 HydrophobicContact CE2-CB 4.17Å; F111-E116 HydrophobicContact CE2-CG 4.09Å
112	T	93.2	Very high	79	Confident	2 Å²	2	57.2 Å²	57.2	1%	0.012	31%	0.314	C	S	.	.	H	α-helix	trans	-78.3	-37.3	175.4	-57.7	0	0	0	0	111.3	R23 G108 K109 T110 I133 I331	R23-T112 PolarHBondContact NH1-OG1 3.2Å; G108-T112 WeakPolarHBondContact O-CB 3.49Å; G108-T112 PolarHBondContact O-N 3.24Å; G108-T112 PolarHBondContact O-OG1 3.32Å; K109-T112 WeakPolarHBondContact O-CA 3.48Å; K109-T112 VanDerWaalsContact O-CB 3.32Å; K109-T112 WeakPolarHBondContact O-CB 3.48Å; K109-T112 PolarHBondContact O-N 3.43Å; T110-T112 VanDerWaalsContact C-N 3.25Å; T110-T112 PolarHBondContact O-N 3.26Å; T112-I133 HydrophobicContact CG2-CD1 3.72Å; T112-I133 HydrophobicContact CG2-CG1 4.44Å; T112-I133 WeakPolarHBondContact O-CB 3.29Å; T112-I133 VanDerWaalsContact O-CG1 3.29Å; T112-I133 WeakPolarHBondContact O-CG1 3.38Å; T112-I133 PolarHBondContact O-N 3.41Å; T112-I331 HydrophobicContact CG2-CD1 4.09Å; T112-I331 HydrophobicContact CG2-CG2 4.35Å
113	M	91.8	Very high	77.3	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-81.8	-59.3	-178.9	-72.4	-62.3	179.8	0	0	113.5	V99 A101 K109 T110 G132 I133 I134 L261 D263	V99-M113 HydrophobicContact CB-CE 4.37Å; V99-M113 HydrophobicContact CG1-CE 4.03Å; V99-M113 WeakPolarHBondContact O-CE 3.17Å; A101-M113 HydrophobicContact CB-CE 3.9Å; A101-M113 HydrophobicContact CB-CG 4.02Å; K109-M113 PolarHBondContact O-N 3.25Å; T110-M113 PolarHBondContact O-N 3.46Å; M113-G132 CarbonylContact O-C 3.53Å; M113-I133 PolarHBondContact O-N 3.09Å; M113-I133 HydrophobicContact SD-CB 4.33Å; M113-I133 HydrophobicContact SD-CD1 4.33Å; M113-I133 HydrophobicContact SD-CG2 4.43Å; M113-I134 HydrophobicContact CB-CD1 4.03Å; M113-I134 HydrophobicContact CB-CG1 4.46Å; M113-I134 WeakPolarHBondContact O-CB 3.44Å; M113-I134 WeakPolarHBondContact O-CG1 3.36Å; M113-I134 PolarHBondContact O-N 3.03Å; M113-L261 HydrophobicContact SD-CB 4.32Å; M113-D263 HydrophobicContact CB-CB 4.29Å; M113-D263 HydrophobicContact CG-CB 4.13Å
114	E	87.6	Confident	75.8	Confident	74 Å²	74	64.4 Å²	64.4	35%	0.346	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-49	-178.5	-60.6	175.9	-164.6	0	0	111	T110 G132 I134 R219	T110-E114 HydrophobicContact CG2-CB 4.3Å; T110-E114 VanDerWaalsContact CG2-CD 3.47Å; T110-E114 HydrophobicContact CG2-CG 4Å; T110-E114 PolarHBondContact O-N 3.47Å; E114-G132 WeakPolarHBondContact O-CA 3.48Å; E114-G132 PolarHBondContact O-N 3Å; E114-I134 HydrophobicContact CG-CD1 4.26Å; E114-R219 IonicContact OE1-CZ 3.21Å; E114-R219 IonicContact OE1-NH1 3.71Å; E114-R219 PolarHBondContact OE1-NH1 2.93Å
115	G	87.3	Confident	74.3	Confident	19 Å²	19	67.4 Å²	67.4	20%	0.196	36%	0.362	C	S	.	.	B	Isolated β-bridge	trans	97.6	-164.9	-174.6	0	0	0	0	0	113.9	T110 F111 L130	T110-G115 PolarHBondContact O-N 2.93Å; F111-G115 VanDerWaalsContact O-CA 3.27Å; F111-G115 WeakPolarHBondContact O-CA 3.42Å; F111-G115 PolarHBondContact O-N 2.79Å; G115-L130 WeakPolarHBondContact CA-O 3.28Å
116	E	80.6	Confident	73	Confident	119 Å²	119	67 Å²	67	56%	0.556	36%	0.357	S	S	*	.			trans	-126.3	157.7	168.5	-80.6	171.2	-151.5	0	0	109.1	F111 L130	F111-E116 HydrophobicContact CD2-CB 4.37Å; F111-E116 HydrophobicContact CD2-CG 3.87Å; F111-E116 WeakPolarHBondContact CD2-OE1 3.4Å; F111-E116 HydrophobicContact CE2-CB 4.17Å; F111-E116 HydrophobicContact CE2-CG 4.09Å; E116-L130 HydrophobicContact CB-CB 4.32Å; E116-L130 HydrophobicContact CB-CD1 4.44Å; E116-L130 PolarHBondContact N-O 3.05Å; E116-L130 CarbonylContact O-C 3.59Å; E116-L130 WeakPolarHBondContact O-CB 3.33Å
117	R	68.7	Low	72.3	Confident	142 Å²	142	71 Å²	71	54%	0.536	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-100	127.9	174.4	-172.8	-174.1	-173.6	165.8	2.3	109.2	P119 W125	R117-P119 VanDerWaalsContact O-CD 3.29Å; R117-P119 WeakPolarHBondContact O-CD 3.3Å; R117-W125 HydrophobicContact CB-CH2 3.9Å; R117-W125 HydrophobicContact CB-CZ3 3.94Å; R117-W125 HydrophobicContact CG-CH2 3.96Å; R117-W125 HydrophobicContact CG-CZ2 4.21Å; R117-W125 HydrophobicContact CG-CZ3 4.12Å
118	T	64.9	Low	71.7	Confident	33 Å²	33	71 Å²	71	20%	0.202	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-63.1	118.7	176.9	-62.8	0	0	0	0	110.5	A121 D128	T118-A121 HydrophobicContact CG2-CB 3.96Å; T118-D128 WeakPolarHBondContact CB-OD2 3.46Å; T118-D128 PolarHBondContact N-OD2 2.91Å; T118-D128 PolarHBondContact OG1-OD1 3.08Å; T118-D128 PolarHBondContact OG1-OD2 2.83Å
119	P	52	Low	71.3	Confident	104 Å²	104	73.8 Å²	73.8	68%	0.675	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	142.7	179.4	-20.9	33.5	0	0	0	112.1	R117 A121	R117-P119 VanDerWaalsContact O-CD 3.29Å; R117-P119 WeakPolarHBondContact O-CD 3.3Å; P119-A121 PolarHBondContact O-N 3.45Å; P119-A121 VanDerWaalsContact O-N 3.15Å
120	N	49	Very low	71	Confident	177 Å²	177	76 Å²	76	95%	0.947	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.4	11.2	170.2	-50.1	-26.3	0	0	0	117
121	A	47.1	Very low	70.8	Confident	37 Å²	37	73.9 Å²	73.9	31%	0.306	38%	0.375	S	S	.	.			trans	-106.5	142	174.6	0	0	0	0	0	112	T118 P119 F123	T118-A121 HydrophobicContact CG2-CB 3.96Å; P119-A121 PolarHBondContact O-N 3.45Å; P119-A121 VanDerWaalsContact O-N 3.15Å; A121-F123 VanDerWaalsContact C-N 3.26Å; A121-F123 HydrophobicContact CB-CD2 3.51Å; A121-F123 HydrophobicContact CB-CE2 3.63Å; A121-F123 PolarHBondContact O-N 2.55Å
122	Q	48.2	Very low	70.8	Confident	207 Å²	207	71 Å²	71	97%	0.967	36%	0.363	S	S	*	.			trans	-89.3	34.5	177.6	-64.9	-173.6	-1	0	0	113
123	F	56.7	Low	70.8	Confident	104 Å²	104	71.1 Å²	71.1	46%	0.456	36%	0.363	S	S	.	.			trans	-67.5	141.7	168.5	-62.5	-63	0	0	0	109.6	A121 E127	A121-F123 VanDerWaalsContact C-N 3.26Å; A121-F123 HydrophobicContact CB-CD2 3.51Å; A121-F123 HydrophobicContact CB-CE2 3.63Å; A121-F123 PolarHBondContact O-N 2.55Å; F123-E127 HydrophobicContact CB-CB 4.5Å; F123-E127 HydrophobicContact CD1-CB 4.36Å
124	T	60.2	Low	70.7	Confident	67 Å²	67	71.8 Å²	71.8	41%	0.411	37%	0.367	S	S	.	.			trans	-64.5	153.5	158.5	62.4	0	0	0	0	108.2	E126 E127 D128	T124-E126 PolarHBondContact O-N 2.76Å; T124-E127 PolarHBondContact O-N 3.38Å; T124-E127 VanDerWaalsContact O-N 3.09Å; T124-D128 PolarHBondContact O-N 3.21Å
125	W	56.3	Low	70.7	Confident	87 Å²	87	68.7 Å²	68.7	33%	0.33	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-7.9	177.4	-68.9	89.9	0	0	0	113.6	R117 Y209	R117-W125 HydrophobicContact CB-CH2 3.9Å; R117-W125 HydrophobicContact CB-CZ3 3.94Å; R117-W125 HydrophobicContact CG-CH2 3.96Å; R117-W125 HydrophobicContact CG-CZ2 4.21Å; R117-W125 HydrophobicContact CG-CZ3 4.12Å; W125-Y209 HydrophobicContact CB-CD1 3.82Å; W125-Y209 HydrophobicContact CB-CE1 3.38Å; W125-Y209 HydrophobicContact CD2-CD1 4.5Å; W125-Y209 AromaticContact CG-CD1 3.99Å; W125-Y209 HydrophobicContact CG-CD1 3.99Å; W125-Y209 HydrophobicContact CG-CE1 4.07Å
126	E	58.8	Low	70.7	Confident	40 Å²	40	69.1 Å²	69.1	19%	0.187	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-43.7	177.1	-45	-174.8	110.2	0	0	110.5	T124 H139 K205	T124-E126 PolarHBondContact O-N 2.76Å; E126-H139 IonicContact OE1-CE1 3.01Å; E126-H139 PolarHBondContact OE1-CE1 3.41Å; E126-H139 IonicContact OE1-ND1 3.89Å; E126-H139 PolarHBondContact OE1-ND1 3.17Å; E126-K205 WeakPolarHBondContact OE1-CD 3.45Å; E126-K205 WeakPolarHBondContact OE1-CE 3.49Å; E126-K205 IonicContact OE1-NZ 3.04Å; E126-K205 PolarHBondContact OE1-NZ 3.28Å; E126-K205 IonicContact OE2-NZ 3.65Å; E126-K205 PolarHBondContact OE2-NZ 3.19Å
127	E	68.2	Low	71.2	Confident	138 Å²	138	63.4 Å²	63.4	65%	0.645	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-22.9	-178.7	-63.8	-170	151.2	0	0	114	F123 T124 P129	F123-E127 HydrophobicContact CB-CB 4.5Å; F123-E127 HydrophobicContact CD1-CB 4.36Å; T124-E127 PolarHBondContact O-N 3.38Å; T124-E127 VanDerWaalsContact O-N 3.09Å; E127-P129 WeakPolarHBondContact O-CD 3.43Å; E127-P129 VanDerWaalsContact O-N 3.11Å
128	D	76.6	Confident	72	Confident	6 Å²	6	56.8 Å²	56.8	3%	0.032	30%	0.297	C	S	.	.			trans	-54.2	118.1	-174.9	-170.3	-30.5	0	0	0	111.1	T118 T124 L130 A131 R136	T118-D128 WeakPolarHBondContact CB-OD2 3.46Å; T118-D128 PolarHBondContact N-OD2 2.91Å; T118-D128 PolarHBondContact OG1-OD1 3.08Å; T118-D128 PolarHBondContact OG1-OD2 2.83Å; T124-D128 PolarHBondContact O-N 3.21Å; D128-L130 PolarHBondContact O-N 3.4Å; D128-L130 VanDerWaalsContact O-N 3.15Å; D128-L130 WeakPolarHBondContact OD1-CB 3.35Å; D128-L130 PolarHBondContact OD1-N 3.09Å; D128-A131 HydrophobicContact CB-CB 4.44Å; D128-A131 WeakPolarHBondContact O-CB 3.36Å; D128-A131 PolarHBondContact O-N 3.32Å; D128-R136 PolarHBondContact O-NH2 3.49Å
129	P	79.9	Confident	72.9	Confident	75 Å²	75	57.1 Å²	57.1	49%	0.487	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-13.9	-177.2	27.7	-35.7	0	0	0	113.8	Q76 E127 R136	Q76-P129 WeakPolarHBondContact CG-O 3.42Å; E127-P129 WeakPolarHBondContact O-CD 3.43Å; E127-P129 VanDerWaalsContact O-N 3.11Å; P129-R136 PolarHBondContact O-NH2 3.44Å
130	L	84.1	Confident	74.6	Confident	58 Å²	58	53.9 Å²	53.9	30%	0.304	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-12	178.9	-58.7	-176.8	0	0	0	113.9	Q76 G115 E116 D128 G132	Q76-L130 PolarHBondContact NE2-O 2.96Å; G115-L130 WeakPolarHBondContact CA-O 3.28Å; E116-L130 HydrophobicContact CB-CB 4.32Å; E116-L130 HydrophobicContact CB-CD1 4.44Å; E116-L130 PolarHBondContact N-O 3.05Å; E116-L130 CarbonylContact O-C 3.59Å; E116-L130 WeakPolarHBondContact O-CB 3.33Å; D128-L130 PolarHBondContact O-N 3.4Å; D128-L130 VanDerWaalsContact O-N 3.15Å; D128-L130 WeakPolarHBondContact OD1-CB 3.35Å; D128-L130 PolarHBondContact OD1-N 3.09Å; L130-G132 PolarHBondContact O-N 3.47Å
131	A	86.4	Confident	76.5	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.008	23%	0.227	C	C	.	.	B	Isolated β-bridge	trans	-58.6	136.8	176.3	0	0	0	0	0	112	Q76 D128 P135 R136	Q76-A131 VanDerWaalsContact CB-O 3.27Å; Q76-A131 WeakPolarHBondContact CB-O 3.46Å; Q76-A131 WeakPolarHBondContact CG-O 3.42Å; D128-A131 HydrophobicContact CB-CB 4.44Å; D128-A131 WeakPolarHBondContact O-CB 3.36Å; D128-A131 PolarHBondContact O-N 3.32Å; A131-P135 HydrophobicContact CB-CG 4.01Å; A131-R136 VanDerWaalsContact O-CZ 3.26Å; A131-R136 PolarHBondContact O-NE 3.04Å; A131-R136 PolarHBondContact O-NH2 3.45Å
132	G	90.3	Very high	78.3	Confident	2 Å²	2	44.6 Å²	44.6	2%	0.021	22%	0.216	C	C	.	.			trans	-83.5	-165	-174.5	0	0	0	0	0	114.5	M113 E114 L130 R136	M113-G132 CarbonylContact O-C 3.53Å; E114-G132 WeakPolarHBondContact O-CA 3.48Å; E114-G132 PolarHBondContact O-N 3Å; L130-G132 PolarHBondContact O-N 3.47Å; G132-R136 VanDerWaalsContact O-CG 3.3Å; G132-R136 WeakPolarHBondContact O-CG 3.48Å
133	I	92.6	Very high	80.1	Confident	4 Å²	4	39 Å²	39	2%	0.021	19%	0.19	C	C	.	.	H	α-helix	trans	-63	-46.9	179.8	-71.8	171.2	0	0	0	112.1	V84 T112 M113 R136 T137 L261 I331	V84-I133 HydrophobicContact CG1-CG2 4.09Å; V84-I133 HydrophobicContact CG2-CB 4.49Å; V84-I133 HydrophobicContact CG2-CD1 3.79Å; V84-I133 HydrophobicContact CG2-CG1 3.91Å; V84-I133 HydrophobicContact CG2-CG2 3.78Å; T112-I133 HydrophobicContact CG2-CD1 3.72Å; T112-I133 HydrophobicContact CG2-CG1 4.44Å; T112-I133 WeakPolarHBondContact O-CB 3.29Å; T112-I133 VanDerWaalsContact O-CG1 3.29Å; T112-I133 WeakPolarHBondContact O-CG1 3.38Å; T112-I133 PolarHBondContact O-N 3.41Å; M113-I133 PolarHBondContact O-N 3.09Å; M113-I133 HydrophobicContact SD-CB 4.33Å; M113-I133 HydrophobicContact SD-CD1 4.33Å; M113-I133 HydrophobicContact SD-CG2 4.43Å; I133-R136 PolarHBondContact O-N 3.48Å; I133-T137 WeakPolarHBondContact O-CB 3.45Å; I133-T137 PolarHBondContact O-N 2.93Å; I133-T137 PolarHBondContact O-OG1 3.02Å; I133-L261 HydrophobicContact CG2-CD1 4.04Å; I133-L261 HydrophobicContact CG2-CD2 3.92Å; I133-I331 HydrophobicContact CD1-CD1 3.57Å
134	I	90	Very high	81.5	Confident	13 Å²	13	35.3 Å²	35.3	7%	0.067	17%	0.174	C	C	.	.	H	α-helix	trans	-56.7	-59.2	-173.8	-66.7	169.5	0	0	0	112	M113 E114 R136 T137 L138 L212 F237 L261	M113-I134 HydrophobicContact CB-CD1 4.03Å; M113-I134 HydrophobicContact CB-CG1 4.46Å; M113-I134 WeakPolarHBondContact O-CB 3.44Å; M113-I134 WeakPolarHBondContact O-CG1 3.36Å; M113-I134 PolarHBondContact O-N 3.03Å; E114-I134 HydrophobicContact CG-CD1 4.26Å; I134-R136 PolarHBondContact O-N 2.86Å; I134-T137 PolarHBondContact O-N 3.03Å; I134-L138 HydrophobicContact CG2-CD1 3.75Å; I134-L138 VanDerWaalsContact O-CD1 3.23Å; I134-L138 WeakPolarHBondContact O-CD1 3.32Å; I134-L138 WeakPolarHBondContact O-CG 3.49Å; I134-L138 PolarHBondContact O-N 3.41Å; I134-L212 HydrophobicContact CG2-CD1 3.92Å; I134-L212 HydrophobicContact CG2-CD2 3.7Å; I134-L212 HydrophobicContact CG2-CG 4.5Å; I134-F237 HydrophobicContact CD1-CB 4.33Å; I134-F237 HydrophobicContact CG1-CD1 4.37Å; I134-F237 HydrophobicContact CG2-CD1 3.88Å; I134-F237 HydrophobicContact CG2-CE1 3.81Å; I134-F237 HydrophobicContact CG2-CG 4.41Å; I134-F237 HydrophobicContact CG2-CZ 4.29Å; I134-L261 HydrophobicContact CB-CD1 4.34Å; I134-L261 HydrophobicContact CG1-CB 4.14Å; I134-L261 HydrophobicContact CG1-CD1 3.74Å
135	P	87	Confident	82.7	Confident	9 Å²	9	32.1 Å²	32.1	6%	0.058	16%	0.155	C	C	.	.	H	α-helix	trans	-62	-40.3	-179.5	23.1	-34	0	0	0	112.8	A131 T137 L138 H139 Y209	A131-P135 HydrophobicContact CB-CG 4.01Å; P135-T137 PolarHBondContact O-N 3.01Å; P135-L138 PolarHBondContact O-N 3.38Å; P135-H139 PolarHBondContact O-N 2.97Å; P135-Y209 HydrophobicContact CB-CE1 4.08Å
136	R	87.9	Confident	84	Confident	28 Å²	28	31.8 Å²	31.8	11%	0.106	17%	0.165	C	C	.	.	H	α-helix	trans	-64.5	-39.7	178.2	-68.4	-175.8	-164.2	-67.6	-5.6	112.9	Y80 D128 P129 A131 G132 I133 I134 L138 Q140	Y80-R136 HydrophobicContact CD1-CB 4.34Å; Y80-R136 HydrophobicContact CD2-CB 3.67Å; Y80-R136 HydrophobicContact CE1-CB 4.27Å; Y80-R136 HydrophobicContact CE2-CB 3.57Å; Y80-R136 HydrophobicContact CG-CB 4.08Å; Y80-R136 PolarHBondContact OH-O 2.92Å; D128-R136 PolarHBondContact O-NH2 3.49Å; P129-R136 PolarHBondContact O-NH2 3.44Å; A131-R136 VanDerWaalsContact O-CZ 3.26Å; A131-R136 PolarHBondContact O-NE 3.04Å; A131-R136 PolarHBondContact O-NH2 3.45Å; G132-R136 VanDerWaalsContact O-CG 3.3Å; G132-R136 WeakPolarHBondContact O-CG 3.48Å; I133-R136 PolarHBondContact O-N 3.48Å; I134-R136 PolarHBondContact O-N 2.86Å; R136-L138 VanDerWaalsContact C-N 3.31Å; R136-L138 PolarHBondContact O-N 3.45Å; R136-Q140 WeakPolarHBondContact O-CB 3.47Å; R136-Q140 PolarHBondContact O-N 3.2Å
137	T	89.9	Confident	85.1	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-59.6	-46.1	176.1	-55.8	0	0	0	0	110.2	Y80 I133 I134 P135 Q140 I141 L259 L261	Y80-T137 WeakPolarHBondContact OH-CA 3.45Å; I133-T137 WeakPolarHBondContact O-CB 3.45Å; I133-T137 PolarHBondContact O-N 2.93Å; I133-T137 PolarHBondContact O-OG1 3.02Å; I134-T137 PolarHBondContact O-N 3.03Å; P135-T137 PolarHBondContact O-N 3.01Å; T137-Q140 PolarHBondContact O-N 3.46Å; T137-I141 HydrophobicContact CG2-CD1 3.89Å; T137-I141 HydrophobicContact CG2-CG1 4.49Å; T137-I141 WeakPolarHBondContact O-CB 3.34Å; T137-I141 WeakPolarHBondContact O-CG1 3.18Å; T137-I141 PolarHBondContact O-N 3.14Å; T137-L259 HydrophobicContact CG2-CD2 3.43Å; T137-L259 VanDerWaalsContact CG2-CD2 3.43Å; T137-L261 HydrophobicContact CG2-CD1 4.3Å
138	L	86.4	Confident	85.5	Confident	2 Å²	2	35.7 Å²	35.7	1%	0.01	19%	0.187	C	C	.	.	H	α-helix	trans	-71.1	-41.8	-175.7	-66.7	150.4	0	0	0	111.5	I134 P135 R136 I141 F142 V156 V208 L212 F237 V239	I134-L138 HydrophobicContact CG2-CD1 3.75Å; I134-L138 VanDerWaalsContact O-CD1 3.23Å; I134-L138 WeakPolarHBondContact O-CD1 3.32Å; I134-L138 WeakPolarHBondContact O-CG 3.49Å; I134-L138 PolarHBondContact O-N 3.41Å; P135-L138 PolarHBondContact O-N 3.38Å; R136-L138 VanDerWaalsContact C-N 3.31Å; R136-L138 PolarHBondContact O-N 3.45Å; L138-I141 WeakPolarHBondContact O-CB 3.35Å; L138-I141 PolarHBondContact O-N 3.3Å; L138-F142 WeakPolarHBondContact O-CD2 3.4Å; L138-F142 PolarHBondContact O-N 3.09Å; L138-V156 HydrophobicContact CD2-CG1 3.99Å; L138-V208 HydrophobicContact CB-CG1 3.76Å; L138-V208 HydrophobicContact CB-CG2 4.38Å; L138-V208 HydrophobicContact CD1-CG1 3.37Å; L138-V208 HydrophobicContact CD2-CG1 4.19Å; L138-V208 HydrophobicContact CG-CG1 3.93Å; L138-L212 HydrophobicContact CD1-CD1 4Å; L138-F237 HydrophobicContact CD1-CE1 3.6Å; L138-F237 HydrophobicContact CD1-CZ 3.61Å; L138-F237 HydrophobicContact CD2-CE1 4.09Å; L138-F237 HydrophobicContact CD2-CZ 4.11Å; L138-F237 HydrophobicContact CG-CE1 4.21Å; L138-F237 HydrophobicContact CG-CZ 4.42Å; L138-V239 HydrophobicContact CD2-CG1 4.25Å; L138-V239 HydrophobicContact CD2-CG2 3.89Å
139	H	83.6	Confident	85.4	Confident	41 Å²	41	38.7 Å²	38.7	19%	0.19	22%	0.22	C	C	.	.	H	α-helix	trans	-56.9	-52.8	170.8	174.9	81	0	0	0	111.4	E126 P135 I141 F142 E143	E126-H139 IonicContact OE1-CE1 3.01Å; E126-H139 PolarHBondContact OE1-CE1 3.41Å; E126-H139 IonicContact OE1-ND1 3.89Å; E126-H139 PolarHBondContact OE1-ND1 3.17Å; P135-H139 PolarHBondContact O-N 2.97Å; H139-I141 VanDerWaalsContact C-N 3.29Å; H139-I141 PolarHBondContact O-N 3.02Å; H139-F142 PolarHBondContact O-N 3.32Å; H139-F142 VanDerWaalsContact O-N 3.1Å; H139-E143 IonicContact CD2-OE2 3.18Å; H139-E143 IonicContact CE1-OE1 3.19Å; H139-E143 IonicContact NE2-OE1 2.74Å; H139-E143 PolarHBondContact NE2-OE1 2.96Å; H139-E143 IonicContact NE2-OE2 2.71Å; H139-E143 PolarHBondContact O-N 3.15Å
140	Q	86.9	Confident	85.1	Confident	35 Å²	35	36.9 Å²	36.9	16%	0.164	21%	0.207	C	C	.	.	H	α-helix	trans	-67.5	-25.3	-179.5	-166.4	174.3	44.9	0	0	113.7	Y80 L88 R136 T137 K144	Y80-Q140 VanDerWaalsContact CE1-OE1 3.32Å; Y80-Q140 WeakPolarHBondContact OH-CB 3.4Å; Y80-Q140 PolarHBondContact OH-OE1 2.66Å; L88-Q140 HydrophobicContact CD2-CB 3.9Å; L88-Q140 HydrophobicContact CD2-CG 3.88Å; R136-Q140 WeakPolarHBondContact O-CB 3.47Å; R136-Q140 PolarHBondContact O-N 3.2Å; T137-Q140 PolarHBondContact O-N 3.46Å; Q140-K144 HydrophobicContact CG-CD 4.06Å; Q140-K144 HydrophobicContact CG-CG 4.12Å; Q140-K144 WeakPolarHBondContact O-CB 3.45Å; Q140-K144 WeakPolarHBondContact O-CG 3.25Å; Q140-K144 PolarHBondContact O-N 3.49Å
141	I	88.7	Confident	85.2	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-60.4	-51.9	169.2	-81.4	166.2	0	0	0	110.1	L88 T137 L138 H139 L145 V154 V239 I241	L88-I141 HydrophobicContact CD1-CD1 4.04Å; L88-I141 HydrophobicContact CD1-CG1 3.42Å; L88-I141 VanDerWaalsContact CD1-CG1 3.42Å; L88-I141 HydrophobicContact CD2-CG1 4.15Å; L88-I141 HydrophobicContact CG-CG1 4.43Å; T137-I141 HydrophobicContact CG2-CD1 3.89Å; T137-I141 HydrophobicContact CG2-CG1 4.49Å; T137-I141 WeakPolarHBondContact O-CB 3.34Å; T137-I141 WeakPolarHBondContact O-CG1 3.18Å; T137-I141 PolarHBondContact O-N 3.14Å; L138-I141 WeakPolarHBondContact O-CB 3.35Å; L138-I141 PolarHBondContact O-N 3.3Å; H139-I141 VanDerWaalsContact C-N 3.29Å; H139-I141 PolarHBondContact O-N 3.02Å; I141-L145 HydrophobicContact CG2-CD1 3.69Å; I141-L145 VanDerWaalsContact O-CB 3.29Å; I141-L145 WeakPolarHBondContact O-CB 3.37Å; I141-L145 WeakPolarHBondContact O-CG 3.32Å; I141-L145 PolarHBondContact O-N 3.49Å; I141-V154 HydrophobicContact CG2-CG2 3.77Å; I141-V239 HydrophobicContact CD1-CG1 3.87Å; I141-I241 HydrophobicContact CD1-CD1 3.84Å; I141-I241 HydrophobicContact CG1-CD1 3.86Å; I141-I241 HydrophobicContact CG2-CD1 4.06Å
142	F	85.7	Confident	85.3	Confident	19 Å²	19	43 Å²	43	8%	0.083	23%	0.233	C	C	.	.	H	α-helix	trans	-67.9	-36.8	-178.7	-82.7	-82.6	0	0	0	112.2	L138 H139 S146 F152 V154 V202 H203 K205 V208	L138-F142 WeakPolarHBondContact O-CD2 3.4Å; L138-F142 PolarHBondContact O-N 3.09Å; H139-F142 PolarHBondContact O-N 3.32Å; H139-F142 VanDerWaalsContact O-N 3.1Å; F142-S146 VanDerWaalsContact O-CB 3.27Å; F142-S146 WeakPolarHBondContact O-CB 3.49Å; F142-S146 PolarHBondContact O-N 3.04Å; F142-S146 VanDerWaalsContact O-N 3.16Å; F142-S146 PolarHBondContact O-OG 3.47Å; F142-F152 AromaticContact CD1-CE2 3.84Å; F142-F152 HydrophobicContact CD1-CE2 3.84Å; F142-F152 AromaticContact CD1-CZ 3.88Å; F142-F152 HydrophobicContact CD1-CZ 3.88Å; F142-F152 AromaticContact CE1-CE2 3.7Å; F142-F152 HydrophobicContact CE1-CE2 3.7Å; F142-F152 HydrophobicContact CE1-CZ 4.13Å; F142-V154 HydrophobicContact CE1-CG2 4.46Å; F142-V154 HydrophobicContact CE2-CB 4.49Å; F142-V154 HydrophobicContact CE2-CG2 4.25Å; F142-V154 HydrophobicContact CZ-CB 4.17Å; F142-V154 HydrophobicContact CZ-CG2 3.98Å; F142-V202 HydrophobicContact CE2-CG1 3.84Å; F142-V202 HydrophobicContact CZ-CB 4.12Å; F142-V202 HydrophobicContact CZ-CG1 3.59Å; F142-H203 WeakPolarHBondContact CE1-O 3.43Å; F142-K205 HydrophobicContact CB-CB 4.49Å; F142-K205 HydrophobicContact CD2-CB 4.43Å; F142-K205 HydrophobicContact CG-CB 4.4Å; F142-V208 HydrophobicContact CE2-CG2 3.99Å
143	E	85.1	Confident	85.2	Confident	89 Å²	89	45.1 Å²	45.1	42%	0.416	25%	0.247	S	C	.	.	H	α-helix	trans	-58.9	-64	171.2	-67.3	-175.5	125.3	0	0	111.3	H139 L145 S146 E147	H139-E143 IonicContact CD2-OE2 3.18Å; H139-E143 IonicContact CE1-OE1 3.19Å; H139-E143 IonicContact NE2-OE1 2.74Å; H139-E143 PolarHBondContact NE2-OE1 2.96Å; H139-E143 IonicContact NE2-OE2 2.71Å; H139-E143 PolarHBondContact O-N 3.15Å; E143-L145 VanDerWaalsContact C-N 3.3Å; E143-L145 PolarHBondContact O-N 3.01Å; E143-S146 PolarHBondContact O-N 2.82Å; E143-E147 WeakPolarHBondContact O-CG 3.45Å; E143-E147 PolarHBondContact O-N 2.62Å
144	K	86.9	Confident	85.2	Confident	27 Å²	27	44.9 Å²	44.9	12%	0.117	25%	0.246	C	C	.	.	H	α-helix	trans	-61	-36.3	-173.7	-74.1	-175.2	172.9	-176.7	0	112.9	C85 D89 I92 Q140 N148	C85-K144 PolarHBondContact SG-NZ 2.71Å; D89-K144 IonicContact OD1-NZ 2.77Å; D89-K144 PolarHBondContact OD1-NZ 3.38Å; D89-K144 IonicContact OD2-NZ 2.76Å; D89-K144 PolarHBondContact OD2-NZ 3.43Å; I92-K144 HydrophobicContact CD1-CB 3.84Å; I92-K144 HydrophobicContact CD1-CD 3.91Å; Q140-K144 HydrophobicContact CG-CD 4.06Å; Q140-K144 HydrophobicContact CG-CG 4.12Å; Q140-K144 WeakPolarHBondContact O-CB 3.45Å; Q140-K144 WeakPolarHBondContact O-CG 3.25Å; Q140-K144 PolarHBondContact O-N 3.49Å; K144-N148 WeakPolarHBondContact O-CB 3.5Å; K144-N148 PolarHBondContact O-N 3.42Å; K144-N148 VanDerWaalsContact O-N 3.14Å; K144-N148 PolarHBondContact O-ND2 3.43Å
145	L	85.3	Confident	85.3	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-73.5	-29.6	178.4	-65.9	175.3	0	0	0	112.5	I92 I141 E143 F152 V154 I241 M243	I92-L145 HydrophobicContact CG1-CD2 4.29Å; I92-L145 HydrophobicContact CG2-CD2 4.3Å; I141-L145 HydrophobicContact CG2-CD1 3.69Å; I141-L145 VanDerWaalsContact O-CB 3.29Å; I141-L145 WeakPolarHBondContact O-CB 3.37Å; I141-L145 WeakPolarHBondContact O-CG 3.32Å; I141-L145 PolarHBondContact O-N 3.49Å; E143-L145 VanDerWaalsContact C-N 3.3Å; E143-L145 PolarHBondContact O-N 3.01Å; L145-F152 HydrophobicContact CB-CD1 3.51Å; L145-F152 HydrophobicContact CB-CD2 4.22Å; L145-F152 HydrophobicContact CB-CE1 3.58Å; L145-F152 HydrophobicContact CB-CE2 4.28Å; L145-F152 HydrophobicContact CB-CG 3.85Å; L145-F152 HydrophobicContact CB-CZ 3.97Å; L145-F152 HydrophobicContact CD1-CB 4.09Å; L145-F152 HydrophobicContact CD1-CD1 4.34Å; L145-F152 HydrophobicContact CD1-CD2 3.65Å; L145-F152 HydrophobicContact CD1-CE2 4.1Å; L145-F152 HydrophobicContact CD1-CG 3.79Å; L145-F152 HydrophobicContact CG-CD1 4.46Å; L145-F152 HydrophobicContact CG-CG 4.35Å; L145-V154 HydrophobicContact CD1-CG2 4.28Å; L145-I241 HydrophobicContact CD1-CD1 4.49Å; L145-I241 HydrophobicContact CD1-CG2 3.56Å; L145-I241 HydrophobicContact CD2-CG2 4.41Å; L145-M243 HydrophobicContact CD2-CG 3.98Å; L145-M243 HydrophobicContact CD2-SD 3.86Å
146	S	83.4	Confident	85.6	Confident	79 Å²	79	46.5 Å²	46.5	55%	0.552	25%	0.252	S	S	*	.	H	α-helix	trans	-72.8	-44.3	172.9	-56.7	0	0	0	0	111.7	F142 E143 N148 G149	F142-S146 VanDerWaalsContact O-CB 3.27Å; F142-S146 WeakPolarHBondContact O-CB 3.49Å; F142-S146 PolarHBondContact O-N 3.04Å; F142-S146 VanDerWaalsContact O-N 3.16Å; F142-S146 PolarHBondContact O-OG 3.47Å; E143-S146 PolarHBondContact O-N 2.82Å; S146-N148 VanDerWaalsContact C-N 3.28Å; S146-N148 PolarHBondContact O-N 3.22Å; S146-G149 PolarHBondContact O-N 2.98Å; S146-G149 VanDerWaalsContact O-N 3.13Å
147	E	83.2	Confident	85.8	Confident	157 Å²	157	45.3 Å²	45.3	73%	0.734	25%	0.248	S	C	*	.	H	α-helix	trans	-58.4	-38.5	175.6	-71.3	179.7	148.5	0	0	112.5	E143 G149	E143-E147 WeakPolarHBondContact O-CG 3.45Å; E143-E147 PolarHBondContact O-N 2.62Å; E147-G149 VanDerWaalsContact C-N 3.27Å; E147-G149 PolarHBondContact O-N 3.37Å
148	N	76.4	Confident	85.9	Confident	103 Å²	103	46 Å²	46	55%	0.551	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-10	179.4	-80.2	-62.3	0	0	0	114.2	K144 S146 T150	K144-N148 WeakPolarHBondContact O-CB 3.5Å; K144-N148 PolarHBondContact O-N 3.42Å; K144-N148 VanDerWaalsContact O-N 3.14Å; K144-N148 PolarHBondContact O-ND2 3.43Å; S146-N148 VanDerWaalsContact C-N 3.28Å; S146-N148 PolarHBondContact O-N 3.22Å; N148-T150 HydrophobicContact CB-CG2 4.44Å; N148-T150 PolarHBondContact O-N 3.33Å; N148-T150 VanDerWaalsContact O-N 3.08Å
149	G	72.8	Confident	86.1	Confident	70 Å²	70	46.1 Å²	46.1	72%	0.722	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.5	12	177.6	0	0	0	0	0	116.1	S146 E147	S146-G149 PolarHBondContact O-N 2.98Å; S146-G149 VanDerWaalsContact O-N 3.13Å; E147-G149 VanDerWaalsContact C-N 3.27Å; E147-G149 PolarHBondContact O-N 3.37Å
150	T	75.3	Confident	86.4	Confident	37 Å²	37	44.2 Å²	44.2	23%	0.227	24%	0.243	C	C	.	.			trans	-82.3	141.2	-179.7	50.5	0	0	0	0	111.7	N148 F152	N148-T150 HydrophobicContact CB-CG2 4.44Å; N148-T150 PolarHBondContact O-N 3.33Å; N148-T150 VanDerWaalsContact O-N 3.08Å; T150-F152 WeakPolarHBondContact O-CD1 3.34Å; T150-F152 PolarHBondContact O-N 3.47Å
151	E	85.1	Confident	86.5	Confident	122 Å²	122	42.6 Å²	42.6	57%	0.57	24%	0.236	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-62.3	124.1	165.8	-85.7	173.5	-125.7	0	0	109.8	K244	E151-K244 HydrophobicContact CB-CB 3.99Å; E151-K244 HydrophobicContact CB-CD 3.83Å; E151-K244 VanDerWaalsContact CD-CD 3.48Å; E151-K244 HydrophobicContact CG-CD 4.27Å; E151-K244 PolarHBondContact O-N 2.96Å; E151-K244 IonicContact OE1-NZ 3.19Å; E151-K244 PolarHBondContact OE1-NZ 2.94Å; E151-K244 WeakPolarHBondContact OE2-CD 3.45Å; E151-K244 WeakPolarHBondContact OE2-CE 3.32Å; E151-K244 IonicContact OE2-NZ 2.8Å; E151-K244 PolarHBondContact OE2-NZ 2.67Å
152	F	88.6	Confident	86.3	Confident	66 Å²	66	43.8 Å²	43.8	29%	0.289	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	160	-178.3	71.2	-95.1	0	0	0	113.3	F142 L145 T150 V154 H242 M243	F142-F152 AromaticContact CD1-CE2 3.84Å; F142-F152 HydrophobicContact CD1-CE2 3.84Å; F142-F152 AromaticContact CD1-CZ 3.88Å; F142-F152 HydrophobicContact CD1-CZ 3.88Å; F142-F152 AromaticContact CE1-CE2 3.7Å; F142-F152 HydrophobicContact CE1-CE2 3.7Å; F142-F152 HydrophobicContact CE1-CZ 4.13Å; L145-F152 HydrophobicContact CB-CD1 3.51Å; L145-F152 HydrophobicContact CB-CD2 4.22Å; L145-F152 HydrophobicContact CB-CE1 3.58Å; L145-F152 HydrophobicContact CB-CE2 4.28Å; L145-F152 HydrophobicContact CB-CG 3.85Å; L145-F152 HydrophobicContact CB-CZ 3.97Å; L145-F152 HydrophobicContact CD1-CB 4.09Å; L145-F152 HydrophobicContact CD1-CD1 4.34Å; L145-F152 HydrophobicContact CD1-CD2 3.65Å; L145-F152 HydrophobicContact CD1-CE2 4.1Å; L145-F152 HydrophobicContact CD1-CG 3.79Å; L145-F152 HydrophobicContact CG-CD1 4.46Å; L145-F152 HydrophobicContact CG-CG 4.35Å; T150-F152 WeakPolarHBondContact O-CD1 3.34Å; T150-F152 PolarHBondContact O-N 3.47Å; F152-V154 HydrophobicContact CD2-CG2 3.93Å; F152-V154 HydrophobicContact CE2-CG2 4.05Å; F152-H242 CarbonylContact C-O 3.56Å; F152-H242 VanDerWaalsContact CA-O 3.24Å; F152-H242 WeakPolarHBondContact CA-O 3.42Å; F152-M243 HydrophobicContact CB-CG 4.44Å
153	S	89.1	Confident	85.9	Confident	45 Å²	45	45.3 Å²	45.3	32%	0.315	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	120	169.9	178.5	0	0	0	0	109.7	H242	S153-H242 PolarHBondContact N-O 3.35Å; S153-H242 PolarHBondContact O-N 3.12Å
154	V	91.3	Very high	86	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	130.7	177	-175.6	0	0	0	0	108.8	I141 F142 L145 F152 V156 V202 V239	I141-V154 HydrophobicContact CG2-CG2 3.77Å; F142-V154 HydrophobicContact CE1-CG2 4.46Å; F142-V154 HydrophobicContact CE2-CB 4.49Å; F142-V154 HydrophobicContact CE2-CG2 4.25Å; F142-V154 HydrophobicContact CZ-CB 4.17Å; F142-V154 HydrophobicContact CZ-CG2 3.98Å; L145-V154 HydrophobicContact CD1-CG2 4.28Å; F152-V154 HydrophobicContact CD2-CG2 3.93Å; F152-V154 HydrophobicContact CE2-CG2 4.05Å; V154-V156 HydrophobicContact CG1-CG1 4.34Å; V154-V202 HydrophobicContact CB-CB 4.43Å; V154-V202 PolarHBondContact O-N 2.96Å; V154-V239 HydrophobicContact CG1-CG1 3.69Å
155	K	92.4	Very high	85.9	Confident	54 Å²	54	43.5 Å²	43.5	24%	0.235	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	146.4	165.7	-54.7	-165	-166.9	178	0	110.8	E199 V200 V201 V239 T240	K155-E199 HydrophobicContact CB-CB 4.28Å; K155-E199 HydrophobicContact CD-CB 3.73Å; K155-E199 HydrophobicContact CD-CG 4.47Å; K155-E199 VanDerWaalsContact CD-OE2 3.24Å; K155-E199 WeakPolarHBondContact CD-OE2 3.48Å; K155-E199 IonicContact NZ-OE2 3.51Å; K155-E199 PolarHBondContact NZ-OE2 3.32Å; K155-V200 CarbonylContact C-O 3.53Å; K155-V200 VanDerWaalsContact CA-O 3.31Å; K155-V200 WeakPolarHBondContact CA-O 3.36Å; K155-V201 HydrophobicContact CG-CG2 4.32Å; K155-V239 WeakPolarHBondContact O-CA 3.47Å; K155-T240 PolarHBondContact N-O 3.32Å; K155-T240 PolarHBondContact O-N 3.45Å
156	V	93.1	Very high	86.1	Confident	2 Å²	2	43.5 Å²	43.5	1%	0.012	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	144.7	175.5	-58.6	0	0	0	0	111.5	L138 V154 L170 V200 V202 I211 F237 S238 V239	L138-V156 HydrophobicContact CD2-CG1 3.99Å; V154-V156 HydrophobicContact CG1-CG1 4.34Å; V156-L170 HydrophobicContact CG2-CD1 4.11Å; V156-V200 HydrophobicContact CG2-CB 4.24Å; V156-V200 PolarHBondContact N-O 3.45Å; V156-V200 PolarHBondContact O-N 2.96Å; V156-V202 HydrophobicContact CB-CG2 4.42Å; V156-V202 HydrophobicContact CG1-CG2 3.92Å; V156-V202 HydrophobicContact CG2-CG2 3.68Å; V156-I211 HydrophobicContact CG2-CD1 4.17Å; V156-I211 HydrophobicContact CG2-CG2 3.89Å; V156-F237 HydrophobicContact CB-CE2 3.96Å; V156-F237 HydrophobicContact CB-CZ 3.9Å; V156-F237 HydrophobicContact CG1-CE2 4.4Å; V156-F237 HydrophobicContact CG1-CZ 3.82Å; V156-S238 CarbonylContact C-O 3.51Å; V156-S238 VanDerWaalsContact CA-O 3.32Å; V156-S238 WeakPolarHBondContact CA-O 3.27Å; V156-V239 HydrophobicContact CG1-CG1 4.32Å; V156-V239 HydrophobicContact CG1-CG2 4.36Å
157	S	92.5	Very high	86.4	Confident	2 Å²	2	40.7 Å²	40.7	1%	0.014	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	142.7	169.1	64.6	0	0	0	0	110.7	E198 F237 S238	S157-E198 WeakPolarHBondContact CB-O 3.43Å; S157-F237 CarbonylContact O-C 3.58Å; S157-F237 WeakPolarHBondContact O-CA 3.37Å; S157-S238 PolarHBondContact N-O 3.11Å; S157-S238 PolarHBondContact O-N 3.11Å
158	L	91.7	Very high	86.7	Confident	15 Å²	15	33.9 Å²	33.9	8%	0.079	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	96.8	-179.5	-175.2	64.6	0	0	0	109.3	L169 L170 S235 F237	L158-L169 HydrophobicContact CB-CB 4.22Å; L158-L169 HydrophobicContact CD2-CB 3.74Å; L158-L169 HydrophobicContact CD2-CD1 3.78Å; L158-L169 HydrophobicContact CD2-CG 4.41Å; L158-L169 HydrophobicContact CG-CB 3.91Å; L158-L169 HydrophobicContact CG-CD1 3.96Å; L158-L169 HydrophobicContact CG-CG 4.45Å; L158-L169 PolarHBondContact O-N 3.2Å; L158-L169 VanDerWaalsContact O-N 3.08Å; L158-L170 HydrophobicContact CB-CD1 4.27Å; L158-L170 HydrophobicContact CB-CD2 3.73Å; L158-L170 HydrophobicContact CB-CG 3.77Å; L158-L170 HydrophobicContact CD2-CD2 4.29Å; L158-S235 WeakPolarHBondContact CD1-OG 3.41Å; L158-F237 HydrophobicContact CB-CD2 4.14Å; L158-F237 HydrophobicContact CD1-CB 3.78Å; L158-F237 HydrophobicContact CD1-CD2 3.87Å; L158-F237 HydrophobicContact CD1-CG 4.3Å
159	L	91	Very high	87.3	Confident	4 Å²	4	29 Å²	29	2%	0.021	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	123.9	-179.1	175.5	69.4	0	0	0	109.8	L166 L180 V194 L197 V236 I317	L159-L166 HydrophobicContact CD1-CB 4.18Å; L159-L166 HydrophobicContact CD1-CD2 4.37Å; L159-L180 HydrophobicContact CD1-CD1 3.84Å; L159-V194 HydrophobicContact CD1-CG1 4.39Å; L159-V194 HydrophobicContact CD2-CG2 4.08Å; L159-L197 HydrophobicContact CB-CD1 4.09Å; L159-L197 HydrophobicContact CB-CD2 4.5Å; L159-L197 HydrophobicContact CD1-CD1 4.23Å; L159-V236 HydrophobicContact CB-CB 4.33Å; L159-V236 PolarHBondContact N-O 3.35Å; L159-V236 PolarHBondContact O-N 2.99Å; L159-I317 HydrophobicContact CD2-CD1 3.81Å
160	E	89.9	Confident	88.1	Confident	1 Å²	1	25.9 Å²	25.9	1%	0.005	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	134.2	172.8	-169.6	157.3	-130.2	0	0	111.3	L166 F167 L169 R219 Y229 S233	E160-L166 WeakPolarHBondContact O-CA 3.36Å; E160-F167 PolarHBondContact N-O 3.23Å; E160-F167 PolarHBondContact O-N 2.73Å; E160-L169 HydrophobicContact CB-CD1 3.87Å; E160-L169 HydrophobicContact CB-CD2 4.47Å; E160-L169 HydrophobicContact CB-CG 3.97Å; E160-L169 HydrophobicContact CG-CD1 4.49Å; E160-R219 WeakPolarHBondContact OE1-CG 3.42Å; E160-R219 IonicContact OE1-CZ 2.77Å; E160-R219 IonicContact OE1-NE 3.97Å; E160-R219 PolarHBondContact OE1-NE 2.92Å; E160-R219 IonicContact OE1-NH2 3.18Å; E160-Y229 HydrophobicContact CG-CE1 4.43Å; E160-Y229 WeakPolarHBondContact OE2-CE1 3.34Å; E160-S233 WeakPolarHBondContact OE1-CB 3.39Å; E160-S233 PolarHBondContact OE1-OG 2.95Å
161	I	88.8	Confident	88.5	Confident	2 Å²	2	24.9 Å²	24.9	1%	0.01	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	112.4	178.8	-45.7	-176.9	0	0	0	108.2	E165 L166 S233 H234 V236 L314 I317	I161-E165 WeakPolarHBondContact CA-O 3.45Å; I161-L166 HydrophobicContact CB-CD2 4.27Å; I161-L166 HydrophobicContact CD1-CD2 4.18Å; I161-L166 HydrophobicContact CG1-CD2 3.72Å; I161-L166 HydrophobicContact CG2-CD2 4.05Å; I161-S233 CarbonylContact O-C 3.56Å; I161-S233 WeakPolarHBondContact O-CA 3.28Å; I161-H234 HydrophobicContact CB-CB 4.29Å; I161-H234 PolarHBondContact N-O 2.92Å; I161-H234 PolarHBondContact O-N 3.19Å; I161-V236 HydrophobicContact CD1-CG2 4.22Å; I161-L314 HydrophobicContact CD1-CB 4.36Å; I161-L314 HydrophobicContact CD1-CD1 3.91Å; I161-I317 HydrophobicContact CD1-CD1 3.67Å
162	Y	84.2	Confident	88.2	Confident	25 Å²	25	23.1 Å²	23.1	10%	0.098	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	133.7	180	172.9	-97.4	0	0	0	110	E164 E165 Y229 R232 I286	Y162-E164 PolarHBondContact O-N 3.17Å; Y162-E164 VanDerWaalsContact O-N 3.17Å; Y162-E165 PolarHBondContact N-O 3.27Å; Y162-E165 VanDerWaalsContact N-O 3.07Å; Y162-E165 WeakPolarHBondContact O-CA 3.47Å; Y162-E165 WeakPolarHBondContact O-CB 3.5Å; Y162-E165 PolarHBondContact O-N 3.03Å; Y162-Y229 WeakPolarHBondContact CB-OH 3.41Å; Y162-Y229 HydrophobicContact CD1-CD2 4.39Å; Y162-Y229 AromaticContact CD1-CE2 3.43Å; Y162-Y229 HydrophobicContact CD1-CE2 3.43Å; Y162-Y229 VanDerWaalsContact CD1-CE2 3.43Å; Y162-Y229 AromaticContact CD1-CZ 3.7Å; Y162-Y229 HydrophobicContact CD2-CD1 4.47Å; Y162-Y229 AromaticContact CD2-CD2 3.93Å; Y162-Y229 HydrophobicContact CD2-CD2 3.93Å; Y162-Y229 HydrophobicContact CD2-CE1 4.15Å; Y162-Y229 AromaticContact CD2-CE2 3.57Å; Y162-Y229 HydrophobicContact CD2-CE2 3.57Å; Y162-Y229 HydrophobicContact CD2-CG 4.38Å; Y162-Y229 AromaticContact CD2-CZ 3.7Å; Y162-Y229 HydrophobicContact CE1-CD2 4.13Å; Y162-Y229 AromaticContact CE1-CE2 3.47Å; Y162-Y229 HydrophobicContact CE1-CE2 3.47Å; Y162-Y229 VanDerWaalsContact CE1-CE2 3.47Å; Y162-Y229 AromaticContact CE2-CD2 3.64Å; Y162-Y229 HydrophobicContact CE2-CD2 3.64Å; Y162-Y229 AromaticContact CE2-CE2 3.62Å; Y162-Y229 HydrophobicContact CE2-CE2 3.62Å; Y162-Y229 HydrophobicContact CE2-CG 4.28Å; Y162-Y229 HydrophobicContact CG-CD2 4.28Å; Y162-Y229 HydrophobicContact CG-CE1 4.15Å; Y162-Y229 AromaticContact CG-CE2 3.46Å; Y162-Y229 HydrophobicContact CG-CE2 3.46Å; Y162-Y229 VanDerWaalsContact CG-CE2 3.46Å; Y162-Y229 AromaticContact CG-CZ 3.38Å; Y162-Y229 AromaticContact CZ-CD2 3.73Å; Y162-Y229 AromaticContact CZ-CE2 3.56Å; Y162-R232 HydrophobicContact CE2-CB 4.2Å; Y162-I286 HydrophobicContact CE2-CD1 4.42Å
163	N	78.9	Confident	87.6	Confident	51 Å²	51	22.7 Å²	22.7	27%	0.273	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.4	36.7	179.1	-174.3	60.4	0	0	0	113.6	E165 N285	N163-E165 PolarHBondContact O-N 3.38Å; N163-N285 PolarHBondContact OD1-ND2 3.28Å
164	E	85.4	Confident	86.5	Confident	37 Å²	37	29.2 Å²	29.2	17%	0.173	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.7	26.1	-172	-70.9	-68.3	148.2	0	0	114.4	Y162 S289 S312 K313	Y162-E164 PolarHBondContact O-N 3.17Å; Y162-E164 VanDerWaalsContact O-N 3.17Å; E164-S289 WeakPolarHBondContact OE1-CB 3.41Å; E164-S312 VanDerWaalsContact OE1-CB 3.27Å; E164-S312 WeakPolarHBondContact OE1-CB 3.32Å; E164-S312 PolarHBondContact OE1-OG 3.21Å; E164-K313 VanDerWaalsContact O-CD 3.3Å; E164-K313 WeakPolarHBondContact O-CD 3.49Å; E164-K313 WeakPolarHBondContact O-CE 3.26Å; E164-K313 PolarHBondContact O-NZ 3.33Å; E164-K313 WeakPolarHBondContact OE2-CB 3.47Å; E164-K313 WeakPolarHBondContact OE2-CG 3.33Å; E164-K313 PolarHBondContact OE2-N 2.81Å
165	E	86.6	Confident	85.3	Confident	41 Å²	41	34.9 Å²	34.9	19%	0.192	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	158.9	169.7	-63.4	-178.3	162.5	0	0	110.3	I161 Y162 N163 F167 R179	I161-E165 WeakPolarHBondContact CA-O 3.45Å; Y162-E165 PolarHBondContact N-O 3.27Å; Y162-E165 VanDerWaalsContact N-O 3.07Å; Y162-E165 WeakPolarHBondContact O-CA 3.47Å; Y162-E165 WeakPolarHBondContact O-CB 3.5Å; Y162-E165 PolarHBondContact O-N 3.03Å; N163-E165 PolarHBondContact O-N 3.38Å; E165-F167 HydrophobicContact CB-CE2 3.62Å; E165-F167 HydrophobicContact CB-CZ 3.7Å; E165-R179 IonicContact OE1-CZ 3.16Å; E165-R179 IonicContact OE1-NE 2.71Å; E165-R179 IonicContact OE1-NH1 3.82Å; E165-R179 PolarHBondContact OE1-NH1 3.23Å; E165-R179 IonicContact OE1-NH2 2.76Å; E165-R179 PolarHBondContact OE1-NH2 3.49Å; E165-R179 IonicContact OE2-CZ 3.96Å; E165-R179 IonicContact OE2-NE 2.8Å; E165-R179 PolarHBondContact OE2-NE 3.07Å; E165-R179 IonicContact OE2-NH1 2.85Å; E165-R179 IonicContact OE2-NH2 3.71Å; E165-R179 PolarHBondContact OE2-NH2 3.47Å
166	L	89.6	Confident	84	Confident	1 Å²	1	33.8 Å²	33.8	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	128.5	-171.5	-63.4	-178.4	0	0	0	109.6	L159 E160 I161 R179 L180 L182 V194 K313 I317	L159-L166 HydrophobicContact CD1-CB 4.18Å; L159-L166 HydrophobicContact CD1-CD2 4.37Å; E160-L166 WeakPolarHBondContact O-CA 3.36Å; I161-L166 HydrophobicContact CB-CD2 4.27Å; I161-L166 HydrophobicContact CD1-CD2 4.18Å; I161-L166 HydrophobicContact CG1-CD2 3.72Å; I161-L166 HydrophobicContact CG2-CD2 4.05Å; L166-R179 WeakPolarHBondContact O-CA 3.47Å; L166-L180 HydrophobicContact CB-CB 3.87Å; L166-L180 PolarHBondContact O-N 3.13Å; L166-L182 HydrophobicContact CD1-CB 3.97Å; L166-L182 HydrophobicContact CD1-CD1 4.47Å; L166-V194 HydrophobicContact CD1-CG1 4.32Å; L166-K313 HydrophobicContact CD1-CD 4.19Å; L166-K313 HydrophobicContact CD2-CB 4.45Å; L166-K313 HydrophobicContact CD2-CD 4.27Å; L166-K313 HydrophobicContact CG-CD 3.94Å; L166-I317 HydrophobicContact CD2-CD1 3.97Å
167	F	88.5	Confident	82.7	Confident	19 Å²	19	39.5 Å²	39.5	8%	0.083	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	143.5	-174.9	-56.6	-83.5	0	0	0	111.2	E160 E165 R179	E160-F167 PolarHBondContact N-O 3.23Å; E160-F167 PolarHBondContact O-N 2.73Å; E165-F167 HydrophobicContact CB-CE2 3.62Å; E165-F167 HydrophobicContact CB-CZ 3.7Å; F167-R179 HydrophobicContact CE1-CG 4.07Å
168	D	90.6	Very high	82	Confident	15 Å²	15	45.6 Å²	45.6	8%	0.08	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	117.8	176	-159.9	-51.9	0	0	0	111	L170 S171 L180 L197 E198	D168-L170 WeakPolarHBondContact OD1-CA 3.38Å; D168-L170 PolarHBondContact OD1-N 3.13Å; D168-S171 PolarHBondContact OD1-N 3.27Å; D168-L180 HydrophobicContact CB-CD1 4.12Å; D168-L197 WeakPolarHBondContact OD2-CA 3.49Å; D168-L197 WeakPolarHBondContact OD2-CD1 3.4Å; D168-E198 PolarHBondContact OD2-N 3.41Å
169	L	88.1	Confident	81.6	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.005	26%	0.262	C	S	.	.	S	Bend	trans	-89.1	-5.7	177.2	-65.4	-175.6	0	0	0	113.7	L158 E160 K218 R219	L158-L169 HydrophobicContact CB-CB 4.22Å; L158-L169 HydrophobicContact CD2-CB 3.74Å; L158-L169 HydrophobicContact CD2-CD1 3.78Å; L158-L169 HydrophobicContact CD2-CG 4.41Å; L158-L169 HydrophobicContact CG-CB 3.91Å; L158-L169 HydrophobicContact CG-CD1 3.96Å; L158-L169 HydrophobicContact CG-CG 4.45Å; L158-L169 PolarHBondContact O-N 3.2Å; L158-L169 VanDerWaalsContact O-N 3.08Å; E160-L169 HydrophobicContact CB-CD1 3.87Å; E160-L169 HydrophobicContact CB-CD2 4.47Å; E160-L169 HydrophobicContact CB-CG 3.97Å; E160-L169 HydrophobicContact CG-CD1 4.49Å; L169-K218 HydrophobicContact CD2-CB 3.96Å; L169-K218 WeakPolarHBondContact O-CD 3.48Å; L169-R219 HydrophobicContact CD1-CB 4.04Å; L169-R219 HydrophobicContact CD1-CG 4.18Å
170	L	88.8	Confident	81.5	Confident	3 Å²	3	52.7 Å²	52.7	2%	0.016	26%	0.264	C	S	.	.	S	Bend	trans	-108.7	-19.1	178.6	-54.7	-165.1	0	0	0	114.5	V156 L158 D168 V200 I211 R214	V156-L170 HydrophobicContact CG2-CD1 4.11Å; L158-L170 HydrophobicContact CB-CD1 4.27Å; L158-L170 HydrophobicContact CB-CD2 3.73Å; L158-L170 HydrophobicContact CB-CG 3.77Å; L158-L170 HydrophobicContact CD2-CD2 4.29Å; D168-L170 WeakPolarHBondContact OD1-CA 3.38Å; D168-L170 PolarHBondContact OD1-N 3.13Å; L170-V200 HydrophobicContact CB-CG2 3.98Å; L170-V200 HydrophobicContact CD1-CB 4.4Å; L170-V200 HydrophobicContact CD1-CG2 3.88Å; L170-I211 HydrophobicContact CD1-CG2 3.67Å; L170-I211 HydrophobicContact CD2-CG2 3.62Å; L170-I211 HydrophobicContact CG-CG2 4.26Å; L170-R214 PolarHBondContact O-NH1 3.27Å
171	S	85.3	Confident	81.3	Confident	16 Å²	16	58 Å²	58	11%	0.112	29%	0.289	C	S	.	.			trans	-44.3	143.4	-180	154.5	0	0	0	0	113.4	D168 T173 R214 K218	D168-S171 PolarHBondContact OD1-N 3.27Å; S171-T173 VanDerWaalsContact C-N 3.27Å; S171-T173 PolarHBondContact O-N 3.48Å; S171-T173 PolarHBondContact OG-N 3.04Å; S171-T173 PolarHBondContact OG-OG1 3.43Å; S171-R214 PolarHBondContact O-NH1 3.06Å; S171-R214 PolarHBondContact O-NH2 3.07Å; S171-K218 PolarHBondContact O-NZ 3.49Å
172	P	77.6	Confident	81.3	Confident	86 Å²	86	58.9 Å²	58.9	56%	0.558	29%	0.294	S	S	*	.	S	Bend	trans	-63.6	-28.6	178.9	26.6	-36.4	0	0	0	113.3	E198 R214	P172-E198 WeakPolarHBondContact CD-OE2 3.44Å; P172-R214 VanDerWaalsContact CA-NH2 3.35Å; P172-R214 PolarHBondContact O-NH2 2.87Å
173	T	76.3	Confident	81.4	Confident	57 Å²	57	62.3 Å²	62.3	35%	0.35	31%	0.309	S	S	.	.	S	Bend	trans	-71.5	148.7	-174.1	60.3	0	0	0	0	112.4	S171 D175 K218	S171-T173 VanDerWaalsContact C-N 3.27Å; S171-T173 PolarHBondContact O-N 3.48Å; S171-T173 PolarHBondContact OG-N 3.04Å; S171-T173 PolarHBondContact OG-OG1 3.43Å; T173-D175 VanDerWaalsContact C-N 3.29Å; T173-K218 VanDerWaalsContact O-CE 3.29Å; T173-K218 WeakPolarHBondContact O-CE 3.34Å; T173-K218 PolarHBondContact O-NZ 3.1Å
174	E	66	Low	81.5	Confident	182 Å²	182	63.2 Å²	63.2	85%	0.85	31%	0.314	S	S	*	.	S	Bend	trans	-78.2	-15.7	174.5	-60.7	-167.2	151.9	0	0	112.5	V176	E174-V176 VanDerWaalsContact O-CG2 3.25Å; E174-V176 WeakPolarHBondContact O-CG2 3.34Å; E174-V176 PolarHBondContact O-N 3.02Å
175	D	66.1	Low	81.1	Confident	119 Å²	119	62.5 Å²	62.5	64%	0.636	31%	0.311	S	S	*	.			trans	-70	81.5	179.3	-75.9	-58.5	0	0	0	113	T173 N177 E178	T173-D175 VanDerWaalsContact C-N 3.29Å; D175-N177 PolarHBondContact O-N 3.01Å; D175-E178 PolarHBondContact O-N 3.43Å
176	V	65	Low	80.2	Confident	31 Å²	31	66.2 Å²	66.2	19%	0.188	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	3.9	177.1	-145.5	0	0	0	0	114.1	E174	E174-V176 VanDerWaalsContact O-CG2 3.25Å; E174-V176 WeakPolarHBondContact O-CG2 3.34Å; E174-V176 PolarHBondContact O-N 3.02Å
177	N	65.4	Low	79.1	Confident	121 Å²	121	75.7 Å²	75.7	65%	0.647	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.6	-3.3	-177.4	-71.1	-56.9	0	0	0	114.2	D175	D175-N177 PolarHBondContact O-N 3.01Å
178	E	77.8	Confident	78.1	Confident	131 Å²	131	77.1 Å²	77.1	61%	0.612	38%	0.383	S	S	*	.			trans	-68.5	132.8	177.3	-171.5	166.5	-165.8	0	0	111.4	D175	D175-E178 PolarHBondContact O-N 3.43Å
179	R	83	Confident	77	Confident	153 Å²	153	86.3 Å²	86.3	58%	0.577	42%	0.423	S	S	*	.			trans	-109.7	112.4	-169.1	-67.2	167	175	-146.5	-14.6	110.9	E165 L166 F167	E165-R179 IonicContact OE1-CZ 3.16Å; E165-R179 IonicContact OE1-NE 2.71Å; E165-R179 IonicContact OE1-NH1 3.82Å; E165-R179 PolarHBondContact OE1-NH1 3.23Å; E165-R179 IonicContact OE1-NH2 2.76Å; E165-R179 PolarHBondContact OE1-NH2 3.49Å; E165-R179 IonicContact OE2-CZ 3.96Å; E165-R179 IonicContact OE2-NE 2.8Å; E165-R179 PolarHBondContact OE2-NE 3.07Å; E165-R179 IonicContact OE2-NH1 2.85Å; E165-R179 IonicContact OE2-NH2 3.71Å; E165-R179 PolarHBondContact OE2-NH2 3.47Å; L166-R179 WeakPolarHBondContact O-CA 3.47Å; F167-R179 HydrophobicContact CE1-CG 4.07Å
180	L	88.6	Confident	76	Confident	14 Å²	14	92.4 Å²	92.4	7%	0.073	45%	0.445	C	S	.	.			trans	-72.6	150.4	-178.1	-50.2	-176.5	0	0	0	112.5	L159 L166 D168 V194 G196 L197	L159-L180 HydrophobicContact CD1-CD1 3.84Å; L166-L180 HydrophobicContact CB-CB 3.87Å; L166-L180 PolarHBondContact O-N 3.13Å; D168-L180 HydrophobicContact CB-CD1 4.12Å; L180-V194 HydrophobicContact CB-CG1 3.56Å; L180-V194 HydrophobicContact CD1-CG1 3.59Å; L180-V194 HydrophobicContact CG-CG1 4.23Å; L180-G196 WeakPolarHBondContact CD2-O 3.29Å; L180-L197 HydrophobicContact CD1-CB 4.01Å; L180-L197 HydrophobicContact CD1-CD1 4.17Å
181	Q	87	Confident	75.1	Confident	113 Å²	113	93 Å²	93	53%	0.528	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	137.1	-178	-69	-176.9	-18.5	0	0	111.7	F183 V194 K195	Q181-F183 HydrophobicContact CB-CD2 4.36Å; Q181-F183 HydrophobicContact CB-CE2 3.54Å; Q181-F183 HydrophobicContact CB-CZ 4.09Å; Q181-V194 WeakPolarHBondContact O-CA 3.37Å; Q181-K195 PolarHBondContact O-N 2.98Å
182	L	88.4	Confident	75	Confident	21 Å²	21	93.9 Å²	93.9	11%	0.11	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	109.8	-174.8	-172	71.3	0	0	0	112.2	L166 V192 V194 K313 R316 I317	L166-L182 HydrophobicContact CD1-CB 3.97Å; L166-L182 HydrophobicContact CD1-CD1 4.47Å; L182-V192 HydrophobicContact CD1-CB 3.87Å; L182-V192 HydrophobicContact CD1-CG2 3.83Å; L182-V192 HydrophobicContact CG-CB 4.33Å; L182-V194 HydrophobicContact CD1-CG2 3.69Å; L182-K313 HydrophobicContact CD2-CB 4.2Å; L182-K313 HydrophobicContact CD2-CG 4.22Å; L182-R316 HydrophobicContact CD2-CB 3.79Å; L182-R316 PolarHBondContact O-NH2 3.5Å; L182-R316 VanDerWaalsContact O-NH2 3.14Å; L182-I317 HydrophobicContact CD1-CD1 4.34Å; L182-I317 HydrophobicContact CD1-CG1 3.89Å; L182-I317 HydrophobicContact CD2-CG1 4.21Å
183	F	85.9	Confident	75.3	Confident	97 Å²	97	92.8 Å²	92.8	43%	0.425	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	154.3	177.9	-61.9	-89	0	0	0	110.8	Q181 V192 V193 K195	Q181-F183 HydrophobicContact CB-CD2 4.36Å; Q181-F183 HydrophobicContact CB-CE2 3.54Å; Q181-F183 HydrophobicContact CB-CZ 4.09Å; F183-V192 CarbonylContact O-C 3.45Å; F183-V192 VanDerWaalsContact O-CA 3.23Å; F183-V192 WeakPolarHBondContact O-CA 3.45Å; F183-V192 WeakPolarHBondContact O-CB 3.46Å; F183-V193 PolarHBondContact N-O 3.44Å; F183-V193 PolarHBondContact O-N 3.06Å; F183-K195 HydrophobicContact CD2-CB 3.85Å; F183-K195 HydrophobicContact CE2-CB 3.63Å; F183-K195 HydrophobicContact CE2-CD 3.79Å; F183-K195 HydrophobicContact CE2-CG 4.35Å; F183-K195 HydrophobicContact CZ-CD 4.37Å
184	D	81.9	Confident	75.9	Confident	70 Å²	70	91.2 Å²	91.2	37%	0.374	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	140.7	169.5	-64.4	-11	0	0	0	108.6	P186 R310 R316	D184-P186 WeakPolarHBondContact O-CD 3.32Å; D184-R310 IonicContact OD2-CZ 3.64Å; D184-R310 IonicContact OD2-NE 3.45Å; D184-R310 IonicContact OD2-NH2 2.92Å; D184-R310 PolarHBondContact OD2-NH2 3.49Å; D184-R316 IonicContact OD1-CZ 3.96Å; D184-R316 IonicContact OD1-NE 2.62Å; D184-R316 IonicContact OD1-NH2 3.77Å; D184-R316 PolarHBondContact OD1-NH2 2.96Å
185	D	76.8	Confident	76.9	Confident	22 Å²	22	89 Å²	89	12%	0.118	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-76.5	119.9	-177.3	-167.7	-38.9	0	0	0	110.7	R187 N188 G191 V193	D185-R187 PolarHBondContact O-N 3.1Å; D185-R187 VanDerWaalsContact O-N 3.13Å; D185-R187 VanDerWaalsContact OD1-CB 3.3Å; D185-R187 WeakPolarHBondContact OD1-CB 3.38Å; D185-R187 IonicContact OD1-CZ 3.33Å; D185-R187 PolarHBondContact OD1-N 3.49Å; D185-R187 IonicContact OD1-NE 2.71Å; D185-R187 PolarHBondContact OD1-NE 3.05Å; D185-R187 IonicContact OD1-NH2 2.97Å; D185-R187 IonicContact OD2-CZ 2.65Å; D185-R187 IonicContact OD2-NE 2.79Å; D185-R187 IonicContact OD2-NH2 2.97Å; D185-R187 PolarHBondContact OD2-NH2 3.02Å; D185-N188 HydrophobicContact CB-CB 4.29Å; D185-N188 CarbonylContact O-C 3.26Å; D185-N188 VanDerWaalsContact O-C 3.26Å; D185-N188 PolarHBondContact O-N 2.96Å; D185-N188 VanDerWaalsContact O-N 3.09Å; D185-G191 PolarHBondContact N-O 2.91Å; D185-V193 HydrophobicContact CB-CG2 3.9Å
186	P	68.2	Low	77.7	Confident	118 Å²	118	86.1 Å²	86.1	77%	0.766	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-22.3	179.9	25.6	-34.6	0	0	0	113.5	D184	D184-P186 WeakPolarHBondContact O-CD 3.32Å
187	R	65.9	Low	78.8	Confident	200 Å²	200	86.7 Å²	86.7	76%	0.755	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-23.1	178.5	-53.7	161.9	-62.3	177.8	7.2	112.4	D185	D185-R187 PolarHBondContact O-N 3.1Å; D185-R187 VanDerWaalsContact O-N 3.13Å; D185-R187 VanDerWaalsContact OD1-CB 3.3Å; D185-R187 WeakPolarHBondContact OD1-CB 3.38Å; D185-R187 IonicContact OD1-CZ 3.33Å; D185-R187 PolarHBondContact OD1-N 3.49Å; D185-R187 IonicContact OD1-NE 2.71Å; D185-R187 PolarHBondContact OD1-NE 3.05Å; D185-R187 IonicContact OD1-NH2 2.97Å; D185-R187 IonicContact OD2-CZ 2.65Å; D185-R187 IonicContact OD2-NE 2.79Å; D185-R187 IonicContact OD2-NH2 2.97Å; D185-R187 PolarHBondContact OD2-NH2 3.02Å
188	N	67.8	Low	79.9	Confident	49 Å²	49	84.5 Å²	84.5	26%	0.262	41%	0.412	S	S	.	.			trans	-132.2	101.5	-179.2	-179.9	0.6	0	0	0	110.5	D185 R190 G191	D185-N188 HydrophobicContact CB-CB 4.29Å; D185-N188 CarbonylContact O-C 3.26Å; D185-N188 VanDerWaalsContact O-C 3.26Å; D185-N188 PolarHBondContact O-N 2.96Å; D185-N188 VanDerWaalsContact O-N 3.09Å; N188-R190 PolarHBondContact O-N 3.14Å; N188-R190 PolarHBondContact OD1-N 2.73Å; N188-R190 VanDerWaalsContact OD1-N 3.08Å; N188-G191 PolarHBondContact O-N 2.99Å; N188-G191 PolarHBondContact OD1-N 3.36Å
189	K	66.4	Low	80.5	Confident	209 Å²	209	82 Å²	82	91%	0.909	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-1.9	179.4	-60.1	-173.8	178	-174.6	0	115.7
190	R	66.8	Low	80.9	Confident	128 Å²	128	76.3 Å²	76.3	48%	0.483	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.4	-5	173.1	-64.4	-177.7	171.7	-150.8	-1.4	113.9	N188 G323	N188-R190 PolarHBondContact O-N 3.14Å; N188-R190 PolarHBondContact OD1-N 2.73Å; N188-R190 VanDerWaalsContact OD1-N 3.08Å; R190-G323 PolarHBondContact NH1-O 3.48Å
191	G	70.6	Confident	81	Confident	15 Å²	15	78.4 Å²	78.4	16%	0.155	40%	0.396	C	S	.	.			trans	-93.3	157.1	179.1	0	0	0	0	0	111.7	D185 N188	D185-G191 PolarHBondContact N-O 2.91Å; N188-G191 PolarHBondContact O-N 2.99Å; N188-G191 PolarHBondContact OD1-N 3.36Å
192	V	83.6	Confident	81.1	Confident	35 Å²	35	73.2 Å²	73.2	21%	0.212	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	147.3	174.9	-65.2	0	0	0	0	110.3	L182 F183 R316 I317	L182-V192 HydrophobicContact CD1-CB 3.87Å; L182-V192 HydrophobicContact CD1-CG2 3.83Å; L182-V192 HydrophobicContact CG-CB 4.33Å; F183-V192 CarbonylContact O-C 3.45Å; F183-V192 VanDerWaalsContact O-CA 3.23Å; F183-V192 WeakPolarHBondContact O-CA 3.45Å; F183-V192 WeakPolarHBondContact O-CB 3.46Å; V192-R316 HydrophobicContact CG1-CB 4.33Å; V192-R316 WeakPolarHBondContact CG2-O 3.45Å; V192-I317 HydrophobicContact CG2-CG1 4.16Å
193	V	84.5	Confident	80.8	Confident	64 Å²	64	78 Å²	78	39%	0.388	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	126.5	179.3	-176.5	0	0	0	0	108.7	F183 D185	F183-V193 PolarHBondContact N-O 3.44Å; F183-V193 PolarHBondContact O-N 3.06Å; D185-V193 HydrophobicContact CB-CG2 3.9Å
194	V	88.8	Confident	80.5	Confident	23 Å²	23	77.8 Å²	77.8	14%	0.139	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	111.3	171.9	-174.2	0	0	0	0	108	L159 L166 L180 Q181 L182 L197	L159-V194 HydrophobicContact CD1-CG1 4.39Å; L159-V194 HydrophobicContact CD2-CG2 4.08Å; L166-V194 HydrophobicContact CD1-CG1 4.32Å; L180-V194 HydrophobicContact CB-CG1 3.56Å; L180-V194 HydrophobicContact CD1-CG1 3.59Å; L180-V194 HydrophobicContact CG-CG1 4.23Å; Q181-V194 WeakPolarHBondContact O-CA 3.37Å; L182-V194 HydrophobicContact CD1-CG2 3.69Å; V194-L197 HydrophobicContact CB-CB 3.86Å; V194-L197 HydrophobicContact CB-CD2 4.1Å; V194-L197 HydrophobicContact CG1-CB 3.8Å; V194-L197 HydrophobicContact CG2-CD2 4.4Å
195	K	85.4	Confident	80.1	Confident	135 Å²	135	78.1 Å²	78.1	59%	0.587	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75	126.2	176.3	-176.3	-173.9	175.9	-171.9	0	109.3	Q181 F183	Q181-K195 PolarHBondContact O-N 2.98Å; F183-K195 HydrophobicContact CD2-CB 3.85Å; F183-K195 HydrophobicContact CE2-CB 3.63Å; F183-K195 HydrophobicContact CE2-CD 3.79Å; F183-K195 HydrophobicContact CE2-CG 4.35Å; F183-K195 HydrophobicContact CZ-CD 4.37Å
196	G	83.8	Confident	80.1	Confident	59 Å²	59	81.2 Å²	81.2	61%	0.608	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.1	4.7	-179.4	0	0	0	0	0	114.9	L180	L180-G196 WeakPolarHBondContact CD2-O 3.29Å
197	L	89	Confident	80.7	Confident	43 Å²	43	78.4 Å²	78.4	23%	0.225	39%	0.388	C	S	.	.			trans	-74.7	128.6	169.3	179.1	62.7	0	0	0	109.9	L159 D168 L180 V194	L159-L197 HydrophobicContact CB-CD1 4.09Å; L159-L197 HydrophobicContact CB-CD2 4.5Å; L159-L197 HydrophobicContact CD1-CD1 4.23Å; D168-L197 WeakPolarHBondContact OD2-CA 3.49Å; D168-L197 WeakPolarHBondContact OD2-CD1 3.4Å; L180-L197 HydrophobicContact CD1-CB 4.01Å; L180-L197 HydrophobicContact CD1-CD1 4.17Å; V194-L197 HydrophobicContact CB-CB 3.86Å; V194-L197 HydrophobicContact CB-CD2 4.1Å; V194-L197 HydrophobicContact CG1-CB 3.8Å; V194-L197 HydrophobicContact CG2-CD2 4.4Å
198	E	88.5	Confident	81	Confident	76 Å²	76	69.1 Å²	69.1	36%	0.355	35%	0.354	S	S	.	.			trans	-85.6	128.8	180	-166.5	160.5	130.8	0	0	112	S157 D168 P172 V200	S157-E198 WeakPolarHBondContact CB-O 3.43Å; D168-E198 PolarHBondContact OD2-N 3.41Å; P172-E198 WeakPolarHBondContact CD-OE2 3.44Å; E198-V200 HydrophobicContact CG-CG2 4.11Å
199	E	90.4	Very high	81.3	Confident	79 Å²	79	68.4 Å²	68.4	37%	0.369	35%	0.348	S	S	.	.			trans	-102.7	90.9	169.4	-64	-165.7	139.4	0	0	109.4	K155 V201	K155-E199 HydrophobicContact CB-CB 4.28Å; K155-E199 HydrophobicContact CD-CB 3.73Å; K155-E199 HydrophobicContact CD-CG 4.47Å; K155-E199 VanDerWaalsContact CD-OE2 3.24Å; K155-E199 WeakPolarHBondContact CD-OE2 3.48Å; K155-E199 IonicContact NZ-OE2 3.51Å; K155-E199 PolarHBondContact NZ-OE2 3.32Å; E199-V201 PolarHBondContact O-N 3.05Å
200	V	90.8	Very high	82	Confident	32 Å²	32	65 Å²	65	19%	0.194	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	124.8	178.9	-176.2	0	0	0	0	109.2	K155 V156 L170 E198 I211	K155-V200 CarbonylContact C-O 3.53Å; K155-V200 VanDerWaalsContact CA-O 3.31Å; K155-V200 WeakPolarHBondContact CA-O 3.36Å; V156-V200 HydrophobicContact CG2-CB 4.24Å; V156-V200 PolarHBondContact N-O 3.45Å; V156-V200 PolarHBondContact O-N 2.96Å; L170-V200 HydrophobicContact CB-CG2 3.98Å; L170-V200 HydrophobicContact CD1-CB 4.4Å; L170-V200 HydrophobicContact CD1-CG2 3.88Å; E198-V200 HydrophobicContact CG-CG2 4.11Å; V200-I211 HydrophobicContact CB-CD1 4.43Å; V200-I211 HydrophobicContact CG1-CD1 3.66Å; V200-I211 HydrophobicContact CG1-CG1 4.31Å
201	V	90.3	Very high	82.7	Confident	58 Å²	58	60 Å²	60	35%	0.352	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	131.7	173.5	-175.9	0	0	0	0	108.9	K155 E199	K155-V201 HydrophobicContact CG-CG2 4.32Å; E199-V201 PolarHBondContact O-N 3.05Å
202	V	88.8	Confident	83.2	Confident	4 Å²	4	61 Å²	61	2%	0.024	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	122.7	177.5	-172.4	0	0	0	0	108.7	F142 V154 V156 N204 E207 V208 I211	F142-V202 HydrophobicContact CE2-CG1 3.84Å; F142-V202 HydrophobicContact CZ-CB 4.12Å; F142-V202 HydrophobicContact CZ-CG1 3.59Å; V154-V202 HydrophobicContact CB-CB 4.43Å; V154-V202 PolarHBondContact O-N 2.96Å; V156-V202 HydrophobicContact CB-CG2 4.42Å; V156-V202 HydrophobicContact CG1-CG2 3.92Å; V156-V202 HydrophobicContact CG2-CG2 3.68Å; V202-N204 VanDerWaalsContact CG1-O 3.32Å; V202-N204 WeakPolarHBondContact CG1-O 3.35Å; V202-E207 HydrophobicContact CG1-CB 4.2Å; V202-V208 HydrophobicContact CG1-CG2 3.53Å; V202-I211 HydrophobicContact CG2-CD1 3.87Å
203	H	82.4	Confident	83.1	Confident	122 Å²	122	64.8 Å²	64.8	57%	0.565	34%	0.335	S	S	*	.			trans	-98	-43.8	178.9	-44.7	87.5	0	0	0	110.5	F142 E207	F142-H203 WeakPolarHBondContact CE1-O 3.43Å; H203-E207 WeakPolarHBondContact CB-OE2 3.39Å; H203-E207 IonicContact CG-OE2 3.08Å; H203-E207 PolarHBondContact N-OE2 2.88Å; H203-E207 IonicContact ND1-OE1 3.36Å; H203-E207 IonicContact ND1-OE2 3.34Å; H203-E207 PolarHBondContact ND1-OE2 3.49Å; H203-E207 VanDerWaalsContact ND1-OE2 3.16Å
204	N	79.2	Confident	83	Confident	93 Å²	93	66.8 Å²	66.8	50%	0.497	34%	0.335	S	S	.	.	S	Bend	trans	-118.7	147.6	-175.7	-64.1	-16.6	0	0	0	111.4	V202 D206 E207	V202-N204 VanDerWaalsContact CG1-O 3.32Å; V202-N204 WeakPolarHBondContact CG1-O 3.35Å; N204-D206 PolarHBondContact O-N 3.33Å; N204-D206 VanDerWaalsContact O-N 3.08Å; N204-E207 HydrophobicContact CB-CG 4.23Å; N204-E207 PolarHBondContact N-OE2 2.96Å; N204-E207 WeakPolarHBondContact O-CB 3.41Å; N204-E207 PolarHBondContact O-N 3.38Å; N204-E207 VanDerWaalsContact O-N 3.12Å
205	K	73.7	Confident	82.8	Confident	77 Å²	77	65.7 Å²	65.7	34%	0.335	33%	0.328	S	S	.	.	H	α-helix	trans	-53.1	-32.1	174.6	69.7	177	-164.2	162.7	0	113	E126 F142 V208 Y209	E126-K205 WeakPolarHBondContact OE1-CD 3.45Å; E126-K205 WeakPolarHBondContact OE1-CE 3.49Å; E126-K205 IonicContact OE1-NZ 3.04Å; E126-K205 PolarHBondContact OE1-NZ 3.28Å; E126-K205 IonicContact OE2-NZ 3.65Å; E126-K205 PolarHBondContact OE2-NZ 3.19Å; F142-K205 HydrophobicContact CB-CB 4.49Å; F142-K205 HydrophobicContact CD2-CB 4.43Å; F142-K205 HydrophobicContact CG-CB 4.4Å; K205-V208 VanDerWaalsContact O-CB 3.28Å; K205-V208 WeakPolarHBondContact O-CB 3.49Å; K205-V208 WeakPolarHBondContact O-CG2 3.25Å; K205-V208 PolarHBondContact O-N 3.06Å; K205-Y209 WeakPolarHBondContact O-CD2 3.4Å; K205-Y209 WeakPolarHBondContact O-CE2 3.42Å
206	D	76.3	Confident	82.5	Confident	87 Å²	87	60.7 Å²	60.7	47%	0.465	31%	0.312	S	S	.	.	H	α-helix	trans	-75.7	-27	-175.8	-52.1	-60.8	0	0	0	113.1	N204 V208 Y209	N204-D206 PolarHBondContact O-N 3.33Å; N204-D206 VanDerWaalsContact O-N 3.08Å; D206-V208 VanDerWaalsContact C-N 3.27Å; D206-V208 PolarHBondContact O-N 3.32Å; D206-Y209 PolarHBondContact O-N 2.94Å
207	E	80.9	Confident	82.3	Confident	58 Å²	58	59.8 Å²	59.8	27%	0.271	30%	0.299	S	S	.	.	H	α-helix	trans	-65.2	-34.2	174.5	-65.9	175.1	158.4	0	0	110.9	V202 H203 N204 Y209 Q210 I211	V202-E207 HydrophobicContact CG1-CB 4.2Å; H203-E207 WeakPolarHBondContact CB-OE2 3.39Å; H203-E207 IonicContact CG-OE2 3.08Å; H203-E207 PolarHBondContact N-OE2 2.88Å; H203-E207 IonicContact ND1-OE1 3.36Å; H203-E207 IonicContact ND1-OE2 3.34Å; H203-E207 PolarHBondContact ND1-OE2 3.49Å; H203-E207 VanDerWaalsContact ND1-OE2 3.16Å; N204-E207 HydrophobicContact CB-CG 4.23Å; N204-E207 PolarHBondContact N-OE2 2.96Å; N204-E207 WeakPolarHBondContact O-CB 3.41Å; N204-E207 PolarHBondContact O-N 3.38Å; N204-E207 VanDerWaalsContact O-N 3.12Å; E207-Y209 VanDerWaalsContact C-N 3.31Å; E207-Y209 PolarHBondContact O-N 3.28Å; E207-Q210 PolarHBondContact O-N 3Å; E207-I211 WeakPolarHBondContact O-CD1 3.26Å; E207-I211 VanDerWaalsContact O-CG1 3.27Å; E207-I211 WeakPolarHBondContact O-CG1 3.22Å; E207-I211 PolarHBondContact O-N 3.3Å
208	V	73.9	Confident	81.9	Confident	5 Å²	5	58.7 Å²	58.7	3%	0.03	29%	0.292	C	S	.	.	H	α-helix	trans	-53.5	-47.8	177.1	-177.5	0	0	0	0	111.5	L138 F142 V202 K205 D206 Q210 I211 L212	L138-V208 HydrophobicContact CB-CG1 3.76Å; L138-V208 HydrophobicContact CB-CG2 4.38Å; L138-V208 HydrophobicContact CD1-CG1 3.37Å; L138-V208 HydrophobicContact CD2-CG1 4.19Å; L138-V208 HydrophobicContact CG-CG1 3.93Å; F142-V208 HydrophobicContact CE2-CG2 3.99Å; V202-V208 HydrophobicContact CG1-CG2 3.53Å; K205-V208 VanDerWaalsContact O-CB 3.28Å; K205-V208 WeakPolarHBondContact O-CB 3.49Å; K205-V208 WeakPolarHBondContact O-CG2 3.25Å; K205-V208 PolarHBondContact O-N 3.06Å; D206-V208 VanDerWaalsContact C-N 3.27Å; D206-V208 PolarHBondContact O-N 3.32Å; V208-Q210 VanDerWaalsContact C-N 3.32Å; V208-Q210 PolarHBondContact O-N 3.03Å; V208-I211 PolarHBondContact O-N 3.47Å; V208-L212 HydrophobicContact CG1-CD1 3.92Å; V208-L212 HydrophobicContact CG1-CG 4.26Å; V208-L212 WeakPolarHBondContact O-CG 3.32Å; V208-L212 PolarHBondContact O-N 3.35Å
209	Y	72.9	Confident	81.5	Confident	35 Å²	35	55.7 Å²	55.7	14%	0.137	28%	0.278	C	S	.	.	H	α-helix	trans	-67.6	-35.3	-175.6	-62.6	-73.1	0	0	0	111.6	W125 P135 K205 D206 E207 L212 E213	W125-Y209 HydrophobicContact CB-CD1 3.82Å; W125-Y209 HydrophobicContact CB-CE1 3.38Å; W125-Y209 HydrophobicContact CD2-CD1 4.5Å; W125-Y209 AromaticContact CG-CD1 3.99Å; W125-Y209 HydrophobicContact CG-CD1 3.99Å; W125-Y209 HydrophobicContact CG-CE1 4.07Å; P135-Y209 HydrophobicContact CB-CE1 4.08Å; K205-Y209 WeakPolarHBondContact O-CD2 3.4Å; K205-Y209 WeakPolarHBondContact O-CE2 3.42Å; D206-Y209 PolarHBondContact O-N 2.94Å; E207-Y209 VanDerWaalsContact C-N 3.31Å; E207-Y209 PolarHBondContact O-N 3.28Å; Y209-L212 PolarHBondContact O-N 3.22Å; Y209-E213 WeakPolarHBondContact O-CB 3.33Å; Y209-E213 PolarHBondContact O-N 3.38Å
210	Q	80.7	Confident	80.4	Confident	136 Å²	136	58.8 Å²	58.8	64%	0.636	29%	0.286	S	S	*	.	H	α-helix	trans	-66.1	-41.7	173.2	-58.3	179.8	25.5	0	0	111.4	E207 V208 E213 R214	E207-Q210 PolarHBondContact O-N 3Å; V208-Q210 VanDerWaalsContact C-N 3.32Å; V208-Q210 PolarHBondContact O-N 3.03Å; Q210-E213 PolarHBondContact O-N 3.13Å; Q210-R214 WeakPolarHBondContact O-CB 3.36Å; Q210-R214 PolarHBondContact O-N 3.33Å
211	I	81.8	Confident	79.2	Confident	24 Å²	24	60.6 Å²	60.6	12%	0.123	30%	0.297	C	S	.	.	H	α-helix	trans	-63.8	-44	176.8	-67.6	163.4	0	0	0	111	V156 L170 V200 V202 E207 V208 R214 G215	V156-I211 HydrophobicContact CG2-CD1 4.17Å; V156-I211 HydrophobicContact CG2-CG2 3.89Å; L170-I211 HydrophobicContact CD1-CG2 3.67Å; L170-I211 HydrophobicContact CD2-CG2 3.62Å; L170-I211 HydrophobicContact CG-CG2 4.26Å; V200-I211 HydrophobicContact CB-CD1 4.43Å; V200-I211 HydrophobicContact CG1-CD1 3.66Å; V200-I211 HydrophobicContact CG1-CG1 4.31Å; V202-I211 HydrophobicContact CG2-CD1 3.87Å; E207-I211 WeakPolarHBondContact O-CD1 3.26Å; E207-I211 VanDerWaalsContact O-CG1 3.27Å; E207-I211 WeakPolarHBondContact O-CG1 3.22Å; E207-I211 PolarHBondContact O-N 3.3Å; V208-I211 PolarHBondContact O-N 3.47Å; I211-R214 PolarHBondContact O-N 3.45Å; I211-G215 PolarHBondContact O-N 3Å
212	L	80.8	Confident	77.7	Confident	37 Å²	37	58.6 Å²	58.6	19%	0.194	29%	0.287	C	S	.	.	H	α-helix	trans	-67.6	-42.9	176.6	-69.6	176.1	0	0	0	112.4	I134 L138 V208 Y209 R214 G215 A216 F237	I134-L212 HydrophobicContact CG2-CD1 3.92Å; I134-L212 HydrophobicContact CG2-CD2 3.7Å; I134-L212 HydrophobicContact CG2-CG 4.5Å; L138-L212 HydrophobicContact CD1-CD1 4Å; V208-L212 HydrophobicContact CG1-CD1 3.92Å; V208-L212 HydrophobicContact CG1-CG 4.26Å; V208-L212 WeakPolarHBondContact O-CG 3.32Å; V208-L212 PolarHBondContact O-N 3.35Å; Y209-L212 PolarHBondContact O-N 3.22Å; L212-R214 VanDerWaalsContact C-N 3.34Å; L212-R214 PolarHBondContact O-N 2.98Å; L212-G215 PolarHBondContact O-N 3.2Å; L212-A216 WeakPolarHBondContact O-CB 3.38Å; L212-A216 PolarHBondContact O-N 3.31Å; L212-F237 HydrophobicContact CD2-CD2 4.35Å; L212-F237 HydrophobicContact CD2-CE2 3.84Å; L212-F237 HydrophobicContact CD2-CZ 4.11Å
213	E	81.5	Confident	76.1	Confident	114 Å²	114	59.8 Å²	59.8	53%	0.533	30%	0.295	S	S	.	.	H	α-helix	trans	-64.5	-39.5	176.3	-177.6	160.9	-125.5	0	0	111.4	Y209 Q210 A216 A217	Y209-E213 WeakPolarHBondContact O-CB 3.33Å; Y209-E213 PolarHBondContact O-N 3.38Å; Q210-E213 PolarHBondContact O-N 3.13Å; E213-A216 CarbonylContact O-C 3.34Å; E213-A216 PolarHBondContact O-N 3.15Å; E213-A217 VanDerWaalsContact O-CB 3.27Å; E213-A217 WeakPolarHBondContact O-CB 3.4Å; E213-A217 PolarHBondContact O-N 3Å
214	R	84.1	Confident	74.6	Confident	105 Å²	105	59.4 Å²	59.4	40%	0.396	30%	0.302	S	S	.	.	H	α-helix	trans	-64.4	-42.1	174.6	-173.1	163.6	-179.5	-90.6	-18.9	112.2	L170 S171 P172 Q210 I211 L212 A217 K218	L170-R214 PolarHBondContact O-NH1 3.27Å; S171-R214 PolarHBondContact O-NH1 3.06Å; S171-R214 PolarHBondContact O-NH2 3.07Å; P172-R214 VanDerWaalsContact CA-NH2 3.35Å; P172-R214 PolarHBondContact O-NH2 2.87Å; Q210-R214 WeakPolarHBondContact O-CB 3.36Å; Q210-R214 PolarHBondContact O-N 3.33Å; I211-R214 PolarHBondContact O-N 3.45Å; L212-R214 VanDerWaalsContact C-N 3.34Å; L212-R214 PolarHBondContact O-N 2.98Å; R214-A217 PolarHBondContact O-N 2.94Å; R214-K218 PolarHBondContact O-N 2.96Å
215	G	82.7	Confident	73.2	Confident	0 Å²	0	61 Å²	61	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-61.3	-48	171.4	0	0	0	0	0	112.6	I211 L212 A217 K218 R219	I211-G215 PolarHBondContact O-N 3Å; L212-G215 PolarHBondContact O-N 3.2Å; G215-A217 VanDerWaalsContact C-N 3.27Å; G215-A217 PolarHBondContact O-N 3.46Å; G215-K218 PolarHBondContact O-N 3.38Å; G215-R219 WeakPolarHBondContact O-CB 3.5Å; G215-R219 PolarHBondContact O-N 3.09Å
216	A	79.9	Confident	71.8	Confident	30 Å²	30	63 Å²	63	25%	0.248	32%	0.322	C	S	.	.	H	α-helix	trans	-67.9	-23.7	177	0	0	0	0	0	113.5	L212 E213 R220	L212-A216 WeakPolarHBondContact O-CB 3.38Å; L212-A216 PolarHBondContact O-N 3.31Å; E213-A216 CarbonylContact O-C 3.34Å; E213-A216 PolarHBondContact O-N 3.15Å; A216-R220 WeakPolarHBondContact O-CB 3.49Å; A216-R220 WeakPolarHBondContact O-CG 3.36Å; A216-R220 PolarHBondContact O-N 3.28Å; A216-R220 PolarHBondContact O-NE 3.1Å
217	A	80.5	Confident	70	Confident	40 Å²	40	64.4 Å²	64.4	33%	0.331	33%	0.329	S	S	.	.	H	α-helix	trans	-74.2	-49.6	170.3	0	0	0	0	0	111	E213 R214 G215 R219 R220 T221	E213-A217 VanDerWaalsContact O-CB 3.27Å; E213-A217 WeakPolarHBondContact O-CB 3.4Å; E213-A217 PolarHBondContact O-N 3Å; R214-A217 PolarHBondContact O-N 2.94Å; G215-A217 VanDerWaalsContact C-N 3.27Å; G215-A217 PolarHBondContact O-N 3.46Å; A217-R219 PolarHBondContact O-N 3.44Å; A217-R220 WeakPolarHBondContact O-CA 3.37Å; A217-R220 WeakPolarHBondContact O-CB 3.44Å; A217-R220 PolarHBondContact O-N 3.15Å; A217-R220 VanDerWaalsContact O-N 3.09Å; A217-T221 PolarHBondContact O-N 3.42Å; A217-T221 PolarHBondContact O-OG1 2.76Å
218	K	80.4	Confident	68.5	Low	20 Å²	20	65 Å²	65	9%	0.087	34%	0.344	C	S	.	.	H	α-helix	trans	-57.4	-45	173.6	-84.8	-173.6	155.2	-169.3	0	112	L169 S171 T173 R214 G215 R220 T221 A222	L169-K218 HydrophobicContact CD2-CB 3.96Å; L169-K218 WeakPolarHBondContact O-CD 3.48Å; S171-K218 PolarHBondContact O-NZ 3.49Å; T173-K218 VanDerWaalsContact O-CE 3.29Å; T173-K218 WeakPolarHBondContact O-CE 3.34Å; T173-K218 PolarHBondContact O-NZ 3.1Å; R214-K218 PolarHBondContact O-N 2.96Å; G215-K218 PolarHBondContact O-N 3.38Å; K218-R220 VanDerWaalsContact C-N 3.29Å; K218-R220 PolarHBondContact O-N 3.48Å; K218-T221 PolarHBondContact O-N 2.95Å; K218-T221 VanDerWaalsContact O-N 3.16Å; K218-A222 PolarHBondContact O-N 3.02Å
219	R	78.8	Confident	67.7	Low	14 Å²	14	65.5 Å²	65.5	5%	0.053	35%	0.345	C	S	.	.	H	α-helix	trans	-58.3	-37.9	174.4	-158.6	173.2	-168.3	-153.2	-6.9	112	E114 E160 L169 G215 A217 S223 S230 S233 D263	E114-R219 IonicContact OE1-CZ 3.21Å; E114-R219 IonicContact OE1-NH1 3.71Å; E114-R219 PolarHBondContact OE1-NH1 2.93Å; E160-R219 WeakPolarHBondContact OE1-CG 3.42Å; E160-R219 IonicContact OE1-CZ 2.77Å; E160-R219 IonicContact OE1-NE 3.97Å; E160-R219 PolarHBondContact OE1-NE 2.92Å; E160-R219 IonicContact OE1-NH2 3.18Å; L169-R219 HydrophobicContact CD1-CB 4.04Å; L169-R219 HydrophobicContact CD1-CG 4.18Å; G215-R219 WeakPolarHBondContact O-CB 3.5Å; G215-R219 PolarHBondContact O-N 3.09Å; A217-R219 PolarHBondContact O-N 3.44Å; R219-S223 PolarHBondContact O-N 3.28Å; R219-S230 PolarHBondContact NH2-O 3.46Å; R219-S233 PolarHBondContact NH2-OG 2.87Å; R219-S233 VanDerWaalsContact NH2-OG 3.14Å; R219-D263 IonicContact NH1-OD2 2.82Å; R219-D263 IonicContact NH2-OD2 2.71Å
220	R	68.6	Low	67.2	Low	144 Å²	144	67 Å²	67	54%	0.543	36%	0.36	S	S	.	.	H	α-helix	trans	-69.7	-43.9	173	-85.9	179.1	-75.7	173.4	-4.4	112.9	A216 A217 K218 A222 S223 T224	A216-R220 WeakPolarHBondContact O-CB 3.49Å; A216-R220 WeakPolarHBondContact O-CG 3.36Å; A216-R220 PolarHBondContact O-N 3.28Å; A216-R220 PolarHBondContact O-NE 3.1Å; A217-R220 WeakPolarHBondContact O-CA 3.37Å; A217-R220 WeakPolarHBondContact O-CB 3.44Å; A217-R220 PolarHBondContact O-N 3.15Å; A217-R220 VanDerWaalsContact O-N 3.09Å; K218-R220 VanDerWaalsContact C-N 3.29Å; K218-R220 PolarHBondContact O-N 3.48Å; R220-A222 VanDerWaalsContact C-N 3.34Å; R220-A222 PolarHBondContact O-N 3.19Å; R220-S223 WeakPolarHBondContact CA-OG 3.38Å; R220-S223 CarbonylContact O-C 3.58Å; R220-S223 WeakPolarHBondContact O-CA 3.47Å; R220-S223 WeakPolarHBondContact O-CB 3.45Å; R220-S223 PolarHBondContact O-N 2.78Å; R220-S223 PolarHBondContact O-OG 3.2Å; R220-T224 PolarHBondContact O-N 3.38Å; R220-T224 PolarHBondContact O-OG1 3.41Å
221	T	65	Low	66.5	Low	69 Å²	69	62.2 Å²	62.2	42%	0.423	34%	0.342	S	S	.	.	H	α-helix	trans	-61.4	-39.7	177.4	-57.6	0	0	0	0	112.3	A217 K218 S223 T224 L225	A217-T221 PolarHBondContact O-N 3.42Å; A217-T221 PolarHBondContact O-OG1 2.76Å; K218-T221 PolarHBondContact O-N 2.95Å; K218-T221 VanDerWaalsContact O-N 3.16Å; T221-S223 VanDerWaalsContact C-N 3.33Å; T221-S223 PolarHBondContact O-N 2.89Å; T221-T224 PolarHBondContact O-N 3.34Å; T221-T224 PolarHBondContact O-OG1 3.39Å; T221-L225 HydrophobicContact CG2-CD1 4.41Å; T221-L225 PolarHBondContact O-N 3.08Å
222	A	59.5	Low	66.2	Low	17 Å²	17	63.7 Å²	63.7	14%	0.14	35%	0.346	C	S	.	.	H	α-helix	trans	-59.3	-44.1	170.3	0	0	0	0	0	111.6	K218 R220 T224 L225 M226 Y229	K218-A222 PolarHBondContact O-N 3.02Å; R220-A222 VanDerWaalsContact C-N 3.34Å; R220-A222 PolarHBondContact O-N 3.19Å; A222-T224 VanDerWaalsContact C-N 3.34Å; A222-T224 PolarHBondContact O-N 2.92Å; A222-L225 PolarHBondContact O-N 3.18Å; A222-M226 PolarHBondContact O-N 3.49Å; A222-M226 VanDerWaalsContact O-N 3.08Å; A222-Y229 HydrophobicContact CB-CE1 4.34Å
223	S	55.3	Low	66.3	Low	28 Å²	28	62 Å²	62	20%	0.196	34%	0.337	C	S	.	.	H	α-helix	trans	-68.7	-23.8	-179.9	82.7	0	0	0	0	115.5	R219 R220 T221 M226	R219-S223 PolarHBondContact O-N 3.28Å; R220-S223 WeakPolarHBondContact CA-OG 3.38Å; R220-S223 CarbonylContact O-C 3.58Å; R220-S223 WeakPolarHBondContact O-CA 3.47Å; R220-S223 WeakPolarHBondContact O-CB 3.45Å; R220-S223 PolarHBondContact O-N 2.78Å; R220-S223 PolarHBondContact O-OG 3.2Å; T221-S223 VanDerWaalsContact C-N 3.33Å; T221-S223 PolarHBondContact O-N 2.89Å; S223-M226 CarbonylContact O-C 3.49Å; S223-M226 VanDerWaalsContact O-O 3.11Å
224	T	50.3	Low	66.6	Low	114 Å²	114	56.7 Å²	56.7	70%	0.699	31%	0.313	S	S	*	.	H	α-helix	trans	-83.6	-30.6	175.2	50.6	0	0	0	0	112.3	R220 T221 A222	R220-T224 PolarHBondContact O-N 3.38Å; R220-T224 PolarHBondContact O-OG1 3.41Å; T221-T224 PolarHBondContact O-N 3.34Å; T221-T224 PolarHBondContact O-OG1 3.39Å; A222-T224 VanDerWaalsContact C-N 3.34Å; A222-T224 PolarHBondContact O-N 2.92Å
225	L	48.9	Very low	66.9	Low	128 Å²	128	52 Å²	52	67%	0.67	30%	0.296	S	S	*	.	H	α-helix	trans	-72.6	-33.9	172.2	-73.3	165.1	0	0	0	112.3	T221 A222	T221-L225 HydrophobicContact CG2-CD1 4.41Å; T221-L225 PolarHBondContact O-N 3.08Å; A222-L225 PolarHBondContact O-N 3.18Å
226	M	44.3	Very low	67.3	Low	119 Å²	119	52.2 Å²	52.2	59%	0.586	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.4	108	172.2	-60	-163.8	-161.8	0	0	112.2	A222 S223	A222-M226 PolarHBondContact O-N 3.49Å; A222-M226 VanDerWaalsContact O-N 3.08Å; S223-M226 CarbonylContact O-C 3.49Å; S223-M226 VanDerWaalsContact O-O 3.11Å
227	N	39	Very low	67.9	Low	116 Å²	116	50.9 Å²	50.9	62%	0.62	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-21.2	123.5	179.2	-63.5	-101.1	0	0	0	117.2	Y229	N227-Y229 PolarHBondContact O-N 3.01Å
228	A	50.4	Low	68.5	Low	69 Å²	69	49.4 Å²	49.4	57%	0.57	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.7	43.1	159.4	0	0	0	0	0	115.2
229	Y	56.7	Low	69.1	Low	17 Å²	17	48.5 Å²	48.5	7%	0.067	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-71.2	-32.2	-173	-167.8	-86.9	0	0	0	115.3	E160 Y162 A222 N227 S231 R232 S233	E160-Y229 HydrophobicContact CG-CE1 4.43Å; E160-Y229 WeakPolarHBondContact OE2-CE1 3.34Å; Y162-Y229 WeakPolarHBondContact CB-OH 3.41Å; Y162-Y229 HydrophobicContact CD1-CD2 4.39Å; Y162-Y229 AromaticContact CD1-CE2 3.43Å; Y162-Y229 HydrophobicContact CD1-CE2 3.43Å; Y162-Y229 VanDerWaalsContact CD1-CE2 3.43Å; Y162-Y229 AromaticContact CD1-CZ 3.7Å; Y162-Y229 HydrophobicContact CD2-CD1 4.47Å; Y162-Y229 AromaticContact CD2-CD2 3.93Å; Y162-Y229 HydrophobicContact CD2-CD2 3.93Å; Y162-Y229 HydrophobicContact CD2-CE1 4.15Å; Y162-Y229 AromaticContact CD2-CE2 3.57Å; Y162-Y229 HydrophobicContact CD2-CE2 3.57Å; Y162-Y229 HydrophobicContact CD2-CG 4.38Å; Y162-Y229 AromaticContact CD2-CZ 3.7Å; Y162-Y229 HydrophobicContact CE1-CD2 4.13Å; Y162-Y229 AromaticContact CE1-CE2 3.47Å; Y162-Y229 HydrophobicContact CE1-CE2 3.47Å; Y162-Y229 VanDerWaalsContact CE1-CE2 3.47Å; Y162-Y229 AromaticContact CE2-CD2 3.64Å; Y162-Y229 HydrophobicContact CE2-CD2 3.64Å; Y162-Y229 AromaticContact CE2-CE2 3.62Å; Y162-Y229 HydrophobicContact CE2-CE2 3.62Å; Y162-Y229 HydrophobicContact CE2-CG 4.28Å; Y162-Y229 HydrophobicContact CG-CD2 4.28Å; Y162-Y229 HydrophobicContact CG-CE1 4.15Å; Y162-Y229 AromaticContact CG-CE2 3.46Å; Y162-Y229 HydrophobicContact CG-CE2 3.46Å; Y162-Y229 VanDerWaalsContact CG-CE2 3.46Å; Y162-Y229 AromaticContact CG-CZ 3.38Å; Y162-Y229 AromaticContact CZ-CD2 3.73Å; Y162-Y229 AromaticContact CZ-CE2 3.56Å; A222-Y229 HydrophobicContact CB-CE1 4.34Å; N227-Y229 PolarHBondContact O-N 3.01Å; Y229-S231 VanDerWaalsContact C-N 3.31Å; Y229-S231 PolarHBondContact O-N 3.01Å; Y229-R232 WeakPolarHBondContact O-CA 3.43Å; Y229-R232 WeakPolarHBondContact O-CB 3.15Å; Y229-R232 PolarHBondContact O-N 2.82Å; Y229-S233 PolarHBondContact O-N 3.45Å
230	S	61.2	Low	69.8	Low	65 Å²	65	48.3 Å²	48.3	46%	0.455	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-67.5	-22	-166.2	55.6	0	0	0	0	115.6	R219 R232	R219-S230 PolarHBondContact NH2-O 3.46Å; S230-R232 VanDerWaalsContact C-N 3.32Å
231	S	67.4	Low	70.8	Confident	36 Å²	36	41.4 Å²	41.4	25%	0.252	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-89.4	1.1	173.4	80.6	0	0	0	0	113.7	Y229 G266	Y229-S231 VanDerWaalsContact C-N 3.31Å; Y229-S231 PolarHBondContact O-N 3.01Å; S231-G266 PolarHBondContact O-N 3.4Å
232	R	74.9	Confident	72	Confident	56 Å²	56	40.6 Å²	40.6	21%	0.211	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.6	-18.6	-169.1	-73.8	-171.2	-177.6	171.9	4.7	113.7	Y162 Y229 S230 E282 I286	Y162-R232 HydrophobicContact CE2-CB 4.2Å; Y229-R232 WeakPolarHBondContact O-CA 3.43Å; Y229-R232 WeakPolarHBondContact O-CB 3.15Å; Y229-R232 PolarHBondContact O-N 2.82Å; S230-R232 VanDerWaalsContact C-N 3.32Å; R232-E282 WeakPolarHBondContact CD-OE1 3.43Å; R232-E282 IonicContact CZ-OE1 3.52Å; R232-E282 IonicContact NE-OE1 3.47Å; R232-E282 IonicContact NH1-OE1 3.63Å; R232-E282 PolarHBondContact NH1-OE1 2.76Å; R232-E282 IonicContact NH1-OE2 3.66Å; R232-I286 HydrophobicContact CB-CD1 3.6Å; R232-I286 HydrophobicContact CG-CD1 3.95Å; R232-I286 WeakPolarHBondContact O-CD1 3.35Å; R232-I286 WeakPolarHBondContact O-CG1 3.25Å; R232-I286 WeakPolarHBondContact O-CG2 3.42Å
233	S	82.4	Confident	73.3	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	23%	0.229	C	C	.	.	S	Bend	trans	-88	157	166.4	60.4	0	0	0	0	111.6	E160 I161 R219 Y229	E160-S233 WeakPolarHBondContact OE1-CB 3.39Å; E160-S233 PolarHBondContact OE1-OG 2.95Å; I161-S233 CarbonylContact O-C 3.56Å; I161-S233 WeakPolarHBondContact O-CA 3.28Å; R219-S233 PolarHBondContact NH2-OG 2.87Å; R219-S233 VanDerWaalsContact NH2-OG 3.14Å; Y229-S233 PolarHBondContact O-N 3.45Å
234	H	88.7	Confident	74.7	Confident	4 Å²	4	40.4 Å²	40.4	2%	0.019	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	139.9	159.3	-45.2	-90.1	0	0	0	108.2	I161 D263 L264 A265 S289 L314	I161-H234 HydrophobicContact CB-CB 4.29Å; I161-H234 PolarHBondContact N-O 2.92Å; I161-H234 PolarHBondContact O-N 3.19Å; H234-D263 CarbonylContact C-O 3.35Å; H234-D263 VanDerWaalsContact CA-O 3.31Å; H234-D263 WeakPolarHBondContact CA-O 3.29Å; H234-L264 HydrophobicContact CB-CD2 4.36Å; H234-L264 WeakPolarHBondContact ND1-CA 3.39Å; H234-L264 WeakPolarHBondContact ND1-CD2 3.37Å; H234-A265 PolarHBondContact ND1-N 2.89Å; H234-S289 PolarHBondContact CE1-OG 2.99Å; H234-S289 PolarHBondContact NE2-OG 3.27Å; H234-L314 HydrophobicContact CB-CD1 4.26Å
235	S	89.8	Confident	76	Confident	6 Å²	6	37.4 Å²	37.4	4%	0.042	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	127.2	175.8	-147.2	0	0	0	0	110	L158 V262 D263	L158-S235 WeakPolarHBondContact CD1-OG 3.41Å; S235-V262 CarbonylContact O-C 3.59Å; S235-V262 WeakPolarHBondContact O-CA 3.24Å; S235-D263 PolarHBondContact N-O 3.48Å; S235-D263 PolarHBondContact O-N 3.07Å
236	V	92.3	Very high	77.3	Confident	4 Å²	4	36.4 Å²	36.4	2%	0.024	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	95.5	-179.2	177.9	0	0	0	0	107.8	L159 I161 V262	L159-V236 HydrophobicContact CB-CB 4.33Å; L159-V236 PolarHBondContact N-O 3.35Å; L159-V236 PolarHBondContact O-N 2.99Å; I161-V236 HydrophobicContact CD1-CG2 4.22Å; V236-V262 HydrophobicContact CB-CG2 4.45Å; V236-V262 HydrophobicContact CG1-CG2 4.16Å; V236-V262 HydrophobicContact CG2-CG1 4.02Å; V236-V262 HydrophobicContact CG2-CG2 4.17Å
237	F	92.7	Very high	78.7	Confident	3 Å²	3	32.5 Å²	32.5	1%	0.013	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	114.5	172.6	-176.3	-106.3	0	0	0	109.2	I134 L138 V156 S157 L158 L212 V239 L261	I134-F237 HydrophobicContact CD1-CB 4.33Å; I134-F237 HydrophobicContact CG1-CD1 4.37Å; I134-F237 HydrophobicContact CG2-CD1 3.88Å; I134-F237 HydrophobicContact CG2-CE1 3.81Å; I134-F237 HydrophobicContact CG2-CG 4.41Å; I134-F237 HydrophobicContact CG2-CZ 4.29Å; L138-F237 HydrophobicContact CD1-CE1 3.6Å; L138-F237 HydrophobicContact CD1-CZ 3.61Å; L138-F237 HydrophobicContact CD2-CE1 4.09Å; L138-F237 HydrophobicContact CD2-CZ 4.11Å; L138-F237 HydrophobicContact CG-CE1 4.21Å; L138-F237 HydrophobicContact CG-CZ 4.42Å; V156-F237 HydrophobicContact CB-CE2 3.96Å; V156-F237 HydrophobicContact CB-CZ 3.9Å; V156-F237 HydrophobicContact CG1-CE2 4.4Å; V156-F237 HydrophobicContact CG1-CZ 3.82Å; S157-F237 CarbonylContact O-C 3.58Å; S157-F237 WeakPolarHBondContact O-CA 3.37Å; L158-F237 HydrophobicContact CB-CD2 4.14Å; L158-F237 HydrophobicContact CD1-CB 3.78Å; L158-F237 HydrophobicContact CD1-CD2 3.87Å; L158-F237 HydrophobicContact CD1-CG 4.3Å; L212-F237 HydrophobicContact CD2-CD2 4.35Å; L212-F237 HydrophobicContact CD2-CE2 3.84Å; L212-F237 HydrophobicContact CD2-CZ 4.11Å; F237-V239 HydrophobicContact CD1-CG2 3.89Å; F237-V239 HydrophobicContact CE1-CG2 3.3Å; F237-V239 HydrophobicContact CZ-CG2 4.05Å; F237-L261 HydrophobicContact CB-CB 4.45Å; F237-L261 HydrophobicContact CD1-CB 4.48Å; F237-L261 HydrophobicContact CD1-CD1 4.26Å; F237-L261 PolarHBondContact N-O 3.5Å; F237-L261 PolarHBondContact O-N 3.35Å
238	S	92.9	Very high	80.3	Confident	9 Å²	9	35.8 Å²	35.8	6%	0.063	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	131.6	179.2	-56.5	0	0	0	0	110.4	V156 S157	V156-S238 CarbonylContact C-O 3.51Å; V156-S238 VanDerWaalsContact CA-O 3.32Å; V156-S238 WeakPolarHBondContact CA-O 3.27Å; S157-S238 PolarHBondContact N-O 3.11Å; S157-S238 PolarHBondContact O-N 3.11Å
239	V	92.8	Very high	81.4	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	119	169.3	-168.4	0	0	0	0	108.7	L138 I141 V154 K155 V156 F237 I241 K258 L259	L138-V239 HydrophobicContact CD2-CG1 4.25Å; L138-V239 HydrophobicContact CD2-CG2 3.89Å; I141-V239 HydrophobicContact CD1-CG1 3.87Å; V154-V239 HydrophobicContact CG1-CG1 3.69Å; K155-V239 WeakPolarHBondContact O-CA 3.47Å; V156-V239 HydrophobicContact CG1-CG1 4.32Å; V156-V239 HydrophobicContact CG1-CG2 4.36Å; F237-V239 HydrophobicContact CD1-CG2 3.89Å; F237-V239 HydrophobicContact CE1-CG2 3.3Å; F237-V239 HydrophobicContact CZ-CG2 4.05Å; V239-I241 HydrophobicContact CG1-CG1 4.19Å; V239-K258 WeakPolarHBondContact O-CA 3.35Å; V239-L259 PolarHBondContact N-O 2.94Å; V239-L259 PolarHBondContact O-N 3.39Å
240	T	92	Very high	82.1	Confident	10 Å²	10	41 Å²	41	6%	0.061	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	111.3	177.3	-50.6	0	0	0	0	108.7	K155 I256	K155-T240 PolarHBondContact N-O 3.32Å; K155-T240 PolarHBondContact O-N 3.45Å; T240-I256 HydrophobicContact CG2-CG2 3.77Å
241	I	91.4	Very high	82.6	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	114.7	-178.6	-47	178.7	0	0	0	108.7	V91 I141 L145 V239 M243 I256 G257	V91-I241 HydrophobicContact CG1-CD1 3.94Å; I141-I241 HydrophobicContact CD1-CD1 3.84Å; I141-I241 HydrophobicContact CG1-CD1 3.86Å; I141-I241 HydrophobicContact CG2-CD1 4.06Å; L145-I241 HydrophobicContact CD1-CD1 4.49Å; L145-I241 HydrophobicContact CD1-CG2 3.56Å; L145-I241 HydrophobicContact CD2-CG2 4.41Å; V239-I241 HydrophobicContact CG1-CG1 4.19Å; I241-M243 HydrophobicContact CB-CE 4.34Å; I241-M243 HydrophobicContact CG2-CE 4.14Å; I241-M243 HydrophobicContact CG2-CG 3.85Å; I241-M243 HydrophobicContact CG2-SD 4.22Å; I241-I256 WeakPolarHBondContact O-CA 3.23Å; I241-G257 PolarHBondContact N-O 3.48Å; I241-G257 PolarHBondContact O-N 2.98Å
242	H	88.8	Confident	82.9	Confident	51 Å²	51	44.1 Å²	44.1	24%	0.236	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	126.1	169.6	-55.7	74.7	0	0	0	107.5	F152 S153	F152-H242 CarbonylContact C-O 3.56Å; F152-H242 VanDerWaalsContact CA-O 3.24Å; F152-H242 WeakPolarHBondContact CA-O 3.42Å; S153-H242 PolarHBondContact N-O 3.35Å; S153-H242 PolarHBondContact O-N 3.12Å
243	M	86.9	Confident	82.8	Confident	3 Å²	3	42.4 Å²	42.4	2%	0.015	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	133.9	178.7	-66.2	158.2	-79.6	0	0	109.2	I92 L145 F152 I241 K255	I92-M243 HydrophobicContact CB-SD 4.41Å; I92-M243 HydrophobicContact CG2-SD 4.01Å; I92-M243 VanDerWaalsContact O-SD 3.35Å; L145-M243 HydrophobicContact CD2-CG 3.98Å; L145-M243 HydrophobicContact CD2-SD 3.86Å; F152-M243 HydrophobicContact CB-CG 4.44Å; I241-M243 HydrophobicContact CB-CE 4.34Å; I241-M243 HydrophobicContact CG2-CE 4.14Å; I241-M243 HydrophobicContact CG2-CG 3.85Å; I241-M243 HydrophobicContact CG2-SD 4.22Å; M243-K255 HydrophobicContact CB-CB 4.33Å; M243-K255 HydrophobicContact CE-CB 4.24Å; M243-K255 PolarHBondContact N-O 2.71Å; M243-K255 PolarHBondContact O-N 3.24Å
244	K	84.4	Confident	82.7	Confident	39 Å²	39	43.8 Å²	43.8	17%	0.17	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	120.7	174.7	178.3	-159.2	-179	-174.9	0	109	E151 E252	E151-K244 HydrophobicContact CB-CB 3.99Å; E151-K244 HydrophobicContact CB-CD 3.83Å; E151-K244 VanDerWaalsContact CD-CD 3.48Å; E151-K244 HydrophobicContact CG-CD 4.27Å; E151-K244 PolarHBondContact O-N 2.96Å; E151-K244 IonicContact OE1-NZ 3.19Å; E151-K244 PolarHBondContact OE1-NZ 2.94Å; E151-K244 WeakPolarHBondContact OE2-CD 3.45Å; E151-K244 WeakPolarHBondContact OE2-CE 3.32Å; E151-K244 IonicContact OE2-NZ 2.8Å; E151-K244 PolarHBondContact OE2-NZ 2.67Å; K244-E252 WeakPolarHBondContact CE-OE1 3.37Å; K244-E252 IonicContact NZ-OE1 2.74Å; K244-E252 PolarHBondContact NZ-OE1 3.17Å
245	E	77.9	Confident	82.5	Confident	50 Å²	50	44.4 Å²	44.4	23%	0.234	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	144.6	167.1	-68.8	175.9	163.5	0	0	108.8	L253 K255 K366	E245-L253 PolarHBondContact N-O 2.76Å; E245-L253 PolarHBondContact O-N 2.65Å; E245-K255 VanDerWaalsContact CD-CE 3.47Å; E245-K255 HydrophobicContact CG-CD 4.39Å; E245-K255 WeakPolarHBondContact OE1-CD 3.28Å; E245-K255 WeakPolarHBondContact OE1-CE 3.35Å; E245-K255 IonicContact OE1-NZ 2.68Å; E245-K255 PolarHBondContact OE1-NZ 3.32Å; E245-K366 WeakPolarHBondContact OE2-CE 3.32Å; E245-K366 IonicContact OE2-NZ 3.95Å; E245-K366 PolarHBondContact OE2-NZ 3.43Å
246	I	77.2	Confident	82.4	Confident	107 Å²	107	46.9 Å²	46.9	55%	0.549	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	124.8	168.7	-55.1	177.5	0	0	0	106.3	E251 E252	I246-E251 WeakPolarHBondContact CA-O 3.5Å; I246-E252 HydrophobicContact CG1-CG 4.47Å
247	T	72.8	Confident	82.3	Confident	38 Å²	38	46.7 Å²	46.7	23%	0.233	25%	0.251	C	S	.	.			trans	-73.1	166.5	177.3	65.3	0	0	0	0	111.7	D249 G250 E251 L253	T247-D249 PolarHBondContact O-N 2.95Å; T247-D249 PolarHBondContact OG1-N 3.26Å; T247-G250 PolarHBondContact O-N 3Å; T247-G250 PolarHBondContact OG1-N 3.44Å; T247-E251 HydrophobicContact CG2-CB 4.37Å; T247-E251 PolarHBondContact N-O 2.73Å; T247-E251 PolarHBondContact OG1-N 2.97Å; T247-L253 HydrophobicContact CG2-CD1 3.35Å; T247-L253 HydrophobicContact CG2-CG 3.89Å
248	L	72.1	Confident	82.2	Confident	185 Å²	185	49.5 Å²	49.5	97%	0.969	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-25.7	169.3	-64.2	173.4	0	0	0	112.1	G250	L248-G250 VanDerWaalsContact C-N 3.28Å
249	D	73.3	Confident	82.3	Confident	143 Å²	143	49.1 Å²	49.1	77%	0.765	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-1.4	175.9	-39.2	-83.7	0	0	0	113.2	T247	T247-D249 PolarHBondContact O-N 2.95Å; T247-D249 PolarHBondContact OG1-N 3.26Å
250	G	71.5	Confident	82.4	Confident	51 Å²	51	50.2 Å²	50.2	53%	0.526	27%	0.266	S	S	.	.			trans	82.6	9.6	179.5	0	0	0	0	0	115.5	T247 L248	T247-G250 PolarHBondContact O-N 3Å; T247-G250 PolarHBondContact OG1-N 3.44Å; L248-G250 VanDerWaalsContact C-N 3.28Å
251	E	73.4	Confident	82.5	Confident	108 Å²	108	49.8 Å²	49.8	51%	0.505	26%	0.263	S	S	.	.			trans	-80	125.5	178.5	-62.5	-156.8	140.4	0	0	111.7	I246 T247 L253 T368	I246-E251 WeakPolarHBondContact CA-O 3.5Å; T247-E251 HydrophobicContact CG2-CB 4.37Å; T247-E251 PolarHBondContact N-O 2.73Å; T247-E251 PolarHBondContact OG1-N 2.97Å; E251-L253 PolarHBondContact O-N 3.39Å; E251-T368 WeakPolarHBondContact OE2-CG2 3.47Å
252	E	73.6	Confident	82.6	Confident	59 Å²	59	49.8 Å²	49.8	28%	0.276	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	103.3	169.9	-64.9	-173	141.4	0	0	110	K244 I246 K369	K244-E252 WeakPolarHBondContact CE-OE1 3.37Å; K244-E252 IonicContact NZ-OE1 2.74Å; K244-E252 PolarHBondContact NZ-OE1 3.17Å; I246-E252 HydrophobicContact CG1-CG 4.47Å; E252-K369 HydrophobicContact CB-CB 4.28Å; E252-K369 HydrophobicContact CB-CD 4.36Å; E252-K369 PolarHBondContact O-N 3.3Å; E252-K369 IonicContact OE1-NZ 3.58Å; E252-K369 WeakPolarHBondContact OE2-CD 3.34Å; E252-K369 WeakPolarHBondContact OE2-CE 3.46Å; E252-K369 IonicContact OE2-NZ 2.77Å; E252-K369 PolarHBondContact OE2-NZ 3.26Å
253	L	72.4	Confident	82.8	Confident	21 Å²	21	47.6 Å²	47.6	11%	0.11	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	129.6	176.3	-67.3	-179.2	0	0	0	110.7	E245 T247 E251 K366 T368	E245-L253 PolarHBondContact N-O 2.76Å; E245-L253 PolarHBondContact O-N 2.65Å; T247-L253 HydrophobicContact CG2-CD1 3.35Å; T247-L253 HydrophobicContact CG2-CG 3.89Å; E251-L253 PolarHBondContact O-N 3.39Å; L253-K366 HydrophobicContact CB-CB 4.27Å; L253-K366 HydrophobicContact CB-CD 4.45Å; L253-K366 HydrophobicContact CD1-CB 4.1Å; L253-K366 HydrophobicContact CD1-CD 3.72Å; L253-K366 HydrophobicContact CD2-CB 4.22Å; L253-K366 HydrophobicContact CG-CB 4.44Å; L253-T368 HydrophobicContact CD2-CG2 3.44Å; L253-T368 VanDerWaalsContact CD2-CG2 3.44Å
254	V	80	Confident	82.9	Confident	29 Å²	29	47.6 Å²	47.6	18%	0.176	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	122.5	173.5	-175.3	0	0	0	0	109.6	I256 L367	V254-I256 HydrophobicContact CG1-CG1 4.21Å; V254-L367 PolarHBondContact N-O 2.98Å; V254-L367 PolarHBondContact O-N 2.91Å
255	K	84	Confident	83	Confident	17 Å²	17	45.7 Å²	45.7	7%	0.074	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	145.8	161.9	-61.2	-177	-58.1	-172.2	0	109	I92 M243 E245 K366	I92-K255 PolarHBondContact O-NZ 2.9Å; M243-K255 HydrophobicContact CB-CB 4.33Å; M243-K255 HydrophobicContact CE-CB 4.24Å; M243-K255 PolarHBondContact N-O 2.71Å; M243-K255 PolarHBondContact O-N 3.24Å; E245-K255 VanDerWaalsContact CD-CE 3.47Å; E245-K255 HydrophobicContact CG-CD 4.39Å; E245-K255 WeakPolarHBondContact OE1-CD 3.28Å; E245-K255 WeakPolarHBondContact OE1-CE 3.35Å; E245-K255 IonicContact OE1-NZ 2.68Å; E245-K255 PolarHBondContact OE1-NZ 3.32Å; K255-K366 HydrophobicContact CG-CG 4.27Å
256	I	87.8	Confident	83.3	Confident	57 Å²	57	43.4 Å²	43.4	29%	0.292	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	118.5	168.8	-54.4	179.7	0	0	0	107.8	T240 I241 V254 N364	T240-I256 HydrophobicContact CG2-CG2 3.77Å; I241-I256 WeakPolarHBondContact O-CA 3.23Å; V254-I256 HydrophobicContact CG1-CG1 4.21Å; I256-N364 WeakPolarHBondContact O-CB 3.38Å; I256-N364 PolarHBondContact O-ND2 3.06Å
257	G	90.4	Very high	83.6	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	141.2	166.7	0	0	0	0	0	109.5	V91 I241	V91-G257 WeakPolarHBondContact O-CA 3.41Å; I241-G257 PolarHBondContact N-O 3.48Å; I241-G257 PolarHBondContact O-N 2.98Å
258	K	91.8	Very high	83.8	Confident	63 Å²	63	39.4 Å²	39.4	27%	0.274	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	128.1	172.2	-170.2	168.1	-174.6	170.6	0	111.3	Y95 N96 C97 V239 N260	Y95-K258 PolarHBondContact O-N 3.07Å; N96-K258 CarbonylContact C-O 3.57Å; N96-K258 WeakPolarHBondContact CA-O 3.33Å; C97-K258 PolarHBondContact N-O 3.03Å; V239-K258 WeakPolarHBondContact O-CA 3.35Å; K258-N260 VanDerWaalsContact CE-OD1 3.27Å; K258-N260 WeakPolarHBondContact CE-OD1 3.5Å
259	L	94.5	Very high	83.5	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	120.1	176.8	-178.9	54.8	0	0	0	109.6	I87 V91 C97 V99 T137 V239 L261	I87-L259 HydrophobicContact CG2-CD1 4.08Å; V91-L259 HydrophobicContact CG1-CB 4.26Å; V91-L259 HydrophobicContact CG2-CB 3.9Å; V91-L259 HydrophobicContact CG2-CD1 4.21Å; V91-L259 HydrophobicContact CG2-CD2 4.47Å; V91-L259 HydrophobicContact CG2-CG 4.41Å; C97-L259 HydrophobicContact CB-CD1 3.98Å; C97-L259 WeakPolarHBondContact O-CA 3.49Å; V99-L259 HydrophobicContact CG2-CD1 4.37Å; T137-L259 HydrophobicContact CG2-CD2 3.43Å; T137-L259 VanDerWaalsContact CG2-CD2 3.43Å; V239-L259 PolarHBondContact N-O 2.94Å; V239-L259 PolarHBondContact O-N 3.39Å; L259-L261 HydrophobicContact CD1-CD2 4.09Å; L259-L261 HydrophobicContact CD2-CD2 4.24Å; L259-L261 HydrophobicContact CD2-CG 4.48Å; L259-L261 HydrophobicContact CG-CD2 4.03Å; L259-L261 HydrophobicContact CG-CG 4.19Å
260	N	93.7	Very high	82.7	Confident	23 Å²	23	30.8 Å²	30.8	12%	0.123	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	121.9	172.6	-42.4	-60.5	0	0	0	109	C97 T98 V99 K258 V262	C97-N260 PolarHBondContact O-N 3.5Å; T98-N260 CarbonylContact C-O 3.5Å; T98-N260 VanDerWaalsContact CA-O 3.29Å; T98-N260 WeakPolarHBondContact CA-O 3.3Å; T98-N260 HydrophobicContact CG2-CB 3.96Å; T98-N260 PolarHBondContact OG1-ND2 3.12Å; V99-N260 PolarHBondContact N-O 3.33Å; K258-N260 VanDerWaalsContact CE-OD1 3.27Å; K258-N260 WeakPolarHBondContact CE-OD1 3.5Å; N260-V262 HydrophobicContact CB-CG2 4.32Å
261	L	94.2	Very high	81.9	Confident	1 Å²	1	32.1 Å²	32.1	1%	0.005	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	118.2	175.2	-60.7	178.5	0	0	0	108.1	V99 M113 I133 I134 T137 F237 L259	V99-L261 HydrophobicContact CB-CD2 3.87Å; V99-L261 HydrophobicContact CG2-CD2 4Å; M113-L261 HydrophobicContact SD-CB 4.32Å; I133-L261 HydrophobicContact CG2-CD1 4.04Å; I133-L261 HydrophobicContact CG2-CD2 3.92Å; I134-L261 HydrophobicContact CB-CD1 4.34Å; I134-L261 HydrophobicContact CG1-CB 4.14Å; I134-L261 HydrophobicContact CG1-CD1 3.74Å; T137-L261 HydrophobicContact CG2-CD1 4.3Å; F237-L261 HydrophobicContact CB-CB 4.45Å; F237-L261 HydrophobicContact CD1-CB 4.48Å; F237-L261 HydrophobicContact CD1-CD1 4.26Å; F237-L261 PolarHBondContact N-O 3.5Å; F237-L261 PolarHBondContact O-N 3.35Å; L259-L261 HydrophobicContact CD1-CD2 4.09Å; L259-L261 HydrophobicContact CD2-CD2 4.24Å; L259-L261 HydrophobicContact CD2-CG 4.48Å; L259-L261 HydrophobicContact CG-CD2 4.03Å; L259-L261 HydrophobicContact CG-CG 4.19Å
262	V	93.9	Very high	81	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	110.3	-163.7	-177.1	0	0	0	0	112.1	T98 V99 F100 A101 S235 V236 N260 L264 L318	T98-V262 HydrophobicContact CG2-CG2 4.32Å; V99-V262 PolarHBondContact O-N 3.14Å; F100-V262 HydrophobicContact CD1-CB 3.56Å; F100-V262 HydrophobicContact CD1-CG1 3.73Å; F100-V262 HydrophobicContact CD1-CG2 4.1Å; F100-V262 HydrophobicContact CE1-CB 3.83Å; F100-V262 HydrophobicContact CE1-CG1 3.92Å; F100-V262 HydrophobicContact CE1-CG2 3.86Å; A101-V262 PolarHBondContact N-O 3.12Å; S235-V262 CarbonylContact O-C 3.59Å; S235-V262 WeakPolarHBondContact O-CA 3.24Å; V236-V262 HydrophobicContact CB-CG2 4.45Å; V236-V262 HydrophobicContact CG1-CG2 4.16Å; V236-V262 HydrophobicContact CG2-CG1 4.02Å; V236-V262 HydrophobicContact CG2-CG2 4.17Å; N260-V262 HydrophobicContact CB-CG2 4.32Å; V262-L264 HydrophobicContact CG1-CD2 3.66Å; V262-L264 HydrophobicContact CG1-CG 4.2Å; V262-L318 HydrophobicContact CG2-CD2 4.45Å
263	D	92.5	Very high	80	Confident	5 Å²	5	34.2 Å²	34.2	3%	0.027	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	106.5	170.9	-170.8	37.7	0	0	0	108.7	K109 T110 M113 R219 H234 S235	K109-D263 WeakPolarHBondContact CB-OD1 3.42Å; T110-D263 WeakPolarHBondContact CB-OD2 3.39Å; T110-D263 WeakPolarHBondContact CG2-OD2 3.46Å; T110-D263 PolarHBondContact N-OD1 3.24Å; T110-D263 VanDerWaalsContact N-OD1 3.08Å; T110-D263 PolarHBondContact OG1-OD1 3.24Å; T110-D263 PolarHBondContact OG1-OD2 3.44Å; M113-D263 HydrophobicContact CB-CB 4.29Å; M113-D263 HydrophobicContact CG-CB 4.13Å; R219-D263 IonicContact NH1-OD2 2.82Å; R219-D263 IonicContact NH2-OD2 2.71Å; H234-D263 CarbonylContact C-O 3.35Å; H234-D263 VanDerWaalsContact CA-O 3.31Å; H234-D263 WeakPolarHBondContact CA-O 3.29Å; S235-D263 PolarHBondContact N-O 3.48Å; S235-D263 PolarHBondContact O-N 3.07Å
264	L	90.4	Very high	79	Confident	3 Å²	3	36.6 Å²	36.6	2%	0.016	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-80.9	162.7	179.2	-60.7	174.4	0	0	0	111.4	F100 A101 Y102 K109 H234 V262 L290 L293 L314	F100-L264 HydrophobicContact CD1-CD1 4.48Å; A101-L264 VanDerWaalsContact O-CB 3.32Å; A101-L264 WeakPolarHBondContact O-CB 3.37Å; A101-L264 WeakPolarHBondContact O-CG 3.45Å; A101-L264 PolarHBondContact O-N 3.22Å; Y102-L264 HydrophobicContact CD2-CD1 3.9Å; K109-L264 WeakPolarHBondContact CE-O 3.25Å; H234-L264 HydrophobicContact CB-CD2 4.36Å; H234-L264 WeakPolarHBondContact ND1-CA 3.39Å; H234-L264 WeakPolarHBondContact ND1-CD2 3.37Å; V262-L264 HydrophobicContact CG1-CD2 3.66Å; V262-L264 HydrophobicContact CG1-CG 4.2Å; L264-L290 HydrophobicContact CB-CD2 4.42Å; L264-L290 HydrophobicContact CD1-CD2 4.41Å; L264-L293 HydrophobicContact CD1-CD2 4.03Å; L264-L314 HydrophobicContact CD2-CD1 3.99Å; L264-L314 HydrophobicContact CD2-CD2 4.04Å
265	A	86.6	Confident	77.6	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-66.7	171.3	172.5	0	0	0	0	0	113.1	K109 H234 I286	K109-A265 WeakPolarHBondContact CE-O 3.42Å; K109-A265 PolarHBondContact NZ-O 3.2Å; H234-A265 PolarHBondContact ND1-N 2.89Å; A265-I286 HydrophobicContact CB-CG2 3.69Å
266	G	84.3	Confident	76	Confident	2 Å²	2	40.8 Å²	40.8	2%	0.021	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-56.2	133.2	169.8	0	0	0	0	0	113.5	T105 S231 E268 L290	T105-G266 WeakPolarHBondContact OG1-CA 3.45Å; S231-G266 PolarHBondContact O-N 3.4Å; G266-E268 VanDerWaalsContact C-OE2 3.3Å; G266-E268 WeakPolarHBondContact CA-OE2 3.4Å; G266-L290 VanDerWaalsContact O-CD1 3.26Å; G266-L290 WeakPolarHBondContact O-CD1 3.48Å
267	S	82.8	Confident	74.7	Confident	18 Å²	18	44 Å²	44	13%	0.126	27%	0.269	C	S	.	.			trans	-88.2	0.5	178	68.3	0	0	0	0	114.7	G103 Q104	G103-S267 PolarHBondContact O-N 3.1Å; G103-S267 PolarHBondContact O-OG 2.97Å; Q104-S267 PolarHBondContact N-OG 3.01Å
268	E	76.5	Confident	73.1	Confident	42 Å²	42	52.8 Å²	52.8	20%	0.196	31%	0.307	C	S	.	.			trans	-74.5	159.3	-170.1	62.4	-81.9	-175.5	0	0	116	Q104 T105 G266 N287 E343	Q104-E268 WeakPolarHBondContact CA-OE2 3.3Å; Q104-E268 HydrophobicContact CG-CB 4.15Å; T105-E268 WeakPolarHBondContact CB-OE1 3.4Å; T105-E268 PolarHBondContact N-OE2 3.03Å; T105-E268 PolarHBondContact OG1-OE1 3.31Å; T105-E268 PolarHBondContact OG1-OE2 3.11Å; G266-E268 VanDerWaalsContact C-OE2 3.3Å; G266-E268 WeakPolarHBondContact CA-OE2 3.4Å; E268-N287 PolarHBondContact O-ND2 3.18Å; E268-E343 HydrophobicContact CB-CG 4.48Å
269	N	65.3	Low	71.5	Confident	95 Å²	95	55.4 Å²	55.4	51%	0.508	32%	0.315	S	S	.	.			trans	-81.6	124.7	-176.6	-69.4	-79.1	0	0	0	113.4	G271 R272 E343	N269-G271 PolarHBondContact O-N 3.27Å; N269-R272 PolarHBondContact O-N 3.47Å; N269-R272 VanDerWaalsContact O-N 3.09Å; N269-E343 PolarHBondContact N-OE1 2.77Å; N269-E343 PolarHBondContact ND2-OE1 2.76Å; N269-E343 VanDerWaalsContact ND2-OE1 3.11Å; N269-E343 PolarHBondContact ND2-OE2 2.92Å
270	I	57.4	Low	69.8	Low	52 Å²	52	57.2 Å²	57.2	27%	0.267	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-49.2	-32	-178.9	-44.6	178	0	0	0	113	R272 S273 A275 A283	I270-R272 VanDerWaalsContact C-N 3.25Å; I270-R272 PolarHBondContact O-N 3.47Å; I270-S273 WeakPolarHBondContact O-CB 3.26Å; I270-S273 PolarHBondContact O-N 2.85Å; I270-A275 HydrophobicContact CG2-CB 4.49Å; I270-A283 HydrophobicContact CD1-CB 3.83Å; I270-A283 HydrophobicContact CG1-CB 3.91Å; I270-A283 HydrophobicContact CG2-CB 3.94Å
271	G	55	Low	68.4	Low	79 Å²	79	65.9 Å²	65.9	81%	0.814	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-59.2	-27.5	-179.1	0	0	0	0	0	115.1	N269	N269-G271 PolarHBondContact O-N 3.27Å
272	R	53.9	Low	66.7	Low	146 Å²	146	67.4 Å²	67.4	55%	0.551	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-82.7	-14	173.7	-73.2	-179	66.7	171.1	-3.7	113.3	N269 I270 S339	N269-R272 PolarHBondContact O-N 3.47Å; N269-R272 VanDerWaalsContact O-N 3.09Å; I270-R272 VanDerWaalsContact C-N 3.25Å; I270-R272 PolarHBondContact O-N 3.47Å; R272-S339 PolarHBondContact NH1-O 3.45Å; R272-S339 PolarHBondContact NH2-O 3.17Å
273	S	52.2	Low	65.2	Low	66 Å²	66	68 Å²	68	46%	0.462	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-3.9	-168.8	-47.3	0	0	0	0	115	I270 A275	I270-S273 WeakPolarHBondContact O-CB 3.26Å; I270-S273 PolarHBondContact O-N 2.85Å; S273-A275 PolarHBondContact O-N 3.41Å; S273-A275 VanDerWaalsContact O-N 3.11Å
274	G	52.6	Low	63.9	Low	70 Å²	70	69.1 Å²	69.1	72%	0.722	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.4	22.1	176.9	0	0	0	0	0	115.1
275	A	50.1	Low	62.9	Low	26 Å²	26	71.7 Å²	71.7	22%	0.215	40%	0.4	C	S	.	.			trans	-82	123.6	-169.2	0	0	0	0	0	112.7	I270 S273 R279	I270-A275 HydrophobicContact CG2-CB 4.49Å; S273-A275 PolarHBondContact O-N 3.41Å; S273-A275 VanDerWaalsContact O-N 3.11Å; A275-R279 HydrophobicContact CB-CB 3.76Å
276	V	51.2	Low	62	Low	108 Å²	108	72 Å²	72	66%	0.655	40%	0.401	S	S	*	.			trans	-98.8	140.5	178	-174.4	0	0	0	0	111.2	K278 R279	V276-K278 PolarHBondContact O-N 2.99Å; V276-R279 PolarHBondContact O-N 2.97Å
277	D	59.3	Low	61.4	Low	126 Å²	126	73.6 Å²	73.6	67%	0.674	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	40.6	-92	173.1	-66	-19.9	0	0	0	116.8	R279 A280 R281	D277-R279 PolarHBondContact O-N 2.77Å; D277-A280 WeakPolarHBondContact O-CB 3.4Å; D277-A280 PolarHBondContact O-N 3.47Å; D277-R281 PolarHBondContact O-N 3.28Å; D277-R281 VanDerWaalsContact O-N 3.09Å
278	K	56.8	Low	61.3	Low	184 Å²	184	76.8 Å²	76.8	80%	0.8	42%	0.422	S	S	*	.	H	α-helix	trans	-60	-45.6	-174.4	-71.5	-170.6	176.8	-175.4	0	111.6	V276 A280 R281 E282	V276-K278 PolarHBondContact O-N 2.99Å; K278-A280 PolarHBondContact O-N 2.96Å; K278-R281 PolarHBondContact O-N 3.45Å; K278-E282 WeakPolarHBondContact O-CB 3.34Å; K278-E282 PolarHBondContact O-N 3.14Å; K278-E282 VanDerWaalsContact O-N 3.07Å
279	R	57.6	Low	61.7	Low	118 Å²	118	74.9 Å²	74.9	45%	0.445	41%	0.414	S	S	.	.	H	α-helix	trans	-67.9	-24.2	176.8	-71.6	-178.4	177.7	174.3	1	112.5	A275 V276 D277 A283	A275-R279 HydrophobicContact CB-CB 3.76Å; V276-R279 PolarHBondContact O-N 2.97Å; D277-R279 PolarHBondContact O-N 2.77Å; R279-A283 VanDerWaalsContact O-CB 3.24Å; R279-A283 WeakPolarHBondContact O-CB 3.43Å; R279-A283 PolarHBondContact O-N 3.11Å
280	A	60.6	Low	62.6	Low	38 Å²	38	71 Å²	71	31%	0.314	39%	0.393	S	S	.	.	H	α-helix	trans	-75.5	-37.5	176.6	0	0	0	0	0	112.1	D277 K278 G284	D277-A280 WeakPolarHBondContact O-CB 3.4Å; D277-A280 PolarHBondContact O-N 3.47Å; K278-A280 PolarHBondContact O-N 2.96Å; A280-G284 PolarHBondContact O-N 3.44Å
281	R	63.8	Low	63.9	Low	204 Å²	204	73.4 Å²	73.4	77%	0.77	41%	0.406	S	S	*	.	H	α-helix	trans	-68.2	-44.8	171.2	-65.2	-172.5	-169.9	174.3	3.4	112.1	D277 K278 G284 N285	D277-R281 PolarHBondContact O-N 3.28Å; D277-R281 VanDerWaalsContact O-N 3.09Å; K278-R281 PolarHBondContact O-N 3.45Å; R281-G284 WeakPolarHBondContact O-CA 3.48Å; R281-G284 PolarHBondContact O-N 2.84Å; R281-G284 VanDerWaalsContact O-N 3.12Å; R281-N285 PolarHBondContact O-N 3.24Å
282	E	59.2	Low	65.5	Low	34 Å²	34	69.7 Å²	69.7	16%	0.159	37%	0.367	C	S	.	.	H	α-helix	trans	-54.3	-56.3	175.8	-176.2	-157.7	132.2	0	0	111	R232 K278 G284 N285 I286	R232-E282 WeakPolarHBondContact CD-OE1 3.43Å; R232-E282 IonicContact CZ-OE1 3.52Å; R232-E282 IonicContact NE-OE1 3.47Å; R232-E282 IonicContact NH1-OE1 3.63Å; R232-E282 PolarHBondContact NH1-OE1 2.76Å; R232-E282 IonicContact NH1-OE2 3.66Å; K278-E282 WeakPolarHBondContact O-CB 3.34Å; K278-E282 PolarHBondContact O-N 3.14Å; K278-E282 VanDerWaalsContact O-N 3.07Å; E282-G284 VanDerWaalsContact C-N 3.26Å; E282-G284 PolarHBondContact O-N 3.11Å; E282-N285 PolarHBondContact O-N 3.07Å; E282-I286 HydrophobicContact CG-CD1 4.15Å; E282-I286 WeakPolarHBondContact O-CD1 3.29Å; E282-I286 VanDerWaalsContact O-CG1 3.3Å; E282-I286 WeakPolarHBondContact O-CG1 3.35Å; E282-I286 PolarHBondContact O-N 3.29Å
283	A	61.4	Low	67.3	Low	13 Å²	13	63 Å²	63	11%	0.107	34%	0.342	C	S	.	.	H	α-helix	trans	-63.6	-30.4	175.1	0	0	0	0	0	112.7	I270 R279 N287	I270-A283 HydrophobicContact CD1-CB 3.83Å; I270-A283 HydrophobicContact CG1-CB 3.91Å; I270-A283 HydrophobicContact CG2-CB 3.94Å; R279-A283 VanDerWaalsContact O-CB 3.24Å; R279-A283 WeakPolarHBondContact O-CB 3.43Å; R279-A283 PolarHBondContact O-N 3.11Å; A283-N287 VanDerWaalsContact O-CB 3.28Å; A283-N287 WeakPolarHBondContact O-CB 3.41Å; A283-N287 PolarHBondContact O-N 2.96Å; A283-N287 PolarHBondContact O-OD1 3.32Å
284	G	65.5	Low	69	Low	28 Å²	28	60.4 Å²	60.4	29%	0.289	33%	0.326	S	S	.	.	H	α-helix	trans	-60.6	-46.4	172.1	0	0	0	0	0	112.8	A280 R281 E282 Q288	A280-G284 PolarHBondContact O-N 3.44Å; R281-G284 WeakPolarHBondContact O-CA 3.48Å; R281-G284 PolarHBondContact O-N 2.84Å; R281-G284 VanDerWaalsContact O-N 3.12Å; E282-G284 VanDerWaalsContact C-N 3.26Å; E282-G284 PolarHBondContact O-N 3.11Å; G284-Q288 WeakPolarHBondContact O-CB 3.39Å; G284-Q288 PolarHBondContact O-N 3.49Å
285	N	69	Low	70.8	Confident	56 Å²	56	63 Å²	63	30%	0.299	31%	0.314	S	S	.	.	H	α-helix	trans	-70.4	-36.9	178.7	-67.3	-7.3	0	0	0	112	N163 R281 E282 Q288 S289	N163-N285 PolarHBondContact OD1-ND2 3.28Å; R281-N285 PolarHBondContact O-N 3.24Å; E282-N285 PolarHBondContact O-N 3.07Å; N285-Q288 WeakPolarHBondContact O-CB 3.11Å; N285-Q288 PolarHBondContact O-N 2.87Å; N285-S289 PolarHBondContact O-N 2.93Å
286	I	67.6	Low	72.8	Confident	7 Å²	7	61.8 Å²	61.8	4%	0.036	30%	0.304	C	S	.	.	H	α-helix	trans	-64.9	-50.5	174.6	-62.9	157.2	0	0	0	109.8	Y162 R232 A265 E282 Q288 S289 L290	Y162-I286 HydrophobicContact CE2-CD1 4.42Å; R232-I286 HydrophobicContact CB-CD1 3.6Å; R232-I286 HydrophobicContact CG-CD1 3.95Å; R232-I286 WeakPolarHBondContact O-CD1 3.35Å; R232-I286 WeakPolarHBondContact O-CG1 3.25Å; R232-I286 WeakPolarHBondContact O-CG2 3.42Å; A265-I286 HydrophobicContact CB-CG2 3.69Å; E282-I286 HydrophobicContact CG-CD1 4.15Å; E282-I286 WeakPolarHBondContact O-CD1 3.29Å; E282-I286 VanDerWaalsContact O-CG1 3.3Å; E282-I286 WeakPolarHBondContact O-CG1 3.35Å; E282-I286 PolarHBondContact O-N 3.29Å; I286-Q288 VanDerWaalsContact C-N 3.27Å; I286-Q288 PolarHBondContact O-N 3.21Å; I286-S289 PolarHBondContact O-N 3.05Å; I286-S289 VanDerWaalsContact O-N 3.14Å; I286-S289 PolarHBondContact O-OG 2.87Å; I286-L290 PolarHBondContact O-N 3.27Å
287	N	71.6	Confident	74.6	Confident	36 Å²	36	56.7 Å²	56.7	19%	0.193	27%	0.273	C	S	.	.	H	α-helix	trans	-68.9	-25.1	178.3	-71.2	32.1	0	0	0	112	E268 A283 L290 L291	E268-N287 PolarHBondContact O-ND2 3.18Å; A283-N287 VanDerWaalsContact O-CB 3.28Å; A283-N287 WeakPolarHBondContact O-CB 3.41Å; A283-N287 PolarHBondContact O-N 2.96Å; A283-N287 PolarHBondContact O-OD1 3.32Å; N287-L290 PolarHBondContact O-N 3.4Å; N287-L291 WeakPolarHBondContact O-CB 3.43Å; N287-L291 PolarHBondContact O-N 3.09Å
288	Q	80.8	Confident	76.1	Confident	84 Å²	84	52.3 Å²	52.3	39%	0.393	25%	0.251	S	S	.	.	H	α-helix	trans	-59	-45.6	169.1	172.8	-179	-21	0	0	111.1	G284 N285 I286 L290 L291 T292 E311	G284-Q288 WeakPolarHBondContact O-CB 3.39Å; G284-Q288 PolarHBondContact O-N 3.49Å; N285-Q288 WeakPolarHBondContact O-CB 3.11Å; N285-Q288 PolarHBondContact O-N 2.87Å; I286-Q288 VanDerWaalsContact C-N 3.27Å; I286-Q288 PolarHBondContact O-N 3.21Å; Q288-L290 PolarHBondContact O-N 3.18Å; Q288-L291 PolarHBondContact O-N 3.43Å; Q288-T292 WeakPolarHBondContact O-CB 3.34Å; Q288-T292 PolarHBondContact O-N 3.17Å; Q288-T292 PolarHBondContact O-OG1 2.92Å; Q288-E311 PolarHBondContact NE2-O 3.06Å
289	S	85.5	Confident	77.8	Confident	3 Å²	3	43.8 Å²	43.8	2%	0.021	22%	0.215	C	C	.	.	H	α-helix	trans	-61.5	-41.7	179.9	70.9	0	0	0	0	112.2	E164 H234 N285 I286 L293 S312	E164-S289 WeakPolarHBondContact OE1-CB 3.41Å; H234-S289 PolarHBondContact CE1-OG 2.99Å; H234-S289 PolarHBondContact NE2-OG 3.27Å; N285-S289 PolarHBondContact O-N 2.93Å; I286-S289 PolarHBondContact O-N 3.05Å; I286-S289 VanDerWaalsContact O-N 3.14Å; I286-S289 PolarHBondContact O-OG 2.87Å; S289-L293 WeakPolarHBondContact O-CB 3.5Å; S289-L293 PolarHBondContact O-N 3.48Å; S289-S312 WeakPolarHBondContact CB-OG 3.27Å
290	L	84.5	Confident	79.3	Confident	12 Å²	12	39.6 Å²	39.6	6%	0.063	20%	0.201	C	C	.	.	H	α-helix	trans	-75.9	-33.3	176.7	-67	-177.9	0	0	0	113.5	Y102 L264 G266 I286 N287 Q288 L293 G294 L314	Y102-L290 HydrophobicContact CD2-CD2 4.46Å; Y102-L290 HydrophobicContact CE2-CD1 4.49Å; Y102-L290 HydrophobicContact CE2-CD2 4.17Å; L264-L290 HydrophobicContact CB-CD2 4.42Å; L264-L290 HydrophobicContact CD1-CD2 4.41Å; G266-L290 VanDerWaalsContact O-CD1 3.26Å; G266-L290 WeakPolarHBondContact O-CD1 3.48Å; I286-L290 PolarHBondContact O-N 3.27Å; N287-L290 PolarHBondContact O-N 3.4Å; Q288-L290 PolarHBondContact O-N 3.18Å; L290-L293 HydrophobicContact CD2-CD2 4.06Å; L290-L293 WeakPolarHBondContact O-CB 3.33Å; L290-L293 PolarHBondContact O-N 3.09Å; L290-G294 PolarHBondContact O-N 3.39Å; L290-L314 HydrophobicContact CD2-CD2 4.49Å
291	L	84.1	Confident	80.7	Confident	103 Å²	103	40 Å²	40	54%	0.539	20%	0.199	S	C	.	.	H	α-helix	trans	-67.4	-42.6	173.7	179.7	63.2	0	0	0	110.7	N287 Q288 G294 R295	N287-L291 WeakPolarHBondContact O-CB 3.43Å; N287-L291 PolarHBondContact O-N 3.09Å; Q288-L291 PolarHBondContact O-N 3.43Å; L291-G294 CarbonylContact O-C 3.54Å; L291-G294 WeakPolarHBondContact O-CA 3.36Å; L291-G294 PolarHBondContact O-N 3.14Å; L291-R295 WeakPolarHBondContact O-CG 3.44Å; L291-R295 PolarHBondContact O-N 3.23Å
292	T	89.4	Confident	81.9	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.012	19%	0.186	C	C	.	.	H	α-helix	trans	-62.9	-43.1	173.6	-61	0	0	0	0	111	Q288 G294 R295 V296 E311 T315	Q288-T292 WeakPolarHBondContact O-CB 3.34Å; Q288-T292 PolarHBondContact O-N 3.17Å; Q288-T292 PolarHBondContact O-OG1 2.92Å; T292-G294 VanDerWaalsContact C-N 3.32Å; T292-G294 PolarHBondContact O-N 3.36Å; T292-R295 WeakPolarHBondContact O-CB 3.29Å; T292-R295 PolarHBondContact O-N 3.43Å; T292-R295 VanDerWaalsContact O-N 3.13Å; T292-V296 WeakPolarHBondContact O-CG2 3.38Å; T292-V296 PolarHBondContact O-N 2.96Å; T292-E311 HydrophobicContact CG2-CB 3.37Å; T292-T315 HydrophobicContact CG2-CG2 4.08Å
293	L	89.7	Confident	83.2	Confident	4 Å²	4	40.8 Å²	40.8	2%	0.021	21%	0.209	C	C	.	.	H	α-helix	trans	-57.3	-44.7	171.1	-171.4	66.3	0	0	0	111.2	L264 S289 L290 R295 V296 I297 L314 T315 L318 L322 Y350	L264-L293 HydrophobicContact CD1-CD2 4.03Å; S289-L293 WeakPolarHBondContact O-CB 3.5Å; S289-L293 PolarHBondContact O-N 3.48Å; L290-L293 HydrophobicContact CD2-CD2 4.06Å; L290-L293 WeakPolarHBondContact O-CB 3.33Å; L290-L293 PolarHBondContact O-N 3.09Å; L293-R295 PolarHBondContact O-N 3.12Å; L293-V296 PolarHBondContact O-N 3Å; L293-I297 WeakPolarHBondContact O-CG1 3.4Å; L293-I297 PolarHBondContact O-N 3.11Å; L293-L314 HydrophobicContact CD2-CD2 4.31Å; L293-T315 HydrophobicContact CB-CG2 4.04Å; L293-T315 HydrophobicContact CD1-CG2 3.77Å; L293-L318 HydrophobicContact CD1-CD1 4.38Å; L293-L322 HydrophobicContact CD1-CD1 3.48Å; L293-L322 VanDerWaalsContact CD1-CD1 3.48Å; L293-Y350 WeakPolarHBondContact CD2-OH 3.31Å; L293-Y350 VanDerWaalsContact CG-OH 3.32Å; L293-Y350 WeakPolarHBondContact CG-OH 3.38Å
294	G	88.4	Confident	84.6	Confident	12 Å²	12	46.5 Å²	46.5	12%	0.124	23%	0.228	C	C	.	.	H	α-helix	trans	-62.4	-35.8	173	0	0	0	0	0	114.5	L290 L291 T292 T298	L290-G294 PolarHBondContact O-N 3.39Å; L291-G294 CarbonylContact O-C 3.54Å; L291-G294 WeakPolarHBondContact O-CA 3.36Å; L291-G294 PolarHBondContact O-N 3.14Å; T292-G294 VanDerWaalsContact C-N 3.32Å; T292-G294 PolarHBondContact O-N 3.36Å; G294-T298 WeakPolarHBondContact O-CB 3.2Å; G294-T298 PolarHBondContact O-N 3.3Å; G294-T298 PolarHBondContact O-OG1 2.86Å
295	R	89.9	Confident	85.6	Confident	126 Å²	126	52 Å²	52	48%	0.475	26%	0.259	S	S	.	.	H	α-helix	trans	-65.9	-45.5	171.9	-70.5	172.1	179.2	-177.5	-2.5	111.3	L291 T292 L293 T298 A299 P308 E311	L291-R295 WeakPolarHBondContact O-CG 3.44Å; L291-R295 PolarHBondContact O-N 3.23Å; T292-R295 WeakPolarHBondContact O-CB 3.29Å; T292-R295 PolarHBondContact O-N 3.43Å; T292-R295 VanDerWaalsContact O-N 3.13Å; L293-R295 PolarHBondContact O-N 3.12Å; R295-T298 PolarHBondContact O-N 2.94Å; R295-A299 VanDerWaalsContact O-CB 3.31Å; R295-A299 WeakPolarHBondContact O-CB 3.42Å; R295-A299 PolarHBondContact O-N 3.12Å; R295-P308 HydrophobicContact CB-CG 4.22Å; R295-E311 IonicContact CZ-OE2 2.7Å; R295-E311 IonicContact NH1-OE1 3.5Å; R295-E311 IonicContact NH1-OE2 3.47Å; R295-E311 PolarHBondContact NH1-OE2 3.47Å
296	V	92.5	Very high	86.6	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-58.8	-47.8	176.1	163	0	0	0	0	110.8	T292 L293 T298 A299 L300 V307 P308 Y309 T315 L322	T292-V296 WeakPolarHBondContact O-CG2 3.38Å; T292-V296 PolarHBondContact O-N 2.96Å; L293-V296 PolarHBondContact O-N 3Å; V296-T298 PolarHBondContact O-N 3.4Å; V296-A299 PolarHBondContact O-N 3.01Å; V296-L300 HydrophobicContact CG1-CD1 3.93Å; V296-L300 WeakPolarHBondContact O-CB 3.45Å; V296-L300 WeakPolarHBondContact O-CG 3.36Å; V296-L300 PolarHBondContact O-N 3.32Å; V296-V307 HydrophobicContact CB-CG1 4.17Å; V296-V307 HydrophobicContact CG1-CG1 3.86Å; V296-V307 HydrophobicContact CG2-CG1 4.06Å; V296-P308 HydrophobicContact CG2-CG 4.11Å; V296-Y309 HydrophobicContact CG1-CD1 3.87Å; V296-Y309 HydrophobicContact CG1-CE1 3.44Å; V296-Y309 VanDerWaalsContact CG1-CE1 3.44Å; V296-Y309 HydrophobicContact CG2-CD1 4.18Å; V296-T315 HydrophobicContact CB-CG2 4.43Å; V296-T315 HydrophobicContact CG2-CG2 3.98Å; V296-L322 HydrophobicContact CG1-CD1 4.47Å
297	I	90.4	Very high	87.7	Confident	1 Å²	1	57 Å²	57	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-59	-47.1	174.7	-70.5	-163.8	0	0	0	111.4	L293 A299 L300 V301 Y350 R353 A354 I357	L293-I297 WeakPolarHBondContact O-CG1 3.4Å; L293-I297 PolarHBondContact O-N 3.11Å; I297-A299 PolarHBondContact O-N 3.07Å; I297-L300 PolarHBondContact O-N 3.48Å; I297-V301 HydrophobicContact CG2-CG2 4.49Å; I297-V301 VanDerWaalsContact O-CG2 3.31Å; I297-V301 WeakPolarHBondContact O-CG2 3.48Å; I297-V301 PolarHBondContact O-N 2.72Å; I297-Y350 HydrophobicContact CD1-CE1 3.99Å; I297-Y350 HydrophobicContact CD1-CE2 3.93Å; I297-Y350 WeakPolarHBondContact CD1-OH 2.84Å; I297-R353 HydrophobicContact CG2-CB 4.18Å; I297-A354 HydrophobicContact CD1-CB 3.79Å; I297-A354 HydrophobicContact CG2-CB 4.36Å; I297-I357 HydrophobicContact CB-CD1 4.12Å; I297-I357 HydrophobicContact CD1-CD1 4.02Å; I297-I357 HydrophobicContact CG1-CD1 3.69Å; I297-I357 HydrophobicContact CG2-CD1 4Å
298	T	89.6	Confident	88.6	Confident	33 Å²	33	56 Å²	56	20%	0.202	28%	0.277	C	S	.	.	H	α-helix	trans	-64	-43.8	-179.2	-55.6	0	0	0	0	111.2	G294 R295 V296 L300 V301 E302 R353	G294-T298 WeakPolarHBondContact O-CB 3.2Å; G294-T298 PolarHBondContact O-N 3.3Å; G294-T298 PolarHBondContact O-OG1 2.86Å; R295-T298 PolarHBondContact O-N 2.94Å; V296-T298 PolarHBondContact O-N 3.4Å; T298-L300 PolarHBondContact O-N 2.96Å; T298-V301 PolarHBondContact O-N 3.25Å; T298-E302 VanDerWaalsContact CG2-OE1 3.24Å; T298-E302 WeakPolarHBondContact CG2-OE1 3.37Å; T298-E302 WeakPolarHBondContact O-CB 3.42Å; T298-E302 WeakPolarHBondContact O-CG 3.28Å; T298-E302 PolarHBondContact O-N 3Å; T298-R353 PolarHBondContact OG1-NH1 2.68Å; T298-R353 VanDerWaalsContact OG1-NH1 3.14Å
299	A	91.8	Very high	89.1	Confident	5 Å²	5	53.3 Å²	53.3	4%	0.041	26%	0.264	C	S	.	.	H	α-helix	trans	-64.6	-34.8	176	0	0	0	0	0	113.2	R295 V296 I297 K303 R304 V307	R295-A299 VanDerWaalsContact O-CB 3.31Å; R295-A299 WeakPolarHBondContact O-CB 3.42Å; R295-A299 PolarHBondContact O-N 3.12Å; V296-A299 PolarHBondContact O-N 3.01Å; I297-A299 PolarHBondContact O-N 3.07Å; A299-K303 WeakPolarHBondContact O-CA 3.5Å; A299-K303 PolarHBondContact O-N 3.26Å; A299-R304 HydrophobicContact CB-CB 4.2Å; A299-R304 HydrophobicContact CB-CG 4.31Å; A299-R304 PolarHBondContact O-N 3.36Å; A299-V307 HydrophobicContact CB-CB 4.48Å; A299-V307 HydrophobicContact CB-CG1 4.26Å; A299-V307 HydrophobicContact CB-CG2 4.1Å
300	L	90.6	Very high	89.2	Confident	31 Å²	31	62.1 Å²	62.1	16%	0.162	30%	0.296	C	S	.	.	H	α-helix	trans	-68.6	-44.4	174.7	-82.2	167.9	0	0	0	112.7	V296 I297 T298 K303 V307 Y309 L322 I357	V296-L300 HydrophobicContact CG1-CD1 3.93Å; V296-L300 WeakPolarHBondContact O-CB 3.45Å; V296-L300 WeakPolarHBondContact O-CG 3.36Å; V296-L300 PolarHBondContact O-N 3.32Å; I297-L300 PolarHBondContact O-N 3.48Å; T298-L300 PolarHBondContact O-N 2.96Å; L300-K303 PolarHBondContact O-N 3.39Å; L300-K303 VanDerWaalsContact O-N 3.16Å; L300-V307 HydrophobicContact CD2-CG2 4.47Å; L300-V307 HydrophobicContact CG-CG1 4.25Å; L300-Y309 WeakPolarHBondContact CD2-OH 3.32Å; L300-L322 HydrophobicContact CD1-CB 3.84Å; L300-I357 HydrophobicContact CB-CG1 4.12Å; L300-I357 HydrophobicContact CB-CG2 4.34Å; L300-I357 HydrophobicContact CD1-CD1 4.33Å; L300-I357 HydrophobicContact CD1-CG1 4.48Å; L300-I357 HydrophobicContact CD1-CG2 4.01Å
301	V	89.2	Confident	89.4	Confident	45 Å²	45	65.2 Å²	65.2	27%	0.273	31%	0.311	S	S	.	.	H	α-helix	trans	-66.1	-42.2	178.5	173.1	0	0	0	0	111	I297 T298 K303 R353 N356 I357	I297-V301 HydrophobicContact CG2-CG2 4.49Å; I297-V301 VanDerWaalsContact O-CG2 3.31Å; I297-V301 WeakPolarHBondContact O-CG2 3.48Å; I297-V301 PolarHBondContact O-N 2.72Å; T298-V301 PolarHBondContact O-N 3.25Å; V301-K303 PolarHBondContact O-N 3.37Å; V301-R353 VanDerWaalsContact CG2-O 3.23Å; V301-R353 WeakPolarHBondContact CG2-O 3.25Å; V301-N356 HydrophobicContact CG1-CB 3.96Å; V301-N356 HydrophobicContact CG2-CB 4.03Å; V301-I357 HydrophobicContact CG2-CG1 3.96Å
302	E	89.4	Confident	89.7	Confident	107 Å²	107	60.4 Å²	60.4	50%	0.5	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-6.1	174	-67.7	176.7	-156.2	0	0	113.7	T298 R304	T298-E302 VanDerWaalsContact CG2-OE1 3.24Å; T298-E302 WeakPolarHBondContact CG2-OE1 3.37Å; T298-E302 WeakPolarHBondContact O-CB 3.42Å; T298-E302 WeakPolarHBondContact O-CG 3.28Å; T298-E302 PolarHBondContact O-N 3Å; E302-R304 VanDerWaalsContact C-N 3.29Å; E302-R304 HydrophobicContact CB-CG 4.1Å; E302-R304 PolarHBondContact O-N 2.94Å; E302-R304 IonicContact OE1-NH2 3.77Å; E302-R304 PolarHBondContact OE1-NH2 3.43Å; E302-R304 IonicContact OE2-CZ 3.69Å; E302-R304 IonicContact OE2-NE 2.65Å; E302-R304 PolarHBondContact OE2-NE 3.18Å; E302-R304 IonicContact OE2-NH2 3.53Å; E302-R304 PolarHBondContact OE2-NH2 3.36Å
303	K	87.1	Confident	89.7	Confident	148 Å²	148	63.2 Å²	63.2	64%	0.643	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	37.9	-179.5	-53.1	174.4	-171.3	176.2	0	113.5	A299 L300 V301 M358	A299-K303 WeakPolarHBondContact O-CA 3.5Å; A299-K303 PolarHBondContact O-N 3.26Å; L300-K303 PolarHBondContact O-N 3.39Å; L300-K303 VanDerWaalsContact O-N 3.16Å; V301-K303 PolarHBondContact O-N 3.37Å; K303-M358 HydrophobicContact CD-CE 4.41Å
304	R	89.3	Confident	89.7	Confident	133 Å²	133	63 Å²	63	50%	0.502	30%	0.297	S	S	.	.			trans	-61.3	142.7	176.7	-61.6	-172.4	-174.8	-167	3.1	110.5	A299 E302 H306	A299-R304 HydrophobicContact CB-CB 4.2Å; A299-R304 HydrophobicContact CB-CG 4.31Å; A299-R304 PolarHBondContact O-N 3.36Å; E302-R304 VanDerWaalsContact C-N 3.29Å; E302-R304 HydrophobicContact CB-CG 4.1Å; E302-R304 PolarHBondContact O-N 2.94Å; E302-R304 IonicContact OE1-NH2 3.77Å; E302-R304 PolarHBondContact OE1-NH2 3.43Å; E302-R304 IonicContact OE2-CZ 3.69Å; E302-R304 IonicContact OE2-NE 2.65Å; E302-R304 PolarHBondContact OE2-NE 3.18Å; E302-R304 IonicContact OE2-NH2 3.53Å; E302-R304 PolarHBondContact OE2-NH2 3.36Å; R304-H306 VanDerWaalsContact C-N 3.34Å; R304-H306 PolarHBondContact O-N 3.31Å
305	P	86.5	Confident	89.8	Confident	144 Å²	144	62.5 Å²	62.5	94%	0.935	29%	0.291	S	S	*	.	S	Bend	trans	-68.3	-31.3	-176.8	26.5	-34.7	0	0	0	113.2
306	H	89.8	Confident	89.8	Confident	143 Å²	143	58.8 Å²	58.8	66%	0.662	28%	0.277	S	S	*	.			trans	-105.7	125.1	170.6	-178.9	-104.2	0	0	0	110.1	R304	R304-H306 VanDerWaalsContact C-N 3.34Å; R304-H306 PolarHBondContact O-N 3.31Å
307	V	90.8	Very high	89.7	Confident	24 Å²	24	60.3 Å²	60.3	15%	0.145	29%	0.285	C	S	.	.			trans	-118.4	122.6	175.8	-179.6	0	0	0	0	107.9	V296 A299 L300 Y309	V296-V307 HydrophobicContact CB-CG1 4.17Å; V296-V307 HydrophobicContact CG1-CG1 3.86Å; V296-V307 HydrophobicContact CG2-CG1 4.06Å; A299-V307 HydrophobicContact CB-CB 4.48Å; A299-V307 HydrophobicContact CB-CG1 4.26Å; A299-V307 HydrophobicContact CB-CG2 4.1Å; L300-V307 HydrophobicContact CD2-CG2 4.47Å; L300-V307 HydrophobicContact CG-CG1 4.25Å; V307-Y309 VanDerWaalsContact C-N 3.25Å; V307-Y309 HydrophobicContact CB-CD2 4.13Å; V307-Y309 HydrophobicContact CB-CE2 3.58Å; V307-Y309 HydrophobicContact CG1-CD2 4.02Å; V307-Y309 HydrophobicContact CG1-CE1 4.01Å; V307-Y309 HydrophobicContact CG1-CE2 3.47Å; V307-Y309 VanDerWaalsContact CG1-CE2 3.47Å; V307-Y309 HydrophobicContact CG1-CG 4.49Å; V307-Y309 VanDerWaalsContact CG1-CZ 3.45Å; V307-Y309 WeakPolarHBondContact O-CD2 3.27Å; V307-Y309 PolarHBondContact O-N 3.49Å
308	P	92.1	Very high	89.6	Confident	15 Å²	15	60.4 Å²	60.4	10%	0.097	29%	0.285	C	S	.	.			trans	-82.6	51.4	-162.4	33.7	-38.1	0	0	0	114.3	R295 V296 R310 E311	R295-P308 HydrophobicContact CB-CG 4.22Å; V296-P308 HydrophobicContact CG2-CG 4.11Å; P308-R310 PolarHBondContact O-N 2.87Å; P308-R310 VanDerWaalsContact O-N 3.08Å; P308-E311 HydrophobicContact CB-CG 4.05Å; P308-E311 VanDerWaalsContact CB-OE1 3.26Å; P308-E311 WeakPolarHBondContact CB-OE1 3.13Å; P308-E311 PolarHBondContact O-N 3.44Å; P308-E311 VanDerWaalsContact O-N 3.14Å
309	Y	89.8	Confident	89.5	Confident	29 Å²	29	60.4 Å²	60.4	11%	0.114	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-55.5	-30.9	179.6	-60.4	-76.1	0	0	0	113.4	V296 L300 V307 E311 S312 T315 R316 Q319 L322	V296-Y309 HydrophobicContact CG1-CD1 3.87Å; V296-Y309 HydrophobicContact CG1-CE1 3.44Å; V296-Y309 VanDerWaalsContact CG1-CE1 3.44Å; V296-Y309 HydrophobicContact CG2-CD1 4.18Å; L300-Y309 WeakPolarHBondContact CD2-OH 3.32Å; V307-Y309 VanDerWaalsContact C-N 3.25Å; V307-Y309 HydrophobicContact CB-CD2 4.13Å; V307-Y309 HydrophobicContact CB-CE2 3.58Å; V307-Y309 HydrophobicContact CG1-CD2 4.02Å; V307-Y309 HydrophobicContact CG1-CE1 4.01Å; V307-Y309 HydrophobicContact CG1-CE2 3.47Å; V307-Y309 VanDerWaalsContact CG1-CE2 3.47Å; V307-Y309 HydrophobicContact CG1-CG 4.49Å; V307-Y309 VanDerWaalsContact CG1-CZ 3.45Å; V307-Y309 WeakPolarHBondContact O-CD2 3.27Å; V307-Y309 PolarHBondContact O-N 3.49Å; Y309-E311 VanDerWaalsContact C-N 3.32Å; Y309-E311 PolarHBondContact O-N 3Å; Y309-S312 VanDerWaalsContact O-O 3.06Å; Y309-T315 WeakPolarHBondContact CD1-O 3.5Å; Y309-T315 CarbonylContact O-C 3.59Å; Y309-T315 WeakPolarHBondContact O-CB 3.41Å; Y309-T315 PolarHBondContact O-OG1 3.26Å; Y309-R316 WeakPolarHBondContact O-CG 3.27Å; Y309-R316 PolarHBondContact O-N 3.22Å; Y309-Q319 HydrophobicContact CD1-CB 3.99Å; Y309-Q319 HydrophobicContact CD1-CG 3.91Å; Y309-Q319 HydrophobicContact CD2-CG 3.89Å; Y309-Q319 HydrophobicContact CE1-CB 4.46Å; Y309-Q319 HydrophobicContact CE1-CG 4.19Å; Y309-Q319 HydrophobicContact CE2-CG 4.16Å; Y309-Q319 HydrophobicContact CG-CB 4.18Å; Y309-Q319 HydrophobicContact CG-CG 3.77Å; Y309-L322 PolarHBondContact OH-O 2.98Å
310	R	89.1	Confident	89.2	Confident	187 Å²	187	61.3 Å²	61.3	71%	0.706	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-75.5	-8.5	-177.8	-74.2	-178.8	165.9	179.7	-5.4	115.1	D184 P308 S312 R316	D184-R310 IonicContact OD2-CZ 3.64Å; D184-R310 IonicContact OD2-NE 3.45Å; D184-R310 IonicContact OD2-NH2 2.92Å; D184-R310 PolarHBondContact OD2-NH2 3.49Å; P308-R310 PolarHBondContact O-N 2.87Å; P308-R310 VanDerWaalsContact O-N 3.08Å; R310-S312 VanDerWaalsContact C-N 3.26Å; R310-S312 PolarHBondContact O-N 3.31Å; R310-R316 HydrophobicContact CG-CG 4.32Å
311	E	88.2	Confident	89	Confident	78 Å²	78	60 Å²	60	36%	0.364	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-71.1	-14.3	177.3	-83.8	177.3	-149.6	0	0	114	Q288 T292 R295 P308 Y309	Q288-E311 PolarHBondContact NE2-O 3.06Å; T292-E311 HydrophobicContact CG2-CB 3.37Å; R295-E311 IonicContact CZ-OE2 2.7Å; R295-E311 IonicContact NH1-OE1 3.5Å; R295-E311 IonicContact NH1-OE2 3.47Å; R295-E311 PolarHBondContact NH1-OE2 3.47Å; P308-E311 HydrophobicContact CB-CG 4.05Å; P308-E311 VanDerWaalsContact CB-OE1 3.26Å; P308-E311 WeakPolarHBondContact CB-OE1 3.13Å; P308-E311 PolarHBondContact O-N 3.44Å; P308-E311 VanDerWaalsContact O-N 3.14Å; Y309-E311 VanDerWaalsContact C-N 3.32Å; Y309-E311 PolarHBondContact O-N 3Å
312	S	90.5	Very high	88.9	Confident	2 Å²	2	58 Å²	58	1%	0.014	27%	0.269	C	S	.	.			trans	-149.5	145.5	175.5	167.1	0	0	0	0	111.2	E164 S289 Y309 R310 L314 T315 R316	E164-S312 VanDerWaalsContact OE1-CB 3.27Å; E164-S312 WeakPolarHBondContact OE1-CB 3.32Å; E164-S312 PolarHBondContact OE1-OG 3.21Å; S289-S312 WeakPolarHBondContact CB-OG 3.27Å; Y309-S312 VanDerWaalsContact O-O 3.06Å; R310-S312 VanDerWaalsContact C-N 3.26Å; R310-S312 PolarHBondContact O-N 3.31Å; S312-L314 VanDerWaalsContact C-N 3.27Å; S312-L314 PolarHBondContact O-N 3.25Å; S312-L314 WeakPolarHBondContact OG-CB 3.48Å; S312-L314 PolarHBondContact OG-N 3.41Å; S312-T315 WeakPolarHBondContact CB-OG1 3.48Å; S312-T315 PolarHBondContact O-N 2.95Å; S312-T315 PolarHBondContact O-OG1 2.97Å; S312-R316 PolarHBondContact O-N 3.49Å; S312-R316 VanDerWaalsContact O-N 3.11Å
313	K	89.3	Confident	88.5	Confident	61 Å²	61	53.7 Å²	53.7	27%	0.265	25%	0.253	S	S	.	.	H	α-helix	trans	-63	-34.3	173.5	-68.4	-177.7	-173.5	170	0	112	E164 L166 L182 R316 I317	E164-K313 VanDerWaalsContact O-CD 3.3Å; E164-K313 WeakPolarHBondContact O-CD 3.49Å; E164-K313 WeakPolarHBondContact O-CE 3.26Å; E164-K313 PolarHBondContact O-NZ 3.33Å; E164-K313 WeakPolarHBondContact OE2-CB 3.47Å; E164-K313 WeakPolarHBondContact OE2-CG 3.33Å; E164-K313 PolarHBondContact OE2-N 2.81Å; L166-K313 HydrophobicContact CD1-CD 4.19Å; L166-K313 HydrophobicContact CD2-CB 4.45Å; L166-K313 HydrophobicContact CD2-CD 4.27Å; L166-K313 HydrophobicContact CG-CD 3.94Å; L182-K313 HydrophobicContact CD2-CB 4.2Å; L182-K313 HydrophobicContact CD2-CG 4.22Å; K313-R316 PolarHBondContact O-N 3.34Å; K313-I317 WeakPolarHBondContact O-CD1 3.19Å; K313-I317 WeakPolarHBondContact O-CG1 3.32Å; K313-I317 PolarHBondContact O-N 2.89Å
314	L	89.5	Confident	88.4	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-57.3	-52.7	173.4	179.2	69.8	0	0	0	109.9	I161 H234 L264 L290 L293 S312 R316 I317 L318	I161-L314 HydrophobicContact CD1-CB 4.36Å; I161-L314 HydrophobicContact CD1-CD1 3.91Å; H234-L314 HydrophobicContact CB-CD1 4.26Å; L264-L314 HydrophobicContact CD2-CD1 3.99Å; L264-L314 HydrophobicContact CD2-CD2 4.04Å; L290-L314 HydrophobicContact CD2-CD2 4.49Å; L293-L314 HydrophobicContact CD2-CD2 4.31Å; S312-L314 VanDerWaalsContact C-N 3.27Å; S312-L314 PolarHBondContact O-N 3.25Å; S312-L314 WeakPolarHBondContact OG-CB 3.48Å; S312-L314 PolarHBondContact OG-N 3.41Å; L314-R316 VanDerWaalsContact C-N 3.3Å; L314-R316 PolarHBondContact O-N 2.97Å; L314-I317 PolarHBondContact O-N 2.84Å; L314-L318 HydrophobicContact CD1-CD1 3.68Å; L314-L318 HydrophobicContact CD1-CG 4.18Å; L314-L318 HydrophobicContact CG-CD1 3.87Å; L314-L318 HydrophobicContact CG-CG 4.48Å; L314-L318 WeakPolarHBondContact O-CB 3.38Å; L314-L318 VanDerWaalsContact O-CG 3.26Å; L314-L318 WeakPolarHBondContact O-CG 3.42Å; L314-L318 PolarHBondContact O-N 2.98Å
315	T	90.9	Very high	88.2	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.006	22%	0.218	C	C	.	.	H	α-helix	trans	-69.2	-23.7	-179.2	45.1	0	0	0	0	114.1	T292 L293 V296 Y309 S312 Q319	T292-T315 HydrophobicContact CG2-CG2 4.08Å; L293-T315 HydrophobicContact CB-CG2 4.04Å; L293-T315 HydrophobicContact CD1-CG2 3.77Å; V296-T315 HydrophobicContact CB-CG2 4.43Å; V296-T315 HydrophobicContact CG2-CG2 3.98Å; Y309-T315 WeakPolarHBondContact CD1-O 3.5Å; Y309-T315 CarbonylContact O-C 3.59Å; Y309-T315 WeakPolarHBondContact O-CB 3.41Å; Y309-T315 PolarHBondContact O-OG1 3.26Å; S312-T315 WeakPolarHBondContact CB-OG1 3.48Å; S312-T315 PolarHBondContact O-N 2.95Å; S312-T315 PolarHBondContact O-OG1 2.97Å; T315-Q319 PolarHBondContact O-N 2.92Å; T315-Q319 VanDerWaalsContact O-N 3.17Å
316	R	89.7	Confident	88.3	Confident	47 Å²	47	38.6 Å²	38.6	18%	0.177	17%	0.174	C	C	.	.	H	α-helix	trans	-68.6	-46.7	167.6	-72.6	179.3	67.8	-160	-5.8	112.1	L182 D184 V192 Y309 R310 S312 K313 L314 L318 Q319	L182-R316 HydrophobicContact CD2-CB 3.79Å; L182-R316 PolarHBondContact O-NH2 3.5Å; L182-R316 VanDerWaalsContact O-NH2 3.14Å; D184-R316 IonicContact OD1-CZ 3.96Å; D184-R316 IonicContact OD1-NE 2.62Å; D184-R316 IonicContact OD1-NH2 3.77Å; D184-R316 PolarHBondContact OD1-NH2 2.96Å; V192-R316 HydrophobicContact CG1-CB 4.33Å; V192-R316 WeakPolarHBondContact CG2-O 3.45Å; Y309-R316 WeakPolarHBondContact O-CG 3.27Å; Y309-R316 PolarHBondContact O-N 3.22Å; R310-R316 HydrophobicContact CG-CG 4.32Å; S312-R316 PolarHBondContact O-N 3.49Å; S312-R316 VanDerWaalsContact O-N 3.11Å; K313-R316 PolarHBondContact O-N 3.34Å; L314-R316 VanDerWaalsContact C-N 3.3Å; L314-R316 PolarHBondContact O-N 2.97Å; R316-L318 VanDerWaalsContact C-N 3.29Å; R316-L318 PolarHBondContact O-N 3.07Å; R316-Q319 WeakPolarHBondContact O-CB 3.39Å; R316-Q319 PolarHBondContact O-N 3.39Å
317	I	89.4	Confident	88.3	Confident	32 Å²	32	32.6 Å²	32.6	16%	0.164	15%	0.146	C	C	.	.	H	α-helix	trans	-64.3	-37	178.2	-68.4	160.4	0	0	0	110.9	L159 I161 L166 L182 V192 K313 L314 Q319	L159-I317 HydrophobicContact CD2-CD1 3.81Å; I161-I317 HydrophobicContact CD1-CD1 3.67Å; L166-I317 HydrophobicContact CD2-CD1 3.97Å; L182-I317 HydrophobicContact CD1-CD1 4.34Å; L182-I317 HydrophobicContact CD1-CG1 3.89Å; L182-I317 HydrophobicContact CD2-CG1 4.21Å; V192-I317 HydrophobicContact CG2-CG1 4.16Å; K313-I317 WeakPolarHBondContact O-CD1 3.19Å; K313-I317 WeakPolarHBondContact O-CG1 3.32Å; K313-I317 PolarHBondContact O-N 2.89Å; L314-I317 PolarHBondContact O-N 2.84Å; I317-Q319 VanDerWaalsContact C-N 3.33Å; I317-Q319 PolarHBondContact O-N 3.48Å
318	L	88.6	Confident	88.4	Confident	3 Å²	3	31.9 Å²	31.9	2%	0.016	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	9.4	178.9	-54.4	-178	0	0	0	114	F100 V262 L293 L314 R316 D320 S321 L322	F100-L318 HydrophobicContact CD1-CD1 4.26Å; F100-L318 HydrophobicContact CE1-CD1 3.3Å; F100-L318 HydrophobicContact CE1-CD2 3.51Å; F100-L318 HydrophobicContact CE1-CG 3.94Å; F100-L318 HydrophobicContact CZ-CB 4.31Å; F100-L318 HydrophobicContact CZ-CD1 3.69Å; F100-L318 HydrophobicContact CZ-CD2 3.7Å; F100-L318 HydrophobicContact CZ-CG 4.07Å; V262-L318 HydrophobicContact CG2-CD2 4.45Å; L293-L318 HydrophobicContact CD1-CD1 4.38Å; L314-L318 HydrophobicContact CD1-CD1 3.68Å; L314-L318 HydrophobicContact CD1-CG 4.18Å; L314-L318 HydrophobicContact CG-CD1 3.87Å; L314-L318 HydrophobicContact CG-CG 4.48Å; L314-L318 WeakPolarHBondContact O-CB 3.38Å; L314-L318 VanDerWaalsContact O-CG 3.26Å; L314-L318 WeakPolarHBondContact O-CG 3.42Å; L314-L318 PolarHBondContact O-N 2.98Å; R316-L318 VanDerWaalsContact C-N 3.29Å; R316-L318 PolarHBondContact O-N 3.07Å; L318-D320 VanDerWaalsContact C-N 3.34Å; L318-D320 PolarHBondContact O-N 2.72Å; L318-S321 WeakPolarHBondContact O-CA 3.48Å; L318-S321 WeakPolarHBondContact O-CB 3.36Å; L318-S321 PolarHBondContact O-N 3.35Å; L318-L322 HydrophobicContact CB-CD1 4.42Å; L318-L322 PolarHBondContact O-N 3.48Å; L318-L322 VanDerWaalsContact O-N 3.16Å
319	Q	89	Confident	88.5	Confident	34 Å²	34	31.4 Å²	31.4	16%	0.159	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-33.6	-176.6	-178.1	171.7	-23.5	0	0	113.3	Y309 T315 R316 I317 S321	Y309-Q319 HydrophobicContact CD1-CB 3.99Å; Y309-Q319 HydrophobicContact CD1-CG 3.91Å; Y309-Q319 HydrophobicContact CD2-CG 3.89Å; Y309-Q319 HydrophobicContact CE1-CB 4.46Å; Y309-Q319 HydrophobicContact CE1-CG 4.19Å; Y309-Q319 HydrophobicContact CE2-CG 4.16Å; Y309-Q319 HydrophobicContact CG-CB 4.18Å; Y309-Q319 HydrophobicContact CG-CG 3.77Å; T315-Q319 PolarHBondContact O-N 2.92Å; T315-Q319 VanDerWaalsContact O-N 3.17Å; R316-Q319 WeakPolarHBondContact O-CB 3.39Å; R316-Q319 PolarHBondContact O-N 3.39Å; I317-Q319 VanDerWaalsContact C-N 3.33Å; I317-Q319 PolarHBondContact O-N 3.48Å; Q319-S321 VanDerWaalsContact C-N 3.26Å
320	D	85.2	Confident	88.7	Confident	24 Å²	24	30.2 Å²	30.2	13%	0.128	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-13.7	171.5	-163.6	42.6	0	0	0	112.8	N96 L318 G324 R325 T326	N96-D320 PolarHBondContact ND2-OD2 2.98Å; L318-D320 VanDerWaalsContact C-N 3.34Å; L318-D320 PolarHBondContact O-N 2.72Å; D320-G324 CarbonylContact O-C 3.59Å; D320-G324 VanDerWaalsContact O-CA 3.3Å; D320-G324 WeakPolarHBondContact O-CA 3.36Å; D320-R325 PolarHBondContact O-N 3.35Å; D320-R325 VanDerWaalsContact O-N 3.16Å; D320-R325 WeakPolarHBondContact OD1-CB 3.45Å; D320-R325 PolarHBondContact OD1-N 3.13Å; D320-T326 WeakPolarHBondContact O-CB 3.27Å; D320-T326 PolarHBondContact O-N 2.87Å; D320-T326 VanDerWaalsContact O-N 3.15Å
321	S	86.1	Confident	89	Confident	3 Å²	3	21.3 Å²	21.3	2%	0.021	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-21.3	-178.7	-55	0	0	0	0	114.4	T98 L318 Q319 T326 T328 N359	T98-S321 PolarHBondContact OG1-OG 2.6Å; L318-S321 WeakPolarHBondContact O-CA 3.48Å; L318-S321 WeakPolarHBondContact O-CB 3.36Å; L318-S321 PolarHBondContact O-N 3.35Å; Q319-S321 VanDerWaalsContact C-N 3.26Å; S321-T326 VanDerWaalsContact CA-CG2 3.48Å; S321-T328 PolarHBondContact O-OG1 3.29Å; S321-N359 PolarHBondContact O-ND2 3.44Å
322	L	86.2	Confident	89.4	Confident	4 Å²	4	17.6 Å²	17.6	2%	0.021	8%	0.083	C	C	.	.	S	Bend	trans	-128	106.4	-175.2	-59.8	172.4	0	0	0	108.3	I18 F100 L293 V296 L300 Y309 L318 G324 I357	I18-L322 HydrophobicContact CD1-CD2 3.7Å; F100-L322 HydrophobicContact CE2-CD2 4.34Å; L293-L322 HydrophobicContact CD1-CD1 3.48Å; L293-L322 VanDerWaalsContact CD1-CD1 3.48Å; V296-L322 HydrophobicContact CG1-CD1 4.47Å; L300-L322 HydrophobicContact CD1-CB 3.84Å; Y309-L322 PolarHBondContact OH-O 2.98Å; L318-L322 HydrophobicContact CB-CD1 4.42Å; L318-L322 PolarHBondContact O-N 3.48Å; L318-L322 VanDerWaalsContact O-N 3.16Å; L322-G324 PolarHBondContact O-N 3.3Å; L322-I357 HydrophobicContact CD2-CD1 4.4Å
323	G	80.8	Confident	89.6	Confident	16 Å²	16	17.6 Å²	17.6	17%	0.165	8%	0.083	C	C	.	.	S	Bend	trans	72.3	12.7	-171.6	0	0	0	0	0	114.8	R190 N359	R190-G323 PolarHBondContact NH1-O 3.48Å; G323-N359 WeakPolarHBondContact CA-OD1 3.5Å; G323-N359 PolarHBondContact N-OD1 3.41Å
324	G	85.7	Confident	89.9	Confident	2 Å²	2	14.7 Å²	14.7	2%	0.021	7%	0.07	C	C	.	.	S	Bend	trans	-107.2	-150.1	179.7	0	0	0	0	0	114.2	D320 L322 K360	D320-G324 CarbonylContact O-C 3.59Å; D320-G324 VanDerWaalsContact O-CA 3.3Å; D320-G324 WeakPolarHBondContact O-CA 3.36Å; L322-G324 PolarHBondContact O-N 3.3Å; G324-K360 PolarHBondContact O-N 3.5Å
325	R	85.1	Confident	90	Very high	104 Å²	104	14.7 Å²	14.7	39%	0.392	7%	0.07	S	C	.	.	S	Bend	trans	-100.6	-0.1	-172.4	-68.1	170.2	158.1	-180	-21.5	115	D320 K360 P361 E362	D320-R325 PolarHBondContact O-N 3.35Å; D320-R325 VanDerWaalsContact O-N 3.16Å; D320-R325 WeakPolarHBondContact OD1-CB 3.45Å; D320-R325 PolarHBondContact OD1-N 3.13Å; R325-K360 WeakPolarHBondContact CA-O 3.32Å; R325-P361 WeakPolarHBondContact O-CA 3.4Å; R325-E362 HydrophobicContact CB-CB 4.48Å; R325-E362 HydrophobicContact CG-CB 4.41Å; R325-E362 HydrophobicContact CG-CG 4.31Å; R325-E362 IonicContact CZ-OE1 2.74Å; R325-E362 IonicContact CZ-OE2 2.84Å; R325-E362 IonicContact NE-OE1 3.86Å; R325-E362 PolarHBondContact NE-OE1 3.21Å; R325-E362 IonicContact NE-OE2 3.56Å; R325-E362 PolarHBondContact NE-OE2 2.94Å; R325-E362 VanDerWaalsContact NH2-CD 3.31Å; R325-E362 IonicContact NH2-OE1 3.77Å; R325-E362 PolarHBondContact NH2-OE1 3.34Å; R325-E362 VanDerWaalsContact NH2-OE1 3.08Å; R325-E362 IonicContact NH2-OE2 2.73Å; R325-E362 PolarHBondContact NH2-OE2 3.35Å; R325-E362 PolarHBondContact O-N 3.44Å
326	T	88.1	Confident	90.1	Very high	1 Å²	1	14.9 Å²	14.9	1%	0.006	7%	0.072	C	C	.	.	S	Bend	trans	-83.2	154	174.8	-128.4	0	0	0	0	112.1	N96 C97 D320 S321 T328 N359	N96-T326 VanDerWaalsContact CB-OG1 3.23Å; N96-T326 WeakPolarHBondContact CB-OG1 3.4Å; N96-T326 CarbonylContact O-C 3.43Å; N96-T326 VanDerWaalsContact O-CA 3.29Å; N96-T326 WeakPolarHBondContact O-CA 3.26Å; N96-T326 PolarHBondContact O-OG1 3.34Å; C97-T326 WeakPolarHBondContact CA-OG1 3.3Å; C97-T326 PolarHBondContact N-OG1 3.35Å; C97-T326 VanDerWaalsContact N-OG1 3.12Å; D320-T326 WeakPolarHBondContact O-CB 3.27Å; D320-T326 PolarHBondContact O-N 2.87Å; D320-T326 VanDerWaalsContact O-N 3.15Å; S321-T326 VanDerWaalsContact CA-CG2 3.48Å; T326-T328 WeakPolarHBondContact CG2-OG1 3.23Å; T326-N359 WeakPolarHBondContact O-CB 3.29Å; T326-N359 PolarHBondContact O-ND2 3.1Å
327	K	90.4	Very high	90.2	Very high	18 Å²	18	12.7 Å²	12.7	8%	0.078	6%	0.063	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	120.9	161.3	-62.6	-178.8	-175.5	167.8	0	110	E90 Y95 N96 C97 T98 P361	E90-K327 HydrophobicContact CB-CD 4.21Å; E90-K327 VanDerWaalsContact CD-CD 3.4Å; E90-K327 HydrophobicContact CG-CD 4.33Å; E90-K327 WeakPolarHBondContact OE1-CD 3.35Å; E90-K327 IonicContact OE1-NZ 2.95Å; E90-K327 PolarHBondContact OE1-NZ 3.23Å; E90-K327 WeakPolarHBondContact OE2-CD 3.4Å; E90-K327 IonicContact OE2-NZ 2.72Å; Y95-K327 HydrophobicContact CD1-CD 4.37Å; Y95-K327 VanDerWaalsContact CE1-CE 3.48Å; Y95-K327 HydrophobicContact CG-CD 4.34Å; N96-K327 PolarHBondContact O-N 2.72Å; C97-K327 CarbonylContact C-O 3.59Å; C97-K327 VanDerWaalsContact CA-O 3.22Å; C97-K327 WeakPolarHBondContact CA-O 3.44Å; T98-K327 PolarHBondContact N-O 2.8Å; K327-P361 HydrophobicContact CD-CB 4.14Å; K327-P361 HydrophobicContact CG-CB 3.4Å; K327-P361 HydrophobicContact CG-CG 4.03Å
328	T	92.5	Very high	90.1	Very high	9 Å²	9	12.3 Å²	12.3	6%	0.055	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	137.1	-171.6	-60.9	0	0	0	0	112.6	I18 Q19 T98 F100 S321 T326 I330 N359	I18-T328 HydrophobicContact CD1-CG2 3.99Å; I18-T328 HydrophobicContact CG1-CG2 4.44Å; I18-T328 HydrophobicContact CG2-CG2 3.83Å; Q19-T328 PolarHBondContact N-O 3.02Å; Q19-T328 VanDerWaalsContact N-O 3.08Å; T98-T328 WeakPolarHBondContact O-CA 3.34Å; F100-T328 HydrophobicContact CD2-CG2 3.64Å; F100-T328 HydrophobicContact CE2-CG2 3.51Å; S321-T328 PolarHBondContact O-OG1 3.29Å; T326-T328 WeakPolarHBondContact CG2-OG1 3.23Å; T328-I330 HydrophobicContact CG2-CG1 4.26Å; T328-N359 PolarHBondContact OG1-ND2 2.96Å
329	S	93.9	Very high	90	Very high	5 Å²	5	14.2 Å²	14.2	4%	0.035	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	138.7	165.8	-63.1	0	0	0	0	111.4	Q19 I87 T98 V99 F100	Q19-S329 WeakPolarHBondContact O-CA 3.43Å; Q19-S329 PolarHBondContact OE1-OG 3.29Å; I87-S329 VanDerWaalsContact CD1-OG 3.27Å; I87-S329 WeakPolarHBondContact CD1-OG 3.35Å; T98-S329 PolarHBondContact O-N 3.44Å; V99-S329 WeakPolarHBondContact CA-O 3.47Å; F100-S329 PolarHBondContact N-O 3.07Å
330	I	94.5	Very high	89.9	Confident	4 Å²	4	13.3 Å²	13.3	2%	0.021	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	122.8	177.3	-61.6	168.6	0	0	0	108.9	I18 Q19 V21 F100 T328 A354	I18-I330 HydrophobicContact CG2-CD1 3.84Å; I18-I330 HydrophobicContact CG2-CG1 4.07Å; Q19-I330 PolarHBondContact O-N 3.49Å; V21-I330 PolarHBondContact N-O 3.14Å; F100-I330 HydrophobicContact CB-CG1 4.32Å; F100-I330 HydrophobicContact CD2-CG1 4Å; T328-I330 HydrophobicContact CG2-CG1 4.26Å; I330-A354 HydrophobicContact CD1-CB 3.62Å
331	I	96.2	Very high	90.1	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	101.5	173.2	-52	175.9	0	0	0	108	V21 R23 V79 V83 V99 F100 A101 Y102 T112 I133 T333	V21-I331 HydrophobicContact CB-CG1 4.49Å; V21-I331 WeakPolarHBondContact O-CA 3.47Å; R23-I331 HydrophobicContact CB-CG2 4.11Å; V79-I331 HydrophobicContact CG1-CD1 4.23Å; V83-I331 HydrophobicContact CG1-CD1 4.31Å; V83-I331 HydrophobicContact CG1-CG1 4.4Å; V99-I331 HydrophobicContact CG1-CD1 3.87Å; V99-I331 HydrophobicContact CG1-CG1 4.21Å; F100-I331 PolarHBondContact O-N 3.02Å; A101-I331 WeakPolarHBondContact CA-O 3.37Å; Y102-I331 PolarHBondContact N-O 2.87Å; T112-I331 HydrophobicContact CG2-CD1 4.09Å; T112-I331 HydrophobicContact CG2-CG2 4.35Å; I133-I331 HydrophobicContact CD1-CD1 3.57Å; I331-T333 HydrophobicContact CG2-CG2 4.35Å; I331-T333 PolarHBondContact O-N 2.92Å
332	A	96	Very high	90.2	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	109.6	175.2	0	0	0	0	0	110	V21 V22 R23 Y102 T347 A351	V21-A332 PolarHBondContact O-N 2.79Å; V22-A332 WeakPolarHBondContact CA-O 3.19Å; V22-A332 HydrophobicContact CG2-CB 4.26Å; R23-A332 PolarHBondContact N-O 3.05Å; Y102-A332 CarbonylContact O-C 3.42Å; Y102-A332 WeakPolarHBondContact O-CA 3.49Å; A332-T347 HydrophobicContact CB-CG2 4.09Å; A332-A351 HydrophobicContact CB-CB 3.86Å
333	T	95.2	Very high	90.3	Very high	1 Å²	1	20 Å²	20	1%	0.006	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	125.9	-179.7	56.9	0	0	0	0	111	R23 Y102 T107 K109 I331	R23-T333 HydrophobicContact CB-CG2 4.44Å; R23-T333 WeakPolarHBondContact O-CA 3.49Å; Y102-T333 PolarHBondContact O-N 3.16Å; Y102-T333 PolarHBondContact O-OG1 3.38Å; T107-T333 WeakPolarHBondContact CB-O 3.27Å; T107-T333 PolarHBondContact OG1-O 3.46Å; T107-T333 PolarHBondContact OG1-OG1 2.9Å; K109-T333 WeakPolarHBondContact CG-OG1 3.4Å; I331-T333 HydrophobicContact CG2-CG2 4.35Å; I331-T333 PolarHBondContact O-N 2.92Å
334	V	95	Very high	90.8	Very high	1 Å²	1	19.3 Å²	19.3	1%	0.006	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	154.6	-175	-64.2	0	0	0	0	112.5	V22 R23 C24 R25 I39 T344 T347 L348	V22-V334 HydrophobicContact CG1-CG2 3.8Å; R23-V334 PolarHBondContact O-N 2.95Å; C24-V334 HydrophobicContact CB-CG2 3.93Å; R25-V334 PolarHBondContact N-O 3.3Å; R25-V334 VanDerWaalsContact N-O 3.12Å; I39-V334 HydrophobicContact CD1-CB 3.94Å; I39-V334 HydrophobicContact CD1-CG2 3.66Å; V334-T344 HydrophobicContact CB-CG2 4.25Å; V334-T344 HydrophobicContact CG1-CG2 4.3Å; V334-T347 HydrophobicContact CG1-CG2 3.77Å; V334-L348 HydrophobicContact CG1-CD2 4.26Å; V334-L348 HydrophobicContact CG1-CG 4.35Å
335	S	92.6	Very high	91.1	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.102	C	C	.	.			trans	-103.4	131.7	177.3	168.3	0	0	0	0	110.5	R25 E31 I39 S337 N340 T344	R25-S335 PolarHBondContact NH2-OG 3.23Å; E31-S335 PolarHBondContact OE1-OG 3.22Å; I39-S335 WeakPolarHBondContact CD1-O 3.34Å; S335-S337 PolarHBondContact O-N 2.97Å; S335-S337 VanDerWaalsContact O-N 3.14Å; S335-S337 WeakPolarHBondContact OG-CB 3.2Å; S335-S337 PolarHBondContact OG-N 3.02Å; S335-N340 WeakPolarHBondContact CB-ND2 3.42Å; S335-N340 PolarHBondContact OG-ND2 2.97Å; S335-T344 PolarHBondContact O-OG1 2.83Å
336	P	92.1	Very high	91.3	Very high	5 Å²	5	18.1 Å²	18.1	3%	0.032	10%	0.102	C	C	.	.			trans	-71.1	-5.6	-179.9	31.4	-37.7	0	0	0	114	R25 F27 G37 V38	R25-P336 WeakPolarHBondContact O-CD 3.45Å; R25-P336 WeakPolarHBondContact O-CG 3.38Å; F27-P336 HydrophobicContact CD2-CB 4.06Å; F27-P336 HydrophobicContact CD2-CG 3.5Å; F27-P336 HydrophobicContact CE2-CB 3.58Å; F27-P336 HydrophobicContact CE2-CG 3.53Å; F27-P336 HydrophobicContact CG-CG 4.08Å; F27-P336 HydrophobicContact CZ-CB 4.12Å; F27-P336 HydrophobicContact CZ-CG 4.11Å; G37-P336 WeakPolarHBondContact CA-O 3.39Å; V38-P336 PolarHBondContact N-O 3.46Å
337	S	90.9	Very high	91.5	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.102	C	C	.	.	B	Isolated β-bridge	trans	-78.3	134.6	-172.5	178.2	0	0	0	0	114	S35 S335 S339 N340	S35-S337 WeakPolarHBondContact CB-OG 3.29Å; S35-S337 PolarHBondContact OG-OG 2.91Å; S335-S337 PolarHBondContact O-N 2.97Å; S335-S337 VanDerWaalsContact O-N 3.14Å; S335-S337 WeakPolarHBondContact OG-CB 3.2Å; S335-S337 PolarHBondContact OG-N 3.02Å; S337-S339 PolarHBondContact O-N 3.4Å; S337-S339 VanDerWaalsContact O-N 3.11Å; S337-S339 PolarHBondContact OG-N 3.44Å; S337-S339 PolarHBondContact OG-OG 3.4Å; S337-N340 PolarHBondContact O-N 2.96Å
338	S	88.8	Confident	91.7	Very high	25 Å²	25	17.2 Å²	17.2	18%	0.175	10%	0.098	C	C	.	.	G	3₁₀ helix	trans	-51.2	-29.6	169.3	52.5	0	0	0	0	114.6	S35 Y36 N340 L341	S35-S338 WeakPolarHBondContact CA-OG 3.44Å; S35-S338 WeakPolarHBondContact CB-OG 3.48Å; S35-S338 PolarHBondContact OG-OG 2.98Å; S35-S338 VanDerWaalsContact OG-OG 3.12Å; Y36-S338 WeakPolarHBondContact CD1-OG 3.39Å; Y36-S338 PolarHBondContact N-OG 3.48Å; Y36-S338 PolarHBondContact O-N 3.43Å; S338-N340 PolarHBondContact O-N 2.93Å; S338-N340 VanDerWaalsContact O-N 3.14Å; S338-L341 PolarHBondContact O-N 2.95Å
339	S	86.1	Confident	91.6	Very high	42 Å²	42	20.2 Å²	20.2	29%	0.294	11%	0.112	S	C	.	.	G	3₁₀ helix	trans	-63	-17.7	177.3	65.3	0	0	0	0	114.4	S35 R272 S337	S35-S339 PolarHBondContact OG-N 3.13Å; R272-S339 PolarHBondContact NH1-O 3.45Å; R272-S339 PolarHBondContact NH2-O 3.17Å; S337-S339 PolarHBondContact O-N 3.4Å; S337-S339 VanDerWaalsContact O-N 3.11Å; S337-S339 PolarHBondContact OG-N 3.44Å; S337-S339 PolarHBondContact OG-OG 3.4Å
340	N	87.3	Confident	91.5	Very high	15 Å²	15	20.6 Å²	20.6	8%	0.08	11%	0.112	C	C	.	.	G	3₁₀ helix	trans	-124.7	17.1	-167.6	-53.9	-23.6	0	0	0	111.8	E31 S335 S337 S338 E342 E343 T344	E31-N340 PolarHBondContact OE1-ND2 3.35Å; S335-N340 WeakPolarHBondContact CB-ND2 3.42Å; S335-N340 PolarHBondContact OG-ND2 2.97Å; S337-N340 PolarHBondContact O-N 2.96Å; S338-N340 PolarHBondContact O-N 2.93Å; S338-N340 VanDerWaalsContact O-N 3.14Å; N340-E342 PolarHBondContact O-N 3.41Å; N340-E343 PolarHBondContact O-N 2.69Å; N340-T344 VanDerWaalsContact O-CB 3.28Å; N340-T344 WeakPolarHBondContact O-CB 3.45Å; N340-T344 PolarHBondContact O-N 2.76Å; N340-T344 PolarHBondContact O-OG1 3.03Å
341	L	88.4	Confident	91.4	Very high	35 Å²	35	20.4 Å²	20.4	18%	0.183	11%	0.111	C	C	.	.	H	α-helix	trans	-58.7	-47.3	-175.7	175.3	58.8	0	0	0	112.9	V38 V50 R51 S338 T344 L345	V38-L341 HydrophobicContact CB-CD1 4.25Å; V38-L341 HydrophobicContact CG2-CB 4.44Å; V38-L341 HydrophobicContact CG2-CD1 4.06Å; V50-L341 HydrophobicContact CG1-CD1 3.39Å; R51-L341 WeakPolarHBondContact O-CD1 3.48Å; S338-L341 PolarHBondContact O-N 2.95Å; L341-T344 WeakPolarHBondContact O-CB 3.45Å; L341-T344 PolarHBondContact O-N 2.77Å; L341-L345 HydrophobicContact CD1-CD1 4.12Å; L341-L345 HydrophobicContact CD1-CG 4.27Å; L341-L345 HydrophobicContact CG-CD1 4.23Å; L341-L345 VanDerWaalsContact O-CG 3.3Å; L341-L345 WeakPolarHBondContact O-CG 3.48Å; L341-L345 PolarHBondContact O-N 3.24Å
342	E	87.4	Confident	91.1	Very high	133 Å²	133	22.7 Å²	22.7	62%	0.621	13%	0.127	S	C	*	.	H	α-helix	trans	-64.5	-43	-178.8	-61.4	175.7	144.1	0	0	112.6	N340 L345 S346	N340-E342 PolarHBondContact O-N 3.41Å; E342-L345 PolarHBondContact O-N 2.89Å; E342-S346 WeakPolarHBondContact O-CB 3.39Å; E342-S346 PolarHBondContact O-N 3.35Å; E342-S346 PolarHBondContact O-OG 3.06Å
343	E	88.6	Confident	90.9	Very high	4 Å²	4	27.7 Å²	27.7	2%	0.019	15%	0.146	C	C	.	.	H	α-helix	trans	-70.7	-34.6	178.9	-59.4	-68.6	-176.4	0	0	111.2	Q104 E268 N269 N340 T347	Q104-E343 HydrophobicContact CB-CB 4.26Å; Q104-E343 HydrophobicContact CG-CB 4.49Å; E268-E343 HydrophobicContact CB-CG 4.48Å; N269-E343 PolarHBondContact N-OE1 2.77Å; N269-E343 PolarHBondContact ND2-OE1 2.76Å; N269-E343 VanDerWaalsContact ND2-OE1 3.11Å; N269-E343 PolarHBondContact ND2-OE2 2.92Å; N340-E343 PolarHBondContact O-N 2.69Å; E343-T347 WeakPolarHBondContact O-CB 3.45Å; E343-T347 PolarHBondContact O-N 2.73Å; E343-T347 PolarHBondContact O-OG1 2.8Å
344	T	92.1	Very high	90.6	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.006	15%	0.146	C	C	.	.	H	α-helix	trans	-62.2	-49.1	169.6	-69	0	0	0	0	111.4	I39 V50 V334 S335 N340 L341 S346 T347 L348	I39-T344 HydrophobicContact CD1-CG2 3.48Å; I39-T344 VanDerWaalsContact CD1-CG2 3.48Å; I39-T344 HydrophobicContact CG1-CG2 3.99Å; V50-T344 HydrophobicContact CG2-CG2 4.44Å; V334-T344 HydrophobicContact CB-CG2 4.25Å; V334-T344 HydrophobicContact CG1-CG2 4.3Å; S335-T344 PolarHBondContact O-OG1 2.83Å; N340-T344 VanDerWaalsContact O-CB 3.28Å; N340-T344 WeakPolarHBondContact O-CB 3.45Å; N340-T344 PolarHBondContact O-N 2.76Å; N340-T344 PolarHBondContact O-OG1 3.03Å; L341-T344 WeakPolarHBondContact O-CB 3.45Å; L341-T344 PolarHBondContact O-N 2.77Å; T344-S346 VanDerWaalsContact C-N 3.32Å; T344-S346 PolarHBondContact O-N 2.92Å; T344-T347 WeakPolarHBondContact O-CB 3.41Å; T344-T347 PolarHBondContact O-N 3.46Å; T344-L348 HydrophobicContact CG2-CD1 3.89Å; T344-L348 WeakPolarHBondContact O-CG 3.34Å; T344-L348 PolarHBondContact O-N 2.92Å
345	L	91.1	Very high	90.4	Very high	26 Å²	26	29.9 Å²	29.9	14%	0.136	16%	0.155	C	C	.	.	H	α-helix	trans	-59.9	-44.8	177.8	-72.7	168.6	0	0	0	111.1	V50 T52 K62 Y64 L341 E342 T347 L348 E349	V50-L345 HydrophobicContact CB-CD2 4.17Å; V50-L345 HydrophobicContact CG1-CD2 3.82Å; V50-L345 HydrophobicContact CG1-CG 4.3Å; T52-L345 HydrophobicContact CG2-CD1 4.03Å; T52-L345 HydrophobicContact CG2-CD2 3.98Å; K62-L345 HydrophobicContact CD-CD2 4.02Å; Y64-L345 HydrophobicContact CE2-CD2 4.19Å; L341-L345 HydrophobicContact CD1-CD1 4.12Å; L341-L345 HydrophobicContact CD1-CG 4.27Å; L341-L345 HydrophobicContact CG-CD1 4.23Å; L341-L345 VanDerWaalsContact O-CG 3.3Å; L341-L345 WeakPolarHBondContact O-CG 3.48Å; L341-L345 PolarHBondContact O-N 3.24Å; E342-L345 PolarHBondContact O-N 2.89Å; L345-T347 VanDerWaalsContact C-N 3.32Å; L345-T347 PolarHBondContact O-N 2.9Å; L345-L348 PolarHBondContact O-N 3.28Å; L345-E349 WeakPolarHBondContact O-CB 3.38Å; L345-E349 WeakPolarHBondContact O-CG 3.34Å; L345-E349 PolarHBondContact O-N 2.95Å
346	S	90.1	Very high	90.2	Very high	55 Å²	55	34.2 Å²	34.2	39%	0.385	18%	0.179	S	C	.	.	H	α-helix	trans	-61.4	-40.4	176.6	-64.6	0	0	0	0	112.1	E342 T344 Y350	E342-S346 WeakPolarHBondContact O-CB 3.39Å; E342-S346 PolarHBondContact O-N 3.35Å; E342-S346 PolarHBondContact O-OG 3.06Å; T344-S346 VanDerWaalsContact C-N 3.32Å; T344-S346 PolarHBondContact O-N 2.92Å; S346-Y350 VanDerWaalsContact O-CB 3.31Å; S346-Y350 WeakPolarHBondContact O-CB 3.5Å; S346-Y350 PolarHBondContact O-N 3.46Å
347	T	93.1	Very high	90	Very high	1 Å²	1	34 Å²	34	1%	0.006	18%	0.178	C	C	.	.	H	α-helix	trans	-64	-42.8	175.4	-58.3	0	0	0	0	111.9	Y102 A332 V334 E343 T344 L345 A351	Y102-T347 HydrophobicContact CD1-CG2 4.1Å; Y102-T347 HydrophobicContact CE1-CG2 4.24Å; A332-T347 HydrophobicContact CB-CG2 4.09Å; V334-T347 HydrophobicContact CG1-CG2 3.77Å; E343-T347 WeakPolarHBondContact O-CB 3.45Å; E343-T347 PolarHBondContact O-N 2.73Å; E343-T347 PolarHBondContact O-OG1 2.8Å; T344-T347 WeakPolarHBondContact O-CB 3.41Å; T344-T347 PolarHBondContact O-N 3.46Å; L345-T347 VanDerWaalsContact C-N 3.32Å; L345-T347 PolarHBondContact O-N 2.9Å; T347-A351 WeakPolarHBondContact O-CB 3.48Å; T347-A351 PolarHBondContact O-N 3.4Å
348	L	93.6	Very high	89.8	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-73.1	-36.3	179.2	-65	169.9	0	0	0	112.6	V22 V48 V50 Y64 F66 V334 T344 L345 A351 S352	V22-L348 HydrophobicContact CG1-CD2 4.05Å; V22-L348 HydrophobicContact CG2-CD2 3.72Å; V48-L348 HydrophobicContact CG1-CD1 3.92Å; V48-L348 HydrophobicContact CG1-CD2 4.24Å; V50-L348 HydrophobicContact CG2-CD1 3.47Å; V50-L348 VanDerWaalsContact CG2-CD1 3.47Å; Y64-L348 HydrophobicContact CD1-CB 4.29Å; Y64-L348 HydrophobicContact CD2-CB 4.11Å; Y64-L348 HydrophobicContact CD2-CD1 3.92Å; Y64-L348 HydrophobicContact CE1-CB 4.27Å; Y64-L348 HydrophobicContact CE2-CB 4.07Å; Y64-L348 HydrophobicContact CE2-CD1 4Å; Y64-L348 HydrophobicContact CG-CB 4.21Å; F66-L348 HydrophobicContact CE2-CD2 3.8Å; F66-L348 HydrophobicContact CZ-CB 4.44Å; F66-L348 HydrophobicContact CZ-CD2 3.84Å; V334-L348 HydrophobicContact CG1-CD2 4.26Å; V334-L348 HydrophobicContact CG1-CG 4.35Å; T344-L348 HydrophobicContact CG2-CD1 3.89Å; T344-L348 WeakPolarHBondContact O-CG 3.34Å; T344-L348 PolarHBondContact O-N 2.92Å; L345-L348 PolarHBondContact O-N 3.28Å; L348-A351 PolarHBondContact O-N 2.89Å; L348-S352 VanDerWaalsContact O-CB 3.22Å; L348-S352 WeakPolarHBondContact O-CB 3.03Å; L348-S352 PolarHBondContact O-N 3.12Å
349	E	91.3	Very high	89.8	Confident	72 Å²	72	37.5 Å²	37.5	34%	0.336	19%	0.192	S	C	.	.	H	α-helix	trans	-73.5	-26.1	175.5	-71.5	177.7	-175.5	0	0	112.7	K62 Y64 L345 R353	K62-E349 IonicContact NZ-OE1 3.23Å; K62-E349 PolarHBondContact NZ-OE1 3.4Å; Y64-E349 HydrophobicContact CE1-CG 3.79Å; Y64-E349 WeakPolarHBondContact OH-CG 3.46Å; Y64-E349 PolarHBondContact OH-OE1 2.85Å; Y64-E349 VanDerWaalsContact OH-OE1 3.08Å; L345-E349 WeakPolarHBondContact O-CB 3.38Å; L345-E349 WeakPolarHBondContact O-CG 3.34Å; L345-E349 PolarHBondContact O-N 2.95Å; E349-R353 WeakPolarHBondContact O-CG 3.24Å; E349-R353 PolarHBondContact O-NE 2.99Å
350	Y	90.3	Very high	89.8	Confident	12 Å²	12	41.9 Å²	41.9	5%	0.047	21%	0.206	C	C	.	.	H	α-helix	trans	-68.9	-52.9	165.4	176.6	-85.3	0	0	0	110.9	Y102 L293 I297 S346 S352 R353 A354	Y102-Y350 AromaticContact CD1-CD1 3.42Å; Y102-Y350 HydrophobicContact CD1-CD1 3.42Å; Y102-Y350 VanDerWaalsContact CD1-CD1 3.42Å; Y102-Y350 AromaticContact CD1-CE1 3.59Å; Y102-Y350 HydrophobicContact CD1-CE1 3.59Å; Y102-Y350 HydrophobicContact CD1-CG 4.14Å; Y102-Y350 HydrophobicContact CD2-CE1 4.03Å; Y102-Y350 AromaticContact CE1-CD1 3.24Å; Y102-Y350 HydrophobicContact CE1-CD1 3.24Å; Y102-Y350 HydrophobicContact CE1-CD2 4.08Å; Y102-Y350 AromaticContact CE1-CE1 3.68Å; Y102-Y350 HydrophobicContact CE1-CE1 3.68Å; Y102-Y350 HydrophobicContact CE1-CE2 4.44Å; Y102-Y350 AromaticContact CE1-CG 3.46Å; Y102-Y350 HydrophobicContact CE1-CG 3.46Å; Y102-Y350 VanDerWaalsContact CE1-CG 3.46Å; Y102-Y350 HydrophobicContact CE2-CD1 4.42Å; Y102-Y350 HydrophobicContact CE2-CE1 4.1Å; Y102-Y350 HydrophobicContact CE2-CE2 4.21Å; Y102-Y350 AromaticContact CE2-CZ 3.98Å; Y102-Y350 HydrophobicContact CG-CD1 4.1Å; Y102-Y350 AromaticContact CG-CE1 3.77Å; Y102-Y350 HydrophobicContact CG-CE1 3.77Å; Y102-Y350 AromaticContact CZ-CD1 3.79Å; Y102-Y350 AromaticContact CZ-CD2 3.85Å; Y102-Y350 AromaticContact CZ-CE1 3.93Å; Y102-Y350 AromaticContact CZ-CE2 3.99Å; Y102-Y350 AromaticContact CZ-CG 3.74Å; L293-Y350 WeakPolarHBondContact CD2-OH 3.31Å; L293-Y350 VanDerWaalsContact CG-OH 3.32Å; L293-Y350 WeakPolarHBondContact CG-OH 3.38Å; I297-Y350 HydrophobicContact CD1-CE1 3.99Å; I297-Y350 HydrophobicContact CD1-CE2 3.93Å; I297-Y350 WeakPolarHBondContact CD1-OH 2.84Å; S346-Y350 VanDerWaalsContact O-CB 3.31Å; S346-Y350 WeakPolarHBondContact O-CB 3.5Å; S346-Y350 PolarHBondContact O-N 3.46Å; Y350-S352 PolarHBondContact O-N 3Å; Y350-R353 PolarHBondContact O-N 2.77Å; Y350-R353 VanDerWaalsContact O-N 3.14Å; Y350-A354 PolarHBondContact O-N 2.93Å
351	A	92.6	Very high	89.6	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-59.2	-43.3	-179.3	0	0	0	0	0	112.4	V20 F66 A332 T347 L348 R353 A354 K355	V20-A351 HydrophobicContact CG1-CB 3.76Å; F66-A351 HydrophobicContact CE1-CB 3.76Å; F66-A351 HydrophobicContact CZ-CB 4.26Å; A332-A351 HydrophobicContact CB-CB 3.86Å; T347-A351 WeakPolarHBondContact O-CB 3.48Å; T347-A351 PolarHBondContact O-N 3.4Å; L348-A351 PolarHBondContact O-N 2.89Å; A351-R353 VanDerWaalsContact C-N 3.27Å; A351-R353 PolarHBondContact O-N 3.5Å; A351-A354 PolarHBondContact O-N 3.2Å; A351-K355 PolarHBondContact O-N 3.04Å
352	S	91.4	Very high	89.4	Confident	49 Å²	49	44.1 Å²	44.1	34%	0.343	22%	0.216	S	C	.	.	H	α-helix	trans	-66.8	-24.7	179	-172.4	0	0	0	0	113.4	L348 Y350	L348-S352 VanDerWaalsContact O-CB 3.22Å; L348-S352 WeakPolarHBondContact O-CB 3.03Å; L348-S352 PolarHBondContact O-N 3.12Å; Y350-S352 PolarHBondContact O-N 3Å
353	R	90.4	Very high	89.1	Confident	105 Å²	105	40.9 Å²	40.9	40%	0.396	21%	0.205	S	C	.	.	H	α-helix	trans	-78.4	-45.9	169.5	-77.4	178.9	-73.3	163	-8.7	111	I297 T298 V301 E349 Y350 A351 K355 N356	I297-R353 HydrophobicContact CG2-CB 4.18Å; T298-R353 PolarHBondContact OG1-NH1 2.68Å; T298-R353 VanDerWaalsContact OG1-NH1 3.14Å; V301-R353 VanDerWaalsContact CG2-O 3.23Å; V301-R353 WeakPolarHBondContact CG2-O 3.25Å; E349-R353 WeakPolarHBondContact O-CG 3.24Å; E349-R353 PolarHBondContact O-NE 2.99Å; Y350-R353 PolarHBondContact O-N 2.77Å; Y350-R353 VanDerWaalsContact O-N 3.14Å; A351-R353 VanDerWaalsContact C-N 3.27Å; A351-R353 PolarHBondContact O-N 3.5Å; R353-K355 PolarHBondContact O-N 3.35Å; R353-K355 VanDerWaalsContact O-N 3.13Å; R353-N356 PolarHBondContact O-N 2.82Å
354	A	90.1	Very high	88.4	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-55.3	-33.5	-177.6	0	0	0	0	0	113.6	V20 I297 I330 Y350 A351 N356 I357	V20-A354 HydrophobicContact CG2-CB 4.34Å; I297-A354 HydrophobicContact CD1-CB 3.79Å; I297-A354 HydrophobicContact CG2-CB 4.36Å; I330-A354 HydrophobicContact CD1-CB 3.62Å; Y350-A354 PolarHBondContact O-N 2.93Å; A351-A354 PolarHBondContact O-N 3.2Å; A354-N356 PolarHBondContact O-N 3.44Å; A354-N356 VanDerWaalsContact O-N 3.1Å; A354-I357 HydrophobicContact CB-CD1 4.41Å; A354-I357 WeakPolarHBondContact O-CB 3.29Å; A354-I357 WeakPolarHBondContact O-CG1 2.94Å; A354-I357 PolarHBondContact O-N 3.22Å; A354-I357 VanDerWaalsContact O-N 3.1Å
355	K	90.4	Very high	87	Confident	47 Å²	47	50.7 Å²	50.7	20%	0.204	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-21.3	176.1	-173.1	166.8	-178.9	163.7	0	114.9	N17 V20 D67 A351 R353	N17-K355 WeakPolarHBondContact CB-O 3.41Å; N17-K355 PolarHBondContact ND2-O 2.69Å; V20-K355 HydrophobicContact CB-CB 4.15Å; V20-K355 HydrophobicContact CG2-CB 3.69Å; V20-K355 HydrophobicContact CG2-CG 4.36Å; D67-K355 VanDerWaalsContact CG-CE 3.48Å; D67-K355 WeakPolarHBondContact OD1-CE 3.45Å; D67-K355 IonicContact OD1-NZ 3.58Å; D67-K355 PolarHBondContact OD1-NZ 2.97Å; D67-K355 WeakPolarHBondContact OD2-CE 3.46Å; D67-K355 IonicContact OD2-NZ 3.99Å; D67-K355 PolarHBondContact OD2-NZ 2.85Å; A351-K355 PolarHBondContact O-N 3.04Å; R353-K355 PolarHBondContact O-N 3.35Å; R353-K355 VanDerWaalsContact O-N 3.13Å
356	N	88.3	Confident	85.5	Confident	92 Å²	92	54.7 Å²	54.7	49%	0.492	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	4.3	-179.2	-65.2	-35	0	0	0	113.7	V301 R353 A354	V301-N356 HydrophobicContact CG1-CB 3.96Å; V301-N356 HydrophobicContact CG2-CB 4.03Å; R353-N356 PolarHBondContact O-N 2.82Å; A354-N356 PolarHBondContact O-N 3.44Å; A354-N356 VanDerWaalsContact O-N 3.1Å
357	I	88.6	Confident	84.2	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.005	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-75	130.8	171.1	-59.4	166.8	0	0	0	109.1	N17 I18 I297 L300 V301 L322 A354	N17-I357 CarbonylContact C-O 3.51Å; N17-I357 VanDerWaalsContact CA-O 3.27Å; N17-I357 WeakPolarHBondContact CA-O 3.29Å; I18-I357 HydrophobicContact CB-CB 4.5Å; I18-I357 HydrophobicContact CD1-CB 3.77Å; I18-I357 HydrophobicContact CD1-CD1 4.05Å; I18-I357 HydrophobicContact CD1-CG2 3.57Å; I18-I357 HydrophobicContact CG1-CB 4.01Å; I18-I357 HydrophobicContact CG1-CG2 4.04Å; I18-I357 PolarHBondContact N-O 2.98Å; I297-I357 HydrophobicContact CB-CD1 4.12Å; I297-I357 HydrophobicContact CD1-CD1 4.02Å; I297-I357 HydrophobicContact CG1-CD1 3.69Å; I297-I357 HydrophobicContact CG2-CD1 4Å; L300-I357 HydrophobicContact CB-CG1 4.12Å; L300-I357 HydrophobicContact CB-CG2 4.34Å; L300-I357 HydrophobicContact CD1-CD1 4.33Å; L300-I357 HydrophobicContact CD1-CG1 4.48Å; L300-I357 HydrophobicContact CD1-CG2 4.01Å; V301-I357 HydrophobicContact CG2-CG1 3.96Å; L322-I357 HydrophobicContact CD2-CD1 4.4Å; A354-I357 HydrophobicContact CB-CD1 4.41Å; A354-I357 WeakPolarHBondContact O-CB 3.29Å; A354-I357 WeakPolarHBondContact O-CG1 2.94Å; A354-I357 PolarHBondContact O-N 3.22Å; A354-I357 VanDerWaalsContact O-N 3.1Å
358	M	86.6	Confident	82.8	Confident	93 Å²	93	55.8 Å²	55.8	46%	0.458	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	122.5	173.7	-57.1	175.7	-56.9	0	0	110.1	K303	K303-M358 HydrophobicContact CD-CE 4.41Å
359	N	87.1	Confident	81.4	Confident	4 Å²	4	60.2 Å²	60.2	2%	0.021	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	155.8	166.5	-74.7	12.6	0	0	0	109.9	G15 R16 S321 G323 T326 T328 P361	G15-N359 CarbonylContact C-O 3.47Å; G15-N359 WeakPolarHBondContact CA-O 3.31Å; R16-N359 PolarHBondContact N-O 3.33Å; R16-N359 PolarHBondContact O-N 3.33Å; S321-N359 PolarHBondContact O-ND2 3.44Å; G323-N359 WeakPolarHBondContact CA-OD1 3.5Å; G323-N359 PolarHBondContact N-OD1 3.41Å; T326-N359 WeakPolarHBondContact O-CB 3.29Å; T326-N359 PolarHBondContact O-ND2 3.1Å; T328-N359 PolarHBondContact OG1-ND2 2.96Å; N359-P361 WeakPolarHBondContact O-CD 3.29Å
360	K	86.7	Confident	80.1	Confident	134 Å²	134	67.3 Å²	67.3	58%	0.583	31%	0.314	S	S	*	.			trans	-113.7	83.1	171.8	-76.4	-165.9	173.3	-164.6	0	108.6	G324 R325 E362	G324-K360 PolarHBondContact O-N 3.5Å; R325-K360 WeakPolarHBondContact CA-O 3.32Å; K360-E362 PolarHBondContact O-N 3.1Å
361	P	84.1	Confident	78.9	Confident	13 Å²	13	69.5 Å²	69.5	8%	0.084	33%	0.329	C	S	.	.			trans	-65.6	129.2	-175.4	27.8	-34.7	0	0	0	111.2	Y95 R325 K327 N359	Y95-P361 HydrophobicContact CD1-CB 4.21Å; Y95-P361 HydrophobicContact CE1-CB 4.35Å; R325-P361 WeakPolarHBondContact O-CA 3.4Å; K327-P361 HydrophobicContact CD-CB 4.14Å; K327-P361 HydrophobicContact CG-CB 3.4Å; K327-P361 HydrophobicContact CG-CG 4.03Å; N359-P361 WeakPolarHBondContact O-CD 3.29Å
362	E	82.9	Confident	77.6	Confident	85 Å²	85	71.2 Å²	71.2	40%	0.397	34%	0.338	S	S	.	.			trans	-117.7	140.9	177.6	-71	177.5	-133.8	0	0	109.2	R325 K360	R325-E362 HydrophobicContact CB-CB 4.48Å; R325-E362 HydrophobicContact CG-CB 4.41Å; R325-E362 HydrophobicContact CG-CG 4.31Å; R325-E362 IonicContact CZ-OE1 2.74Å; R325-E362 IonicContact CZ-OE2 2.84Å; R325-E362 IonicContact NE-OE1 3.86Å; R325-E362 PolarHBondContact NE-OE1 3.21Å; R325-E362 IonicContact NE-OE2 3.56Å; R325-E362 PolarHBondContact NE-OE2 2.94Å; R325-E362 VanDerWaalsContact NH2-CD 3.31Å; R325-E362 IonicContact NH2-OE1 3.77Å; R325-E362 PolarHBondContact NH2-OE1 3.34Å; R325-E362 VanDerWaalsContact NH2-OE1 3.08Å; R325-E362 IonicContact NH2-OE2 2.73Å; R325-E362 PolarHBondContact NH2-OE2 3.35Å; R325-E362 PolarHBondContact O-N 3.44Å; K360-E362 PolarHBondContact O-N 3.1Å
363	V	81.7	Confident	76.8	Confident	65 Å²	65	73.3 Å²	73.3	39%	0.394	34%	0.344	S	S	.	.	B	Isolated β-bridge	trans	-75.6	131.3	170.2	-176.4	0	0	0	0	107.9	Y95 Q365	Y95-V363 HydrophobicContact CD1-CG2 3.93Å; Y95-V363 HydrophobicContact CD2-CG2 4.19Å; Y95-V363 HydrophobicContact CE1-CB 4.48Å; Y95-V363 HydrophobicContact CE1-CG2 3.42Å; Y95-V363 VanDerWaalsContact CE1-CG2 3.42Å; Y95-V363 HydrophobicContact CE2-CG2 3.7Å; Y95-V363 HydrophobicContact CG-CG2 4.3Å; V363-Q365 PolarHBondContact O-N 3.47Å
364	N	73.7	Confident	76.1	Confident	49 Å²	49	73.8 Å²	73.8	26%	0.262	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-61.1	127.9	172.4	-67.5	-46.4	0	0	0	109.1	G94 N96 I256 K366	G94-N364 PolarHBondContact O-N 3.05Å; G94-N364 PolarHBondContact O-ND2 3.06Å; N96-N364 PolarHBondContact OD1-ND2 3.35Å; I256-N364 WeakPolarHBondContact O-CB 3.38Å; I256-N364 PolarHBondContact O-ND2 3.06Å; N364-K366 PolarHBondContact O-N 3.48Å
365	Q	63.2	Low	75.2	Confident	162 Å²	162	78.3 Å²	78.3	76%	0.757	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-59.3	136.5	-169	-66	-174.6	13.1	0	0	111.7	V363 L367	V363-Q365 PolarHBondContact O-N 3.47Å; Q365-L367 PolarHBondContact O-N 2.86Å
366	K	59.7	Low	74.5	Confident	109 Å²	109	82.5 Å²	82.5	47%	0.474	39%	0.386	S	S	.	.			trans	-67.8	95.4	171.3	-64.1	-163	-175	-168.9	0	109	E245 L253 K255 N364	E245-K366 WeakPolarHBondContact OE2-CE 3.32Å; E245-K366 IonicContact OE2-NZ 3.95Å; E245-K366 PolarHBondContact OE2-NZ 3.43Å; L253-K366 HydrophobicContact CB-CB 4.27Å; L253-K366 HydrophobicContact CB-CD 4.45Å; L253-K366 HydrophobicContact CD1-CB 4.1Å; L253-K366 HydrophobicContact CD1-CD 3.72Å; L253-K366 HydrophobicContact CD2-CB 4.22Å; L253-K366 HydrophobicContact CG-CB 4.44Å; K255-K366 HydrophobicContact CG-CG 4.27Å; N364-K366 PolarHBondContact O-N 3.48Å
367	L	62.5	Low	74	Confident	48 Å²	48	81.5 Å²	81.5	25%	0.251	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	125.2	178.3	-70.4	167.1	0	0	0	109	V254 Q365 K369 L372	V254-L367 PolarHBondContact N-O 2.98Å; V254-L367 PolarHBondContact O-N 2.91Å; Q365-L367 PolarHBondContact O-N 2.86Å; L367-K369 PolarHBondContact O-N 2.98Å; L367-L372 HydrophobicContact CB-CD1 4.45Å; L367-L372 HydrophobicContact CD1-CD1 3.75Å
368	T	64	Low	73.5	Confident	31 Å²	31	86 Å²	86	19%	0.19	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	134.8	167.5	49.8	0	0	0	0	108.7	E251 L253 R370 T371 L372	E251-T368 WeakPolarHBondContact OE2-CG2 3.47Å; L253-T368 HydrophobicContact CD2-CG2 3.44Å; L253-T368 VanDerWaalsContact CD2-CG2 3.44Å; T368-R370 PolarHBondContact O-N 2.99Å; T368-T371 WeakPolarHBondContact O-CA 3.46Å; T368-T371 WeakPolarHBondContact O-CB 3.45Å; T368-T371 PolarHBondContact O-N 3.42Å; T368-T371 PolarHBondContact OG1-OG1 3.09Å; T368-L372 PolarHBondContact O-N 3.02Å
369	K	63.4	Low	72.9	Confident	93 Å²	93	84.9 Å²	84.9	40%	0.404	40%	0.398	S	S	.	.	H	α-helix	trans	-51.8	-33.9	-179.7	-177.1	-179.6	177.6	175.5	0	113.2	E252 L367 L372 I373	E252-K369 HydrophobicContact CB-CB 4.28Å; E252-K369 HydrophobicContact CB-CD 4.36Å; E252-K369 PolarHBondContact O-N 3.3Å; E252-K369 IonicContact OE1-NZ 3.58Å; E252-K369 WeakPolarHBondContact OE2-CD 3.34Å; E252-K369 WeakPolarHBondContact OE2-CE 3.46Å; E252-K369 IonicContact OE2-NZ 2.77Å; E252-K369 PolarHBondContact OE2-NZ 3.26Å; L367-K369 PolarHBondContact O-N 2.98Å; K369-L372 PolarHBondContact O-N 3.04Å; K369-I373 HydrophobicContact CG-CD1 3.85Å; K369-I373 HydrophobicContact CG-CG1 4.47Å; K369-I373 WeakPolarHBondContact O-CB 3.33Å; K369-I373 VanDerWaalsContact O-CG1 3.24Å; K369-I373 WeakPolarHBondContact O-CG1 3.39Å; K369-I373 PolarHBondContact O-N 3.26Å
370	R	65.4	Low	72.4	Confident	221 Å²	221	88.9 Å²	88.9	83%	0.834	42%	0.418	S	S	*	.	H	α-helix	trans	-62.2	-39.6	173.7	179.8	175	172.6	139.2	-1.3	113.1	T368 K374	T368-R370 PolarHBondContact O-N 2.99Å; R370-K374 WeakPolarHBondContact O-CB 3.31Å; R370-K374 PolarHBondContact O-N 3.05Å; R370-K374 VanDerWaalsContact O-N 3.1Å
371	T	65.3	Low	72	Confident	58 Å²	58	86.5 Å²	86.5	36%	0.356	41%	0.409	S	S	.	.	H	α-helix	trans	-73.7	-43.9	177.1	-50.7	0	0	0	0	110.4	T368 I373 K374 E375	T368-T371 WeakPolarHBondContact O-CA 3.46Å; T368-T371 WeakPolarHBondContact O-CB 3.45Å; T368-T371 PolarHBondContact O-N 3.42Å; T368-T371 PolarHBondContact OG1-OG1 3.09Å; T371-I373 PolarHBondContact O-N 3.31Å; T371-K374 WeakPolarHBondContact O-CB 3.34Å; T371-K374 PolarHBondContact O-N 3.42Å; T371-K374 VanDerWaalsContact O-N 3.07Å; T371-E375 PolarHBondContact O-N 2.96Å
372	L	65.3	Low	71.7	Confident	37 Å²	37	90.4 Å²	90.4	19%	0.194	42%	0.422	C	S	.	.	H	α-helix	trans	-59.3	-43.9	176.3	-166.7	76.7	0	0	0	112.1	L367 T368 K369 E375 Y376	L367-L372 HydrophobicContact CB-CD1 4.45Å; L367-L372 HydrophobicContact CD1-CD1 3.75Å; T368-L372 PolarHBondContact O-N 3.02Å; K369-L372 PolarHBondContact O-N 3.04Å; L372-E375 PolarHBondContact O-N 2.78Å; L372-Y376 HydrophobicContact CD1-CE2 4.09Å; L372-Y376 HydrophobicContact CD2-CE2 3.89Å; L372-Y376 HydrophobicContact CG-CD2 4.01Å; L372-Y376 HydrophobicContact CG-CE2 3.61Å; L372-Y376 WeakPolarHBondContact O-CB 3.32Å; L372-Y376 VanDerWaalsContact O-CD2 3.26Å; L372-Y376 WeakPolarHBondContact O-CD2 3.38Å; L372-Y376 PolarHBondContact O-N 3.15Å
373	I	72.6	Confident	71.3	Confident	92 Å²	92	90.3 Å²	90.3	47%	0.472	42%	0.424	S	S	.	.	H	α-helix	trans	-65.2	-38.4	174.2	-70.8	169.1	0	0	0	111.2	K369 T371 T377	K369-I373 HydrophobicContact CG-CD1 3.85Å; K369-I373 HydrophobicContact CG-CG1 4.47Å; K369-I373 WeakPolarHBondContact O-CB 3.33Å; K369-I373 VanDerWaalsContact O-CG1 3.24Å; K369-I373 WeakPolarHBondContact O-CG1 3.39Å; K369-I373 PolarHBondContact O-N 3.26Å; T371-I373 PolarHBondContact O-N 3.31Å; I373-T377 VanDerWaalsContact O-CB 3.31Å; I373-T377 WeakPolarHBondContact O-CB 3.31Å; I373-T377 PolarHBondContact O-N 2.94Å; I373-T377 PolarHBondContact O-OG1 2.95Å
374	K	76.1	Confident	71	Confident	115 Å²	115	92.5 Å²	92.5	50%	0.5	43%	0.428	S	S	.	.	H	α-helix	trans	-64.2	-47.1	176.7	-177.4	176.7	175.5	-65.6	0	111.3	R370 T371 T377 E378	R370-K374 WeakPolarHBondContact O-CB 3.31Å; R370-K374 PolarHBondContact O-N 3.05Å; R370-K374 VanDerWaalsContact O-N 3.1Å; T371-K374 WeakPolarHBondContact O-CB 3.34Å; T371-K374 PolarHBondContact O-N 3.42Å; T371-K374 VanDerWaalsContact O-N 3.07Å; K374-T377 PolarHBondContact O-N 3.32Å; K374-E378 VanDerWaalsContact CE-OE1 3.24Å; K374-E378 WeakPolarHBondContact CE-OE1 3.27Å; K374-E378 VanDerWaalsContact NZ-CD 3.31Å; K374-E378 IonicContact NZ-OE1 2.73Å; K374-E378 PolarHBondContact NZ-OE1 3.37Å; K374-E378 IonicContact NZ-OE2 2.78Å; K374-E378 PolarHBondContact NZ-OE2 3.36Å; K374-E378 WeakPolarHBondContact O-CB 3.27Å; K374-E378 WeakPolarHBondContact O-CG 3.49Å; K374-E378 PolarHBondContact O-N 3.5Å
375	E	72.9	Confident	71.1	Confident	96 Å²	96	97.2 Å²	97.2	45%	0.449	44%	0.442	S	S	.	.	H	α-helix	trans	-60.8	-46.6	175	-72.6	175.7	-167.5	0	0	111.9	T371 L372 T377 E378 E379	T371-E375 PolarHBondContact O-N 2.96Å; L372-E375 PolarHBondContact O-N 2.78Å; E375-T377 VanDerWaalsContact C-N 3.29Å; E375-T377 PolarHBondContact O-N 3.49Å; E375-E378 PolarHBondContact O-N 3.09Å; E375-E379 VanDerWaalsContact O-CB 3.31Å; E375-E379 WeakPolarHBondContact O-CB 3.45Å; E375-E379 PolarHBondContact O-N 3.37Å
376	Y	74.9	Confident	71.3	Confident	135 Å²	135	92.8 Å²	92.8	53%	0.529	42%	0.424	S	S	.	.	H	α-helix	trans	-63.3	-33.7	174.3	-73.9	-43	0	0	0	112.7	L372 I380	L372-Y376 HydrophobicContact CD1-CE2 4.09Å; L372-Y376 HydrophobicContact CD2-CE2 3.89Å; L372-Y376 HydrophobicContact CG-CD2 4.01Å; L372-Y376 HydrophobicContact CG-CE2 3.61Å; L372-Y376 WeakPolarHBondContact O-CB 3.32Å; L372-Y376 VanDerWaalsContact O-CD2 3.26Å; L372-Y376 WeakPolarHBondContact O-CD2 3.38Å; L372-Y376 PolarHBondContact O-N 3.15Å; Y376-I380 VanDerWaalsContact O-CB 3.24Å; Y376-I380 WeakPolarHBondContact O-CB 3.43Å; Y376-I380 WeakPolarHBondContact O-CD1 3.38Å; Y376-I380 WeakPolarHBondContact O-CG1 3.36Å; Y376-I380 PolarHBondContact O-N 2.98Å
377	T	78.2	Confident	71.8	Confident	70 Å²	70	93.3 Å²	93.3	43%	0.429	43%	0.431	S	S	.	.	H	α-helix	trans	-70.4	-43.8	176	-56.6	0	0	0	0	110.8	I373 K374 E375 E379 I380 E381	I373-T377 VanDerWaalsContact O-CB 3.31Å; I373-T377 WeakPolarHBondContact O-CB 3.31Å; I373-T377 PolarHBondContact O-N 2.94Å; I373-T377 PolarHBondContact O-OG1 2.95Å; K374-T377 PolarHBondContact O-N 3.32Å; E375-T377 VanDerWaalsContact C-N 3.29Å; E375-T377 PolarHBondContact O-N 3.49Å; T377-E379 VanDerWaalsContact C-N 3.33Å; T377-E379 PolarHBondContact O-N 3.34Å; T377-I380 PolarHBondContact O-N 3.09Å; T377-E381 WeakPolarHBondContact O-CG 3.37Å; T377-E381 PolarHBondContact O-N 3.1Å
378	E	77.4	Confident	71.9	Confident	97 Å²	97	93.1 Å²	93.1	45%	0.453	44%	0.437	S	S	.	.	H	α-helix	trans	-64.1	-37.5	176.6	-74.7	169.2	177.3	0	0	112	K374 E375 R382	K374-E378 VanDerWaalsContact CE-OE1 3.24Å; K374-E378 WeakPolarHBondContact CE-OE1 3.27Å; K374-E378 VanDerWaalsContact NZ-CD 3.31Å; K374-E378 IonicContact NZ-OE1 2.73Å; K374-E378 PolarHBondContact NZ-OE1 3.37Å; K374-E378 IonicContact NZ-OE2 2.78Å; K374-E378 PolarHBondContact NZ-OE2 3.36Å; K374-E378 WeakPolarHBondContact O-CB 3.27Å; K374-E378 WeakPolarHBondContact O-CG 3.49Å; K374-E378 PolarHBondContact O-N 3.5Å; E375-E378 PolarHBondContact O-N 3.09Å; E378-R382 WeakPolarHBondContact O-CB 3.29Å; E378-R382 PolarHBondContact O-N 2.87Å
379	E	73.9	Confident	71.8	Confident	69 Å²	69	95.3 Å²	95.3	32%	0.322	46%	0.458	S	S	.	.	H	α-helix	trans	-73.3	-38	174.1	-176.4	65.8	175.2	0	0	112.4	E375 T377 E381 R382 L383	E375-E379 VanDerWaalsContact O-CB 3.31Å; E375-E379 WeakPolarHBondContact O-CB 3.45Å; E375-E379 PolarHBondContact O-N 3.37Å; T377-E379 VanDerWaalsContact C-N 3.33Å; T377-E379 PolarHBondContact O-N 3.34Å; E379-E381 VanDerWaalsContact C-N 3.34Å; E379-R382 VanDerWaalsContact CD-NH2 3.33Å; E379-R382 PolarHBondContact O-N 2.96Å; E379-R382 IonicContact OE1-CZ 2.89Å; E379-R382 IonicContact OE1-NE 2.68Å; E379-R382 IonicContact OE1-NH2 3.11Å; E379-R382 PolarHBondContact OE1-NH2 3.04Å; E379-R382 IonicContact OE2-CZ 3.4Å; E379-R382 IonicContact OE2-NE 3.63Å; E379-R382 PolarHBondContact OE2-NE 2.95Å; E379-R382 IonicContact OE2-NH2 3.23Å; E379-R382 PolarHBondContact OE2-NH2 2.87Å; E379-R382 VanDerWaalsContact OE2-NH2 3.13Å; E379-L383 HydrophobicContact CG-CD1 4.02Å; E379-L383 HydrophobicContact CG-CG 4.38Å; E379-L383 WeakPolarHBondContact O-CB 3.46Å; E379-L383 VanDerWaalsContact O-CG 3.3Å; E379-L383 WeakPolarHBondContact O-CG 3.08Å; E379-L383 PolarHBondContact O-N 2.89Å
380	I	77.4	Confident	71.6	Confident	88 Å²	88	95.8 Å²	95.8	45%	0.451	47%	0.469	S	S	.	.	H	α-helix	trans	-62.1	-43.1	171	-76.8	165.1	0	0	0	110.3	Y376 T377 R382 L383 K384	Y376-I380 VanDerWaalsContact O-CB 3.24Å; Y376-I380 WeakPolarHBondContact O-CB 3.43Å; Y376-I380 WeakPolarHBondContact O-CD1 3.38Å; Y376-I380 WeakPolarHBondContact O-CG1 3.36Å; Y376-I380 PolarHBondContact O-N 2.98Å; T377-I380 PolarHBondContact O-N 3.09Å; I380-R382 VanDerWaalsContact C-N 3.31Å; I380-R382 PolarHBondContact O-N 2.83Å; I380-L383 PolarHBondContact O-N 2.8Å; I380-K384 HydrophobicContact CG2-CD 4Å; I380-K384 HydrophobicContact CG2-CG 4.42Å; I380-K384 VanDerWaalsContact O-CB 3.26Å; I380-K384 WeakPolarHBondContact O-CB 3.33Å; I380-K384 WeakPolarHBondContact O-CG 3.47Å; I380-K384 PolarHBondContact O-N 2.72Å
381	E	77.7	Confident	71.5	Confident	83 Å²	83	95.4 Å²	95.4	39%	0.388	47%	0.467	S	S	.	.	H	α-helix	trans	-69.7	-25.8	174.3	-67.6	-48.3	132	0	0	112.8	T377 E379 K384 R385	T377-E381 WeakPolarHBondContact O-CG 3.37Å; T377-E381 PolarHBondContact O-N 3.1Å; E379-E381 VanDerWaalsContact C-N 3.34Å; E381-K384 WeakPolarHBondContact OE1-CD 3.5Å; E381-K384 IonicContact OE1-NZ 2.87Å; E381-K384 PolarHBondContact OE1-NZ 3.45Å; E381-K384 WeakPolarHBondContact OE2-CD 3.45Å; E381-K384 IonicContact OE2-NZ 2.8Å; E381-R385 VanDerWaalsContact O-CG 3.3Å; E381-R385 WeakPolarHBondContact O-CG 3.39Å; E381-R385 PolarHBondContact O-N 3Å; E381-R385 PolarHBondContact O-NE 3.26Å
382	R	76.7	Confident	71.1	Confident	95 Å²	95	99 Å²	99	36%	0.358	48%	0.484	S	S	.	.	H	α-helix	trans	-70.8	-53.3	170	-167.2	175.7	71.5	89.7	-4.2	111.2	E378 E379 I380 K384 R385 D386	E378-R382 WeakPolarHBondContact O-CB 3.29Å; E378-R382 PolarHBondContact O-N 2.87Å; E379-R382 VanDerWaalsContact CD-NH2 3.33Å; E379-R382 PolarHBondContact O-N 2.96Å; E379-R382 IonicContact OE1-CZ 2.89Å; E379-R382 IonicContact OE1-NE 2.68Å; E379-R382 IonicContact OE1-NH2 3.11Å; E379-R382 PolarHBondContact OE1-NH2 3.04Å; E379-R382 IonicContact OE2-CZ 3.4Å; E379-R382 IonicContact OE2-NE 3.63Å; E379-R382 PolarHBondContact OE2-NE 2.95Å; E379-R382 IonicContact OE2-NH2 3.23Å; E379-R382 PolarHBondContact OE2-NH2 2.87Å; E379-R382 VanDerWaalsContact OE2-NH2 3.13Å; I380-R382 VanDerWaalsContact C-N 3.31Å; I380-R382 PolarHBondContact O-N 2.83Å; R382-K384 VanDerWaalsContact C-N 3.27Å; R382-K384 PolarHBondContact O-N 3.42Å; R382-R385 VanDerWaalsContact CA-NH2 3.26Å; R382-R385 WeakPolarHBondContact O-CA 3.32Å; R382-R385 WeakPolarHBondContact O-CB 3.4Å; R382-R385 PolarHBondContact O-N 3.24Å; R382-D386 IonicContact NH1-OD2 2.69Å; R382-D386 PolarHBondContact NH1-OD2 3.09Å; R382-D386 VanDerWaalsContact O-CG 3.26Å; R382-D386 PolarHBondContact O-N 3.12Å
383	L	75.1	Confident	70.5	Confident	83 Å²	83	105.7 Å²	105.7	44%	0.435	51%	0.512	S	S	.	.	H	α-helix	trans	-63.1	-31.5	178.6	-66.8	171.3	0	0	0	112.4	E379 I380 L387	E379-L383 HydrophobicContact CG-CD1 4.02Å; E379-L383 HydrophobicContact CG-CG 4.38Å; E379-L383 WeakPolarHBondContact O-CB 3.46Å; E379-L383 VanDerWaalsContact O-CG 3.3Å; E379-L383 WeakPolarHBondContact O-CG 3.08Å; E379-L383 PolarHBondContact O-N 2.89Å; I380-L383 PolarHBondContact O-N 2.8Å; L383-L387 WeakPolarHBondContact O-CB 3.47Å; L383-L387 WeakPolarHBondContact O-CG 3.4Å; L383-L387 PolarHBondContact O-N 3.16Å
384	K	76.2	Confident	69.3	Low	111 Å²	111	109.2 Å²	109.2	48%	0.483	53%	0.532	S	S	.	.	H	α-helix	trans	-64.5	-44.9	168.6	-80	169.9	179	177.5	0	112.4	I380 E381 R382 L387 A388	I380-K384 HydrophobicContact CG2-CD 4Å; I380-K384 HydrophobicContact CG2-CG 4.42Å; I380-K384 VanDerWaalsContact O-CB 3.26Å; I380-K384 WeakPolarHBondContact O-CB 3.33Å; I380-K384 WeakPolarHBondContact O-CG 3.47Å; I380-K384 PolarHBondContact O-N 2.72Å; E381-K384 WeakPolarHBondContact OE1-CD 3.5Å; E381-K384 IonicContact OE1-NZ 2.87Å; E381-K384 PolarHBondContact OE1-NZ 3.45Å; E381-K384 WeakPolarHBondContact OE2-CD 3.45Å; E381-K384 IonicContact OE2-NZ 2.8Å; R382-K384 VanDerWaalsContact C-N 3.27Å; R382-K384 PolarHBondContact O-N 3.42Å; K384-L387 PolarHBondContact O-N 3.08Å; K384-A388 VanDerWaalsContact O-CB 3.27Å; K384-A388 WeakPolarHBondContact O-CB 3.32Å; K384-A388 PolarHBondContact O-N 3.09Å
385	R	74.6	Confident	67.9	Low	148 Å²	148	107.3 Å²	107.3	56%	0.558	54%	0.544	S	S	*	.	H	α-helix	trans	-64	-44.6	175.8	-78.1	174.2	-71.7	134.6	-9.1	111.4	E381 R382 A388 A389	E381-R385 VanDerWaalsContact O-CG 3.3Å; E381-R385 WeakPolarHBondContact O-CG 3.39Å; E381-R385 PolarHBondContact O-N 3Å; E381-R385 PolarHBondContact O-NE 3.26Å; R382-R385 VanDerWaalsContact CA-NH2 3.26Å; R382-R385 WeakPolarHBondContact O-CA 3.32Å; R382-R385 WeakPolarHBondContact O-CB 3.4Å; R382-R385 PolarHBondContact O-N 3.24Å; R385-A388 PolarHBondContact O-N 3.31Å; R385-A389 WeakPolarHBondContact O-CB 3.43Å; R385-A389 PolarHBondContact O-N 3.45Å
386	D	69.2	Low	66.7	Low	69 Å²	69	109.2 Å²	109.2	37%	0.369	56%	0.562	S	S	.	*	H	α-helix	trans	-64.7	-40.6	178.1	-61.8	-12.4	0	0	0	110.8	R382 T390	R382-D386 IonicContact NH1-OD2 2.69Å; R382-D386 PolarHBondContact NH1-OD2 3.09Å; R382-D386 VanDerWaalsContact O-CG 3.26Å; R382-D386 PolarHBondContact O-N 3.12Å; D386-T390 WeakPolarHBondContact O-CB 3.48Å; D386-T390 PolarHBondContact O-N 2.9Å; D386-T390 PolarHBondContact O-OG1 3.06Å
387	L	68.2	Low	65.5	Low	120 Å²	120	113.4 Å²	113.4	63%	0.628	58%	0.579	S	S	*	*	H	α-helix	trans	-67.7	-38	172.6	-87.5	167.6	0	0	0	113.2	L383 K384 T390 R391	L383-L387 WeakPolarHBondContact O-CB 3.47Å; L383-L387 WeakPolarHBondContact O-CG 3.4Å; L383-L387 PolarHBondContact O-N 3.16Å; K384-L387 PolarHBondContact O-N 3.08Å; L387-T390 PolarHBondContact O-N 3.45Å; L387-R391 WeakPolarHBondContact O-CB 3.41Å; L387-R391 PolarHBondContact O-N 2.73Å
388	A	66.6	Low	64.2	Low	45 Å²	45	114.2 Å²	114.2	37%	0.372	58%	0.58	S	S	.	*	H	α-helix	trans	-64.4	-49.2	175.7	0	0	0	0	0	110.6	K384 R385 T390 R391 D392	K384-A388 VanDerWaalsContact O-CB 3.27Å; K384-A388 WeakPolarHBondContact O-CB 3.32Å; K384-A388 PolarHBondContact O-N 3.09Å; R385-A388 PolarHBondContact O-N 3.31Å; A388-T390 PolarHBondContact O-N 3.01Å; A388-R391 WeakPolarHBondContact O-CA 3.03Å; A388-R391 WeakPolarHBondContact O-CB 3.24Å; A388-R391 PolarHBondContact O-N 3.49Å; A388-D392 PolarHBondContact O-N 3.18Å
389	A	60.6	Low	63	Low	76 Å²	76	112.4 Å²	112.4	63%	0.628	58%	0.578	S	S	*	*	H	α-helix	trans	-59.5	-28.9	173.5	0	0	0	0	0	113.2	R385	R385-A389 WeakPolarHBondContact O-CB 3.43Å; R385-A389 PolarHBondContact O-N 3.45Å
390	T	60	Low	61.9	Low	104 Å²	104	113.3 Å²	113.3	64%	0.638	59%	0.592	S	S	*	*	H	α-helix	trans	-79.2	-24	173.4	-54.5	0	0	0	0	112.9	D386 L387 A388	D386-T390 WeakPolarHBondContact O-CB 3.48Å; D386-T390 PolarHBondContact O-N 2.9Å; D386-T390 PolarHBondContact O-OG1 3.06Å; L387-T390 PolarHBondContact O-N 3.45Å; A388-T390 PolarHBondContact O-N 3.01Å
391	R	62.3	Low	60.8	Low	213 Å²	213	116.7 Å²	116.7	80%	0.804	61%	0.606	S	S	*	*	H	α-helix	trans	-85.3	-41	178.6	-120.2	175.5	166.9	157.6	-4.3	112.4	L387 A388 K393	L387-R391 WeakPolarHBondContact O-CB 3.41Å; L387-R391 PolarHBondContact O-N 2.73Å; A388-R391 WeakPolarHBondContact O-CA 3.03Å; A388-R391 WeakPolarHBondContact O-CB 3.24Å; A388-R391 PolarHBondContact O-N 3.49Å; R391-K393 VanDerWaalsContact C-N 3.26Å; R391-K393 PolarHBondContact O-N 3.27Å
392	D	56.5	Low	59.7	Low	132 Å²	132	117.3 Å²	117.3	71%	0.706	61%	0.612	S	S	*	*	S	Bend	trans	-80.1	73.4	-178.3	-68.3	-20.2	0	0	0	110.5	A388 N394	A388-D392 PolarHBondContact O-N 3.18Å; D392-N394 PolarHBondContact O-N 3.29Å
393	K	53.6	Low	59	Low	178 Å²	178	118.9 Å²	118.9	77%	0.774	62%	0.618	S	S	*	*			trans	-65	93.5	-176.1	-67.8	179.8	179.6	-179.3	0	112.7	R391	R391-K393 VanDerWaalsContact C-N 3.26Å; R391-K393 PolarHBondContact O-N 3.27Å
394	N	48.2	Very low	58.4	Low	167 Å²	167	121.3 Å²	121.3	89%	0.893	63%	0.628	S	S	*	*	S	Bend	trans	-166.1	104.3	140.2	-97.9	-23.8	0	0	0	112.2	D392	D392-N394 PolarHBondContact O-N 3.29Å
395	G	46.8	Very low	57.9	Low	74 Å²	74	119 Å²	119	76%	0.763	63%	0.625	S	S	*	*			trans	106.3	137.5	172.6	0	0	0	0	0	114.2	Y397	G395-Y397 PolarHBondContact O-N 3.03Å
396	V	47.4	Very low	57	Low	136 Å²	136	117 Å²	117	82%	0.824	62%	0.624	S	S	*	*			trans	-84.7	106.8	170.6	177.6	0	0	0	0	107.9	L398	V396-L398 HydrophobicContact CG1-CD1 4.35Å
397	Y	49.4	Very low	56.5	Low	224 Å²	224	117.7 Å²	117.7	88%	0.878	63%	0.626	S	S	*	*			trans	-112.2	95.5	177.1	-142.1	-87.1	0	0	0	110.4	G395	G395-Y397 PolarHBondContact O-N 3.03Å
398	L	49.4	Very low	56.3	Low	87 Å²	87	116.3 Å²	116.3	46%	0.455	62%	0.622	S	S	.	*			trans	-77.4	144.3	166.6	-77.5	143	0	0	0	109.1	V396 N402	V396-L398 HydrophobicContact CG1-CD1 4.35Å; L398-N402 HydrophobicContact CD2-CB 4.33Å
399	S	54.1	Low	55.9	Low	58 Å²	58	120 Å²	120	41%	0.406	63%	0.632	S	S	.	*			trans	-66.7	144.7	168.3	54	0	0	0	0	110.6	E401 N402 Y403	S399-E401 VanDerWaalsContact C-N 3.3Å; S399-E401 PolarHBondContact O-N 3.46Å; S399-N402 WeakPolarHBondContact O-CB 3.43Å; S399-N402 PolarHBondContact O-N 3.35Å; S399-N402 PolarHBondContact OG-ND2 3.22Å; S399-Y403 PolarHBondContact O-N 2.91Å; S399-Y403 VanDerWaalsContact O-N 3.16Å
400	S	50.6	Low	56.1	Low	88 Å²	88	119.7 Å²	119.7	62%	0.615	62%	0.619	S	S	*	*	H	α-helix	trans	-55.3	-41.3	-172.5	-50	0	0	0	0	113.5	N402 Y403 E404	S400-N402 VanDerWaalsContact C-N 3.29Å; S400-N402 PolarHBondContact O-N 2.87Å; S400-Y403 WeakPolarHBondContact O-CB 3.35Å; S400-Y403 PolarHBondContact O-N 2.89Å; S400-E404 PolarHBondContact O-N 3.48Å
401	E	54.6	Low	56.4	Low	159 Å²	159	118.3 Å²	118.3	74%	0.743	61%	0.61	S	S	*	*	H	α-helix	trans	-58.1	-38.6	176.5	-63	177.5	121	0	0	112.7	S399 S405	S399-E401 VanDerWaalsContact C-N 3.3Å; S399-E401 PolarHBondContact O-N 3.46Å; E401-S405 VanDerWaalsContact O-CB 3.31Å; E401-S405 WeakPolarHBondContact O-CB 3.38Å; E401-S405 PolarHBondContact O-N 2.86Å
402	N	54.5	Low	56.4	Low	96 Å²	96	110.6 Å²	110.6	51%	0.513	59%	0.592	S	S	.	*	H	α-helix	trans	-74.2	-29.1	177.7	-77.1	-40.2	0	0	0	112.1	L398 S399 S400 M406	L398-N402 HydrophobicContact CD2-CB 4.33Å; S399-N402 WeakPolarHBondContact O-CB 3.43Å; S399-N402 PolarHBondContact O-N 3.35Å; S399-N402 PolarHBondContact OG-ND2 3.22Å; S400-N402 VanDerWaalsContact C-N 3.29Å; S400-N402 PolarHBondContact O-N 2.87Å; N402-M406 WeakPolarHBondContact O-CB 3.37Å; N402-M406 PolarHBondContact O-N 2.68Å
403	Y	60.9	Low	56.4	Low	128 Å²	128	110 Å²	110	50%	0.502	59%	0.586	S	S	.	*	H	α-helix	trans	-72.2	-45.3	175.3	-174.4	-97.2	0	0	0	111.6	S399 S400 M406 M407	S399-Y403 PolarHBondContact O-N 2.91Å; S399-Y403 VanDerWaalsContact O-N 3.16Å; S400-Y403 WeakPolarHBondContact O-CB 3.35Å; S400-Y403 PolarHBondContact O-N 2.89Å; Y403-M406 PolarHBondContact O-N 3.1Å; Y403-M406 VanDerWaalsContact O-N 3.14Å; Y403-M407 HydrophobicContact CE1-CE 4.48Å; Y403-M407 HydrophobicContact CE1-CG 4.17Å; Y403-M407 HydrophobicContact CE2-CE 4.31Å; Y403-M407 PolarHBondContact O-N 2.79Å; Y403-M407 WeakPolarHBondContact OH-CE 3.48Å
404	E	63.2	Low	56.6	Low	134 Å²	134	107.2 Å²	107.2	63%	0.626	58%	0.575	S	S	*	*	H	α-helix	trans	-64.1	-41	176	-69.1	178.5	168.3	0	0	112	S400 M406 M407 T408	S400-E404 PolarHBondContact O-N 3.48Å; E404-M406 PolarHBondContact O-N 3.27Å; E404-M407 PolarHBondContact O-N 3.25Å; E404-T408 PolarHBondContact O-N 3.15Å; E404-T408 VanDerWaalsContact O-N 3.13Å; E404-T408 PolarHBondContact O-OG1 2.83Å
405	S	64.1	Low	57.2	Low	62 Å²	62	106.3 Å²	106.3	43%	0.434	57%	0.566	S	S	.	*	H	α-helix	trans	-67.4	-19.6	174	-176.4	0	0	0	0	113.8	E401 T408	E401-S405 VanDerWaalsContact O-CB 3.31Å; E401-S405 WeakPolarHBondContact O-CB 3.38Å; E401-S405 PolarHBondContact O-N 2.86Å; S405-T408 WeakPolarHBondContact CA-OG1 2.9Å; S405-T408 PolarHBondContact O-OG1 3.21Å
406	M	56.6	Low	57.6	Low	107 Å²	107	109.4 Å²	109.4	53%	0.527	56%	0.56	S	S	.	*	H	α-helix	trans	-86.5	-43.3	175	-175.4	166.4	-74.8	0	0	111.1	N402 Y403 E404 T408 Q409 I410	N402-M406 WeakPolarHBondContact O-CB 3.37Å; N402-M406 PolarHBondContact O-N 2.68Å; Y403-M406 PolarHBondContact O-N 3.1Å; Y403-M406 VanDerWaalsContact O-N 3.14Å; E404-M406 PolarHBondContact O-N 3.27Å; M406-T408 VanDerWaalsContact C-N 3.31Å; M406-T408 PolarHBondContact O-N 2.89Å; M406-Q409 PolarHBondContact O-N 2.7Å; M406-I410 HydrophobicContact CG-CD1 4.32Å; M406-I410 PolarHBondContact O-N 2.95Å
407	M	59.1	Low	58.2	Low	83 Å²	83	107.4 Å²	107.4	41%	0.409	54%	0.544	S	S	.	.	H	α-helix	trans	-61.8	-37.5	176.8	-78.7	-65	177	0	0	112.8	Y403 E404 Q409 I410 T411	Y403-M407 HydrophobicContact CE1-CE 4.48Å; Y403-M407 HydrophobicContact CE1-CG 4.17Å; Y403-M407 HydrophobicContact CE2-CE 4.31Å; Y403-M407 PolarHBondContact O-N 2.79Å; Y403-M407 WeakPolarHBondContact OH-CE 3.48Å; E404-M407 PolarHBondContact O-N 3.25Å; M407-Q409 PolarHBondContact O-N 2.7Å; M407-I410 PolarHBondContact O-N 3.47Å; M407-I410 VanDerWaalsContact O-N 3.14Å; M407-I410 HydrophobicContact SD-CD1 4.05Å; M407-T411 PolarHBondContact O-N 3.29Å; M407-T411 VanDerWaalsContact O-N 3.16Å; M407-T411 PolarHBondContact O-OG1 2.87Å
408	T	64.4	Low	58.8	Low	91 Å²	91	99.6 Å²	99.6	56%	0.558	53%	0.525	S	S	*	.	H	α-helix	trans	-68.2	-13	174	41.3	0	0	0	0	114.6	E404 S405 M406	E404-T408 PolarHBondContact O-N 3.15Å; E404-T408 VanDerWaalsContact O-N 3.13Å; E404-T408 PolarHBondContact O-OG1 2.83Å; S405-T408 WeakPolarHBondContact CA-OG1 2.9Å; S405-T408 PolarHBondContact O-OG1 3.21Å; M406-T408 VanDerWaalsContact C-N 3.31Å; M406-T408 PolarHBondContact O-N 2.89Å
409	Q	57.8	Low	59.4	Low	123 Å²	123	102 Å²	102	58%	0.575	54%	0.536	S	S	*	.	H	α-helix	trans	-91.2	-28.1	169.5	-68	-178.1	22.7	0	0	112.6	M406 M407 Q413	M406-Q409 PolarHBondContact O-N 2.7Å; M407-Q409 PolarHBondContact O-N 2.7Å; Q409-Q413 WeakPolarHBondContact O-CG 3.29Å; Q409-Q413 PolarHBondContact O-N 3.03Å
410	I	65.1	Low	59.5	Low	69 Å²	69	105.7 Å²	105.7	35%	0.354	55%	0.548	S	S	.	.	H	α-helix	trans	-70.2	-48.8	177.7	-67.7	167.8	0	0	0	110.1	M406 M407 A412 Q413 E414	M406-I410 HydrophobicContact CG-CD1 4.32Å; M406-I410 PolarHBondContact O-N 2.95Å; M407-I410 PolarHBondContact O-N 3.47Å; M407-I410 VanDerWaalsContact O-N 3.14Å; M407-I410 HydrophobicContact SD-CD1 4.05Å; I410-A412 VanDerWaalsContact C-N 3.27Å; I410-A412 PolarHBondContact O-N 3.1Å; I410-Q413 WeakPolarHBondContact O-CA 3.26Å; I410-Q413 WeakPolarHBondContact O-CB 3.49Å; I410-Q413 PolarHBondContact O-N 3.24Å; I410-E414 PolarHBondContact O-N 3.38Å; I410-E414 VanDerWaalsContact O-N 3.09Å
411	T	64.9	Low	59.9	Low	75 Å²	75	107.8 Å²	107.8	46%	0.46	55%	0.548	S	S	.	.	H	α-helix	trans	-59.8	-37.8	178.4	54.5	0	0	0	0	112.6	M407 Q413 E414 E415	M407-T411 PolarHBondContact O-N 3.29Å; M407-T411 VanDerWaalsContact O-N 3.16Å; M407-T411 PolarHBondContact O-OG1 2.87Å; T411-Q413 PolarHBondContact O-N 3.04Å; T411-E414 PolarHBondContact O-N 3Å; T411-E415 PolarHBondContact O-N 2.66Å
412	A	62.7	Low	60.4	Low	51 Å²	51	106.4 Å²	106.4	42%	0.421	54%	0.542	S	S	.	.	H	α-helix	trans	-68.6	-16.1	175.4	0	0	0	0	0	114.2	I410	I410-A412 VanDerWaalsContact C-N 3.27Å; I410-A412 PolarHBondContact O-N 3.1Å
413	Q	57.5	Low	60.8	Low	121 Å²	121	107.3 Å²	107.3	57%	0.565	54%	0.543	S	S	*	.	H	α-helix	trans	-89.7	-34.2	171.6	-71.5	177.9	7.1	0	0	111.8	Q409 I410 T411 E415 Q416 I417	Q409-Q413 WeakPolarHBondContact O-CG 3.29Å; Q409-Q413 PolarHBondContact O-N 3.03Å; I410-Q413 WeakPolarHBondContact O-CA 3.26Å; I410-Q413 WeakPolarHBondContact O-CB 3.49Å; I410-Q413 PolarHBondContact O-N 3.24Å; T411-Q413 PolarHBondContact O-N 3.04Å; Q413-E415 VanDerWaalsContact C-N 3.33Å; Q413-E415 PolarHBondContact O-N 2.92Å; Q413-Q416 PolarHBondContact O-N 3.16Å; Q413-Q416 VanDerWaalsContact O-N 3.13Å; Q413-I417 WeakPolarHBondContact O-CG1 3.44Å; Q413-I417 PolarHBondContact O-N 2.79Å
414	E	57.5	Low	60.5	Low	119 Å²	119	107.3 Å²	107.3	56%	0.556	55%	0.551	S	S	*	*	H	α-helix	trans	-61.1	-40.3	175.2	-67.2	175.1	145.7	0	0	111.7	I410 T411 Q416 I417 A418	I410-E414 PolarHBondContact O-N 3.38Å; I410-E414 VanDerWaalsContact O-N 3.09Å; T411-E414 PolarHBondContact O-N 3Å; E414-Q416 VanDerWaalsContact C-N 3.28Å; E414-Q416 PolarHBondContact O-N 3.13Å; E414-I417 PolarHBondContact O-N 3.37Å; E414-A418 PolarHBondContact O-N 3.4Å
415	E	61.1	Low	60.7	Low	148 Å²	148	108.3 Å²	108.3	69%	0.692	55%	0.554	S	S	*	*	H	α-helix	trans	-60.6	-32.8	173.7	-69.5	-173.5	152.2	0	0	113.5	T411 Q413	T411-E415 PolarHBondContact O-N 2.66Å; Q413-E415 VanDerWaalsContact C-N 3.33Å; Q413-E415 PolarHBondContact O-N 2.92Å
416	Q	55.1	Low	60.9	Low	138 Å²	138	110.8 Å²	110.8	65%	0.645	56%	0.556	S	S	*	*	H	α-helix	trans	-75.4	-31.1	176.6	-68.8	-163.9	-22.6	0	0	112.9	Q413 E414	Q413-Q416 PolarHBondContact O-N 3.16Å; Q413-Q416 VanDerWaalsContact O-N 3.13Å; E414-Q416 VanDerWaalsContact C-N 3.28Å; E414-Q416 PolarHBondContact O-N 3.13Å
417	I	59.8	Low	61.3	Low	95 Å²	95	110.1 Å²	110.1	49%	0.487	56%	0.558	S	S	.	*	H	α-helix	trans	-68.7	-43.4	177.2	-66.5	167.4	0	0	0	110	Q413 E414 M419 M420 E421	Q413-I417 WeakPolarHBondContact O-CG1 3.44Å; Q413-I417 PolarHBondContact O-N 2.79Å; E414-I417 PolarHBondContact O-N 3.37Å; I417-M419 VanDerWaalsContact C-N 3.33Å; I417-M419 PolarHBondContact O-N 3.49Å; I417-M420 PolarHBondContact O-N 3.5Å; I417-E421 PolarHBondContact O-N 2.89Å
418	A	61.8	Low	61.5	Low	59 Å²	59	111 Å²	111	49%	0.488	57%	0.565	S	S	.	*	H	α-helix	trans	-56	-41.4	-178.9	0	0	0	0	0	113.6	E414 M420 E421	E414-A418 PolarHBondContact O-N 3.4Å; A418-M420 PolarHBondContact O-N 3.49Å; A418-E421 PolarHBondContact O-N 2.87Å
419	M	62.2	Low	61.7	Low	138 Å²	138	111.4 Å²	111.4	68%	0.68	56%	0.563	S	S	*	*	H	α-helix	trans	-65.6	-26	176.4	-68.4	-159.9	-59.7	0	0	113.4	I417	I417-M419 VanDerWaalsContact C-N 3.33Å; I417-M419 PolarHBondContact O-N 3.49Å
420	M	56	Low	62.3	Low	135 Å²	135	109 Å²	109	67%	0.665	55%	0.554	S	S	*	*	H	α-helix	trans	-85.3	-22.5	-177.1	-165.8	156.5	54.6	0	0	112.7	I417 A418	I417-M420 PolarHBondContact O-N 3.5Å; A418-M420 PolarHBondContact O-N 3.49Å
421	E	59.4	Low	62.3	Low	132 Å²	132	111 Å²	111	62%	0.617	56%	0.56	S	S	*	*	H	α-helix	trans	-70.8	-30.7	171.2	-62.6	-167.5	142.4	0	0	112.6	I417 A418 L424 K425	I417-E421 PolarHBondContact O-N 2.89Å; A418-E421 PolarHBondContact O-N 2.87Å; E421-L424 WeakPolarHBondContact O-CB 3.48Å; E421-L424 PolarHBondContact O-N 3.49Å; E421-K425 PolarHBondContact O-N 3.21Å
422	E	65.7	Low	62.5	Low	131 Å²	131	112.8 Å²	112.8	61%	0.612	57%	0.566	S	S	*	*	H	α-helix	trans	-69.5	-35.1	-179.5	-169.5	170.6	-146.3	0	0	112.9
423	E	61.5	Low	62.9	Low	114 Å²	114	112.7 Å²	112.7	53%	0.533	56%	0.559	S	S	.	*	H	α-helix	trans	-62.7	-43.1	170.2	-77.4	-74.2	94.2	0	0	111.8	K425 K426	E423-K425 PolarHBondContact O-N 2.97Å; E423-K426 PolarHBondContact O-N 3.44Å; E423-K426 IonicContact OE1-NZ 2.64Å; E423-K426 PolarHBondContact OE1-NZ 3.2Å
424	L	54.8	Low	63	Low	128 Å²	128	109 Å²	109	67%	0.67	55%	0.547	S	S	*	.	H	α-helix	trans	-61.4	-34.6	-178.1	-126.2	167.3	0	0	0	112.1	E421 V427	E421-L424 WeakPolarHBondContact O-CB 3.48Å; E421-L424 PolarHBondContact O-N 3.49Å; L424-V427 PolarHBondContact O-N 3.33Å
425	K	66.9	Low	63.4	Low	156 Å²	156	109.8 Å²	109.8	68%	0.678	55%	0.548	S	S	*	.	H	α-helix	trans	-62.2	-43.5	179	-141.9	169.4	-171.1	171.2	0	112.5	E421 E423 V427 N428	E421-K425 PolarHBondContact O-N 3.21Å; E423-K425 PolarHBondContact O-N 2.97Å; K425-V427 VanDerWaalsContact C-N 3.25Å; K425-V427 PolarHBondContact O-N 2.88Å; K425-N428 WeakPolarHBondContact O-CB 3.43Å; K425-N428 PolarHBondContact O-N 3.21Å; K425-N428 VanDerWaalsContact O-N 3.16Å
426	K	69.5	Low	63.7	Low	113 Å²	113	106.3 Å²	106.3	49%	0.491	54%	0.54	S	S	.	.	H	α-helix	trans	-60.9	-32.6	-179.8	-59.7	168.9	-166.6	166.2	0	112.6	E423	E423-K426 PolarHBondContact O-N 3.44Å; E423-K426 IonicContact OE1-NZ 2.64Å; E423-K426 PolarHBondContact OE1-NZ 3.2Å
427	V	64.9	Low	64.4	Low	94 Å²	94	106.7 Å²	106.7	57%	0.57	54%	0.536	S	S	*	.	H	α-helix	trans	-71.6	-32.5	-180	-178.2	0	0	0	0	111.7	L424 K425	L424-V427 PolarHBondContact O-N 3.33Å; K425-V427 VanDerWaalsContact C-N 3.25Å; K425-V427 PolarHBondContact O-N 2.88Å
428	N	64.2	Low	64.5	Low	102 Å²	102	108.8 Å²	108.8	55%	0.545	55%	0.547	S	S	.	.	H	α-helix	trans	-69.4	-41.4	-178.8	-177	72.5	0	0	0	112.8	K425 L430 F431 L432	K425-N428 WeakPolarHBondContact O-CB 3.43Å; K425-N428 PolarHBondContact O-N 3.21Å; K425-N428 VanDerWaalsContact O-N 3.16Å; N428-L430 VanDerWaalsContact C-N 3.26Å; N428-L430 PolarHBondContact O-N 3.34Å; N428-F431 VanDerWaalsContact O-CB 3.28Å; N428-F431 WeakPolarHBondContact O-CB 3.24Å; N428-F431 PolarHBondContact O-N 2.79Å; N428-L432 PolarHBondContact O-N 3.16Å
429	D	68	Low	64.7	Low	98 Å²	98	111 Å²	111	52%	0.524	55%	0.548	S	S	.	.	H	α-helix	trans	-65.9	-30.5	-178.6	-63.7	-22	0	0	0	112.3	F431 L432	D429-F431 PolarHBondContact O-N 3.3Å; D429-L432 PolarHBondContact O-N 2.75Å
430	L	70.4	Confident	65	Low	73 Å²	73	111.3 Å²	111.3	38%	0.382	55%	0.547	S	S	.	.	H	α-helix	trans	-65.4	-18.4	171.8	-64.9	171.8	0	0	0	113.2	N428 R1025 K1027	N428-L430 VanDerWaalsContact C-N 3.26Å; N428-L430 PolarHBondContact O-N 3.34Å; L430-R1025 VanDerWaalsContact O-CD 3.27Å; L430-R1025 WeakPolarHBondContact O-CD 3.46Å; L430-R1025 PolarHBondContact O-NH1 3.36Å; L430-K1027 HydrophobicContact CD2-CB 4.17Å; L430-K1027 HydrophobicContact CD2-CD 3.53Å; L430-K1027 HydrophobicContact CD2-CG 4.45Å
431	F	64.6	Low	65.2	Low	111 Å²	111	109.6 Å²	109.6	49%	0.487	55%	0.547	S	S	.	.	H	α-helix	trans	-86.4	-35.8	178.7	-134.1	-88	0	0	0	112.2	N428 D429 S434 S1024	N428-F431 VanDerWaalsContact O-CB 3.28Å; N428-F431 WeakPolarHBondContact O-CB 3.24Å; N428-F431 PolarHBondContact O-N 2.79Å; D429-F431 PolarHBondContact O-N 3.3Å; F431-S434 WeakPolarHBondContact O-CA 3.47Å; F431-S434 WeakPolarHBondContact O-CB 3.04Å; F431-S434 PolarHBondContact O-N 2.95Å; F431-S1024 WeakPolarHBondContact CE2-OG 3.28Å; F431-S1024 WeakPolarHBondContact CZ-OG 3.48Å
432	L	68.9	Low	65.4	Low	112 Å²	112	107.1 Å²	107.1	59%	0.586	54%	0.544	S	S	*	.	H	α-helix	trans	-62.3	-43.7	178.9	-78	163.1	0	0	0	112.7	N428 D429 S434 K435	N428-L432 PolarHBondContact O-N 3.16Å; D429-L432 PolarHBondContact O-N 2.75Å; L432-S434 PolarHBondContact O-N 3.32Å; L432-K435 PolarHBondContact O-N 3.43Å
433	D	70.6	Confident	65.5	Low	50 Å²	50	107.7 Å²	107.7	27%	0.267	55%	0.549	S	S	.	.	H	α-helix	trans	-63.5	-7.3	172.2	158.6	81.5	0	0	0	113.5	R437 R1025 K1027	D433-R437 PolarHBondContact O-NE 3.46Å; D433-R437 IonicContact OD1-CZ 2.7Å; D433-R437 IonicContact OD1-NE 3.81Å; D433-R437 PolarHBondContact OD1-NE 3.3Å; D433-R437 IonicContact OD1-NH2 3.4Å; D433-R437 PolarHBondContact OD1-NH2 2.93Å; D433-R437 IonicContact OD2-NH2 3.98Å; D433-R1025 PolarHBondContact O-NH2 3.07Å; D433-R1025 VanDerWaalsContact O-NH2 3.1Å; D433-R1025 IonicContact OD2-CZ 3.05Å; D433-R1025 VanDerWaalsContact OD2-CZ 3.25Å; D433-R1025 IonicContact OD2-NH1 2.69Å; D433-R1025 PolarHBondContact OD2-NH1 3.2Å; D433-R1025 IonicContact OD2-NH2 2.97Å; D433-R1025 PolarHBondContact OD2-NH2 3.4Å; D433-K1027 VanDerWaalsContact CG-NZ 3.32Å; D433-K1027 IonicContact OD1-NZ 3Å; D433-K1027 VanDerWaalsContact OD2-CE 3.25Å; D433-K1027 WeakPolarHBondContact OD2-CE 3.42Å; D433-K1027 IonicContact OD2-NZ 2.71Å; D433-K1027 PolarHBondContact OD2-NZ 3.04Å
434	S	60.1	Low	65.6	Low	44 Å²	44	108.2 Å²	108.2	31%	0.308	56%	0.555	S	S	.	*	H	α-helix	trans	-84.9	-24.1	169.9	-146	0	0	0	0	114.1	F431 L432 R1025	F431-S434 WeakPolarHBondContact O-CA 3.47Å; F431-S434 WeakPolarHBondContact O-CB 3.04Å; F431-S434 PolarHBondContact O-N 2.95Å; L432-S434 PolarHBondContact O-N 3.32Å; S434-R1025 PolarHBondContact OG-NE 3.07Å
435	K	66.3	Low	66	Low	135 Å²	135	108.2 Å²	108.2	59%	0.587	56%	0.555	S	S	*	*	H	α-helix	trans	-81.2	-48.9	-174.5	-170.7	-174.7	174.7	-162.1	0	111.7	L432 R437 L438 E439	L432-K435 PolarHBondContact O-N 3.43Å; K435-R437 PolarHBondContact O-N 2.76Å; K435-R437 VanDerWaalsContact O-N 3.15Å; K435-L438 WeakPolarHBondContact O-CB 3.15Å; K435-L438 PolarHBondContact O-N 3.11Å; K435-E439 VanDerWaalsContact CE-OE1 3.27Å; K435-E439 WeakPolarHBondContact CE-OE1 3.45Å; K435-E439 IonicContact NZ-OE1 3.65Å
436	S	67.6	Low	65.9	Low	74 Å²	74	106.6 Å²	106.6	52%	0.517	55%	0.554	S	S	.	*	H	α-helix	trans	-55.5	-34.4	-177.8	169.3	0	0	0	0	113.7	L438 E439	S436-L438 PolarHBondContact O-N 2.9Å; S436-E439 PolarHBondContact O-N 3.29Å
437	R	68.8	Low	65.9	Low	146 Å²	146	105.4 Å²	105.4	55%	0.551	55%	0.55	S	S	*	*	H	α-helix	trans	-70.1	-17.3	178.3	-58.6	-174.3	-165.9	-146.4	-3.4	114.2	D433 K435	D433-R437 PolarHBondContact O-NE 3.46Å; D433-R437 IonicContact OD1-CZ 2.7Å; D433-R437 IonicContact OD1-NE 3.81Å; D433-R437 PolarHBondContact OD1-NE 3.3Å; D433-R437 IonicContact OD1-NH2 3.4Å; D433-R437 PolarHBondContact OD1-NH2 2.93Å; D433-R437 IonicContact OD2-NH2 3.98Å; K435-R437 PolarHBondContact O-N 2.76Å; K435-R437 VanDerWaalsContact O-N 3.15Å
438	L	62.4	Low	66	Low	139 Å²	139	107 Å²	107	73%	0.728	55%	0.549	S	S	*	.	H	α-helix	trans	-84.5	-36.5	179.9	-160.4	74.3	0	0	0	111.5	K435 S436 Q440 C441	K435-L438 WeakPolarHBondContact O-CB 3.15Å; K435-L438 PolarHBondContact O-N 3.11Å; S436-L438 PolarHBondContact O-N 2.9Å; L438-Q440 VanDerWaalsContact C-N 3.31Å; L438-Q440 PolarHBondContact O-N 3.21Å; L438-C441 PolarHBondContact O-N 3.09Å
439	E	66.3	Low	65.7	Low	107 Å²	107	109.5 Å²	109.5	50%	0.5	56%	0.558	S	S	.	*	H	α-helix	trans	-65	-36	179.4	-69.2	156.3	175.7	0	0	111	K435 S436 C441 S442	K435-E439 VanDerWaalsContact CE-OE1 3.27Å; K435-E439 WeakPolarHBondContact CE-OE1 3.45Å; K435-E439 IonicContact NZ-OE1 3.65Å; S436-E439 PolarHBondContact O-N 3.29Å; E439-C441 VanDerWaalsContact C-N 3.32Å; E439-C441 PolarHBondContact O-N 3.48Å; E439-S442 WeakPolarHBondContact O-CB 3.38Å; E439-S442 PolarHBondContact O-N 2.93Å; E439-S442 VanDerWaalsContact O-N 3.11Å
440	Q	68.8	Low	65.4	Low	144 Å²	144	111.9 Å²	111.9	67%	0.673	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-63.7	-30.4	179.6	-163.1	169.9	16.3	0	0	114	L438 S442	L438-Q440 VanDerWaalsContact C-N 3.31Å; L438-Q440 PolarHBondContact O-N 3.21Å; Q440-S442 VanDerWaalsContact C-N 3.25Å; Q440-S442 PolarHBondContact O-N 2.92Å
441	C	60.2	Low	65.1	Low	98 Å²	98	116.2 Å²	116.2	66%	0.662	58%	0.577	S	S	*	*	G	3₁₀ helix	trans	-75.5	-9.3	176.2	-72.5	0	0	0	0	114	L438 E439	L438-C441 PolarHBondContact O-N 3.09Å; E439-C441 VanDerWaalsContact C-N 3.32Å; E439-C441 PolarHBondContact O-N 3.48Å
442	S	63.6	Low	64.7	Low	80 Å²	80	117.3 Å²	117.3	56%	0.559	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-78.6	-23.4	179.3	-163.2	0	0	0	0	113.1	E439 Q440	E439-S442 WeakPolarHBondContact O-CB 3.38Å; E439-S442 PolarHBondContact O-N 2.93Å; E439-S442 VanDerWaalsContact O-N 3.11Å; Q440-S442 VanDerWaalsContact C-N 3.25Å; Q440-S442 PolarHBondContact O-N 2.92Å
443	M	67.4	Low	64.4	Low	143 Å²	143	119.2 Å²	119.2	70%	0.704	59%	0.594	S	S	*	*	S	Bend	trans	-84.2	-27.2	-170.6	-62.2	177.7	65.9	0	0	113.5	L445	M443-L445 PolarHBondContact O-N 3.29Å
444	D	64.1	Low	63.9	Low	125 Å²	125	124.7 Å²	124.7	67%	0.668	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	-15.9	-179	-86.7	8.1	0	0	0	113.9
445	L	62.8	Low	63.8	Low	128 Å²	128	127.6 Å²	127.6	67%	0.67	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	-42.2	-178.9	-86.9	166.1	0	0	0	112.7	M443 E447 K448	M443-L445 PolarHBondContact O-N 3.29Å; L445-E447 VanDerWaalsContact C-N 3.31Å; L445-E447 PolarHBondContact O-N 3.45Å; L445-K448 PolarHBondContact O-N 3.02Å
446	D	64.1	Low	63.4	Low	123 Å²	123	125.3 Å²	125.3	66%	0.658	64%	0.635	S	S	*	*	H	α-helix	trans	-66.1	-32.9	-175.2	-66.7	-32.9	0	0	0	112.3	K448 Q449	D446-K448 PolarHBondContact O-N 3.02Å; D446-K448 VanDerWaalsContact O-N 3.11Å; D446-Q449 PolarHBondContact O-N 3.37Å; D446-Q449 VanDerWaalsContact O-N 3.17Å
447	E	70.6	Confident	63.1	Low	87 Å²	87	132.1 Å²	132.1	41%	0.407	65%	0.649	S	S	.	*	H	α-helix	trans	-64.5	-15.6	179.6	-161.1	-108.7	146	0	0	113.6	L445 R451	L445-E447 VanDerWaalsContact C-N 3.31Å; L445-E447 PolarHBondContact O-N 3.45Å; E447-R451 IonicContact OE1-CZ 3.56Å; E447-R451 IonicContact OE1-NE 3.75Å; E447-R451 IonicContact OE1-NH2 2.74Å; E447-R451 PolarHBondContact OE1-NH2 2.89Å
448	K	66.1	Low	62.6	Low	127 Å²	127	132.7 Å²	132.7	55%	0.552	66%	0.657	S	S	*	*	H	α-helix	trans	-89.5	-21	177.9	-54.7	-48.2	177	-151.8	0	113.6	L445 D446	L445-K448 PolarHBondContact O-N 3.02Å; D446-K448 PolarHBondContact O-N 3.02Å; D446-K448 VanDerWaalsContact O-N 3.11Å
449	Q	57.6	Low	62.3	Low	155 Å²	155	132.8 Å²	132.8	72%	0.724	66%	0.658	S	S	*	*	H	α-helix	trans	-69.2	-42.6	-175.8	-157.3	77.3	-5.3	0	0	111.9	D446 R451	D446-Q449 PolarHBondContact O-N 3.37Å; D446-Q449 VanDerWaalsContact O-N 3.17Å; Q449-R451 VanDerWaalsContact C-N 3.34Å; Q449-R451 PolarHBondContact O-N 3.21Å
450	Q	61.4	Low	61.9	Low	149 Å²	149	134.8 Å²	134.8	70%	0.696	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-66.3	-26.4	-172.7	-72.6	-174	-36	0	0	115	L452	Q450-L452 PolarHBondContact O-N 3.39Å; Q450-L452 VanDerWaalsContact O-N 3.16Å
451	R	64.1	Low	61.3	Low	163 Å²	163	136.1 Å²	136.1	62%	0.615	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-74.9	-4.1	-171.9	-60.1	-171.1	-173.2	-153.7	1.8	114.5	E447 Q449	E447-R451 IonicContact OE1-CZ 3.56Å; E447-R451 IonicContact OE1-NE 3.75Å; E447-R451 IonicContact OE1-NH2 2.74Å; E447-R451 PolarHBondContact OE1-NH2 2.89Å; Q449-R451 VanDerWaalsContact C-N 3.34Å; Q449-R451 PolarHBondContact O-N 3.21Å
452	L	57	Low	61	Low	135 Å²	135	136.1 Å²	136.1	71%	0.707	67%	0.668	S	S	*	*	G	3₁₀ helix	trans	-83.9	-36.8	-178.4	-162.9	66.5	0	0	0	112.2	Q450 E454 T455	Q450-L452 PolarHBondContact O-N 3.39Å; Q450-L452 VanDerWaalsContact O-N 3.16Å; L452-E454 PolarHBondContact O-N 3.36Å; L452-T455 PolarHBondContact O-N 3.18Å; L452-T455 PolarHBondContact O-OG1 3.49Å
453	E	62.6	Low	60.6	Low	152 Å²	152	139.6 Å²	139.6	71%	0.71	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-69.9	-34.4	-166.9	-61.3	-177.8	149.5	0	0	113.2	T455 S456	E453-T455 PolarHBondContact O-N 2.86Å; E453-T455 VanDerWaalsContact O-N 3.16Å; E453-S456 PolarHBondContact O-N 2.78Å; E453-S456 PolarHBondContact O-OG 2.89Å
454	E	60.6	Low	60.1	Low	165 Å²	165	140.5 Å²	140.5	77%	0.771	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-61.4	-25.7	-177.8	-61.9	-169.3	127.5	0	0	113.9	L452	L452-E454 PolarHBondContact O-N 3.36Å
455	T	58.6	Low	59.7	Low	105 Å²	105	142.7 Å²	142.7	64%	0.644	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-76.2	-23.5	-172.3	63.3	0	0	0	0	114.1	L452 E453	L452-T455 PolarHBondContact O-N 3.18Å; L452-T455 PolarHBondContact O-OG1 3.49Å; E453-T455 PolarHBondContact O-N 2.86Å; E453-T455 VanDerWaalsContact O-N 3.16Å
456	S	56.7	Low	59.4	Low	87 Å²	87	142 Å²	142	61%	0.608	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-65.3	-40.2	-177.8	59.6	0	0	0	0	112.9	E453 H458	E453-S456 PolarHBondContact O-N 2.78Å; E453-S456 PolarHBondContact O-OG 2.89Å; S456-H458 PolarHBondContact O-N 2.86Å
457	R	60.9	Low	59.1	Low	216 Å²	216	141 Å²	141	82%	0.815	67%	0.674	S	S	*	*	G	3₁₀ helix	trans	-71.5	1.9	-167.2	-148.4	176.6	78.7	136.7	-1.9	115.2
458	H	58.7	Low	58.4	Low	158 Å²	158	144.9 Å²	144.9	73%	0.731	69%	0.692	S	S	*	*	G	3₁₀ helix	trans	-100.2	-12.1	-174.8	-140.3	-60.5	0	0	0	114.2	S456	S456-H458 PolarHBondContact O-N 2.86Å
459	L	55.4	Low	58	Low	141 Å²	141	143.1 Å²	143.1	74%	0.738	69%	0.686	S	S	*	*	S	Bend	trans	-77.9	-31.7	-173.7	-170.1	68	0	0	0	113.8	T462	L459-T462 PolarHBondContact O-N 2.97Å; L459-T462 PolarHBondContact O-OG1 2.68Å
460	E	58.6	Low	58	Low	150 Å²	150	141.2 Å²	141.2	70%	0.701	68%	0.677	S	S	*	*	G	3₁₀ helix	trans	-71.5	-39.7	-162.9	-162	160.1	-135	0	0	113.6	T462 K463	E460-T462 PolarHBondContact O-N 3.22Å; E460-K463 PolarHBondContact O-N 3Å
461	K	56.8	Low	57.8	Low	171 Å²	171	140 Å²	140	74%	0.743	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-64.4	1.1	179.6	-66.8	-172.2	174.4	-174.2	0	115.4
462	T	54.1	Low	57.6	Low	99 Å²	99	133.5 Å²	133.5	61%	0.607	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-100.9	-15.3	-177.6	-5.5	0	0	0	0	113.4	L459 E460	L459-T462 PolarHBondContact O-N 2.97Å; L459-T462 PolarHBondContact O-OG1 2.68Å; E460-T462 PolarHBondContact O-N 3.22Å
463	K	55.1	Low	57.7	Low	153 Å²	153	130.1 Å²	130.1	67%	0.665	63%	0.634	S	S	*	*	S	Bend	trans	-71.2	-39.3	179.7	-71.6	-177.4	176.1	177.7	0	113	E460 K465 L466	E460-K463 PolarHBondContact O-N 3Å; K463-K465 VanDerWaalsContact C-N 3.25Å; K463-K465 PolarHBondContact O-N 3.48Å; K463-K465 VanDerWaalsContact O-N 3.15Å; K463-L466 WeakPolarHBondContact O-CB 3.18Å; K463-L466 PolarHBondContact O-N 3.29Å
464	E	55.7	Low	57.6	Low	162 Å²	162	126 Å²	126	76%	0.757	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.8	-26.7	-170.6	-61.7	175.7	137.9	0	0	114.4	L466	E464-L466 VanDerWaalsContact C-N 3.33Å; E464-L466 PolarHBondContact O-N 3.19Å
465	K	55.7	Low	57.5	Low	171 Å²	171	122.8 Å²	122.8	74%	0.743	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	-2.8	-177.3	-65.4	-171.7	176.7	-173.9	0	114.8	K463	K463-K465 VanDerWaalsContact C-N 3.25Å; K463-K465 PolarHBondContact O-N 3.48Å; K463-K465 VanDerWaalsContact O-N 3.15Å
466	L	56.2	Low	57.5	Low	114 Å²	114	120.8 Å²	120.8	60%	0.597	59%	0.591	S	S	*	*	S	Bend	trans	-78	-40.6	-174.1	-168	64.9	0	0	0	112.1	K463 E464 E468 E469	K463-L466 WeakPolarHBondContact O-CB 3.18Å; K463-L466 PolarHBondContact O-N 3.29Å; E464-L466 VanDerWaalsContact C-N 3.33Å; E464-L466 PolarHBondContact O-N 3.19Å; L466-E468 VanDerWaalsContact C-N 3.3Å; L466-E468 PolarHBondContact O-N 3.47Å; L466-E469 PolarHBondContact O-N 3.3Å
467	V	59.3	Low	57.7	Low	101 Å²	101	119.7 Å²	119.7	61%	0.612	58%	0.583	S	S	*	*	H	α-helix	trans	-63.9	-29.8	-167.7	-173.7	0	0	0	0	113.2	E469	V467-E469 PolarHBondContact O-N 2.87Å
468	E	55.3	Low	57.7	Low	169 Å²	169	113.4 Å²	113.4	79%	0.79	57%	0.573	S	S	*	*	H	α-helix	trans	-72.9	-25.3	-178	-64.1	-173.4	143	0	0	113.9	L466	L466-E468 VanDerWaalsContact C-N 3.3Å; L466-E468 PolarHBondContact O-N 3.47Å
469	E	57.7	Low	57.8	Low	90 Å²	90	108.4 Å²	108.4	42%	0.421	55%	0.553	S	S	.	*	H	α-helix	trans	-90.7	-14.4	177.5	-78.9	-81.6	139.2	0	0	113.1	L466 V467 F471 I472 C473 R946	L466-E469 PolarHBondContact O-N 3.3Å; V467-E469 PolarHBondContact O-N 2.87Å; E469-F471 VanDerWaalsContact C-N 3.32Å; E469-F471 PolarHBondContact O-N 3.43Å; E469-I472 PolarHBondContact O-N 2.97Å; E469-C473 PolarHBondContact O-N 3.41Å; E469-C473 PolarHBondContact O-SG 2.98Å; E469-R946 IonicContact OE1-CZ 3.62Å; E469-R946 IonicContact OE1-NH1 2.72Å; E469-R946 PolarHBondContact OE1-NH1 2.9Å; E469-R946 IonicContact OE1-NH2 2.9Å; E469-R946 PolarHBondContact OE1-NH2 3.48Å; E469-R946 IonicContact OE2-NH1 3.62Å; E469-R946 PolarHBondContact OE2-NH1 2.8Å; E469-R946 IonicContact OE2-NH2 3.37Å
470	E	58.6	Low	58.2	Low	115 Å²	115	105.3 Å²	105.3	54%	0.537	54%	0.535	S	S	.	.	H	α-helix	trans	-61.8	-37.4	-177.3	-68.3	-175.3	153.2	0	0	112.6	C473	E470-C473 WeakPolarHBondContact O-CB 3.37Å; E470-C473 PolarHBondContact O-N 2.88Å
471	F	56.3	Low	58.6	Low	122 Å²	122	105 Å²	105	54%	0.535	53%	0.533	S	S	.	.	H	α-helix	trans	-65.2	-44.8	178.6	-174.4	-101.2	0	0	0	112.3	E469 C473 S474 Q953	E469-F471 VanDerWaalsContact C-N 3.32Å; E469-F471 PolarHBondContact O-N 3.43Å; F471-C473 VanDerWaalsContact C-N 3.26Å; F471-C473 PolarHBondContact O-N 3.35Å; F471-S474 WeakPolarHBondContact O-CB 3.37Å; F471-S474 PolarHBondContact O-N 3.46Å; F471-S474 VanDerWaalsContact O-N 3.14Å; F471-S474 PolarHBondContact O-OG 2.74Å; F471-Q953 HydrophobicContact CE1-CB 4.32Å; F471-Q953 VanDerWaalsContact CE1-CD 3.4Å; F471-Q953 HydrophobicContact CE1-CG 3.84Å; F471-Q953 HydrophobicContact CZ-CG 4.23Å
472	I	60.4	Low	58.9	Low	28 Å²	28	100 Å²	100	14%	0.144	52%	0.52	C	S	.	.	H	α-helix	trans	-67.3	-29.5	-178.9	-64.2	177.2	0	0	0	111.2	E469 S474 L476 R946	E469-I472 PolarHBondContact O-N 2.97Å; I472-S474 PolarHBondContact O-N 3.4Å; I472-L476 HydrophobicContact CG2-CD1 4.3Å; I472-R946 VanDerWaalsContact CD1-NH2 3.3Å
473	C	58.3	Low	59.5	Low	64 Å²	64	98.1 Å²	98.1	43%	0.432	51%	0.506	S	S	.	.	H	α-helix	trans	-63.5	-24.5	174.5	-67.4	0	0	0	0	113.7	E469 E470 F471 S477	E469-C473 PolarHBondContact O-N 3.41Å; E469-C473 PolarHBondContact O-SG 2.98Å; E470-C473 WeakPolarHBondContact O-CB 3.37Å; E470-C473 PolarHBondContact O-N 2.88Å; F471-C473 VanDerWaalsContact C-N 3.26Å; F471-C473 PolarHBondContact O-N 3.35Å; C473-S477 WeakPolarHBondContact O-CB 3.4Å; C473-S477 PolarHBondContact O-N 3.36Å; C473-S477 PolarHBondContact O-OG 3Å
474	S	60.5	Low	60.1	Low	65 Å²	65	98.5 Å²	98.5	46%	0.455	50%	0.504	S	S	.	.	H	α-helix	trans	-67.3	-59.5	-172	67.4	0	0	0	0	114.2	F471 I472 L476 S477	F471-S474 WeakPolarHBondContact O-CB 3.37Å; F471-S474 PolarHBondContact O-N 3.46Å; F471-S474 VanDerWaalsContact O-N 3.14Å; F471-S474 PolarHBondContact O-OG 2.74Å; I472-S474 PolarHBondContact O-N 3.4Å; S474-L476 VanDerWaalsContact C-N 3.26Å; S474-L476 PolarHBondContact O-N 3.14Å; S474-S477 WeakPolarHBondContact O-CB 3.33Å; S474-S477 PolarHBondContact O-N 3.22Å; S474-S477 VanDerWaalsContact O-N 3.13Å
475	E	57.8	Low	60.8	Low	98 Å²	98	94.3 Å²	94.3	46%	0.458	49%	0.493	S	S	.	.	H	α-helix	trans	-62.4	-33.5	176.3	-83.8	-115.3	122.7	0	0	112.1	S477 L949 K952	E475-S477 VanDerWaalsContact C-N 3.34Å; E475-L949 HydrophobicContact CB-CD2 4.2Å; E475-L949 HydrophobicContact CG-CD2 4.42Å; E475-L949 WeakPolarHBondContact OE2-CD2 3.06Å; E475-K952 IonicContact OE1-NZ 3.85Å; E475-K952 IonicContact OE2-NZ 3.77Å; E475-K952 PolarHBondContact OE2-NZ 3.2Å
476	L	59	Low	61.3	Low	63 Å²	63	86.9 Å²	86.9	33%	0.33	46%	0.464	S	S	.	.	H	α-helix	trans	-67.5	-33	175.4	-88.6	166.9	0	0	0	112.7	I472 S474 H480	I472-L476 HydrophobicContact CG2-CD1 4.3Å; S474-L476 VanDerWaalsContact C-N 3.26Å; S474-L476 PolarHBondContact O-N 3.14Å; L476-H480 WeakPolarHBondContact O-CB 3.19Å; L476-H480 PolarHBondContact O-N 3.4Å; L476-H480 PolarHBondContact O-ND1 2.99Å
477	S	60.6	Low	61.8	Low	63 Å²	63	83.2 Å²	83.2	44%	0.441	45%	0.449	S	S	.	.	H	α-helix	trans	-65	-41.4	-179.5	-66.5	0	0	0	0	112.3	C473 S474 E475 V479 H480 E481	C473-S477 WeakPolarHBondContact O-CB 3.4Å; C473-S477 PolarHBondContact O-N 3.36Å; C473-S477 PolarHBondContact O-OG 3Å; S474-S477 WeakPolarHBondContact O-CB 3.33Å; S474-S477 PolarHBondContact O-N 3.22Å; S474-S477 VanDerWaalsContact O-N 3.13Å; E475-S477 VanDerWaalsContact C-N 3.34Å; S477-V479 PolarHBondContact O-N 3.08Å; S477-H480 CarbonylContact O-C 3.53Å; S477-H480 WeakPolarHBondContact O-CA 3.39Å; S477-H480 WeakPolarHBondContact O-CB 3.34Å; S477-H480 PolarHBondContact O-N 3.39Å; S477-H480 VanDerWaalsContact O-N 3.09Å; S477-E481 PolarHBondContact O-N 2.88Å
478	S	61.4	Low	62.4	Low	84 Å²	84	80 Å²	80	59%	0.587	44%	0.437	S	S	*	.	H	α-helix	trans	-56.1	-45.9	177.5	168.7	0	0	0	0	112.9
479	V	62.1	Low	63.3	Low	54 Å²	54	77.2 Å²	77.2	33%	0.327	42%	0.424	S	S	.	.	H	α-helix	trans	-71.7	-37.6	176.3	-175.8	0	0	0	0	110.9	S477 S482	S477-V479 PolarHBondContact O-N 3.08Å; V479-S482 PolarHBondContact O-N 3.16Å; V479-S482 PolarHBondContact O-OG 3.03Å
480	H	62	Low	64	Low	76 Å²	76	75.9 Å²	75.9	35%	0.352	42%	0.42	S	S	.	.	H	α-helix	trans	-64.2	-38.8	177.3	-86.4	90.2	0	0	0	113.6	L476 S477 S482 L483 Y484	L476-H480 WeakPolarHBondContact O-CB 3.19Å; L476-H480 PolarHBondContact O-N 3.4Å; L476-H480 PolarHBondContact O-ND1 2.99Å; S477-H480 CarbonylContact O-C 3.53Å; S477-H480 WeakPolarHBondContact O-CA 3.39Å; S477-H480 WeakPolarHBondContact O-CB 3.34Å; S477-H480 PolarHBondContact O-N 3.39Å; S477-H480 VanDerWaalsContact O-N 3.09Å; H480-S482 VanDerWaalsContact C-N 3.26Å; H480-S482 PolarHBondContact O-N 2.68Å; H480-L483 CarbonylContact O-C 3.53Å; H480-L483 WeakPolarHBondContact O-CA 3.44Å; H480-L483 WeakPolarHBondContact O-CB 3.09Å; H480-L483 PolarHBondContact O-N 3.44Å; H480-Y484 HydrophobicContact CB-CD2 3.87Å; H480-Y484 HydrophobicContact CB-CE2 3.72Å; H480-Y484 AromaticContact CD2-CE2 3.88Å; H480-Y484 WeakPolarHBondContact O-CB 3.23Å; H480-Y484 VanDerWaalsContact O-CD2 3.29Å; H480-Y484 WeakPolarHBondContact O-CD2 3.45Å; H480-Y484 PolarHBondContact O-N 3.09Å
481	E	66.8	Low	64.7	Low	143 Å²	143	76.4 Å²	76.4	67%	0.668	43%	0.426	S	S	*	.	H	α-helix	trans	-54.7	-43.2	176.9	-81	-167.9	119.2	0	0	111.9	S477 L483 Y484 S485	S477-E481 PolarHBondContact O-N 2.88Å; E481-L483 PolarHBondContact O-N 3.43Å; E481-Y484 PolarHBondContact O-N 3.35Å; E481-S485 WeakPolarHBondContact O-CB 3.09Å; E481-S485 PolarHBondContact O-N 3.19Å
482	S	63.5	Low	65.7	Low	65 Å²	65	73.6 Å²	73.6	46%	0.455	42%	0.421	S	S	.	.	H	α-helix	trans	-63.7	-29.1	177.5	78.6	0	0	0	0	113.2	V479 H480	V479-S482 PolarHBondContact O-N 3.16Å; V479-S482 PolarHBondContact O-OG 3.03Å; H480-S482 VanDerWaalsContact C-N 3.26Å; H480-S482 PolarHBondContact O-N 2.68Å
483	L	66.8	Low	66.4	Low	60 Å²	60	73.2 Å²	73.2	31%	0.314	42%	0.422	S	S	.	.	H	α-helix	trans	-88	-38.8	-178.5	-129.8	160.8	0	0	0	111.3	H480 E481 S485 A486 A487 L940	H480-L483 CarbonylContact O-C 3.53Å; H480-L483 WeakPolarHBondContact O-CA 3.44Å; H480-L483 WeakPolarHBondContact O-CB 3.09Å; H480-L483 PolarHBondContact O-N 3.44Å; E481-L483 PolarHBondContact O-N 3.43Å; L483-S485 VanDerWaalsContact C-N 3.35Å; L483-A486 PolarHBondContact O-N 3.42Å; L483-A487 WeakPolarHBondContact O-CB 3.27Å; L483-A487 PolarHBondContact O-N 2.86Å; L483-L940 HydrophobicContact CD2-CD1 4.49Å; L483-L940 HydrophobicContact CD2-CD2 4.16Å
484	Y	68.7	Low	67.3	Low	161 Å²	161	74.3 Å²	74.3	63%	0.631	43%	0.426	S	S	*	.	H	α-helix	trans	-65.1	-34.9	171.1	-75.8	-52.1	0	0	0	112.1	H480 E481 A487 G488	H480-Y484 HydrophobicContact CB-CD2 3.87Å; H480-Y484 HydrophobicContact CB-CE2 3.72Å; H480-Y484 AromaticContact CD2-CE2 3.88Å; H480-Y484 WeakPolarHBondContact O-CB 3.23Å; H480-Y484 VanDerWaalsContact O-CD2 3.29Å; H480-Y484 WeakPolarHBondContact O-CD2 3.45Å; H480-Y484 PolarHBondContact O-N 3.09Å; E481-Y484 PolarHBondContact O-N 3.35Å; Y484-A487 PolarHBondContact O-N 3.36Å; Y484-G488 PolarHBondContact O-N 3.34Å
485	S	70.9	Confident	68	Low	74 Å²	74	73.1 Å²	73.1	52%	0.517	42%	0.424	S	S	.	.	H	α-helix	trans	-61.4	-47.8	172.5	-177.3	0	0	0	0	111.8	E481 L483 G488 Q489	E481-S485 WeakPolarHBondContact O-CB 3.09Å; E481-S485 PolarHBondContact O-N 3.19Å; L483-S485 VanDerWaalsContact C-N 3.35Å; S485-G488 PolarHBondContact O-N 3.2Å; S485-Q489 PolarHBondContact O-N 2.85Å; S485-Q489 VanDerWaalsContact O-N 3.15Å
486	A	66.1	Low	69	Low	16 Å²	16	72.3 Å²	72.3	13%	0.132	42%	0.42	C	S	.	.	H	α-helix	trans	-66.6	-39.7	176	0	0	0	0	0	112.7	L483 Q489 L490 L940	L483-A486 PolarHBondContact O-N 3.42Å; A486-Q489 PolarHBondContact O-N 3.29Å; A486-L490 PolarHBondContact O-N 2.92Å; A486-L940 HydrophobicContact CB-CD2 3.75Å
487	A	65.8	Low	69.8	Low	36 Å²	36	71.5 Å²	71.5	30%	0.298	42%	0.42	S	S	.	.	H	α-helix	trans	-66.3	-37.2	175	0	0	0	0	0	112.2	L483 Y484 L490 L491	L483-A487 WeakPolarHBondContact O-CB 3.27Å; L483-A487 PolarHBondContact O-N 2.86Å; Y484-A487 PolarHBondContact O-N 3.36Å; A487-L490 PolarHBondContact O-N 2.87Å; A487-L491 WeakPolarHBondContact O-CB 3.17Å; A487-L491 WeakPolarHBondContact O-CG 3.35Å; A487-L491 PolarHBondContact O-N 3.29Å
488	G	71.6	Confident	70.6	Confident	35 Å²	35	72.5 Å²	72.5	36%	0.361	42%	0.423	S	S	.	.	H	α-helix	trans	-63.9	-40.6	176.4	0	0	0	0	0	112.6	Y484 S485 L491 S492	Y484-G488 PolarHBondContact O-N 3.34Å; S485-G488 PolarHBondContact O-N 3.2Å; G488-L491 PolarHBondContact O-N 2.87Å; G488-S492 WeakPolarHBondContact O-CB 3.37Å; G488-S492 PolarHBondContact O-N 2.97Å
489	Q	73.6	Confident	71.5	Confident	109 Å²	109	72 Å²	72	51%	0.509	42%	0.42	S	S	.	.	H	α-helix	trans	-63.6	-40.6	173.3	-69	178.8	8.3	0	0	112.1	S485 A486 A493 P937	S485-Q489 PolarHBondContact O-N 2.85Å; S485-Q489 VanDerWaalsContact O-N 3.15Å; A486-Q489 PolarHBondContact O-N 3.29Å; Q489-A493 PolarHBondContact O-N 3.34Å; Q489-A493 VanDerWaalsContact O-N 3.14Å; Q489-P937 HydrophobicContact CB-CG 4.35Å
490	L	73.1	Confident	72.2	Confident	63 Å²	63	73.5 Å²	73.5	33%	0.33	43%	0.426	S	S	.	.	H	α-helix	trans	-66	-43.5	174.2	-75.8	162.9	0	0	0	112.1	A486 A487 A493 V494 Y936	A486-L490 PolarHBondContact O-N 2.92Å; A487-L490 PolarHBondContact O-N 2.87Å; L490-A493 PolarHBondContact O-N 2.95Å; L490-V494 WeakPolarHBondContact O-CG2 3.5Å; L490-V494 PolarHBondContact O-N 3.38Å; L490-Y936 HydrophobicContact CD2-CD2 3.72Å; L490-Y936 HydrophobicContact CD2-CG 3.99Å
491	L	74.6	Confident	73	Confident	126 Å²	126	73.5 Å²	73.5	66%	0.66	43%	0.432	S	S	*	.	H	α-helix	trans	-65.1	-36.8	177.1	-77	165.1	0	0	0	112.2	A487 G488 G495	A487-L491 WeakPolarHBondContact O-CB 3.17Å; A487-L491 WeakPolarHBondContact O-CG 3.35Å; A487-L491 PolarHBondContact O-N 3.29Å; G488-L491 PolarHBondContact O-N 2.87Å; L491-G495 PolarHBondContact O-N 2.87Å
492	S	75.9	Confident	73.5	Confident	63 Å²	63	69.8 Å²	69.8	44%	0.441	42%	0.421	S	S	.	.	H	α-helix	trans	-64.1	-48	173.7	-161.8	0	0	0	0	111.2	G488 V494 G495 E496	G488-S492 WeakPolarHBondContact O-CB 3.37Å; G488-S492 PolarHBondContact O-N 2.97Å; S492-V494 VanDerWaalsContact C-N 3.35Å; S492-V494 PolarHBondContact O-N 3.23Å; S492-G495 PolarHBondContact O-N 2.98Å; S492-G495 VanDerWaalsContact O-N 3.17Å; S492-E496 PolarHBondContact O-N 2.89Å; S492-E496 PolarHBondContact OG-OE1 2.8Å
493	A	75.9	Confident	74.3	Confident	19 Å²	19	68.6 Å²	68.6	16%	0.157	42%	0.42	C	S	.	.	H	α-helix	trans	-63.7	-37.8	178.9	0	0	0	0	0	112.8	Q489 L490 S497	Q489-A493 PolarHBondContact O-N 3.34Å; Q489-A493 VanDerWaalsContact O-N 3.14Å; L490-A493 PolarHBondContact O-N 2.95Å; A493-S497 VanDerWaalsContact O-CB 3.29Å; A493-S497 WeakPolarHBondContact O-CB 3.38Å; A493-S497 PolarHBondContact O-N 2.71Å; A493-S497 VanDerWaalsContact O-N 3.15Å
494	V	76.1	Confident	74.9	Confident	88 Å²	88	69.9 Å²	69.9	53%	0.533	43%	0.426	S	S	.	.	H	α-helix	trans	-69.5	-39.8	173.1	171.6	0	0	0	0	111.2	L490 S492 T498	L490-V494 WeakPolarHBondContact O-CG2 3.5Å; L490-V494 PolarHBondContact O-N 3.38Å; S492-V494 VanDerWaalsContact C-N 3.35Å; S492-V494 PolarHBondContact O-N 3.23Å; V494-T498 VanDerWaalsContact O-CB 3.26Å; V494-T498 WeakPolarHBondContact O-CB 3.5Å; V494-T498 PolarHBondContact O-N 2.76Å; V494-T498 PolarHBondContact O-OG1 2.67Å
495	G	75.7	Confident	75.4	Confident	39 Å²	39	67.4 Å²	67.4	40%	0.402	42%	0.42	S	S	.	.	H	α-helix	trans	-62.6	-49.4	177	0	0	0	0	0	112.7	L491 S492 T498 S499	L491-G495 PolarHBondContact O-N 2.87Å; S492-G495 PolarHBondContact O-N 2.98Å; S492-G495 VanDerWaalsContact O-N 3.17Å; G495-T498 PolarHBondContact O-N 2.77Å; G495-S499 VanDerWaalsContact O-CB 3.28Å; G495-S499 WeakPolarHBondContact O-CB 3.36Å; G495-S499 PolarHBondContact O-N 3.35Å
496	E	78.6	Confident	75.8	Confident	81 Å²	81	66.1 Å²	66.1	38%	0.379	41%	0.414	S	S	.	.	H	α-helix	trans	-59.1	-50.6	174.8	-75.5	177.2	-129.4	0	0	111.6	S492 T498 S499 D500 R932 F934	S492-E496 PolarHBondContact O-N 2.89Å; S492-E496 PolarHBondContact OG-OE1 2.8Å; E496-T498 VanDerWaalsContact C-N 3.32Å; E496-T498 PolarHBondContact O-N 2.88Å; E496-S499 WeakPolarHBondContact O-CB 3.28Å; E496-S499 PolarHBondContact O-N 2.85Å; E496-S499 VanDerWaalsContact O-N 3.14Å; E496-D500 PolarHBondContact O-N 2.65Å; E496-R932 IonicContact OE2-NH2 3.69Å; E496-F934 HydrophobicContact CB-CE1 3.97Å
497	S	76.4	Confident	76.5	Confident	47 Å²	47	72.6 Å²	72.6	33%	0.329	44%	0.44	S	S	.	.	H	α-helix	trans	-60.9	-39.2	178.9	-175.2	0	0	0	0	112.5	A493 V501	A493-S497 VanDerWaalsContact O-CB 3.29Å; A493-S497 WeakPolarHBondContact O-CB 3.38Å; A493-S497 PolarHBondContact O-N 2.71Å; A493-S497 VanDerWaalsContact O-N 3.15Å; S497-V501 WeakPolarHBondContact O-CB 3.47Å; S497-V501 VanDerWaalsContact O-CG2 3.29Å; S497-V501 WeakPolarHBondContact O-CG2 3.31Å; S497-V501 PolarHBondContact O-N 2.97Å; S497-V501 VanDerWaalsContact O-N 3.12Å
498	T	77.6	Confident	77.1	Confident	83 Å²	83	75.3 Å²	75.3	51%	0.509	45%	0.448	S	S	.	.	H	α-helix	trans	-71.3	-34.5	176.1	-53.3	0	0	0	0	111.7	V494 G495 E496 S502	V494-T498 VanDerWaalsContact O-CB 3.26Å; V494-T498 WeakPolarHBondContact O-CB 3.5Å; V494-T498 PolarHBondContact O-N 2.76Å; V494-T498 PolarHBondContact O-OG1 2.67Å; G495-T498 PolarHBondContact O-N 2.77Å; E496-T498 VanDerWaalsContact C-N 3.32Å; E496-T498 PolarHBondContact O-N 2.88Å; T498-S502 WeakPolarHBondContact O-CB 3.36Å; T498-S502 PolarHBondContact O-N 3.01Å; T498-S502 PolarHBondContact O-OG 3.48Å
499	S	78.9	Confident	77.5	Confident	75 Å²	75	77.5 Å²	77.5	52%	0.524	45%	0.452	S	S	.	.	H	α-helix	trans	-65.8	-49.7	174.6	-168.9	0	0	0	0	111.6	G495 E496 V501 S502 G503	G495-S499 VanDerWaalsContact O-CB 3.28Å; G495-S499 WeakPolarHBondContact O-CB 3.36Å; G495-S499 PolarHBondContact O-N 3.35Å; E496-S499 WeakPolarHBondContact O-CB 3.28Å; E496-S499 PolarHBondContact O-N 2.85Å; E496-S499 VanDerWaalsContact O-N 3.14Å; S499-V501 PolarHBondContact O-N 2.81Å; S499-S502 PolarHBondContact O-N 3.46Å; S499-S502 PolarHBondContact O-OG 2.82Å; S499-G503 PolarHBondContact O-N 2.89Å
500	D	78.7	Confident	77.9	Confident	84 Å²	84	80.6 Å²	80.6	45%	0.449	46%	0.459	S	S	.	.	H	α-helix	trans	-59.6	-44.7	177.9	-80.2	-10.3	0	0	0	111.3	E496 L504 R932	E496-D500 PolarHBondContact O-N 2.65Å; D500-L504 PolarHBondContact O-N 3.14Å; D500-L504 VanDerWaalsContact O-N 3.08Å; D500-R932 IonicContact OD2-NH1 3.53Å
501	V	77.6	Confident	78.3	Confident	77 Å²	77	81.2 Å²	81.2	47%	0.467	46%	0.459	S	S	.	.	H	α-helix	trans	-68.2	-46.3	178.5	169.5	0	0	0	0	112	S497 S499 G503 L504 H505	S497-V501 WeakPolarHBondContact O-CB 3.47Å; S497-V501 VanDerWaalsContact O-CG2 3.29Å; S497-V501 WeakPolarHBondContact O-CG2 3.31Å; S497-V501 PolarHBondContact O-N 2.97Å; S497-V501 VanDerWaalsContact O-N 3.12Å; S499-V501 PolarHBondContact O-N 2.81Å; V501-G503 PolarHBondContact O-N 3.35Å; V501-L504 PolarHBondContact O-N 2.68Å; V501-H505 PolarHBondContact O-CD2 3.49Å; V501-H505 VanDerWaalsContact O-CD2 3.22Å; V501-H505 PolarHBondContact O-N 2.96Å
502	S	76.9	Confident	78.6	Confident	64 Å²	64	78 Å²	78	45%	0.448	44%	0.444	S	S	.	.	H	α-helix	trans	-68	-33.8	179	61.2	0	0	0	0	112.5	T498 S499 H505 A506	T498-S502 WeakPolarHBondContact O-CB 3.36Å; T498-S502 PolarHBondContact O-N 3.01Å; T498-S502 PolarHBondContact O-OG 3.48Å; S499-S502 PolarHBondContact O-N 3.46Å; S499-S502 PolarHBondContact O-OG 2.82Å; S502-H505 PolarHBondContact O-N 3.21Å; S502-A506 VanDerWaalsContact O-CB 3.25Å; S502-A506 WeakPolarHBondContact O-CB 3.29Å; S502-A506 PolarHBondContact O-N 3.5Å
503	G	80.7	Confident	79	Confident	41 Å²	41	80.8 Å²	80.8	42%	0.423	45%	0.449	S	S	.	.	H	α-helix	trans	-63.1	-41	171.1	0	0	0	0	0	112.8	S499 V501 A506 K507	S499-G503 PolarHBondContact O-N 2.89Å; V501-G503 PolarHBondContact O-N 3.35Å; G503-A506 PolarHBondContact O-N 2.97Å; G503-K507 WeakPolarHBondContact O-CB 3.46Å; G503-K507 PolarHBondContact O-N 3.48Å
504	L	79.5	Confident	79.4	Confident	87 Å²	87	83.6 Å²	83.6	46%	0.455	46%	0.464	S	S	.	.	H	α-helix	trans	-65.3	-45.5	174.5	-175.7	63.2	0	0	0	111.8	D500 V501 K507 L508	D500-L504 PolarHBondContact O-N 3.14Å; D500-L504 VanDerWaalsContact O-N 3.08Å; V501-L504 PolarHBondContact O-N 2.68Å; L504-K507 PolarHBondContact O-N 3.13Å; L504-L508 PolarHBondContact O-N 2.91Å
505	H	78.5	Confident	79.6	Confident	108 Å²	108	83 Å²	83	50%	0.5	46%	0.455	S	S	.	.	H	α-helix	trans	-62.4	-43.9	174.7	-79.4	-69.5	0	0	0	112.1	V501 S502 K507 L508 D509	V501-H505 PolarHBondContact O-CD2 3.49Å; V501-H505 VanDerWaalsContact O-CD2 3.22Å; V501-H505 PolarHBondContact O-N 2.96Å; S502-H505 PolarHBondContact O-N 3.21Å; H505-K507 VanDerWaalsContact C-N 3.25Å; H505-K507 PolarHBondContact O-N 2.99Å; H505-L508 PolarHBondContact O-N 3.05Å; H505-D509 WeakPolarHBondContact O-CB 3.32Å; H505-D509 PolarHBondContact O-N 3.05Å
506	A	79.7	Confident	80	Confident	48 Å²	48	86 Å²	86	40%	0.397	46%	0.458	S	S	.	.	H	α-helix	trans	-63.3	-29.6	176.6	0	0	0	0	0	113	S502 G503 R510	S502-A506 VanDerWaalsContact O-CB 3.25Å; S502-A506 WeakPolarHBondContact O-CB 3.29Å; S502-A506 PolarHBondContact O-N 3.5Å; G503-A506 PolarHBondContact O-N 2.97Å; A506-R510 VanDerWaalsContact O-CB 3.29Å; A506-R510 WeakPolarHBondContact O-CB 3.32Å; A506-R510 PolarHBondContact O-N 3.27Å
507	K	80.6	Confident	80.3	Confident	152 Å²	152	87 Å²	87	66%	0.661	46%	0.463	S	S	*	.	H	α-helix	trans	-73.4	-42.6	172.5	-170.9	178	-179.3	-178.7	0	111.9	G503 L504 H505 R510 K511	G503-K507 WeakPolarHBondContact O-CB 3.46Å; G503-K507 PolarHBondContact O-N 3.48Å; L504-K507 PolarHBondContact O-N 3.13Å; H505-K507 VanDerWaalsContact C-N 3.25Å; H505-K507 PolarHBondContact O-N 2.99Å; K507-R510 PolarHBondContact O-N 2.94Å; K507-K511 PolarHBondContact O-N 3.17Å
508	L	78.9	Confident	80.6	Confident	92 Å²	92	89.2 Å²	89.2	48%	0.482	47%	0.471	S	S	.	.	H	α-helix	trans	-60.2	-54.6	173.3	-89.7	162	0	0	0	111.3	L504 H505 R510 K511 T512	L504-L508 PolarHBondContact O-N 2.91Å; H505-L508 PolarHBondContact O-N 3.05Å; L508-R510 PolarHBondContact O-N 3.42Å; L508-K511 WeakPolarHBondContact O-CA 3.17Å; L508-K511 WeakPolarHBondContact O-CB 3.37Å; L508-K511 PolarHBondContact O-N 3.37Å; L508-T512 PolarHBondContact O-N 2.88Å; L508-T512 PolarHBondContact O-OG1 3Å
509	D	80.1	Confident	80.8	Confident	82 Å²	82	89.8 Å²	89.8	44%	0.439	47%	0.469	S	S	.	.	H	α-helix	trans	-51.9	-41.4	176.5	-97.9	28.5	0	0	0	112.7	H505 K513	H505-D509 WeakPolarHBondContact O-CB 3.32Å; H505-D509 PolarHBondContact O-N 3.05Å; D509-K513 WeakPolarHBondContact O-CB 3.42Å; D509-K513 WeakPolarHBondContact O-CD 3.34Å; D509-K513 WeakPolarHBondContact O-CG 3.44Å; D509-K513 PolarHBondContact O-N 3.02Å; D509-K513 IonicContact OD2-NZ 3.37Å; D509-K513 PolarHBondContact OD2-NZ 3.06Å
510	R	81.1	Confident	81.1	Confident	174 Å²	174	92 Å²	92	66%	0.657	47%	0.472	S	S	*	.	H	α-helix	trans	-66.2	-41.6	177.2	-168	-176.6	-54.5	165.5	5	111.5	A506 K507 L508 V514	A506-R510 VanDerWaalsContact O-CB 3.29Å; A506-R510 WeakPolarHBondContact O-CB 3.32Å; A506-R510 PolarHBondContact O-N 3.27Å; K507-R510 PolarHBondContact O-N 2.94Å; L508-R510 PolarHBondContact O-N 3.42Å; R510-V514 WeakPolarHBondContact O-CG2 3.27Å; R510-V514 PolarHBondContact O-N 3.29Å; R510-V514 VanDerWaalsContact O-N 3.11Å
511	K	81.6	Confident	81.4	Confident	76 Å²	76	92.6 Å²	92.6	33%	0.33	47%	0.472	S	S	.	.	H	α-helix	trans	-62.8	-51.7	175	-158.7	-165.2	-170.4	-129.2	0	110.7	K507 L508 K513 V514 E515 D922	K507-K511 PolarHBondContact O-N 3.17Å; L508-K511 WeakPolarHBondContact O-CA 3.17Å; L508-K511 WeakPolarHBondContact O-CB 3.37Å; L508-K511 PolarHBondContact O-N 3.37Å; K511-K513 VanDerWaalsContact C-N 3.29Å; K511-K513 PolarHBondContact O-N 2.97Å; K511-V514 PolarHBondContact O-N 3.24Å; K511-E515 VanDerWaalsContact CD-OE1 3.29Å; K511-E515 WeakPolarHBondContact CD-OE1 3.48Å; K511-E515 WeakPolarHBondContact CE-OE1 3.22Å; K511-E515 IonicContact NZ-OE1 3.48Å; K511-E515 PolarHBondContact NZ-OE1 2.94Å; K511-E515 WeakPolarHBondContact O-CG 3.41Å; K511-E515 PolarHBondContact O-N 2.99Å; K511-D922 WeakPolarHBondContact CE-OD2 3.34Å; K511-D922 IonicContact NZ-OD1 3.53Å; K511-D922 PolarHBondContact NZ-OD1 3.31Å; K511-D922 IonicContact NZ-OD2 2.66Å; K511-D922 PolarHBondContact NZ-OD2 3.31Å
512	T	81	Confident	81.7	Confident	57 Å²	57	91.9 Å²	91.9	35%	0.35	46%	0.464	S	S	.	.	H	α-helix	trans	-57.7	-40	179.6	-46.8	0	0	0	0	112.1	L508 E515 Q516	L508-T512 PolarHBondContact O-N 2.88Å; L508-T512 PolarHBondContact O-OG1 3Å; T512-E515 PolarHBondContact O-N 3.19Å; T512-Q516 WeakPolarHBondContact O-CB 3.5Å; T512-Q516 VanDerWaalsContact O-CG 3.23Å; T512-Q516 WeakPolarHBondContact O-CG 3.35Å; T512-Q516 PolarHBondContact O-N 2.79Å
513	K	84.1	Confident	82	Confident	123 Å²	123	93.7 Å²	93.7	54%	0.535	47%	0.466	S	S	.	.	H	α-helix	trans	-66.4	-37.9	175.7	-74.9	163	-173.8	156.6	0	112.6	D509 K511 H517	D509-K513 WeakPolarHBondContact O-CB 3.42Å; D509-K513 WeakPolarHBondContact O-CD 3.34Å; D509-K513 WeakPolarHBondContact O-CG 3.44Å; D509-K513 PolarHBondContact O-N 3.02Å; D509-K513 IonicContact OD2-NZ 3.37Å; D509-K513 PolarHBondContact OD2-NZ 3.06Å; K511-K513 VanDerWaalsContact C-N 3.29Å; K511-K513 PolarHBondContact O-N 2.97Å; K513-H517 WeakPolarHBondContact O-CB 3.49Å; K513-H517 PolarHBondContact O-N 3.45Å
514	V	84.3	Confident	82.4	Confident	77 Å²	77	93.9 Å²	93.9	47%	0.467	46%	0.46	S	S	.	.	H	α-helix	trans	-69.2	-43.7	174.9	170.2	0	0	0	0	111.3	R510 K511 H517 N518	R510-V514 WeakPolarHBondContact O-CG2 3.27Å; R510-V514 PolarHBondContact O-N 3.29Å; R510-V514 VanDerWaalsContact O-N 3.11Å; K511-V514 PolarHBondContact O-N 3.24Å; V514-H517 PolarHBondContact O-N 3.43Å; V514-N518 WeakPolarHBondContact O-CB 3.24Å; V514-N518 PolarHBondContact O-N 3.47Å; V514-N518 PolarHBondContact O-OD1 3.24Å
515	E	81.1	Confident	82.7	Confident	76 Å²	76	93.5 Å²	93.5	36%	0.355	46%	0.455	S	S	.	.	H	α-helix	trans	-60.8	-45.4	175.7	-71.2	169.8	179.4	0	0	111.7	K511 T512 H517 N518 M519	K511-E515 VanDerWaalsContact CD-OE1 3.29Å; K511-E515 WeakPolarHBondContact CD-OE1 3.48Å; K511-E515 WeakPolarHBondContact CE-OE1 3.22Å; K511-E515 IonicContact NZ-OE1 3.48Å; K511-E515 PolarHBondContact NZ-OE1 2.94Å; K511-E515 WeakPolarHBondContact O-CG 3.41Å; K511-E515 PolarHBondContact O-N 2.99Å; T512-E515 PolarHBondContact O-N 3.19Å; E515-H517 PolarHBondContact O-N 2.89Å; E515-N518 PolarHBondContact O-N 3.44Å; E515-M519 WeakPolarHBondContact O-CB 3.37Å; E515-M519 PolarHBondContact O-N 2.94Å
516	Q	83.4	Confident	83.1	Confident	101 Å²	101	90.3 Å²	90.3	47%	0.472	45%	0.445	S	S	.	.	H	α-helix	trans	-61.6	-42.7	174.6	-74.8	175.1	3.5	0	0	112.4	T512 M519 Q520	T512-Q516 WeakPolarHBondContact O-CB 3.5Å; T512-Q516 VanDerWaalsContact O-CG 3.23Å; T512-Q516 WeakPolarHBondContact O-CG 3.35Å; T512-Q516 PolarHBondContact O-N 2.79Å; Q516-M519 PolarHBondContact O-N 3.06Å; Q516-Q520 WeakPolarHBondContact O-CG 3.46Å; Q516-Q520 PolarHBondContact O-N 3.47Å
517	H	85.3	Confident	83.4	Confident	102 Å²	102	94.9 Å²	94.9	47%	0.472	46%	0.458	S	S	.	.	H	α-helix	trans	-63.9	-45.4	176.6	-177.7	67.3	0	0	0	111.9	K513 V514 E515 M519 Q520 M521	K513-H517 WeakPolarHBondContact O-CB 3.49Å; K513-H517 PolarHBondContact O-N 3.45Å; V514-H517 PolarHBondContact O-N 3.43Å; E515-H517 PolarHBondContact O-N 2.89Å; H517-M519 PolarHBondContact O-N 3.5Å; H517-Q520 PolarHBondContact O-N 2.89Å; H517-M521 WeakPolarHBondContact O-CG 3.4Å; H517-M521 PolarHBondContact O-N 2.95Å
518	N	83.2	Confident	83.8	Confident	95 Å²	95	94.5 Å²	94.5	51%	0.508	45%	0.452	S	S	.	.	H	α-helix	trans	-62.1	-42	178	-70.3	-7.8	0	0	0	111.5	V514 E515 M521 Q522	V514-N518 WeakPolarHBondContact O-CB 3.24Å; V514-N518 PolarHBondContact O-N 3.47Å; V514-N518 PolarHBondContact O-OD1 3.24Å; E515-N518 PolarHBondContact O-N 3.44Å; N518-M521 PolarHBondContact O-N 3.43Å; N518-Q522 PolarHBondContact O-N 3.38Å
519	M	82.3	Confident	84.2	Confident	94 Å²	94	92.7 Å²	92.7	46%	0.463	44%	0.442	S	S	.	.	H	α-helix	trans	-63.7	-42	175.3	-174.8	175.8	63.6	0	0	112.3	E515 Q516 H517 M521 Q522 Q523	E515-M519 WeakPolarHBondContact O-CB 3.37Å; E515-M519 PolarHBondContact O-N 2.94Å; Q516-M519 PolarHBondContact O-N 3.06Å; H517-M519 PolarHBondContact O-N 3.5Å; M519-M521 VanDerWaalsContact C-N 3.32Å; M519-M521 PolarHBondContact O-N 2.86Å; M519-Q522 PolarHBondContact O-N 3.4Å; M519-Q523 WeakPolarHBondContact O-CG 3.46Å; M519-Q523 PolarHBondContact O-N 2.99Å
520	Q	85.2	Confident	84.5	Confident	123 Å²	123	90.9 Å²	90.9	58%	0.575	43%	0.433	S	S	*	.	H	α-helix	trans	-62	-40.2	173.6	-73.3	173.8	5.9	0	0	111.8	Q516 H517 S524	Q516-Q520 WeakPolarHBondContact O-CG 3.46Å; Q516-Q520 PolarHBondContact O-N 3.47Å; H517-Q520 PolarHBondContact O-N 2.89Å; Q520-S524 WeakPolarHBondContact O-CB 3.47Å; Q520-S524 PolarHBondContact O-N 3.47Å
521	M	84.3	Confident	84.8	Confident	95 Å²	95	84.5 Å²	84.5	47%	0.468	42%	0.421	S	S	.	.	H	α-helix	trans	-67.6	-40.4	177.2	-72.4	-65.2	-75.1	0	0	112.3	H517 N518 M519 S524 F525	H517-M521 WeakPolarHBondContact O-CG 3.4Å; H517-M521 PolarHBondContact O-N 2.95Å; N518-M521 PolarHBondContact O-N 3.43Å; M519-M521 VanDerWaalsContact C-N 3.32Å; M519-M521 PolarHBondContact O-N 2.86Å; M521-S524 PolarHBondContact O-N 3.34Å; M521-F525 WeakPolarHBondContact O-CB 3.49Å; M521-F525 PolarHBondContact O-N 2.91Å
522	Q	84.4	Confident	85.1	Confident	62 Å²	62	82.9 Å²	82.9	29%	0.29	42%	0.422	S	S	.	.	H	α-helix	trans	-61.7	-47.3	173.8	-174	-176.2	18.2	0	0	111.7	N518 M519 F525 S526 L915 L919	N518-Q522 PolarHBondContact O-N 3.38Å; M519-Q522 PolarHBondContact O-N 3.4Å; Q522-F525 PolarHBondContact O-N 2.93Å; Q522-S526 WeakPolarHBondContact O-CB 3.31Å; Q522-S526 PolarHBondContact O-N 2.9Å; Q522-L915 HydrophobicContact CG-CD2 3.82Å; Q522-L915 PolarHBondContact NE2-O 2.93Å; Q522-L919 HydrophobicContact CG-CD1 4.09Å
523	Q	83.8	Confident	85.6	Confident	103 Å²	103	81.3 Å²	81.3	48%	0.481	41%	0.41	S	S	.	.	H	α-helix	trans	-61.7	-45.1	175.9	-70.7	176.6	7.6	0	0	111.5	M519 F525 S526 Q527	M519-Q523 WeakPolarHBondContact O-CG 3.46Å; M519-Q523 PolarHBondContact O-N 2.99Å; Q523-F525 VanDerWaalsContact C-N 3.34Å; Q523-F525 PolarHBondContact O-N 3.48Å; Q523-S526 PolarHBondContact O-N 3.27Å; Q523-Q527 WeakPolarHBondContact O-CB 3.36Å; Q523-Q527 WeakPolarHBondContact O-CG 3.39Å; Q523-Q527 PolarHBondContact O-N 3.19Å
524	S	87.1	Confident	85.8	Confident	44 Å²	44	77.1 Å²	77.1	31%	0.308	40%	0.397	S	S	.	.	H	α-helix	trans	-64.4	-34.9	177.8	-176.7	0	0	0	0	113.1	Q520 M521 R528	Q520-S524 WeakPolarHBondContact O-CB 3.47Å; Q520-S524 PolarHBondContact O-N 3.47Å; M521-S524 PolarHBondContact O-N 3.34Å; S524-R528 WeakPolarHBondContact O-CB 3.14Å; S524-R528 WeakPolarHBondContact O-CG 3.26Å; S524-R528 PolarHBondContact O-N 2.68Å; S524-R528 PolarHBondContact O-NE 3.46Å; S524-R528 PolarHBondContact OG-NE 2.77Å; S524-R528 PolarHBondContact OG-NH2 3.44Å
525	F	87.3	Confident	86	Confident	79 Å²	79	76.1 Å²	76.1	35%	0.346	39%	0.393	S	S	.	.	H	α-helix	trans	-70	-49.3	174.2	177.1	-103.5	0	0	0	111.1	M521 Q522 Q523 Q527 R528 M529 V911 F914 L915	M521-F525 WeakPolarHBondContact O-CB 3.49Å; M521-F525 PolarHBondContact O-N 2.91Å; Q522-F525 PolarHBondContact O-N 2.93Å; Q523-F525 VanDerWaalsContact C-N 3.34Å; Q523-F525 PolarHBondContact O-N 3.48Å; F525-Q527 PolarHBondContact O-N 2.97Å; F525-R528 PolarHBondContact O-N 3.33Å; F525-R528 VanDerWaalsContact O-N 3.17Å; F525-M529 HydrophobicContact CD1-CG 4.32Å; F525-M529 HydrophobicContact CD2-CG 4.11Å; F525-M529 HydrophobicContact CE1-CG 3.96Å; F525-M529 HydrophobicContact CE2-CG 3.73Å; F525-M529 HydrophobicContact CE2-SD 4.04Å; F525-M529 HydrophobicContact CG-CG 4.4Å; F525-M529 HydrophobicContact CZ-CG 3.65Å; F525-M529 HydrophobicContact CZ-SD 4.24Å; F525-M529 WeakPolarHBondContact O-CG 3.24Å; F525-M529 PolarHBondContact O-N 3.24Å; F525-V911 HydrophobicContact CE1-CG1 4.28Å; F525-F914 HydrophobicContact CE1-CD1 4.46Å; F525-F914 HydrophobicContact CE1-CE1 4.42Å; F525-L915 HydrophobicContact CD1-CD2 4.16Å
526	S	86.3	Confident	86.4	Confident	41 Å²	41	76.5 Å²	76.5	29%	0.287	40%	0.396	S	S	.	.	H	α-helix	trans	-54.4	-51	176.9	178.7	0	0	0	0	112.1	Q522 Q523 R528 M529 D530	Q522-S526 WeakPolarHBondContact O-CB 3.31Å; Q522-S526 PolarHBondContact O-N 2.9Å; Q523-S526 PolarHBondContact O-N 3.27Å; S526-R528 VanDerWaalsContact C-N 3.33Å; S526-R528 PolarHBondContact O-N 2.68Å; S526-M529 PolarHBondContact O-N 3Å; S526-D530 PolarHBondContact O-N 2.83Å
527	Q	86.4	Confident	86.7	Confident	145 Å²	145	74.5 Å²	74.5	68%	0.678	39%	0.386	S	S	*	.	H	α-helix	trans	-60.4	-39.8	177.9	-71.2	174.3	4.6	0	0	112.8	Q523 F525 G531	Q523-Q527 WeakPolarHBondContact O-CB 3.36Å; Q523-Q527 WeakPolarHBondContact O-CG 3.39Å; Q523-Q527 PolarHBondContact O-N 3.19Å; F525-Q527 PolarHBondContact O-N 2.97Å; Q527-G531 PolarHBondContact O-N 2.63Å
528	R	88.1	Confident	86.8	Confident	143 Å²	143	75.9 Å²	75.9	54%	0.54	39%	0.387	S	S	.	.	H	α-helix	trans	-66.8	-42.3	176.4	-81.3	179.9	-81.4	167.1	-9.5	112.2	S524 F525 S526 A532	S524-R528 WeakPolarHBondContact O-CB 3.14Å; S524-R528 WeakPolarHBondContact O-CG 3.26Å; S524-R528 PolarHBondContact O-N 2.68Å; S524-R528 PolarHBondContact O-NE 3.46Å; S524-R528 PolarHBondContact OG-NE 2.77Å; S524-R528 PolarHBondContact OG-NH2 3.44Å; F525-R528 PolarHBondContact O-N 3.33Å; F525-R528 VanDerWaalsContact O-N 3.17Å; S526-R528 VanDerWaalsContact C-N 3.33Å; S526-R528 PolarHBondContact O-N 2.68Å; R528-A532 WeakPolarHBondContact O-CB 3.47Å; R528-A532 PolarHBondContact O-N 3.45Å
529	M	87.8	Confident	87.1	Confident	54 Å²	54	73.5 Å²	73.5	27%	0.266	38%	0.378	S	S	.	.	H	α-helix	trans	-72.5	-48.3	-179	-65.5	-56.7	-71.5	0	0	112.4	F525 S526 G531 A532 F533 V911	F525-M529 HydrophobicContact CD1-CG 4.32Å; F525-M529 HydrophobicContact CD2-CG 4.11Å; F525-M529 HydrophobicContact CE1-CG 3.96Å; F525-M529 HydrophobicContact CE2-CG 3.73Å; F525-M529 HydrophobicContact CE2-SD 4.04Å; F525-M529 HydrophobicContact CG-CG 4.4Å; F525-M529 HydrophobicContact CZ-CG 3.65Å; F525-M529 HydrophobicContact CZ-SD 4.24Å; F525-M529 WeakPolarHBondContact O-CG 3.24Å; F525-M529 PolarHBondContact O-N 3.24Å; S526-M529 PolarHBondContact O-N 3Å; M529-G531 PolarHBondContact O-N 3.14Å; M529-A532 PolarHBondContact O-N 2.96Å; M529-A532 VanDerWaalsContact O-N 3.11Å; M529-F533 HydrophobicContact CE-CE2 3.97Å; M529-F533 HydrophobicContact CE-CZ 4.44Å; M529-F533 WeakPolarHBondContact O-CD2 3.26Å; M529-F533 PolarHBondContact O-N 2.71Å; M529-V911 HydrophobicContact CB-CG1 3.91Å; M529-V911 HydrophobicContact CE-CG2 3.97Å; M529-V911 HydrophobicContact CG-CG1 4.2Å
530	D	86.4	Confident	87.4	Confident	45 Å²	45	70.5 Å²	70.5	24%	0.241	37%	0.365	C	S	.	.	H	α-helix	trans	-63.7	-33	177	-122.6	-46.7	0	0	0	110.9	S526 S534 R908 R912	S526-D530 PolarHBondContact O-N 2.83Å; D530-S534 WeakPolarHBondContact O-CB 3.16Å; D530-S534 PolarHBondContact O-N 2.78Å; D530-S534 PolarHBondContact O-OG 2.88Å; D530-R908 IonicContact OD1-CZ 3.61Å; D530-R908 IonicContact OD1-NE 2.68Å; D530-R908 PolarHBondContact OD1-NE 3.29Å; D530-R908 IonicContact OD1-NH2 3.25Å; D530-R908 PolarHBondContact OD1-NH2 3.03Å; D530-R912 IonicContact OD1-CZ 3.62Å; D530-R912 IonicContact OD1-NH2 3.6Å; D530-R912 PolarHBondContact OD1-NH2 2.67Å; D530-R912 IonicContact OD2-CZ 2.74Å; D530-R912 IonicContact OD2-NE 2.62Å; D530-R912 PolarHBondContact OD2-NE 3.09Å; D530-R912 IonicContact OD2-NH2 3.92Å; D530-R912 PolarHBondContact OD2-NH2 2.74Å
531	G	87.3	Confident	87.4	Confident	40 Å²	40	69 Å²	69	41%	0.412	36%	0.358	S	S	.	.	H	α-helix	trans	-64.5	-44	169.9	0	0	0	0	0	113.7	Q527 M529 S534 S535	Q527-G531 PolarHBondContact O-N 2.63Å; M529-G531 PolarHBondContact O-N 3.14Å; G531-S534 PolarHBondContact O-N 2.83Å; G531-S535 WeakPolarHBondContact O-CB 3.37Å; G531-S535 PolarHBondContact O-N 2.82Å
532	A	88.6	Confident	87.6	Confident	42 Å²	42	69.9 Å²	69.9	35%	0.347	36%	0.361	S	S	.	.	H	α-helix	trans	-64	-50.1	176.5	0	0	0	0	0	112	R528 M529 S534 S535 M536	R528-A532 WeakPolarHBondContact O-CB 3.47Å; R528-A532 PolarHBondContact O-N 3.45Å; M529-A532 PolarHBondContact O-N 2.96Å; M529-A532 VanDerWaalsContact O-N 3.11Å; A532-S534 VanDerWaalsContact C-N 3.35Å; A532-S534 PolarHBondContact O-N 2.96Å; A532-S535 WeakPolarHBondContact O-CB 3.39Å; A532-S535 PolarHBondContact O-N 2.79Å; A532-S535 VanDerWaalsContact O-N 3.1Å; A532-M536 WeakPolarHBondContact O-CG 3.18Å; A532-M536 PolarHBondContact O-N 2.97Å
533	F	91	Very high	87.6	Confident	23 Å²	23	72.8 Å²	72.8	10%	0.101	37%	0.374	C	S	.	.	H	α-helix	trans	-60.4	-42.3	175.8	-74.5	-67.3	0	0	0	112.1	M529 S535 M536 Q537 V904 G907 R908 V911	M529-F533 HydrophobicContact CE-CE2 3.97Å; M529-F533 HydrophobicContact CE-CZ 4.44Å; M529-F533 WeakPolarHBondContact O-CD2 3.26Å; M529-F533 PolarHBondContact O-N 2.71Å; F533-S535 VanDerWaalsContact C-N 3.27Å; F533-S535 PolarHBondContact O-N 3.34Å; F533-M536 HydrophobicContact CD1-CE 3.44Å; F533-M536 VanDerWaalsContact CD1-CE 3.44Å; F533-M536 HydrophobicContact CE1-CE 3.77Å; F533-M536 HydrophobicContact CG-CE 4.13Å; F533-M536 PolarHBondContact O-N 3.23Å; F533-Q537 WeakPolarHBondContact O-CB 3.33Å; F533-Q537 PolarHBondContact O-N 3.47Å; F533-V904 HydrophobicContact CD1-CG1 4.36Å; F533-V904 WeakPolarHBondContact CD1-O 3.49Å; F533-G907 VanDerWaalsContact CZ-O 3.32Å; F533-G907 WeakPolarHBondContact CZ-O 3.45Å; F533-R908 HydrophobicContact CB-CB 4.33Å; F533-R908 HydrophobicContact CB-CG 4.2Å; F533-R908 HydrophobicContact CD1-CB 4.19Å; F533-R908 HydrophobicContact CD2-CB 4.12Å; F533-R908 HydrophobicContact CD2-CG 4.19Å; F533-R908 HydrophobicContact CG-CB 3.97Å; F533-R908 HydrophobicContact CG-CG 4.21Å; F533-V911 HydrophobicContact CE2-CB 4.35Å; F533-V911 HydrophobicContact CE2-CG2 3.91Å; F533-V911 HydrophobicContact CZ-CG2 4.36Å
534	S	88.9	Confident	87.7	Confident	36 Å²	36	68.1 Å²	68.1	25%	0.252	35%	0.354	S	S	.	.	H	α-helix	trans	-63.8	-32.1	175.4	-59.4	0	0	0	0	112.7	D530 G531 A532 R538	D530-S534 WeakPolarHBondContact O-CB 3.16Å; D530-S534 PolarHBondContact O-N 2.78Å; D530-S534 PolarHBondContact O-OG 2.88Å; G531-S534 PolarHBondContact O-N 2.83Å; A532-S534 VanDerWaalsContact C-N 3.35Å; A532-S534 PolarHBondContact O-N 2.96Å; S534-R538 WeakPolarHBondContact O-CB 3.33Å; S534-R538 PolarHBondContact O-N 2.84Å
535	S	88.6	Confident	87.6	Confident	56 Å²	56	68 Å²	68	39%	0.392	36%	0.356	S	S	.	.	H	α-helix	trans	-71.3	-45.1	173.9	-160.6	0	0	0	0	111.5	G531 A532 F533 R538 S539	G531-S535 WeakPolarHBondContact O-CB 3.37Å; G531-S535 PolarHBondContact O-N 2.82Å; A532-S535 WeakPolarHBondContact O-CB 3.39Å; A532-S535 PolarHBondContact O-N 2.79Å; A532-S535 VanDerWaalsContact O-N 3.1Å; F533-S535 VanDerWaalsContact C-N 3.27Å; F533-S535 PolarHBondContact O-N 3.34Å; S535-R538 PolarHBondContact O-N 2.91Å; S535-S539 WeakPolarHBondContact O-CB 3.42Å; S535-S539 PolarHBondContact O-N 2.89Å; S535-S539 PolarHBondContact O-OG 2.91Å
536	M	88.7	Confident	87.5	Confident	84 Å²	84	66.5 Å²	66.5	41%	0.414	36%	0.358	S	S	.	.	H	α-helix	trans	-62.4	-46.2	176.3	-68.3	-172.5	-65.8	0	0	111.9	A532 F533 R538 S539 V540 V904	A532-M536 WeakPolarHBondContact O-CG 3.18Å; A532-M536 PolarHBondContact O-N 2.97Å; F533-M536 HydrophobicContact CD1-CE 3.44Å; F533-M536 VanDerWaalsContact CD1-CE 3.44Å; F533-M536 HydrophobicContact CE1-CE 3.77Å; F533-M536 HydrophobicContact CG-CE 4.13Å; F533-M536 PolarHBondContact O-N 3.23Å; M536-R538 PolarHBondContact O-N 2.85Å; M536-S539 WeakPolarHBondContact O-CB 3.35Å; M536-S539 PolarHBondContact O-N 3.02Å; M536-V540 WeakPolarHBondContact O-CG2 3.44Å; M536-V540 PolarHBondContact O-N 3.21Å; M536-V904 HydrophobicContact CB-CG2 4.27Å
537	Q	89.3	Confident	87.4	Confident	59 Å²	59	68.3 Å²	68.3	28%	0.276	36%	0.362	S	S	.	.	H	α-helix	trans	-58	-45.8	176.4	-170.2	173.5	47.2	0	0	111.8	F533 S539 Q541 V904 E905	F533-Q537 WeakPolarHBondContact O-CB 3.33Å; F533-Q537 PolarHBondContact O-N 3.47Å; Q537-S539 VanDerWaalsContact C-N 3.33Å; Q537-S539 PolarHBondContact O-N 2.89Å; Q537-Q541 WeakPolarHBondContact O-CG 3.43Å; Q537-Q541 PolarHBondContact O-N 2.88Å; Q537-Q541 VanDerWaalsContact O-N 3.1Å; Q537-V904 HydrophobicContact CB-CG1 4.03Å; Q537-E905 PolarHBondContact NE2-OE2 2.66Å
538	R	88.4	Confident	87.3	Confident	131 Å²	131	62.9 Å²	62.9	49%	0.494	34%	0.342	S	S	.	.	H	α-helix	trans	-62.2	-40.2	173.9	-170.7	-174.3	-57.8	111.3	1.9	111.8	S534 S535 M536 Q541 Q542	S534-R538 WeakPolarHBondContact O-CB 3.33Å; S534-R538 PolarHBondContact O-N 2.84Å; S535-R538 PolarHBondContact O-N 2.91Å; M536-R538 PolarHBondContact O-N 2.85Å; R538-Q541 PolarHBondContact O-N 3.31Å; R538-Q542 HydrophobicContact CG-CG 4.41Å; R538-Q542 WeakPolarHBondContact O-CB 3.38Å; R538-Q542 VanDerWaalsContact O-CG 3.28Å; R538-Q542 WeakPolarHBondContact O-CG 3.37Å; R538-Q542 PolarHBondContact O-N 3.08Å
539	S	87.9	Confident	87.2	Confident	44 Å²	44	64.5 Å²	64.5	31%	0.308	35%	0.348	S	S	.	.	H	α-helix	trans	-66.3	-47.1	-179	-58.7	0	0	0	0	111.2	S535 M536 Q537 Q541 Q542 H543	S535-S539 WeakPolarHBondContact O-CB 3.42Å; S535-S539 PolarHBondContact O-N 2.89Å; S535-S539 PolarHBondContact O-OG 2.91Å; M536-S539 WeakPolarHBondContact O-CB 3.35Å; M536-S539 PolarHBondContact O-N 3.02Å; Q537-S539 VanDerWaalsContact C-N 3.33Å; Q537-S539 PolarHBondContact O-N 2.89Å; S539-Q541 VanDerWaalsContact C-N 3.34Å; S539-Q541 PolarHBondContact O-N 2.95Å; S539-Q542 PolarHBondContact O-N 3.36Å; S539-H543 WeakPolarHBondContact O-CB 3.28Å; S539-H543 PolarHBondContact O-N 2.74Å; S539-H543 PolarHBondContact O-ND1 3.08Å
540	V	89.4	Confident	87.2	Confident	31 Å²	31	66.3 Å²	66.3	19%	0.188	36%	0.357	C	S	.	.	H	α-helix	trans	-60.8	-41.9	175.8	173.7	0	0	0	0	111.2	M536 G544 R897 L900 Q901	M536-V540 WeakPolarHBondContact O-CG2 3.44Å; M536-V540 PolarHBondContact O-N 3.21Å; V540-G544 PolarHBondContact O-N 2.9Å; V540-R897 HydrophobicContact CG1-CG 4.33Å; V540-L900 HydrophobicContact CG1-CB 4.31Å; V540-L900 HydrophobicContact CG2-CB 4.45Å; V540-Q901 HydrophobicContact CG1-CG 3.75Å
541	Q	86.2	Confident	87.2	Confident	91 Å²	91	64.9 Å²	64.9	43%	0.425	35%	0.349	S	S	.	.	H	α-helix	trans	-63.5	-45.3	174.8	-72.8	176.7	-1.8	0	0	112.6	Q537 R538 S539 A545	Q537-Q541 WeakPolarHBondContact O-CG 3.43Å; Q537-Q541 PolarHBondContact O-N 2.88Å; Q537-Q541 VanDerWaalsContact O-N 3.1Å; R538-Q541 PolarHBondContact O-N 3.31Å; S539-Q541 VanDerWaalsContact C-N 3.34Å; S539-Q541 PolarHBondContact O-N 2.95Å; Q541-A545 VanDerWaalsContact O-CB 3.26Å; Q541-A545 WeakPolarHBondContact O-CB 3.42Å; Q541-A545 PolarHBondContact O-N 3.22Å
542	Q	87.1	Confident	87.2	Confident	115 Å²	115	65.4 Å²	65.4	54%	0.537	34%	0.344	S	S	.	.	H	α-helix	trans	-67.1	-43.2	-179.5	-75.8	176.2	-20.4	0	0	112.6	R538 S539 A545 A546	R538-Q542 HydrophobicContact CG-CG 4.41Å; R538-Q542 WeakPolarHBondContact O-CB 3.38Å; R538-Q542 VanDerWaalsContact O-CG 3.28Å; R538-Q542 WeakPolarHBondContact O-CG 3.37Å; R538-Q542 PolarHBondContact O-N 3.08Å; S539-Q542 PolarHBondContact O-N 3.36Å; Q542-A545 PolarHBondContact O-N 2.88Å; Q542-A546 WeakPolarHBondContact O-CB 3.33Å; Q542-A546 PolarHBondContact O-N 3.26Å
543	H	85.3	Confident	87.1	Confident	122 Å²	122	65.3 Å²	65.3	57%	0.565	35%	0.347	S	S	*	.	H	α-helix	trans	-68.3	-44.7	177.9	-71.7	77.4	0	0	0	111.3	S539 A545 A546 Q547	S539-H543 WeakPolarHBondContact O-CB 3.28Å; S539-H543 PolarHBondContact O-N 2.74Å; S539-H543 PolarHBondContact O-ND1 3.08Å; H543-A545 VanDerWaalsContact C-N 3.32Å; H543-A545 PolarHBondContact O-N 3.38Å; H543-A546 WeakPolarHBondContact O-CB 3.43Å; H543-A546 PolarHBondContact O-N 2.8Å; H543-Q547 WeakPolarHBondContact O-CG 3.36Å; H543-Q547 PolarHBondContact O-N 2.73Å
544	G	85.6	Confident	86.8	Confident	6 Å²	6	70.2 Å²	70.2	6%	0.062	37%	0.366	C	S	.	.	H	α-helix	trans	-60.3	-39.4	174.7	0	0	0	0	0	112.9	V540 A546 A548	V540-G544 PolarHBondContact O-N 2.9Å; G544-A546 VanDerWaalsContact C-N 3.34Å; G544-A548 VanDerWaalsContact O-CB 3.29Å; G544-A548 WeakPolarHBondContact O-CB 3.2Å; G544-A548 PolarHBondContact O-N 3.38Å
545	A	85	Confident	86.6	Confident	41 Å²	41	69.8 Å²	69.8	34%	0.339	37%	0.365	S	S	.	.	H	α-helix	trans	-71.7	-23.6	174.2	0	0	0	0	0	113.6	Q541 Q542 H543 R549	Q541-A545 VanDerWaalsContact O-CB 3.26Å; Q541-A545 WeakPolarHBondContact O-CB 3.42Å; Q541-A545 PolarHBondContact O-N 3.22Å; Q542-A545 PolarHBondContact O-N 2.88Å; H543-A545 VanDerWaalsContact C-N 3.32Å; H543-A545 PolarHBondContact O-N 3.38Å; A545-R549 WeakPolarHBondContact O-CG 3.47Å; A545-R549 PolarHBondContact O-NE 2.99Å
546	A	84.3	Confident	86.5	Confident	48 Å²	48	73.4 Å²	73.4	40%	0.397	38%	0.375	S	S	.	.	H	α-helix	trans	-75.8	-49.1	171	0	0	0	0	0	111.2	Q542 H543 G544 A548 R549 M550	Q542-A546 WeakPolarHBondContact O-CB 3.33Å; Q542-A546 PolarHBondContact O-N 3.26Å; H543-A546 WeakPolarHBondContact O-CB 3.43Å; H543-A546 PolarHBondContact O-N 2.8Å; G544-A546 VanDerWaalsContact C-N 3.34Å; A546-A548 PolarHBondContact O-N 3.07Å; A546-R549 PolarHBondContact O-N 2.89Å; A546-M550 PolarHBondContact O-N 3.41Å
547	Q	84.9	Confident	86.4	Confident	78 Å²	78	71.8 Å²	71.8	36%	0.364	38%	0.375	S	S	.	.	H	α-helix	trans	-59.7	-45.8	177.9	-72.1	169.9	-38.6	0	0	112.2	H543 R549 M550 L551 L893	H543-Q547 WeakPolarHBondContact O-CG 3.36Å; H543-Q547 PolarHBondContact O-N 2.73Å; Q547-R549 VanDerWaalsContact C-N 3.32Å; Q547-R549 PolarHBondContact O-N 3.26Å; Q547-M550 WeakPolarHBondContact O-CB 3.43Å; Q547-M550 PolarHBondContact O-N 2.83Å; Q547-M550 VanDerWaalsContact O-N 3.17Å; Q547-L551 PolarHBondContact O-N 3.23Å; Q547-L893 HydrophobicContact CB-CD1 4.25Å; Q547-L893 HydrophobicContact CG-CD1 4.47Å
548	A	84.7	Confident	86.3	Confident	31 Å²	31	69.4 Å²	69.4	26%	0.256	37%	0.365	S	S	.	.	H	α-helix	trans	-61.2	-38.9	177.2	0	0	0	0	0	112.6	G544 A546 T552	G544-A548 VanDerWaalsContact O-CB 3.29Å; G544-A548 WeakPolarHBondContact O-CB 3.2Å; G544-A548 PolarHBondContact O-N 3.38Å; A546-A548 PolarHBondContact O-N 3.07Å; A548-T552 VanDerWaalsContact O-CB 3.29Å; A548-T552 WeakPolarHBondContact O-CB 3.36Å; A548-T552 PolarHBondContact O-N 3.22Å; A548-T552 PolarHBondContact O-OG1 2.86Å
549	R	86.6	Confident	86.1	Confident	178 Å²	178	66.5 Å²	66.5	67%	0.672	36%	0.359	S	S	*	.	H	α-helix	trans	-69	-38.4	174.2	-77.2	-179.1	-67.6	169	2.6	112.3	A545 A546 Q547 T552 G553	A545-R549 WeakPolarHBondContact O-CG 3.47Å; A545-R549 PolarHBondContact O-NE 2.99Å; A546-R549 PolarHBondContact O-N 2.89Å; Q547-R549 VanDerWaalsContact C-N 3.32Å; Q547-R549 PolarHBondContact O-N 3.26Å; R549-T552 PolarHBondContact O-N 3.35Å; R549-G553 PolarHBondContact O-N 3.36Å
550	M	86.5	Confident	86	Confident	91 Å²	91	66.6 Å²	66.6	45%	0.448	37%	0.367	S	S	.	.	H	α-helix	trans	-62	-51.6	176.4	-173.5	-176.7	77	0	0	111.4	A546 Q547 T552 G553 Y554	A546-M550 PolarHBondContact O-N 3.41Å; Q547-M550 WeakPolarHBondContact O-CB 3.43Å; Q547-M550 PolarHBondContact O-N 2.83Å; Q547-M550 VanDerWaalsContact O-N 3.17Å; M550-T552 PolarHBondContact O-N 2.98Å; M550-G553 WeakPolarHBondContact O-CA 3.41Å; M550-G553 PolarHBondContact O-N 3.04Å; M550-G553 VanDerWaalsContact O-N 3.14Å; M550-Y554 HydrophobicContact CE-CE2 4.01Å; M550-Y554 HydrophobicContact CG-CD2 4.3Å; M550-Y554 HydrophobicContact CG-CE1 4.4Å; M550-Y554 HydrophobicContact CG-CE2 3.7Å; M550-Y554 PolarHBondContact O-N 2.96Å; M550-Y554 HydrophobicContact SD-CE2 4.1Å
551	L	87.1	Confident	85.8	Confident	15 Å²	15	69.4 Å²	69.4	8%	0.079	38%	0.38	C	S	.	.	H	α-helix	trans	-64.8	-37.7	177.8	-67.7	177.2	0	0	0	112.4	Q547 G553 Y554 A555 T886 R890 L893	Q547-L551 PolarHBondContact O-N 3.23Å; L551-G553 VanDerWaalsContact C-N 3.3Å; L551-G553 PolarHBondContact O-N 2.95Å; L551-Y554 HydrophobicContact CD2-CD2 4.29Å; L551-Y554 PolarHBondContact O-N 3.06Å; L551-A555 PolarHBondContact O-N 3.08Å; L551-T886 HydrophobicContact CB-CG2 4.45Å; L551-T886 HydrophobicContact CD2-CG2 4.09Å; L551-R890 HydrophobicContact CD1-CB 3.86Å; L551-R890 HydrophobicContact CD1-CG 4.33Å; L551-L893 HydrophobicContact CD1-CD1 3.95Å
552	T	86.7	Confident	85.8	Confident	52 Å²	52	67 Å²	67	32%	0.319	37%	0.37	S	S	.	.	H	α-helix	trans	-62.9	-39.2	173.1	-56.8	0	0	0	0	111.2	A548 R549 M550 A555 H556	A548-T552 VanDerWaalsContact O-CB 3.29Å; A548-T552 WeakPolarHBondContact O-CB 3.36Å; A548-T552 PolarHBondContact O-N 3.22Å; A548-T552 PolarHBondContact O-OG1 2.86Å; R549-T552 PolarHBondContact O-N 3.35Å; M550-T552 PolarHBondContact O-N 2.98Å; T552-A555 PolarHBondContact O-N 3.38Å; T552-H556 PolarHBondContact O-N 3.46Å; T552-H556 VanDerWaalsContact O-N 3.09Å; T552-H556 PolarHBondContact O-ND1 2.97Å
553	G	86.3	Confident	85.7	Confident	39 Å²	39	66.6 Å²	66.6	40%	0.402	38%	0.375	S	S	.	.	H	α-helix	trans	-65.7	-40.1	174.1	0	0	0	0	0	113.1	R549 M550 L551 A557	R549-G553 PolarHBondContact O-N 3.36Å; M550-G553 WeakPolarHBondContact O-CA 3.41Å; M550-G553 PolarHBondContact O-N 3.04Å; M550-G553 VanDerWaalsContact O-N 3.14Å; L551-G553 VanDerWaalsContact C-N 3.3Å; L551-G553 PolarHBondContact O-N 2.95Å; G553-A557 VanDerWaalsContact O-CB 3.31Å; G553-A557 WeakPolarHBondContact O-CB 3.29Å; G553-A557 PolarHBondContact O-N 3.02Å
554	Y	84.8	Confident	85.7	Confident	127 Å²	127	62.2 Å²	62.2	50%	0.498	36%	0.363	S	S	.	.	H	α-helix	trans	-65.3	-42.2	173.9	-66.3	-24.7	0	0	0	112.2	M550 L551 A557 V558	M550-Y554 HydrophobicContact CE-CE2 4.01Å; M550-Y554 HydrophobicContact CG-CD2 4.3Å; M550-Y554 HydrophobicContact CG-CE1 4.4Å; M550-Y554 HydrophobicContact CG-CE2 3.7Å; M550-Y554 PolarHBondContact O-N 2.96Å; M550-Y554 HydrophobicContact SD-CE2 4.1Å; L551-Y554 HydrophobicContact CD2-CD2 4.29Å; L551-Y554 PolarHBondContact O-N 3.06Å; Y554-A557 PolarHBondContact O-N 2.89Å; Y554-V558 WeakPolarHBondContact O-CG2 3.29Å; Y554-V558 PolarHBondContact O-N 3.23Å
555	A	85.4	Confident	85.6	Confident	27 Å²	27	64.6 Å²	64.6	22%	0.223	37%	0.374	C	S	.	.	H	α-helix	trans	-58.1	-51.3	174	0	0	0	0	0	111.7	L551 T552 A557 V558 D559	L551-A555 PolarHBondContact O-N 3.08Å; T552-A555 PolarHBondContact O-N 3.38Å; A555-A557 VanDerWaalsContact C-N 3.27Å; A555-A557 PolarHBondContact O-N 3.06Å; A555-V558 PolarHBondContact O-N 2.8Å; A555-V558 VanDerWaalsContact O-N 3.11Å; A555-D559 PolarHBondContact O-N 3.23Å
556	H	87	Confident	85.5	Confident	132 Å²	132	66.5 Å²	66.5	61%	0.611	38%	0.376	S	S	*	.	H	α-helix	trans	-62.3	-32.1	176.8	-74.5	73.1	0	0	0	113	T552 G560	T552-H556 PolarHBondContact O-N 3.46Å; T552-H556 VanDerWaalsContact O-N 3.09Å; T552-H556 PolarHBondContact O-ND1 2.97Å; H556-G560 PolarHBondContact O-N 2.86Å
557	A	85.2	Confident	85.5	Confident	50 Å²	50	67.2 Å²	67.2	41%	0.413	38%	0.382	S	S	.	.	H	α-helix	trans	-70.2	-38.7	174.7	0	0	0	0	0	112	G553 Y554 A555 L561	G553-A557 VanDerWaalsContact O-CB 3.31Å; G553-A557 WeakPolarHBondContact O-CB 3.29Å; G553-A557 PolarHBondContact O-N 3.02Å; Y554-A557 PolarHBondContact O-N 2.89Å; A555-A557 VanDerWaalsContact C-N 3.27Å; A555-A557 PolarHBondContact O-N 3.06Å; A557-L561 WeakPolarHBondContact O-CB 3.46Å; A557-L561 WeakPolarHBondContact O-CG 3.4Å; A557-L561 PolarHBondContact O-N 2.82Å
558	V	87.6	Confident	85.5	Confident	9 Å²	9	68.2 Å²	68.2	6%	0.055	39%	0.393	C	S	.	.	H	α-helix	trans	-68.2	-44.8	175.3	171.3	0	0	0	0	111.2	Y554 A555 G560 L561 L562 L879 L882 Q883	Y554-V558 WeakPolarHBondContact O-CG2 3.29Å; Y554-V558 PolarHBondContact O-N 3.23Å; A555-V558 PolarHBondContact O-N 2.8Å; A555-V558 VanDerWaalsContact O-N 3.11Å; V558-G560 PolarHBondContact O-N 3.32Å; V558-L561 PolarHBondContact O-N 3.3Å; V558-L562 HydrophobicContact CG1-CD1 4.3Å; V558-L562 WeakPolarHBondContact O-CG 3.42Å; V558-L562 PolarHBondContact O-N 3.01Å; V558-L879 HydrophobicContact CG1-CB 4.18Å; V558-L879 HydrophobicContact CG1-CD2 4.28Å; V558-L879 WeakPolarHBondContact CG1-O 3.49Å; V558-L882 HydrophobicContact CG2-CD2 3.92Å; V558-L882 HydrophobicContact CG2-CG 4.3Å; V558-Q883 HydrophobicContact CG1-CB 4.12Å
559	D	84.7	Confident	85.4	Confident	70 Å²	70	68.4 Å²	68.4	37%	0.374	39%	0.39	S	S	.	.	H	α-helix	trans	-60.6	-44.1	173.7	-72.5	-46.1	0	0	0	111.7	A555 L561 L562 V563 Q883	A555-D559 PolarHBondContact O-N 3.23Å; D559-L561 VanDerWaalsContact C-N 3.33Å; D559-L561 PolarHBondContact O-N 2.69Å; D559-L562 PolarHBondContact O-N 3.33Å; D559-V563 PolarHBondContact O-N 3.41Å; D559-V563 VanDerWaalsContact O-N 3.09Å; D559-Q883 PolarHBondContact OD1-NE2 2.84Å; D559-Q883 PolarHBondContact OD2-NE2 3.17Å
560	G	85.4	Confident	85.3	Confident	46 Å²	46	67.2 Å²	67.2	47%	0.474	39%	0.385	S	S	.	.	H	α-helix	trans	-63.8	-35.2	175.3	0	0	0	0	0	113.4	H556 V558 G564	H556-G560 PolarHBondContact O-N 2.86Å; V558-G560 PolarHBondContact O-N 3.32Å; G560-G564 WeakPolarHBondContact O-CA 3.37Å; G560-G564 PolarHBondContact O-N 2.91Å
561	L	85.9	Confident	85.3	Confident	89 Å²	89	64.9 Å²	64.9	47%	0.466	39%	0.385	S	S	.	.	H	α-helix	trans	-72.5	-37.4	173.9	-76.7	168.1	0	0	0	112.4	A557 V558 D559 N565 L879	A557-L561 WeakPolarHBondContact O-CB 3.46Å; A557-L561 WeakPolarHBondContact O-CG 3.4Å; A557-L561 PolarHBondContact O-N 2.82Å; V558-L561 PolarHBondContact O-N 3.3Å; D559-L561 VanDerWaalsContact C-N 3.33Å; D559-L561 PolarHBondContact O-N 2.69Å; L561-N565 WeakPolarHBondContact O-CB 3.46Å; L561-N565 PolarHBondContact O-N 3.22Å; L561-N565 PolarHBondContact O-ND2 2.92Å; L561-L879 HydrophobicContact CB-CD1 4.29Å; L561-L879 HydrophobicContact CB-CD2 4.47Å
562	L	84.8	Confident	85	Confident	40 Å²	40	66.1 Å²	66.1	21%	0.209	40%	0.397	C	S	.	.	H	α-helix	trans	-59.3	-56.4	174.2	-80.5	165.8	0	0	0	110.8	V558 D559 N565 E566 R876 L879	V558-L562 HydrophobicContact CG1-CD1 4.3Å; V558-L562 WeakPolarHBondContact O-CG 3.42Å; V558-L562 PolarHBondContact O-N 3.01Å; D559-L562 PolarHBondContact O-N 3.33Å; L562-N565 PolarHBondContact O-N 2.74Å; L562-E566 PolarHBondContact O-N 2.77Å; L562-E566 VanDerWaalsContact O-N 3.1Å; L562-R876 HydrophobicContact CD2-CG 4.26Å; L562-L879 HydrophobicContact CD1-CB 4.43Å; L562-L879 HydrophobicContact CD2-CB 3.67Å; L562-L879 HydrophobicContact CD2-CD1 3.89Å; L562-L879 HydrophobicContact CD2-CG 4.44Å; L562-L879 HydrophobicContact CG-CB 3.9Å; L562-L879 HydrophobicContact CG-CD1 4.03Å
563	V	86.2	Confident	84.9	Confident	107 Å²	107	65.2 Å²	65.2	65%	0.648	39%	0.39	S	S	*	.	H	α-helix	trans	-65.8	-41.3	-179.6	178.6	0	0	0	0	111.6	D559 A567	D559-V563 PolarHBondContact O-N 3.41Å; D559-V563 VanDerWaalsContact O-N 3.09Å; V563-A567 WeakPolarHBondContact O-CB 3.41Å; V563-A567 PolarHBondContact O-N 3.36Å
564	G	84.6	Confident	84.9	Confident	30 Å²	30	66.9 Å²	66.9	31%	0.309	39%	0.393	S	S	.	.	H	α-helix	trans	-65.4	-42.2	179.2	0	0	0	0	0	113	G560 T568	G560-G564 WeakPolarHBondContact O-CA 3.37Å; G560-G564 PolarHBondContact O-N 2.91Å; G564-T568 VanDerWaalsContact O-CB 3.29Å; G564-T568 WeakPolarHBondContact O-CB 3.33Å; G564-T568 PolarHBondContact O-N 2.8Å; G564-T568 PolarHBondContact O-OG1 2.73Å
565	N	84	Confident	84.8	Confident	56 Å²	56	63.1 Å²	63.1	30%	0.299	39%	0.388	S	S	.	.	H	α-helix	trans	-68.7	-42.2	178.1	-72.1	-19.3	0	0	0	111.4	L561 L562 T568 L569	L561-N565 WeakPolarHBondContact O-CB 3.46Å; L561-N565 PolarHBondContact O-N 3.22Å; L561-N565 PolarHBondContact O-ND2 2.92Å; L562-N565 PolarHBondContact O-N 2.74Å; N565-T568 PolarHBondContact O-N 3.28Å; N565-L569 WeakPolarHBondContact O-CB 3.49Å; N565-L569 VanDerWaalsContact O-CG 3.25Å; N565-L569 WeakPolarHBondContact O-CG 3.36Å; N565-L569 PolarHBondContact O-N 3.22Å
566	E	82.6	Confident	84.7	Confident	82 Å²	82	64.3 Å²	64.3	38%	0.383	39%	0.392	S	S	.	.	H	α-helix	trans	-60.1	-49.3	175	179.4	175	167	0	0	111.5	L562 T568 L569 R570	L562-E566 PolarHBondContact O-N 2.77Å; L562-E566 VanDerWaalsContact O-N 3.1Å; E566-T568 VanDerWaalsContact C-N 3.29Å; E566-T568 PolarHBondContact O-N 3.12Å; E566-L569 PolarHBondContact O-N 2.96Å; E566-R570 VanDerWaalsContact O-CB 3.26Å; E566-R570 WeakPolarHBondContact O-CB 3.21Å; E566-R570 PolarHBondContact O-N 3.06Å; E566-R570 IonicContact OE1-CZ 2.72Å; E566-R570 IonicContact OE1-NE 3.43Å; E566-R570 IonicContact OE1-NH2 3.11Å; E566-R570 PolarHBondContact OE1-NH2 3.27Å
567	A	84.8	Confident	84.6	Confident	62 Å²	62	62 Å²	62	51%	0.512	38%	0.382	S	S	.	.	H	α-helix	trans	-60.5	-39.6	178.6	0	0	0	0	0	112.2	V563 G571	V563-A567 WeakPolarHBondContact O-CB 3.41Å; V563-A567 PolarHBondContact O-N 3.36Å; A567-G571 PolarHBondContact O-N 3.24Å
568	T	84.4	Confident	84.6	Confident	99 Å²	99	64.2 Å²	64.2	61%	0.607	39%	0.39	S	S	*	.	H	α-helix	trans	-70.6	-43.6	179.9	-54.9	0	0	0	0	112	G564 N565 E566 G571 A572	G564-T568 VanDerWaalsContact O-CB 3.29Å; G564-T568 WeakPolarHBondContact O-CB 3.33Å; G564-T568 PolarHBondContact O-N 2.8Å; G564-T568 PolarHBondContact O-OG1 2.73Å; N565-T568 PolarHBondContact O-N 3.28Å; E566-T568 VanDerWaalsContact C-N 3.29Å; E566-T568 PolarHBondContact O-N 3.12Å; T568-G571 PolarHBondContact O-N 3.48Å; T568-A572 WeakPolarHBondContact O-CB 3.37Å; T568-A572 PolarHBondContact O-N 3.08Å
569	L	83.8	Confident	84.5	Confident	35 Å²	35	69.6 Å²	69.6	18%	0.183	42%	0.418	C	S	.	.	H	α-helix	trans	-66.3	-41.2	177.3	-70.9	167.8	0	0	0	111.5	N565 E566 A572 L573 L868 Q872	N565-L569 WeakPolarHBondContact O-CB 3.49Å; N565-L569 VanDerWaalsContact O-CG 3.25Å; N565-L569 WeakPolarHBondContact O-CG 3.36Å; N565-L569 PolarHBondContact O-N 3.22Å; E566-L569 PolarHBondContact O-N 2.96Å; L569-A572 PolarHBondContact O-N 2.64Å; L569-L573 PolarHBondContact O-N 2.9Å; L569-L868 HydrophobicContact CD2-CD2 3.76Å; L569-Q872 HydrophobicContact CD1-CB 3.89Å; L569-Q872 HydrophobicContact CD1-CG 4.1Å
570	R	84.1	Confident	84.6	Confident	153 Å²	153	67.6 Å²	67.6	58%	0.577	41%	0.408	S	S	*	.	H	α-helix	trans	-63.8	-40.8	173.9	-166.7	-172.6	-65.9	-128.7	6.6	111.9	E566 L573 V574	E566-R570 VanDerWaalsContact O-CB 3.26Å; E566-R570 WeakPolarHBondContact O-CB 3.21Å; E566-R570 PolarHBondContact O-N 3.06Å; E566-R570 IonicContact OE1-CZ 2.72Å; E566-R570 IonicContact OE1-NE 3.43Å; E566-R570 IonicContact OE1-NH2 3.11Å; E566-R570 PolarHBondContact OE1-NH2 3.27Å; R570-L573 PolarHBondContact O-N 2.88Å; R570-V574 WeakPolarHBondContact O-CG2 3.32Å; R570-V574 PolarHBondContact O-N 3.45Å
571	G	85.2	Confident	84.5	Confident	43 Å²	43	67 Å²	67	44%	0.443	40%	0.402	S	S	.	.	H	α-helix	trans	-64.7	-36.7	173.3	0	0	0	0	0	113.3	A567 T568 A575	A567-G571 PolarHBondContact O-N 3.24Å; T568-G571 PolarHBondContact O-N 3.48Å; G571-A575 WeakPolarHBondContact O-CB 3.26Å; G571-A575 PolarHBondContact O-N 3.41Å
572	A	81.2	Confident	84.5	Confident	40 Å²	40	64.7 Å²	64.7	33%	0.331	40%	0.4	S	S	.	.	H	α-helix	trans	-67.4	-40	175.5	0	0	0	0	0	112.4	T568 L569 A575 V576	T568-A572 WeakPolarHBondContact O-CB 3.37Å; T568-A572 PolarHBondContact O-N 3.08Å; L569-A572 PolarHBondContact O-N 2.64Å; A572-A575 PolarHBondContact O-N 3.36Å; A572-V576 WeakPolarHBondContact O-CG2 3.22Å; A572-V576 PolarHBondContact O-N 2.91Å
573	L	84.4	Confident	84.6	Confident	33 Å²	33	66.7 Å²	66.7	17%	0.173	41%	0.413	C	S	.	.	H	α-helix	trans	-58	-55	173.2	-77.1	165.5	0	0	0	111.4	L569 R570 A575 V576 E577 E865 L868	L569-L573 PolarHBondContact O-N 2.9Å; R570-L573 PolarHBondContact O-N 2.88Å; L573-A575 PolarHBondContact O-N 3.29Å; L573-V576 WeakPolarHBondContact O-CA 2.79Å; L573-V576 PolarHBondContact O-N 2.91Å; L573-E577 WeakPolarHBondContact O-CG 3.33Å; L573-E577 PolarHBondContact O-N 3.11Å; L573-E865 HydrophobicContact CD2-CG 4.16Å; L573-L868 HydrophobicContact CD2-CB 4.09Å; L573-L868 HydrophobicContact CD2-CD1 3.49Å; L573-L868 VanDerWaalsContact CD2-CD1 3.49Å; L573-L868 HydrophobicContact CD2-CG 4.42Å; L573-L868 HydrophobicContact CG-CB 4.41Å; L573-L868 HydrophobicContact CG-CD1 3.92Å
574	V	86.4	Confident	84.6	Confident	75 Å²	75	63.8 Å²	63.8	46%	0.455	39%	0.393	S	S	.	.	H	α-helix	trans	-59.2	-34.8	178.9	175	0	0	0	0	112.1	R570 T578	R570-V574 WeakPolarHBondContact O-CG2 3.32Å; R570-V574 PolarHBondContact O-N 3.45Å; V574-T578 VanDerWaalsContact O-CB 3.3Å; V574-T578 WeakPolarHBondContact O-CB 3.5Å; V574-T578 PolarHBondContact O-N 3.47Å; V574-T578 PolarHBondContact O-OG1 3.08Å
575	A	83.4	Confident	84.7	Confident	48 Å²	48	65.2 Å²	65.2	40%	0.397	40%	0.402	S	S	.	.	H	α-helix	trans	-67.1	-40.3	173.8	0	0	0	0	0	112.7	G571 A572 L573 L579	G571-A575 WeakPolarHBondContact O-CB 3.26Å; G571-A575 PolarHBondContact O-N 3.41Å; A572-A575 PolarHBondContact O-N 3.36Å; L573-A575 PolarHBondContact O-N 3.29Å; A575-L579 WeakPolarHBondContact O-CB 3.42Å; A575-L579 VanDerWaalsContact O-CG 3.25Å; A575-L579 WeakPolarHBondContact O-CG 3.38Å; A575-L579 PolarHBondContact O-N 3Å
576	V	83.3	Confident	84.8	Confident	51 Å²	51	68.3 Å²	68.3	31%	0.309	42%	0.418	S	S	.	.	H	α-helix	trans	-69	-44.1	175.9	172.9	0	0	0	0	111.1	A572 L573 T578 L579 V580 L861	A572-V576 WeakPolarHBondContact O-CG2 3.22Å; A572-V576 PolarHBondContact O-N 2.91Å; L573-V576 WeakPolarHBondContact O-CA 2.79Å; L573-V576 PolarHBondContact O-N 2.91Å; V576-T578 VanDerWaalsContact C-N 3.34Å; V576-T578 PolarHBondContact O-N 3.37Å; V576-L579 PolarHBondContact O-N 3.2Å; V576-V580 HydrophobicContact CG1-CG2 4.28Å; V576-V580 WeakPolarHBondContact O-CB 3.22Å; V576-V580 WeakPolarHBondContact O-CG2 3.05Å; V576-V580 PolarHBondContact O-N 3.14Å; V576-L861 HydrophobicContact CG1-CD1 3.88Å
577	E	84.4	Confident	85.1	Confident	85 Å²	85	66 Å²	66	40%	0.397	41%	0.409	S	S	.	.	H	α-helix	trans	-53.3	-50.3	171.8	-69.9	164	-156.6	0	0	111.1	L573 L579 V580 G581 L861	L573-E577 WeakPolarHBondContact O-CG 3.33Å; L573-E577 PolarHBondContact O-N 3.11Å; E577-L579 PolarHBondContact O-N 2.93Å; E577-V580 PolarHBondContact O-N 3.19Å; E577-G581 PolarHBondContact O-N 2.9Å; E577-L861 HydrophobicContact CG-CD1 3.96Å; E577-L861 HydrophobicContact CG-CD2 4.44Å
578	T	86.3	Confident	85.2	Confident	96 Å²	96	64.4 Å²	64.4	59%	0.589	40%	0.396	S	S	*	.	H	α-helix	trans	-62.7	-40.6	-179.9	-57	0	0	0	0	111.9	V574 V576 G582	V574-T578 VanDerWaalsContact O-CB 3.3Å; V574-T578 WeakPolarHBondContact O-CB 3.5Å; V574-T578 PolarHBondContact O-N 3.47Å; V574-T578 PolarHBondContact O-OG1 3.08Å; V576-T578 VanDerWaalsContact C-N 3.34Å; V576-T578 PolarHBondContact O-N 3.37Å; T578-G582 PolarHBondContact O-N 3.02Å
579	L	84.3	Confident	85.3	Confident	121 Å²	121	63.4 Å²	63.4	63%	0.634	39%	0.387	S	S	*	.	H	α-helix	trans	-69.2	-44.2	177.8	-75.1	167.9	0	0	0	112.2	A575 V576 E577 G582 V583	A575-L579 WeakPolarHBondContact O-CB 3.42Å; A575-L579 VanDerWaalsContact O-CG 3.25Å; A575-L579 WeakPolarHBondContact O-CG 3.38Å; A575-L579 PolarHBondContact O-N 3Å; V576-L579 PolarHBondContact O-N 3.2Å; E577-L579 PolarHBondContact O-N 2.93Å; L579-G582 PolarHBondContact O-N 2.82Å; L579-V583 WeakPolarHBondContact O-CG2 3.44Å; L579-V583 PolarHBondContact O-N 2.8Å
580	V	86.3	Confident	85.4	Confident	29 Å²	29	63.1 Å²	63.1	18%	0.176	39%	0.392	C	S	.	.	H	α-helix	trans	-64.9	-46.7	178.4	172.4	0	0	0	0	110.5	V576 E577 G582 V583 Q584	V576-V580 HydrophobicContact CG1-CG2 4.28Å; V576-V580 WeakPolarHBondContact O-CB 3.22Å; V576-V580 WeakPolarHBondContact O-CG2 3.05Å; V576-V580 PolarHBondContact O-N 3.14Å; E577-V580 PolarHBondContact O-N 3.19Å; V580-G582 VanDerWaalsContact C-N 3.34Å; V580-G582 PolarHBondContact O-N 2.87Å; V580-V583 PolarHBondContact O-N 2.81Å; V580-Q584 HydrophobicContact CG1-CG 4.5Å; V580-Q584 WeakPolarHBondContact O-CG 3.48Å; V580-Q584 PolarHBondContact O-N 2.95Å
581	G	84.4	Confident	85.6	Confident	34 Å²	34	56.3 Å²	56.3	35%	0.351	37%	0.369	S	S	.	.	H	α-helix	trans	-62.3	-39.2	175.7	0	0	0	0	0	112.9	E577 Q584 A585	E577-G581 PolarHBondContact O-N 2.9Å; G581-Q584 PolarHBondContact O-N 2.79Å; G581-A585 WeakPolarHBondContact O-CB 3.38Å; G581-A585 PolarHBondContact O-N 2.62Å
582	G	86.6	Confident	85.7	Confident	40 Å²	40	57 Å²	57	41%	0.412	37%	0.37	S	S	.	.	H	α-helix	trans	-63.3	-40.8	174.6	0	0	0	0	0	113.4	T578 L579 V580 L586	T578-G582 PolarHBondContact O-N 3.02Å; L579-G582 PolarHBondContact O-N 2.82Å; V580-G582 VanDerWaalsContact C-N 3.34Å; V580-G582 PolarHBondContact O-N 2.87Å; G582-L586 WeakPolarHBondContact O-CB 3.14Å; G582-L586 PolarHBondContact O-N 2.81Å
583	V	85.4	Confident	86	Confident	81 Å²	81	60.7 Å²	60.7	49%	0.491	38%	0.375	S	S	.	.	H	α-helix	trans	-68	-43.7	174.8	170.2	0	0	0	0	111.4	L579 V580 L586 V587 V853	L579-V583 WeakPolarHBondContact O-CG2 3.44Å; L579-V583 PolarHBondContact O-N 2.8Å; V580-V583 PolarHBondContact O-N 2.81Å; V583-L586 PolarHBondContact O-N 2.52Å; V583-V587 HydrophobicContact CG1-CG2 4.44Å; V583-V587 WeakPolarHBondContact O-CB 3.29Å; V583-V587 WeakPolarHBondContact O-CG2 3.49Å; V583-V587 PolarHBondContact O-N 2.9Å; V583-V853 HydrophobicContact CG1-CG1 4.27Å
584	Q	86.7	Confident	86.1	Confident	47 Å²	47	61.6 Å²	61.6	22%	0.22	38%	0.384	C	S	.	.	H	α-helix	trans	-59.5	-47.5	176.4	-75.1	172	-24.5	0	0	111.4	V580 G581 L586 V587 A588 V853 E854	V580-Q584 HydrophobicContact CG1-CG 4.5Å; V580-Q584 WeakPolarHBondContact O-CG 3.48Å; V580-Q584 PolarHBondContact O-N 2.95Å; G581-Q584 PolarHBondContact O-N 2.79Å; Q584-L586 PolarHBondContact O-N 3.37Å; Q584-V587 PolarHBondContact O-N 3.4Å; Q584-A588 WeakPolarHBondContact O-CB 3.5Å; Q584-A588 PolarHBondContact O-N 3.01Å; Q584-V853 HydrophobicContact CG-CG1 4.4Å; Q584-E854 PolarHBondContact NE2-O 2.95Å
585	A	86.3	Confident	86.2	Confident	60 Å²	60	62 Å²	62	50%	0.496	38%	0.377	S	S	.	.	H	α-helix	trans	-61.2	-43.7	177.2	0	0	0	0	0	112.6	G581 A588 D589	G581-A585 WeakPolarHBondContact O-CB 3.38Å; G581-A585 PolarHBondContact O-N 2.62Å; A585-A588 PolarHBondContact O-N 3.37Å; A585-D589 VanDerWaalsContact O-CB 3.24Å; A585-D589 WeakPolarHBondContact O-CB 3.23Å; A585-D589 PolarHBondContact O-N 3.36Å
586	L	87.4	Confident	86.4	Confident	121 Å²	121	63.9 Å²	63.9	63%	0.634	38%	0.378	S	S	*	.	H	α-helix	trans	-68.8	-32.9	179.8	-172.3	131.1	0	0	0	112.8	G582 V583 Q584 G590	G582-L586 WeakPolarHBondContact O-CB 3.14Å; G582-L586 PolarHBondContact O-N 2.81Å; V583-L586 PolarHBondContact O-N 2.52Å; Q584-L586 PolarHBondContact O-N 3.37Å; L586-G590 PolarHBondContact O-N 2.82Å
587	V	87.1	Confident	86.6	Confident	33 Å²	33	67.7 Å²	67.7	20%	0.2	39%	0.39	C	S	.	.	H	α-helix	trans	-73.7	-39.5	173.5	170.9	0	0	0	0	111.6	V583 Q584 G590 A591 H850 V853	V583-V587 HydrophobicContact CG1-CG2 4.44Å; V583-V587 WeakPolarHBondContact O-CB 3.29Å; V583-V587 WeakPolarHBondContact O-CG2 3.49Å; V583-V587 PolarHBondContact O-N 2.9Å; Q584-V587 PolarHBondContact O-N 3.4Å; V587-G590 PolarHBondContact O-N 3.02Å; V587-A591 WeakPolarHBondContact O-CB 3.39Å; V587-A591 PolarHBondContact O-N 2.81Å; V587-H850 HydrophobicContact CG1-CB 4.44Å; V587-V853 HydrophobicContact CB-CG1 4.24Å; V587-V853 HydrophobicContact CG1-CB 4.13Å; V587-V853 HydrophobicContact CG1-CG1 4.32Å; V587-V853 HydrophobicContact CG1-CG2 4.16Å; V587-V853 HydrophobicContact CG2-CG1 4.16Å; V587-V853 HydrophobicContact CG2-CG2 4.43Å
588	A	86.9	Confident	86.8	Confident	29 Å²	29	64.2 Å²	64.2	24%	0.24	38%	0.375	C	S	.	.	H	α-helix	trans	-61	-48.2	174.5	0	0	0	0	0	111.7	Q584 A585 G590 A591 A592	Q584-A588 WeakPolarHBondContact O-CB 3.5Å; Q584-A588 PolarHBondContact O-N 3.01Å; A585-A588 PolarHBondContact O-N 3.37Å; A588-G590 VanDerWaalsContact C-N 3.34Å; A588-G590 PolarHBondContact O-N 2.91Å; A588-A591 PolarHBondContact O-N 2.94Å; A588-A592 WeakPolarHBondContact O-CB 3.3Å; A588-A592 PolarHBondContact O-N 3.03Å
589	D	87.6	Confident	86.9	Confident	77 Å²	77	64.7 Å²	64.7	41%	0.412	37%	0.37	S	S	.	.	H	α-helix	trans	-63.1	-36.7	174.8	173.6	48.5	0	0	0	112.4	A585 R593	A585-D589 VanDerWaalsContact O-CB 3.24Å; A585-D589 WeakPolarHBondContact O-CB 3.23Å; A585-D589 PolarHBondContact O-N 3.36Å; D589-R593 VanDerWaalsContact CG-CZ 3.47Å; D589-R593 VanDerWaalsContact CG-NH2 3.28Å; D589-R593 PolarHBondContact O-N 3.02Å; D589-R593 VanDerWaalsContact O-N 3.13Å; D589-R593 IonicContact OD1-CZ 2.85Å; D589-R593 IonicContact OD1-NH1 3.78Å; D589-R593 PolarHBondContact OD1-NH1 3.06Å; D589-R593 IonicContact OD1-NH2 3.69Å; D589-R593 IonicContact OD2-CZ 2.73Å; D589-R593 IonicContact OD2-NH1 3.92Å; D589-R593 PolarHBondContact OD2-NH1 2.9Å; D589-R593 IonicContact OD2-NH2 3.41Å; D589-R593 PolarHBondContact OD2-NH2 2.7Å
590	G	85	Confident	87.1	Confident	29 Å²	29	65.5 Å²	65.5	30%	0.299	37%	0.365	S	S	.	.	H	α-helix	trans	-63.2	-48.3	170.5	0	0	0	0	0	113.5	L586 V587 A588 R593 C594	L586-G590 PolarHBondContact O-N 2.82Å; V587-G590 PolarHBondContact O-N 3.02Å; A588-G590 VanDerWaalsContact C-N 3.34Å; A588-G590 PolarHBondContact O-N 2.91Å; G590-R593 PolarHBondContact O-N 2.83Å; G590-C594 WeakPolarHBondContact O-CB 3.37Å; G590-C594 PolarHBondContact O-N 2.97Å
591	A	88.6	Confident	87.1	Confident	11 Å²	11	69.2 Å²	69.2	9%	0.091	38%	0.38	C	S	.	.	H	α-helix	trans	-67.5	-37.7	179.3	0	0	0	0	0	112.1	V587 A588 C594 R595 H850	V587-A591 WeakPolarHBondContact O-CB 3.39Å; V587-A591 PolarHBondContact O-N 2.81Å; A588-A591 PolarHBondContact O-N 2.94Å; A591-C594 WeakPolarHBondContact O-CB 3.39Å; A591-C594 PolarHBondContact O-N 3.48Å; A591-R595 PolarHBondContact O-N 2.84Å; A591-H850 HydrophobicContact CB-CB 4.02Å
592	A	86.9	Confident	87.2	Confident	56 Å²	56	69 Å²	69	46%	0.463	37%	0.37	S	S	.	.	H	α-helix	trans	-60.2	-50.1	173.2	0	0	0	0	0	111.6	A588 C594 R595 E596	A588-A592 WeakPolarHBondContact O-CB 3.3Å; A588-A592 PolarHBondContact O-N 3.03Å; A592-C594 VanDerWaalsContact C-N 3.27Å; A592-C594 PolarHBondContact O-N 2.89Å; A592-R595 PolarHBondContact O-N 3.47Å; A592-E596 VanDerWaalsContact O-CB 3.32Å; A592-E596 WeakPolarHBondContact O-CB 3.45Å; A592-E596 PolarHBondContact O-N 3.49Å
593	R	87.9	Confident	87.3	Confident	119 Å²	119	69.6 Å²	69.6	45%	0.449	37%	0.371	S	S	.	.	H	α-helix	trans	-62.8	-29.5	173.8	-79.9	-170.6	-66.1	-95.3	-8	114	D589 G590 K597	D589-R593 VanDerWaalsContact CG-CZ 3.47Å; D589-R593 VanDerWaalsContact CG-NH2 3.28Å; D589-R593 PolarHBondContact O-N 3.02Å; D589-R593 VanDerWaalsContact O-N 3.13Å; D589-R593 IonicContact OD1-CZ 2.85Å; D589-R593 IonicContact OD1-NH1 3.78Å; D589-R593 PolarHBondContact OD1-NH1 3.06Å; D589-R593 IonicContact OD1-NH2 3.69Å; D589-R593 IonicContact OD2-CZ 2.73Å; D589-R593 IonicContact OD2-NH1 3.92Å; D589-R593 PolarHBondContact OD2-NH1 2.9Å; D589-R593 IonicContact OD2-NH2 3.41Å; D589-R593 PolarHBondContact OD2-NH2 2.7Å; G590-R593 PolarHBondContact O-N 2.83Å; R593-K597 WeakPolarHBondContact O-CG 3.38Å; R593-K597 PolarHBondContact O-N 3.18Å
594	C	86.6	Confident	87.6	Confident	52 Å²	52	69.1 Å²	69.1	35%	0.351	37%	0.366	S	S	.	.	H	α-helix	trans	-67.3	-54.2	175.3	-172.9	0	0	0	0	109.8	G590 A591 A592 E596 K597 V598 A846	G590-C594 WeakPolarHBondContact O-CB 3.37Å; G590-C594 PolarHBondContact O-N 2.97Å; A591-C594 WeakPolarHBondContact O-CB 3.39Å; A591-C594 PolarHBondContact O-N 3.48Å; A592-C594 VanDerWaalsContact C-N 3.27Å; A592-C594 PolarHBondContact O-N 2.89Å; C594-E596 PolarHBondContact O-N 3.1Å; C594-K597 WeakPolarHBondContact O-CB 3.47Å; C594-K597 PolarHBondContact O-N 2.84Å; C594-V598 WeakPolarHBondContact O-CG2 3.24Å; C594-V598 PolarHBondContact O-N 2.9Å; C594-A846 HydrophobicContact CB-CB 4.26Å
595	R	88.3	Confident	87.7	Confident	82 Å²	82	67.7 Å²	67.7	31%	0.309	36%	0.36	S	S	.	.	H	α-helix	trans	-55.9	-47.9	176.8	-165.1	-167	-54.6	-93.6	-4.2	112.4	A591 A592 K597 V598 E599	A591-R595 PolarHBondContact O-N 2.84Å; A592-R595 PolarHBondContact O-N 3.47Å; R595-K597 PolarHBondContact O-N 3.41Å; R595-K597 VanDerWaalsContact O-N 3.12Å; R595-V598 PolarHBondContact O-N 2.94Å; R595-E599 VanDerWaalsContact CD-OE1 3.29Å; R595-E599 WeakPolarHBondContact CD-OE1 3.4Å; R595-E599 HydrophobicContact CG-CG 4.36Å; R595-E599 WeakPolarHBondContact CG-OE1 3.3Å; R595-E599 WeakPolarHBondContact O-CG 3.43Å; R595-E599 PolarHBondContact O-N 3.21Å
596	E	88.8	Confident	87.8	Confident	88 Å²	88	69.5 Å²	69.5	41%	0.411	35%	0.354	S	S	.	.	H	α-helix	trans	-63.9	-17.6	178.8	-162.9	-137.4	-165.2	0	0	113.1	A592 C594 R600	A592-E596 VanDerWaalsContact O-CB 3.32Å; A592-E596 WeakPolarHBondContact O-CB 3.45Å; A592-E596 PolarHBondContact O-N 3.49Å; C594-E596 PolarHBondContact O-N 3.1Å; E596-R600 VanDerWaalsContact CD-CZ 3.45Å; E596-R600 WeakPolarHBondContact O-CG 3.46Å; E596-R600 PolarHBondContact O-NH1 3.18Å; E596-R600 IonicContact OE1-CZ 3.13Å; E596-R600 IonicContact OE1-NH1 3.35Å; E596-R600 PolarHBondContact OE1-NH1 3.07Å; E596-R600 IonicContact OE1-NH2 2.67Å; E596-R600 PolarHBondContact OE1-NH2 3.5Å; E596-R600 IonicContact OE2-CZ 3.19Å; E596-R600 IonicContact OE2-NH1 2.65Å; E596-R600 PolarHBondContact OE2-NH1 3.2Å; E596-R600 IonicContact OE2-NH2 3.94Å; E596-R600 PolarHBondContact OE2-NH2 2.88Å
597	K	86.8	Confident	87.9	Confident	132 Å²	132	69.8 Å²	69.8	57%	0.574	35%	0.352	S	S	*	.	H	α-helix	trans	-88.5	-39.8	168.5	-76.4	-179.6	176.6	-172.2	0	112.5	R593 C594 R595 R600 H601	R593-K597 WeakPolarHBondContact O-CG 3.38Å; R593-K597 PolarHBondContact O-N 3.18Å; C594-K597 WeakPolarHBondContact O-CB 3.47Å; C594-K597 PolarHBondContact O-N 2.84Å; R595-K597 PolarHBondContact O-N 3.41Å; R595-K597 VanDerWaalsContact O-N 3.12Å; K597-R600 PolarHBondContact O-N 3.37Å; K597-H601 PolarHBondContact O-CD2 2.83Å; K597-H601 VanDerWaalsContact O-CD2 3.26Å; K597-H601 PolarHBondContact O-N 2.62Å
598	V	89	Confident	87.9	Confident	11 Å²	11	73.6 Å²	73.6	7%	0.067	37%	0.368	C	S	.	.	H	α-helix	trans	-60.2	-49.7	176	175.7	0	0	0	0	110.3	C594 R595 R600 H601 E602 M839 A843	C594-V598 WeakPolarHBondContact O-CG2 3.24Å; C594-V598 PolarHBondContact O-N 2.9Å; R595-V598 PolarHBondContact O-N 2.94Å; V598-R600 VanDerWaalsContact C-N 3.29Å; V598-R600 PolarHBondContact O-N 3.21Å; V598-H601 CarbonylContact O-C 3.6Å; V598-H601 WeakPolarHBondContact O-CA 3.49Å; V598-H601 PolarHBondContact O-N 2.62Å; V598-E602 HydrophobicContact CG1-CG 4.4Å; V598-E602 PolarHBondContact O-N 3.03Å; V598-M839 HydrophobicContact CG1-CB 3.79Å; V598-M839 HydrophobicContact CG1-CG 4.41Å; V598-M839 WeakPolarHBondContact CG1-O 3.31Å; V598-M839 HydrophobicContact CG1-SD 4.36Å; V598-A843 HydrophobicContact CG1-CB 4.28Å
599	E	87.9	Confident	88	Confident	107 Å²	107	76 Å²	76	50%	0.5	37%	0.371	S	S	.	.	H	α-helix	trans	-55.4	-41.4	177.2	-70.6	167.1	-178.7	0	0	112.3	R595 A603	R595-E599 VanDerWaalsContact CD-OE1 3.29Å; R595-E599 WeakPolarHBondContact CD-OE1 3.4Å; R595-E599 HydrophobicContact CG-CG 4.36Å; R595-E599 WeakPolarHBondContact CG-OE1 3.3Å; R595-E599 WeakPolarHBondContact O-CG 3.43Å; R595-E599 PolarHBondContact O-N 3.21Å; E599-A603 WeakPolarHBondContact O-CB 3.44Å; E599-A603 PolarHBondContact O-N 2.9Å; E599-A603 VanDerWaalsContact O-N 3.11Å
600	R	88.8	Confident	88.1	Confident	137 Å²	137	78.7 Å²	78.7	52%	0.517	38%	0.381	S	S	.	.	H	α-helix	trans	-66.4	-40.6	174	-73.4	-178.7	-173.7	107.8	-5.8	112.7	E596 K597 V598 L604	E596-R600 VanDerWaalsContact CD-CZ 3.45Å; E596-R600 WeakPolarHBondContact O-CG 3.46Å; E596-R600 PolarHBondContact O-NH1 3.18Å; E596-R600 IonicContact OE1-CZ 3.13Å; E596-R600 IonicContact OE1-NH1 3.35Å; E596-R600 PolarHBondContact OE1-NH1 3.07Å; E596-R600 IonicContact OE1-NH2 2.67Å; E596-R600 PolarHBondContact OE1-NH2 3.5Å; E596-R600 IonicContact OE2-CZ 3.19Å; E596-R600 IonicContact OE2-NH1 2.65Å; E596-R600 PolarHBondContact OE2-NH1 3.2Å; E596-R600 IonicContact OE2-NH2 3.94Å; E596-R600 PolarHBondContact OE2-NH2 2.88Å; K597-R600 PolarHBondContact O-N 3.37Å; V598-R600 VanDerWaalsContact C-N 3.29Å; V598-R600 PolarHBondContact O-N 3.21Å; R600-L604 WeakPolarHBondContact O-CB 3.38Å; R600-L604 PolarHBondContact O-N 2.93Å; R600-L604 VanDerWaalsContact O-N 3.07Å
601	H	85.2	Confident	88.3	Confident	107 Å²	107	80.2 Å²	80.2	50%	0.495	39%	0.39	S	S	.	.	H	α-helix	trans	-68.9	-41.5	178.3	-86.4	-67.2	0	0	0	111.9	K597 V598 A603 L604 T605 M839	K597-H601 PolarHBondContact O-CD2 2.83Å; K597-H601 VanDerWaalsContact O-CD2 3.26Å; K597-H601 PolarHBondContact O-N 2.62Å; V598-H601 CarbonylContact O-C 3.6Å; V598-H601 WeakPolarHBondContact O-CA 3.49Å; V598-H601 PolarHBondContact O-N 2.62Å; H601-A603 PolarHBondContact O-N 2.9Å; H601-L604 PolarHBondContact O-N 3.43Å; H601-T605 WeakPolarHBondContact O-CB 3.41Å; H601-T605 PolarHBondContact O-N 2.92Å; H601-T605 PolarHBondContact O-OG1 2.98Å; H601-M839 HydrophobicContact CB-SD 4.23Å
602	E	88.3	Confident	88.3	Confident	29 Å²	29	83.8 Å²	83.8	14%	0.136	41%	0.407	C	S	.	.	H	α-helix	trans	-60.4	-44.1	173.4	-67.3	178.8	-144.4	0	0	112.2	V598 L604 T605 R606 L836 M839	V598-E602 HydrophobicContact CG1-CG 4.4Å; V598-E602 PolarHBondContact O-N 3.03Å; E602-L604 VanDerWaalsContact C-N 3.33Å; E602-L604 PolarHBondContact O-N 3.45Å; E602-T605 PolarHBondContact O-N 3.48Å; E602-R606 VanDerWaalsContact CB-NH1 3.33Å; E602-R606 WeakPolarHBondContact O-CG 3.43Å; E602-R606 PolarHBondContact O-N 3.1Å; E602-R606 IonicContact OE2-CZ 2.76Å; E602-R606 IonicContact OE2-NH1 3.66Å; E602-R606 PolarHBondContact OE2-NH1 2.85Å; E602-R606 IonicContact OE2-NH2 3.08Å; E602-R606 PolarHBondContact OE2-NH2 2.93Å; E602-L836 HydrophobicContact CB-CD2 3.75Å; E602-L836 HydrophobicContact CG-CD2 3.91Å; E602-M839 HydrophobicContact CG-CB 3.76Å; E602-M839 HydrophobicContact CG-CG 4.19Å
603	A	88.9	Confident	88.4	Confident	53 Å²	53	83 Å²	83	44%	0.438	40%	0.395	S	S	.	.	H	α-helix	trans	-59.2	-46	177.3	0	0	0	0	0	111.1	E599 H601 R606 E607	E599-A603 WeakPolarHBondContact O-CB 3.44Å; E599-A603 PolarHBondContact O-N 2.9Å; E599-A603 VanDerWaalsContact O-N 3.11Å; H601-A603 PolarHBondContact O-N 2.9Å; A603-R606 PolarHBondContact O-N 3.27Å; A603-E607 PolarHBondContact O-N 3.45Å
604	L	90.7	Very high	88.5	Confident	72 Å²	72	82.9 Å²	82.9	38%	0.377	40%	0.4	S	S	.	.	H	α-helix	trans	-64.2	-39.4	176.1	-175.2	65.6	0	0	0	112.5	R600 H601 E602 R606 E607 Q608	R600-L604 WeakPolarHBondContact O-CB 3.38Å; R600-L604 PolarHBondContact O-N 2.93Å; R600-L604 VanDerWaalsContact O-N 3.07Å; H601-L604 PolarHBondContact O-N 3.43Å; E602-L604 VanDerWaalsContact C-N 3.33Å; E602-L604 PolarHBondContact O-N 3.45Å; L604-R606 VanDerWaalsContact C-N 3.34Å; L604-E607 PolarHBondContact O-N 2.9Å; L604-Q608 HydrophobicContact CD1-CG 4.3Å; L604-Q608 HydrophobicContact CG-CG 4.4Å; L604-Q608 VanDerWaalsContact O-CB 3.32Å; L604-Q608 WeakPolarHBondContact O-CB 3.26Å; L604-Q608 VanDerWaalsContact O-CG 3.25Å; L604-Q608 WeakPolarHBondContact O-CG 3.45Å; L604-Q608 PolarHBondContact O-N 2.98Å
605	T	88.4	Confident	88.6	Confident	16 Å²	16	85.8 Å²	85.8	10%	0.098	41%	0.411	C	S	.	.	H	α-helix	trans	-66.4	-34.7	175.8	-68.4	0	0	0	0	111.8	H601 E602 R609 A832 Q835 L836	H601-T605 WeakPolarHBondContact O-CB 3.41Å; H601-T605 PolarHBondContact O-N 2.92Å; H601-T605 PolarHBondContact O-OG1 2.98Å; E602-T605 PolarHBondContact O-N 3.48Å; T605-R609 VanDerWaalsContact O-CB 3.25Å; T605-R609 WeakPolarHBondContact O-CB 3.27Å; T605-R609 PolarHBondContact O-N 3.39Å; T605-A832 HydrophobicContact CG2-CB 4.29Å; T605-Q835 HydrophobicContact CG2-CB 4.19Å; T605-L836 HydrophobicContact CG2-CD2 4.21Å; T605-L836 HydrophobicContact CG2-CG 4.11Å
606	R	89.2	Confident	88.6	Confident	98 Å²	98	82.4 Å²	82.4	37%	0.37	40%	0.399	S	S	.	.	H	α-helix	trans	-67.6	-48.4	173	-69.7	171.6	-174.3	119.9	6.6	111.1	E602 A603 L604 Q608 R609 E610 L836	E602-R606 VanDerWaalsContact CB-NH1 3.33Å; E602-R606 WeakPolarHBondContact O-CG 3.43Å; E602-R606 PolarHBondContact O-N 3.1Å; E602-R606 IonicContact OE2-CZ 2.76Å; E602-R606 IonicContact OE2-NH1 3.66Å; E602-R606 PolarHBondContact OE2-NH1 2.85Å; E602-R606 IonicContact OE2-NH2 3.08Å; E602-R606 PolarHBondContact OE2-NH2 2.93Å; A603-R606 PolarHBondContact O-N 3.27Å; L604-R606 VanDerWaalsContact C-N 3.34Å; R606-Q608 PolarHBondContact O-N 2.78Å; R606-R609 WeakPolarHBondContact O-CB 3.43Å; R606-R609 PolarHBondContact O-N 3.12Å; R606-E610 WeakPolarHBondContact O-CG 3.47Å; R606-E610 PolarHBondContact O-N 3.14Å; R606-L836 HydrophobicContact CG-CD1 4.15Å; R606-L836 HydrophobicContact CG-CD2 4.28Å
607	E	89.8	Confident	88.6	Confident	128 Å²	128	82.8 Å²	82.8	60%	0.598	40%	0.401	S	S	*	.	H	α-helix	trans	-58.9	-47.2	176.2	-175.5	-178.8	-171.6	0	0	112.3	A603 L604 R609 E610 A611	A603-E607 PolarHBondContact O-N 3.45Å; L604-E607 PolarHBondContact O-N 2.9Å; E607-R609 VanDerWaalsContact C-N 3.35Å; E607-R609 PolarHBondContact O-N 2.89Å; E607-E610 PolarHBondContact O-N 3.45Å; E607-A611 WeakPolarHBondContact O-CB 3.22Å; E607-A611 PolarHBondContact O-N 3.02Å
608	Q	86.3	Confident	88.7	Confident	112 Å²	112	80.9 Å²	80.9	52%	0.523	39%	0.394	S	S	.	.	H	α-helix	trans	-65.2	-36	177.9	-73.6	178.9	4.2	0	0	112.8	L604 R606 L612	L604-Q608 HydrophobicContact CD1-CG 4.3Å; L604-Q608 HydrophobicContact CG-CG 4.4Å; L604-Q608 VanDerWaalsContact O-CB 3.32Å; L604-Q608 WeakPolarHBondContact O-CB 3.26Å; L604-Q608 VanDerWaalsContact O-CG 3.25Å; L604-Q608 WeakPolarHBondContact O-CG 3.45Å; L604-Q608 PolarHBondContact O-N 2.98Å; R606-Q608 PolarHBondContact O-N 2.78Å; Q608-L612 VanDerWaalsContact O-CB 3.26Å; Q608-L612 WeakPolarHBondContact O-CB 3.3Å; Q608-L612 PolarHBondContact O-N 3.48Å; Q608-L612 VanDerWaalsContact O-N 3.09Å
609	R	89.7	Confident	88.6	Confident	81 Å²	81	83.5 Å²	83.5	31%	0.306	41%	0.405	S	S	.	.	H	α-helix	trans	-62.1	-49.5	172.9	170.9	-176.5	171.7	160.7	-4.5	110.7	T605 R606 E607 L612 L613 A832	T605-R609 VanDerWaalsContact O-CB 3.25Å; T605-R609 WeakPolarHBondContact O-CB 3.27Å; T605-R609 PolarHBondContact O-N 3.39Å; R606-R609 WeakPolarHBondContact O-CB 3.43Å; R606-R609 PolarHBondContact O-N 3.12Å; E607-R609 VanDerWaalsContact C-N 3.35Å; E607-R609 PolarHBondContact O-N 2.89Å; R609-L612 PolarHBondContact O-N 3.11Å; R609-L613 HydrophobicContact CG-CD1 3.78Å; R609-L613 HydrophobicContact CG-CG 4.43Å; R609-L613 WeakPolarHBondContact O-CB 3.49Å; R609-L613 WeakPolarHBondContact O-CG 3.41Å; R609-L613 PolarHBondContact O-N 3.5Å; R609-A832 HydrophobicContact CB-CB 3.93Å; R609-A832 HydrophobicContact CG-CB 4.03Å
610	E	88.8	Confident	88.6	Confident	133 Å²	133	80.9 Å²	80.9	62%	0.621	39%	0.393	S	S	*	.	H	α-helix	trans	-64.1	-47.2	-178	-72.4	172.8	-172.2	0	0	111.6	R606 E607 L612 L613 Q614	R606-E610 WeakPolarHBondContact O-CG 3.47Å; R606-E610 PolarHBondContact O-N 3.14Å; E607-E610 PolarHBondContact O-N 3.45Å; E610-L612 PolarHBondContact O-N 3.01Å; E610-L613 PolarHBondContact O-N 3.35Å; E610-Q614 PolarHBondContact O-N 3.09Å
611	A	89.2	Confident	88.5	Confident	60 Å²	60	80.2 Å²	80.2	50%	0.496	40%	0.396	S	S	.	.	H	α-helix	trans	-60.4	-40.1	177	0	0	0	0	0	113.2	E607 L615	E607-A611 WeakPolarHBondContact O-CB 3.22Å; E607-A611 PolarHBondContact O-N 3.02Å; A611-L615 WeakPolarHBondContact O-CB 3.32Å; A611-L615 PolarHBondContact O-N 2.78Å
612	L	88.3	Confident	88.6	Confident	86 Å²	86	82 Å²	82	45%	0.45	40%	0.404	S	S	.	.	H	α-helix	trans	-75.4	-32.8	179.6	-168	147.3	0	0	0	112.3	Q608 R609 E610 L616 A828	Q608-L612 VanDerWaalsContact O-CB 3.26Å; Q608-L612 WeakPolarHBondContact O-CB 3.3Å; Q608-L612 PolarHBondContact O-N 3.48Å; Q608-L612 VanDerWaalsContact O-N 3.09Å; R609-L612 PolarHBondContact O-N 3.11Å; E610-L612 PolarHBondContact O-N 3.01Å; L612-L616 HydrophobicContact CD2-CD1 3.8Å; L612-L616 HydrophobicContact CD2-CG 4.37Å; L612-L616 WeakPolarHBondContact O-CG 3.36Å; L612-L616 PolarHBondContact O-N 3.14Å; L612-L616 VanDerWaalsContact O-N 3.17Å; L612-A828 HydrophobicContact CD2-CB 3.64Å
613	L	89.4	Confident	88.4	Confident	41 Å²	41	82 Å²	82	22%	0.215	41%	0.407	C	S	.	.	H	α-helix	trans	-66.2	-40	171.5	-71.6	171.6	0	0	0	111.7	R609 E610 E617 R825	R609-L613 HydrophobicContact CG-CD1 3.78Å; R609-L613 HydrophobicContact CG-CG 4.43Å; R609-L613 WeakPolarHBondContact O-CB 3.49Å; R609-L613 WeakPolarHBondContact O-CG 3.41Å; R609-L613 PolarHBondContact O-N 3.5Å; E610-L613 PolarHBondContact O-N 3.35Å; L613-E617 PolarHBondContact O-N 3.34Å; L613-R825 HydrophobicContact CD2-CG 3.48Å; L613-R825 VanDerWaalsContact CD2-CG 3.48Å
614	Q	89.7	Confident	88.2	Confident	116 Å²	116	84.5 Å²	84.5	54%	0.542	41%	0.409	S	S	.	.	H	α-helix	trans	-63.8	-47.8	174.8	-179.6	179.7	-24.1	0	0	111.6	E610 L616 E617 E618	E610-Q614 PolarHBondContact O-N 3.09Å; Q614-L616 VanDerWaalsContact C-N 3.28Å; Q614-L616 PolarHBondContact O-N 2.98Å; Q614-E617 WeakPolarHBondContact O-CA 3.43Å; Q614-E617 WeakPolarHBondContact O-CB 3.46Å; Q614-E617 PolarHBondContact O-N 2.86Å; Q614-E618 HydrophobicContact CG-CG 4.41Å; Q614-E618 WeakPolarHBondContact CG-OE1 3.34Å; Q614-E618 PolarHBondContact NE2-OE1 3.17Å; Q614-E618 PolarHBondContact O-N 2.86Å
615	L	89.4	Confident	88	Confident	112 Å²	112	83.7 Å²	83.7	59%	0.586	41%	0.405	S	S	*	.	H	α-helix	trans	-63.8	-32.4	-179.1	-174.3	144.4	0	0	0	112.8	A611 E617 H619	A611-L615 WeakPolarHBondContact O-CB 3.32Å; A611-L615 PolarHBondContact O-N 2.78Å; L615-E617 VanDerWaalsContact C-N 3.3Å; L615-H619 WeakPolarHBondContact O-CB 3.42Å; L615-H619 PolarHBondContact O-N 3.01Å
616	L	88.9	Confident	87.9	Confident	12 Å²	12	86.4 Å²	86.4	6%	0.063	42%	0.422	C	S	.	.	H	α-helix	trans	-68.1	-28.6	170.3	-73.6	171.9	0	0	0	112.8	L612 Q614 Q620 T821 T824 R825	L612-L616 HydrophobicContact CD2-CD1 3.8Å; L612-L616 HydrophobicContact CD2-CG 4.37Å; L612-L616 WeakPolarHBondContact O-CG 3.36Å; L612-L616 PolarHBondContact O-N 3.14Å; L612-L616 VanDerWaalsContact O-N 3.17Å; Q614-L616 VanDerWaalsContact C-N 3.28Å; Q614-L616 PolarHBondContact O-N 2.98Å; L616-Q620 WeakPolarHBondContact O-CB 3.34Å; L616-Q620 PolarHBondContact O-N 2.89Å; L616-Q620 VanDerWaalsContact O-N 3.17Å; L616-T821 HydrophobicContact CB-CG2 4.27Å; L616-T821 HydrophobicContact CD2-CG2 4.46Å; L616-T821 WeakPolarHBondContact O-CG2 3.39Å; L616-T824 HydrophobicContact CD1-CG2 4.14Å; L616-T824 HydrophobicContact CD2-CG2 4.03Å; L616-R825 HydrophobicContact CD1-CB 4.2Å
617	E	88	Confident	87.7	Confident	95 Å²	95	83.5 Å²	83.5	44%	0.444	41%	0.413	S	S	.	.	H	α-helix	trans	-78.8	-39	176.6	-160.4	154.1	151.8	0	0	112.4	L613 Q614 L615 Q620 Q621 R825	L613-E617 PolarHBondContact O-N 3.34Å; Q614-E617 WeakPolarHBondContact O-CA 3.43Å; Q614-E617 WeakPolarHBondContact O-CB 3.46Å; Q614-E617 PolarHBondContact O-N 2.86Å; L615-E617 VanDerWaalsContact C-N 3.3Å; E617-Q620 PolarHBondContact O-N 2.82Å; E617-Q621 WeakPolarHBondContact O-CG 3.5Å; E617-Q621 PolarHBondContact O-N 2.94Å; E617-R825 VanDerWaalsContact CB-NH2 3.3Å; E617-R825 VanDerWaalsContact CG-NH2 3.33Å; E617-R825 IonicContact OE2-CZ 2.71Å; E617-R825 IonicContact OE2-NH2 2.71Å; E617-R825 PolarHBondContact OE2-NH2 2.97Å
618	E	88.8	Confident	87.4	Confident	93 Å²	93	78.9 Å²	78.9	44%	0.435	40%	0.397	S	S	.	.	H	α-helix	trans	-61	-48.9	172.4	-69.8	170.7	176.3	0	0	110.7	Q614 Q620 Q621 E622	Q614-E618 HydrophobicContact CG-CG 4.41Å; Q614-E618 WeakPolarHBondContact CG-OE1 3.34Å; Q614-E618 PolarHBondContact NE2-OE1 3.17Å; Q614-E618 PolarHBondContact O-N 2.86Å; E618-Q620 VanDerWaalsContact C-N 3.34Å; E618-Q620 PolarHBondContact O-N 2.76Å; E618-Q621 PolarHBondContact O-N 2.7Å; E618-E622 PolarHBondContact O-N 3.16Å
619	H	87.9	Confident	87.2	Confident	65 Å²	65	77.9 Å²	77.9	30%	0.301	40%	0.398	S	S	.	.	H	α-helix	trans	-55	-46.8	172.4	173.3	90.2	0	0	0	112.2	L615 Q621 E622 V623 D817	L615-H619 WeakPolarHBondContact O-CB 3.42Å; L615-H619 PolarHBondContact O-N 3.01Å; H619-Q621 VanDerWaalsContact C-N 3.32Å; H619-Q621 PolarHBondContact O-N 3.23Å; H619-E622 PolarHBondContact O-N 3.11Å; H619-V623 WeakPolarHBondContact O-CG2 3.33Å; H619-V623 PolarHBondContact O-N 3.49Å; H619-D817 IonicContact CD2-OD1 3.2Å; H619-D817 IonicContact CD2-OD2 3.96Å; H619-D817 IonicContact CE1-OD1 2.78Å; H619-D817 IonicContact NE2-OD1 3.48Å; H619-D817 PolarHBondContact NE2-OD1 2.8Å; H619-D817 IonicContact NE2-OD2 3.19Å; H619-D817 PolarHBondContact NE2-OD2 2.97Å
620	Q	86.7	Confident	86.9	Confident	53 Å²	53	81.9 Å²	81.9	25%	0.248	41%	0.413	C	S	.	.	H	α-helix	trans	-59.5	-42.5	179.4	-167	177.7	-12.3	0	0	111.9	L616 E617 E618 Q624 T821	L616-Q620 WeakPolarHBondContact O-CB 3.34Å; L616-Q620 PolarHBondContact O-N 2.89Å; L616-Q620 VanDerWaalsContact O-N 3.17Å; E617-Q620 PolarHBondContact O-N 2.82Å; E618-Q620 VanDerWaalsContact C-N 3.34Å; E618-Q620 PolarHBondContact O-N 2.76Å; Q620-Q624 WeakPolarHBondContact O-CB 3.49Å; Q620-Q624 PolarHBondContact O-N 2.79Å; Q620-Q624 VanDerWaalsContact O-N 3.09Å; Q620-T821 HydrophobicContact CB-CG2 4.2Å
621	Q	86.8	Confident	86.6	Confident	123 Å²	123	78.1 Å²	78.1	58%	0.575	40%	0.4	S	S	*	.	H	α-helix	trans	-69.9	-43	178.8	-70	-178.7	28.3	0	0	112.2	E617 E618 H619 Q624 D625	E617-Q621 WeakPolarHBondContact O-CG 3.5Å; E617-Q621 PolarHBondContact O-N 2.94Å; E618-Q621 PolarHBondContact O-N 2.7Å; H619-Q621 VanDerWaalsContact C-N 3.32Å; H619-Q621 PolarHBondContact O-N 3.23Å; Q621-Q624 PolarHBondContact O-N 2.7Å; Q621-D625 WeakPolarHBondContact O-CB 3.32Å; Q621-D625 PolarHBondContact O-N 2.92Å
622	E	86.5	Confident	86.5	Confident	143 Å²	143	76.5 Å²	76.5	67%	0.668	38%	0.382	S	S	*	.	H	α-helix	trans	-63.3	-47	178.4	-73	-167.1	167.1	0	0	112.3	E618 H619 Q624 D625 V626	E618-E622 PolarHBondContact O-N 3.16Å; H619-E622 PolarHBondContact O-N 3.11Å; E622-Q624 PolarHBondContact O-N 2.59Å; E622-D625 PolarHBondContact O-N 3.41Å; E622-V626 WeakPolarHBondContact O-CB 3.27Å; E622-V626 WeakPolarHBondContact O-CG2 3.45Å; E622-V626 PolarHBondContact O-N 3.35Å
623	V	84.1	Confident	86.3	Confident	31 Å²	31	75.4 Å²	75.4	19%	0.188	38%	0.38	C	S	.	.	H	α-helix	trans	-64.8	-40.8	178.3	175.1	0	0	0	0	110.9	H619 L627 D817	H619-V623 WeakPolarHBondContact O-CG2 3.33Å; H619-V623 PolarHBondContact O-N 3.49Å; V623-L627 HydrophobicContact CG1-CD1 3.7Å; V623-L627 HydrophobicContact CG1-CG 4.26Å; V623-L627 VanDerWaalsContact O-CB 3.3Å; V623-L627 WeakPolarHBondContact O-CB 3.39Å; V623-L627 WeakPolarHBondContact O-CG 3.45Å; V623-L627 PolarHBondContact O-N 3.32Å; V623-D817 HydrophobicContact CG1-CB 4.22Å
624	Q	85.6	Confident	86	Confident	105 Å²	105	75 Å²	75	49%	0.491	39%	0.386	S	S	.	.	H	α-helix	trans	-67.7	-39.8	179.1	-170.9	170.5	1.5	0	0	112.5	Q620 Q621 E622 A628 V629	Q620-Q624 WeakPolarHBondContact O-CB 3.49Å; Q620-Q624 PolarHBondContact O-N 2.79Å; Q620-Q624 VanDerWaalsContact O-N 3.09Å; Q621-Q624 PolarHBondContact O-N 2.7Å; E622-Q624 PolarHBondContact O-N 2.59Å; Q624-A628 HydrophobicContact CG-CB 4.24Å; Q624-A628 WeakPolarHBondContact O-CA 3.42Å; Q624-A628 VanDerWaalsContact O-CB 3.27Å; Q624-A628 WeakPolarHBondContact O-CB 3.44Å; Q624-A628 PolarHBondContact O-N 3.25Å; Q624-V629 PolarHBondContact O-N 2.87Å
625	D	85.9	Confident	85.7	Confident	55 Å²	55	70.5 Å²	70.5	29%	0.294	37%	0.366	S	S	.	.	I	π-helix	trans	-66.5	-49.7	175.1	-179.4	62.2	0	0	0	111.7	Q621 E622 L627 V629 R630	Q621-D625 WeakPolarHBondContact O-CB 3.32Å; Q621-D625 PolarHBondContact O-N 2.92Å; E622-D625 PolarHBondContact O-N 3.41Å; D625-L627 PolarHBondContact O-N 2.74Å; D625-V629 CarbonylContact O-C 3.55Å; D625-V629 WeakPolarHBondContact O-CB 3.43Å; D625-V629 PolarHBondContact O-N 2.65Å; D625-R630 WeakPolarHBondContact O-CG 3.19Å; D625-R630 PolarHBondContact O-N 2.98Å; D625-R630 IonicContact OD1-NE 3.8Å; D625-R630 IonicContact OD2-CZ 3.25Å; D625-R630 IonicContact OD2-NE 2.55Å; D625-R630 PolarHBondContact OD2-NE 2.81Å; D625-R630 IonicContact OD2-NH2 3.85Å; D625-R630 PolarHBondContact OD2-NH2 3.46Å
626	V	85.9	Confident	85.4	Confident	73 Å²	73	67 Å²	67	44%	0.442	35%	0.349	S	S	.	.	I	π-helix	trans	-63.4	-46.8	-179	173.6	0	0	0	0	111.8	E622 R630 T631	E622-V626 WeakPolarHBondContact O-CB 3.27Å; E622-V626 WeakPolarHBondContact O-CG2 3.45Å; E622-V626 PolarHBondContact O-N 3.35Å; V626-R630 WeakPolarHBondContact O-CB 3.35Å; V626-T631 WeakPolarHBondContact O-CG2 3.46Å; V626-T631 PolarHBondContact O-N 2.98Å; V626-T631 VanDerWaalsContact O-N 3.15Å
627	L	85.6	Confident	85.1	Confident	36 Å²	36	68.6 Å²	68.6	19%	0.188	36%	0.364	C	S	.	.	I	π-helix	trans	-83.5	-58.9	-175.5	-61.1	-175.9	0	0	0	112.1	V623 D625 T631 L632 V810 L813 V814	V623-L627 HydrophobicContact CG1-CD1 3.7Å; V623-L627 HydrophobicContact CG1-CG 4.26Å; V623-L627 VanDerWaalsContact O-CB 3.3Å; V623-L627 WeakPolarHBondContact O-CB 3.39Å; V623-L627 WeakPolarHBondContact O-CG 3.45Å; V623-L627 PolarHBondContact O-N 3.32Å; D625-L627 PolarHBondContact O-N 2.74Å; L627-T631 WeakPolarHBondContact CA-OG1 3.41Å; L627-T631 PolarHBondContact O-N 2.97Å; L627-T631 PolarHBondContact O-OG1 2.88Å; L627-L632 PolarHBondContact O-N 3.22Å; L627-V810 HydrophobicContact CB-CG1 4.3Å; L627-V810 HydrophobicContact CD2-CG1 4.38Å; L627-L813 HydrophobicContact CD1-CD2 3.69Å; L627-V814 HydrophobicContact CB-CG2 3.45Å; L627-V814 VanDerWaalsContact CB-CG2 3.45Å; L627-V814 HydrophobicContact CD1-CG2 3.92Å; L627-V814 HydrophobicContact CG-CG2 4.35Å
628	A	83.3	Confident	84.9	Confident	31 Å²	31	68.1 Å²	68.1	26%	0.256	36%	0.364	S	S	.	.	I	π-helix	trans	-80.1	-36.1	-171.3	0	0	0	0	0	113.7	Q624 P633 V814	Q624-A628 HydrophobicContact CG-CB 4.24Å; Q624-A628 WeakPolarHBondContact O-CA 3.42Å; Q624-A628 VanDerWaalsContact O-CB 3.27Å; Q624-A628 WeakPolarHBondContact O-CB 3.44Å; Q624-A628 PolarHBondContact O-N 3.25Å; A628-P633 WeakPolarHBondContact O-CD 3.4Å; A628-V814 HydrophobicContact CB-CG1 4.48Å; A628-V814 HydrophobicContact CB-CG2 4.43Å
629	V	83.4	Confident	84.5	Confident	91 Å²	91	68.5 Å²	68.5	55%	0.552	36%	0.361	S	S	*	.	I	π-helix	trans	-88.5	-34.3	-178	-174.3	0	0	0	0	112.3	Q624 D625 P633	Q624-V629 PolarHBondContact O-N 2.87Å; D625-V629 CarbonylContact O-C 3.55Å; D625-V629 WeakPolarHBondContact O-CB 3.43Å; D625-V629 PolarHBondContact O-N 2.65Å; V629-P633 WeakPolarHBondContact O-CG 3.35Å
630	R	82.3	Confident	84.2	Confident	166 Å²	166	70.8 Å²	70.8	63%	0.626	37%	0.372	S	S	*	.	I	π-helix	trans	-100.1	-53.8	-177.6	-57.7	178	-164.3	-154.6	7.8	114.3	D625 V626 G634	D625-R630 WeakPolarHBondContact O-CG 3.19Å; D625-R630 PolarHBondContact O-N 2.98Å; D625-R630 IonicContact OD1-NE 3.8Å; D625-R630 IonicContact OD2-CZ 3.25Å; D625-R630 IonicContact OD2-NE 2.55Å; D625-R630 PolarHBondContact OD2-NE 2.81Å; D625-R630 IonicContact OD2-NH2 3.85Å; D625-R630 PolarHBondContact OD2-NH2 3.46Å; V626-R630 WeakPolarHBondContact O-CB 3.35Å; R630-G634 PolarHBondContact O-N 3.5Å
631	T	83.4	Confident	84	Confident	54 Å²	54	73.4 Å²	73.4	33%	0.331	39%	0.387	S	S	.	.	I	π-helix	trans	-81.8	-40.9	-171.8	63.5	0	0	0	0	114.8	V626 L627 G634 L635	V626-T631 WeakPolarHBondContact O-CG2 3.46Å; V626-T631 PolarHBondContact O-N 2.98Å; V626-T631 VanDerWaalsContact O-N 3.15Å; L627-T631 WeakPolarHBondContact CA-OG1 3.41Å; L627-T631 PolarHBondContact O-N 2.97Å; L627-T631 PolarHBondContact O-OG1 2.88Å; T631-G634 PolarHBondContact O-N 3.44Å; T631-L635 WeakPolarHBondContact O-CG 3.43Å; T631-L635 PolarHBondContact O-N 3.41Å
632	L	86.2	Confident	83.7	Confident	25 Å²	25	68.4 Å²	68.4	13%	0.131	37%	0.368	C	S	.	.	H	α-helix	trans	-59.1	-44.6	177.9	-70.7	-179.9	0	0	0	113	L627 G634 L635 T636 V810	L627-L632 PolarHBondContact O-N 3.22Å; L632-G634 PolarHBondContact O-N 2.89Å; L632-L635 PolarHBondContact O-N 3.12Å; L632-T636 PolarHBondContact O-N 3.18Å; L632-T636 VanDerWaalsContact O-N 3.13Å; L632-T636 PolarHBondContact O-OG1 3.41Å; L632-V810 HydrophobicContact CD2-CB 3.83Å; L632-V810 HydrophobicContact CD2-CG1 3.61Å; L632-V810 HydrophobicContact CG-CG1 3.92Å
633	P	84.6	Confident	83.3	Confident	63 Å²	63	64.9 Å²	64.9	41%	0.409	35%	0.354	S	S	.	.	H	α-helix	trans	-67.7	-32	176.2	-25.6	39.1	0	0	0	113.8	A628 V629 T636 A637	A628-P633 WeakPolarHBondContact O-CD 3.4Å; V629-P633 WeakPolarHBondContact O-CG 3.35Å; P633-T636 WeakPolarHBondContact CA-OG1 3.33Å; P633-T636 PolarHBondContact O-N 2.87Å; P633-T636 PolarHBondContact O-OG1 3.17Å; P633-A637 WeakPolarHBondContact O-CB 3.49Å; P633-A637 PolarHBondContact O-N 2.83Å
634	G	82.6	Confident	83.2	Confident	33 Å²	33	67.6 Å²	67.6	34%	0.34	37%	0.371	S	S	.	.	H	α-helix	trans	-63.2	-40.9	172.4	0	0	0	0	0	112.3	R630 T631 L632 A637 I638	R630-G634 PolarHBondContact O-N 3.5Å; T631-G634 PolarHBondContact O-N 3.44Å; L632-G634 PolarHBondContact O-N 2.89Å; G634-A637 PolarHBondContact O-N 3.07Å; G634-I638 VanDerWaalsContact O-CG1 3.31Å; G634-I638 WeakPolarHBondContact O-CG1 3.28Å; G634-I638 PolarHBondContact O-N 2.91Å
635	L	83.8	Confident	82.9	Confident	22 Å²	22	66.7 Å²	66.7	12%	0.115	37%	0.369	C	S	.	.	H	α-helix	trans	-68	-36.7	176.6	-68.3	171.5	0	0	0	112.6	T631 L632 I638 R639 L806 H807 V810	T631-L635 WeakPolarHBondContact O-CG 3.43Å; T631-L635 PolarHBondContact O-N 3.41Å; L632-L635 PolarHBondContact O-N 3.12Å; L635-I638 PolarHBondContact O-N 2.95Å; L635-R639 PolarHBondContact O-N 3.26Å; L635-R639 VanDerWaalsContact O-N 3.14Å; L635-L806 HydrophobicContact CD1-CD2 4.46Å; L635-L806 HydrophobicContact CD1-CG 4.06Å; L635-L806 HydrophobicContact CD2-CD2 3.78Å; L635-L806 HydrophobicContact CD2-CG 4.21Å; L635-H807 HydrophobicContact CB-CB 4.41Å; L635-H807 HydrophobicContact CD1-CB 4.24Å; L635-V810 HydrophobicContact CD1-CG2 4.4Å
636	T	83.3	Confident	82.6	Confident	39 Å²	39	67.3 Å²	67.3	24%	0.239	37%	0.37	C	S	.	.	H	α-helix	trans	-68	-40.3	173.6	46.8	0	0	0	0	112.3	L632 P633 I638 R639 E640	L632-T636 PolarHBondContact O-N 3.18Å; L632-T636 VanDerWaalsContact O-N 3.13Å; L632-T636 PolarHBondContact O-OG1 3.41Å; P633-T636 WeakPolarHBondContact CA-OG1 3.33Å; P633-T636 PolarHBondContact O-N 2.87Å; P633-T636 PolarHBondContact O-OG1 3.17Å; T636-I638 VanDerWaalsContact C-N 3.31Å; T636-I638 PolarHBondContact O-N 2.82Å; T636-R639 WeakPolarHBondContact O-CB 3.35Å; T636-R639 PolarHBondContact O-N 3.41Å; T636-R639 VanDerWaalsContact O-N 3.09Å; T636-E640 WeakPolarHBondContact O-CG 3.44Å; T636-E640 PolarHBondContact O-N 3.31Å
637	A	83.4	Confident	82.4	Confident	44 Å²	44	67.9 Å²	67.9	36%	0.364	37%	0.373	S	S	.	.	H	α-helix	trans	-63.5	-35.6	175.8	0	0	0	0	0	112.5	P633 G634 E640 L641	P633-A637 WeakPolarHBondContact O-CB 3.49Å; P633-A637 PolarHBondContact O-N 2.83Å; G634-A637 PolarHBondContact O-N 3.07Å; A637-E640 PolarHBondContact O-N 3.24Å; A637-L641 WeakPolarHBondContact O-CG 3.32Å; A637-L641 PolarHBondContact O-N 2.84Å
638	I	82.3	Confident	82.1	Confident	86 Å²	86	68.4 Å²	68.4	44%	0.441	38%	0.38	S	S	.	.	H	α-helix	trans	-65.6	-38	172.8	-68.8	164.8	0	0	0	111.2	G634 L635 T636 L641 G642	G634-I638 VanDerWaalsContact O-CG1 3.31Å; G634-I638 WeakPolarHBondContact O-CG1 3.28Å; G634-I638 PolarHBondContact O-N 2.91Å; L635-I638 PolarHBondContact O-N 2.95Å; T636-I638 VanDerWaalsContact C-N 3.31Å; T636-I638 PolarHBondContact O-N 2.82Å; I638-L641 PolarHBondContact O-N 2.93Å; I638-G642 PolarHBondContact O-N 2.76Å
639	R	81.3	Confident	82	Confident	101 Å²	101	67.9 Å²	67.9	38%	0.381	37%	0.373	S	S	.	.	H	α-helix	trans	-65.2	-46.8	175.1	-165.4	-173.5	69.7	-148.7	-6.1	111.7	L635 T636 L641 G642 D643	L635-R639 PolarHBondContact O-N 3.26Å; L635-R639 VanDerWaalsContact O-N 3.14Å; T636-R639 WeakPolarHBondContact O-CB 3.35Å; T636-R639 PolarHBondContact O-N 3.41Å; T636-R639 VanDerWaalsContact O-N 3.09Å; R639-L641 VanDerWaalsContact C-N 3.27Å; R639-L641 PolarHBondContact O-N 2.74Å; R639-G642 CarbonylContact O-C 3.54Å; R639-G642 VanDerWaalsContact O-CA 3.31Å; R639-G642 WeakPolarHBondContact O-CA 3.43Å; R639-G642 PolarHBondContact O-N 2.69Å; R639-D643 VanDerWaalsContact O-CG 3.25Å; R639-D643 PolarHBondContact O-N 3Å
640	E	81.1	Confident	81.7	Confident	112 Å²	112	68.2 Å²	68.2	52%	0.523	37%	0.368	S	S	.	.	H	α-helix	trans	-60.4	-35.6	177.3	-69.9	168.8	-174.7	0	0	112.5	T636 A637 D643 T644	T636-E640 WeakPolarHBondContact O-CG 3.44Å; T636-E640 PolarHBondContact O-N 3.31Å; A637-E640 PolarHBondContact O-N 3.24Å; E640-D643 PolarHBondContact O-N 2.7Å; E640-T644 WeakPolarHBondContact O-CG2 3.17Å; E640-T644 PolarHBondContact O-N 3.4Å; E640-T644 PolarHBondContact O-OG1 2.72Å
641	L	81.9	Confident	81.5	Confident	109 Å²	109	64.3 Å²	64.3	57%	0.571	36%	0.363	S	S	*	.	H	α-helix	trans	-66.4	-37.4	170	-74.6	168.3	0	0	0	112.4	A637 I638 R639 T644 L645	A637-L641 WeakPolarHBondContact O-CG 3.32Å; A637-L641 PolarHBondContact O-N 2.84Å; I638-L641 PolarHBondContact O-N 2.93Å; R639-L641 VanDerWaalsContact C-N 3.27Å; R639-L641 PolarHBondContact O-N 2.74Å; L641-T644 WeakPolarHBondContact CA-OG1 3.32Å; L641-T644 PolarHBondContact O-OG1 3.32Å; L641-T644 VanDerWaalsContact O-OG1 3.09Å; L641-L645 WeakPolarHBondContact O-CB 3.18Å; L641-L645 WeakPolarHBondContact O-CD1 3.37Å; L641-L645 VanDerWaalsContact O-CG 3.24Å; L641-L645 WeakPolarHBondContact O-CG 3.12Å; L641-L645 PolarHBondContact O-N 2.79Å
642	G	80.6	Confident	81	Confident	17 Å²	17	65 Å²	65	18%	0.175	36%	0.362	C	S	.	.	H	α-helix	trans	-62	-47.8	171.5	0	0	0	0	0	112.6	I638 R639 T644 L645 Q646	I638-G642 PolarHBondContact O-N 2.76Å; R639-G642 CarbonylContact O-C 3.54Å; R639-G642 VanDerWaalsContact O-CA 3.31Å; R639-G642 WeakPolarHBondContact O-CA 3.43Å; R639-G642 PolarHBondContact O-N 2.69Å; G642-T644 PolarHBondContact O-N 2.86Å; G642-L645 PolarHBondContact O-N 3.17Å; G642-Q646 PolarHBondContact O-N 2.86Å
643	D	78.8	Confident	80.6	Confident	69 Å²	69	68.7 Å²	68.7	37%	0.369	37%	0.374	S	S	.	.	H	α-helix	trans	-61.3	-43	-179.8	-59.4	-30.6	0	0	0	111.2	R639 E640 Q646 V647	R639-D643 VanDerWaalsContact O-CG 3.25Å; R639-D643 PolarHBondContact O-N 3Å; E640-D643 PolarHBondContact O-N 2.7Å; D643-Q646 PolarHBondContact O-N 3.32Å; D643-V647 PolarHBondContact O-N 3.39Å
644	T	81.5	Confident	80.3	Confident	89 Å²	89	70.1 Å²	70.1	55%	0.546	38%	0.379	S	S	.	.	H	α-helix	trans	-69.9	-32.9	175.8	51.5	0	0	0	0	113.4	E640 L641 G642 S648	E640-T644 WeakPolarHBondContact O-CG2 3.17Å; E640-T644 PolarHBondContact O-N 3.4Å; E640-T644 PolarHBondContact O-OG1 2.72Å; L641-T644 WeakPolarHBondContact CA-OG1 3.32Å; L641-T644 PolarHBondContact O-OG1 3.32Å; L641-T644 VanDerWaalsContact O-OG1 3.09Å; G642-T644 PolarHBondContact O-N 2.86Å; T644-S648 PolarHBondContact O-N 3.3Å
645	L	79.3	Confident	79.9	Confident	86 Å²	86	73 Å²	73	45%	0.45	39%	0.385	S	S	.	.	H	α-helix	trans	-68.3	-33.9	172	-76.4	169	0	0	0	112.3	L641 G642 S648 M649 L796	L641-L645 WeakPolarHBondContact O-CB 3.18Å; L641-L645 WeakPolarHBondContact O-CD1 3.37Å; L641-L645 VanDerWaalsContact O-CG 3.24Å; L641-L645 WeakPolarHBondContact O-CG 3.12Å; L641-L645 PolarHBondContact O-N 2.79Å; G642-L645 PolarHBondContact O-N 3.17Å; L645-S648 WeakPolarHBondContact O-CB 3.28Å; L645-S648 PolarHBondContact O-N 3.49Å; L645-M649 WeakPolarHBondContact O-CG 3Å; L645-M649 PolarHBondContact O-N 3.47Å; L645-L796 HydrophobicContact CB-CD1 3.98Å; L645-L796 HydrophobicContact CB-CD2 3.81Å; L645-L796 HydrophobicContact CD1-CD2 4.11Å
646	Q	80.9	Confident	79.4	Confident	67 Å²	67	71.9 Å²	71.9	31%	0.313	38%	0.38	S	S	.	.	H	α-helix	trans	-62.1	-47.9	174.8	-178.1	176.4	-31.3	0	0	111.3	G642 D643 S648 M649 E650	G642-Q646 PolarHBondContact O-N 2.86Å; D643-Q646 PolarHBondContact O-N 3.32Å; Q646-S648 PolarHBondContact O-N 3.47Å; Q646-M649 WeakPolarHBondContact O-CB 3.36Å; Q646-M649 PolarHBondContact O-N 2.82Å; Q646-E650 PolarHBondContact NE2-OE1 2.85Å; Q646-E650 PolarHBondContact O-N 2.87Å
647	V	81.9	Confident	79	Confident	86 Å²	86	73.7 Å²	73.7	52%	0.521	39%	0.388	S	S	.	.	H	α-helix	trans	-57.7	-38.1	174	177.6	0	0	0	0	111.2	D643 M649 E650 T651	D643-V647 PolarHBondContact O-N 3.39Å; V647-M649 PolarHBondContact O-N 2.85Å; V647-E650 PolarHBondContact O-N 2.87Å; V647-T651 PolarHBondContact O-N 2.83Å
648	S	78.4	Confident	78.4	Confident	46 Å²	46	77.9 Å²	77.9	32%	0.322	40%	0.4	S	S	.	.	H	α-helix	trans	-61.4	-42.5	174	-171.9	0	0	0	0	112.3	T644 L645 Q646 E650 T651 Q652	T644-S648 PolarHBondContact O-N 3.3Å; L645-S648 WeakPolarHBondContact O-CB 3.28Å; L645-S648 PolarHBondContact O-N 3.49Å; Q646-S648 PolarHBondContact O-N 3.47Å; S648-E650 VanDerWaalsContact C-N 3.31Å; S648-E650 PolarHBondContact O-N 3.19Å; S648-T651 PolarHBondContact O-N 3.48Å; S648-T651 PolarHBondContact O-OG1 2.93Å; S648-Q652 PolarHBondContact O-N 3.43Å; S648-Q652 VanDerWaalsContact O-N 3.08Å
649	M	80.7	Confident	77.8	Confident	21 Å²	21	74.8 Å²	74.8	10%	0.103	39%	0.385	C	S	.	.	H	α-helix	trans	-65.7	-32.9	176.3	-62.6	-54.7	96.1	0	0	112.7	L645 Q646 V647 Q652 R653 N792 L796	L645-M649 WeakPolarHBondContact O-CG 3Å; L645-M649 PolarHBondContact O-N 3.47Å; Q646-M649 WeakPolarHBondContact O-CB 3.36Å; Q646-M649 PolarHBondContact O-N 2.82Å; V647-M649 PolarHBondContact O-N 2.85Å; M649-Q652 PolarHBondContact O-N 2.88Å; M649-R653 PolarHBondContact O-N 3.26Å; M649-N792 HydrophobicContact CG-CB 4.04Å; M649-N792 HydrophobicContact SD-CB 3.44Å; M649-N792 WeakPolarHBondContact SD-CB 3.24Å; M649-N792 PolarHBondContact SD-ND2 2.83Å; M649-N792 VanDerWaalsContact SD-ND2 3.41Å; M649-L796 HydrophobicContact CG-CD1 3.9Å
650	E	77.8	Confident	77.1	Confident	98 Å²	98	73.4 Å²	73.4	46%	0.458	38%	0.383	S	S	.	.	H	α-helix	trans	-65	-43.6	172.7	-69.1	170.8	-172.9	0	0	111	Q646 V647 S648 Q652 R653 D654	Q646-E650 PolarHBondContact NE2-OE1 2.85Å; Q646-E650 PolarHBondContact O-N 2.87Å; V647-E650 PolarHBondContact O-N 2.87Å; S648-E650 VanDerWaalsContact C-N 3.31Å; S648-E650 PolarHBondContact O-N 3.19Å; E650-Q652 VanDerWaalsContact C-N 3.29Å; E650-Q652 PolarHBondContact O-N 2.86Å; E650-R653 WeakPolarHBondContact O-CA 3.26Å; E650-R653 VanDerWaalsContact O-CB 3.22Å; E650-R653 WeakPolarHBondContact O-CB 3.32Å; E650-R653 PolarHBondContact O-N 3.3Å; E650-D654 PolarHBondContact O-N 2.94Å
651	T	77.3	Confident	76.4	Confident	84 Å²	84	70.8 Å²	70.8	52%	0.515	38%	0.381	S	S	.	.	H	α-helix	trans	-63.7	-31.9	173.8	67.5	0	0	0	0	113.4	V647 S648 D654 L655	V647-T651 PolarHBondContact O-N 2.83Å; S648-T651 PolarHBondContact O-N 3.48Å; S648-T651 PolarHBondContact O-OG1 2.93Å; T651-D654 PolarHBondContact O-N 2.94Å; T651-L655 PolarHBondContact O-N 2.92Å
652	Q	73.2	Confident	75.4	Confident	69 Å²	69	70.5 Å²	70.5	32%	0.322	38%	0.378	S	S	.	.	H	α-helix	trans	-70	-33.8	172.8	-68	-177	6.6	0	0	112.3	S648 M649 E650 A656	S648-Q652 PolarHBondContact O-N 3.43Å; S648-Q652 VanDerWaalsContact O-N 3.08Å; M649-Q652 PolarHBondContact O-N 2.88Å; E650-Q652 VanDerWaalsContact C-N 3.29Å; E650-Q652 PolarHBondContact O-N 2.86Å; Q652-A656 PolarHBondContact O-N 3.3Å; Q652-A656 VanDerWaalsContact O-N 3.12Å
653	R	78.3	Confident	74.6	Confident	101 Å²	101	73.4 Å²	73.4	38%	0.381	39%	0.386	S	S	.	.	H	α-helix	trans	-61	-45.7	172	-171	81.2	-165.1	173.9	11.2	110.7	M649 E650 A656 N657 H786	M649-R653 PolarHBondContact O-N 3.26Å; E650-R653 WeakPolarHBondContact O-CA 3.26Å; E650-R653 VanDerWaalsContact O-CB 3.22Å; E650-R653 WeakPolarHBondContact O-CB 3.32Å; E650-R653 PolarHBondContact O-N 3.3Å; R653-A656 WeakPolarHBondContact O-CB 3.3Å; R653-A656 PolarHBondContact O-N 3.41Å; R653-N657 VanDerWaalsContact O-CG 3.31Å; R653-N657 PolarHBondContact O-N 2.9Å; R653-N657 VanDerWaalsContact O-N 3.14Å; R653-N657 PolarHBondContact O-ND2 3.49Å; R653-H786 VanDerWaalsContact CD-CE1 3.46Å; R653-H786 WeakPolarHBondContact CD-CE1 3.37Å; R653-H786 PolarHBondContact NE-NE2 2.81Å; R653-H786 PolarHBondContact O-NE2 2.75Å
654	D	76.9	Confident	73.8	Confident	93 Å²	93	77.5 Å²	77.5	50%	0.497	40%	0.403	S	S	.	.	H	α-helix	trans	-70.8	-36.5	179.7	-75.5	-24.3	0	0	0	113.4	E650 T651 A656 N657 Q658	E650-D654 PolarHBondContact O-N 2.94Å; T651-D654 PolarHBondContact O-N 2.94Å; D654-A656 VanDerWaalsContact C-N 3.3Å; D654-A656 PolarHBondContact O-N 2.96Å; D654-N657 WeakPolarHBondContact O-CB 3.41Å; D654-N657 PolarHBondContact O-N 3.49Å; D654-N657 PolarHBondContact OD1-ND2 2.99Å; D654-Q658 WeakPolarHBondContact O-CG 3.46Å; D654-Q658 PolarHBondContact O-N 3.02Å
655	L	74.9	Confident	72.8	Confident	93 Å²	93	77.2 Å²	77.2	49%	0.487	40%	0.401	S	S	.	.	H	α-helix	trans	-62	-38.8	172.4	-176.3	61.9	0	0	0	111.7	T651 Q658 V659	T651-L655 PolarHBondContact O-N 2.92Å; L655-Q658 PolarHBondContact O-N 3.25Å; L655-V659 WeakPolarHBondContact O-CG2 3.46Å; L655-V659 PolarHBondContact O-N 3.4Å
656	A	74.1	Confident	71.9	Confident	0 Å²	0	73.2 Å²	73.2	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-64	-40.9	174.1	0	0	0	0	0	112.1	Q652 R653 D654 Q658 V659 E660 L785 H786	Q652-A656 PolarHBondContact O-N 3.3Å; Q652-A656 VanDerWaalsContact O-N 3.12Å; R653-A656 WeakPolarHBondContact O-CB 3.3Å; R653-A656 PolarHBondContact O-N 3.41Å; D654-A656 VanDerWaalsContact C-N 3.3Å; D654-A656 PolarHBondContact O-N 2.96Å; A656-Q658 VanDerWaalsContact C-N 3.29Å; A656-Q658 PolarHBondContact O-N 3.35Å; A656-V659 PolarHBondContact O-N 3.42Å; A656-E660 PolarHBondContact O-N 3.38Å; A656-L785 HydrophobicContact CB-CB 3.75Å; A656-L785 HydrophobicContact CB-CD1 4.29Å; A656-H786 WeakPolarHBondContact CB-CE1 3.32Å; A656-H786 WeakPolarHBondContact CB-ND1 3.48Å; A656-H786 WeakPolarHBondContact CB-NE2 3.4Å
657	N	74	Confident	71.1	Confident	77 Å²	77	74.7 Å²	74.7	41%	0.412	39%	0.394	S	S	.	.	H	α-helix	trans	-58.9	-39.2	173.1	-62	-31.6	0	0	0	111.6	R653 D654 E660 A661 H786	R653-N657 VanDerWaalsContact O-CG 3.31Å; R653-N657 PolarHBondContact O-N 2.9Å; R653-N657 VanDerWaalsContact O-N 3.14Å; R653-N657 PolarHBondContact O-ND2 3.49Å; D654-N657 WeakPolarHBondContact O-CB 3.41Å; D654-N657 PolarHBondContact O-N 3.49Å; D654-N657 PolarHBondContact OD1-ND2 2.99Å; N657-E660 WeakPolarHBondContact O-CB 3.42Å; N657-E660 PolarHBondContact O-N 3.5Å; N657-A661 PolarHBondContact O-N 2.98Å; N657-H786 PolarHBondContact N-NE2 2.83Å; N657-H786 PolarHBondContact OD1-NE2 3.43Å
658	Q	70.6	Confident	70.2	Confident	131 Å²	131	77.3 Å²	77.3	61%	0.612	40%	0.398	S	S	*	.	H	α-helix	trans	-69.8	-36.9	176.5	-68.5	178.6	12.2	0	0	113	D654 L655 A656 E660 A661	D654-Q658 WeakPolarHBondContact O-CG 3.46Å; D654-Q658 PolarHBondContact O-N 3.02Å; L655-Q658 PolarHBondContact O-N 3.25Å; A656-Q658 VanDerWaalsContact C-N 3.29Å; A656-Q658 PolarHBondContact O-N 3.35Å; Q658-E660 VanDerWaalsContact C-N 3.29Å; Q658-E660 PolarHBondContact O-N 2.84Å; Q658-A661 WeakPolarHBondContact O-CB 3.39Å; Q658-A661 PolarHBondContact O-N 3.17Å
659	V	69.6	Low	69.4	Low	22 Å²	22	79 Å²	79	13%	0.133	40%	0.403	C	S	.	.	H	α-helix	trans	-65.8	-33	174.2	171.4	0	0	0	0	111.6	L655 A656 M662 S778 L781 A782	L655-V659 WeakPolarHBondContact O-CG2 3.46Å; L655-V659 PolarHBondContact O-N 3.4Å; A656-V659 PolarHBondContact O-N 3.42Å; V659-M662 WeakPolarHBondContact O-CB 3.27Å; V659-M662 PolarHBondContact O-N 2.81Å; V659-S778 PolarHBondContact O-OG 2.89Å; V659-L781 HydrophobicContact CG1-CB 4.36Å; V659-L781 HydrophobicContact CG1-CD2 4.18Å; V659-L781 HydrophobicContact CG1-CG 4.38Å; V659-A782 HydrophobicContact CG1-CB 4.25Å
660	E	67.8	Low	68.5	Low	71 Å²	71	80.6 Å²	80.6	33%	0.332	42%	0.417	S	S	.	.	H	α-helix	trans	-66	-36.3	174.1	-167.4	105.8	-126.7	0	0	111.9	A656 N657 Q658 M662 K663 A782	A656-E660 PolarHBondContact O-N 3.38Å; N657-E660 WeakPolarHBondContact O-CB 3.42Å; N657-E660 PolarHBondContact O-N 3.5Å; Q658-E660 VanDerWaalsContact C-N 3.29Å; Q658-E660 PolarHBondContact O-N 2.84Å; E660-M662 VanDerWaalsContact C-N 3.26Å; E660-M662 PolarHBondContact O-N 2.93Å; E660-K663 WeakPolarHBondContact O-CB 3.45Å; E660-K663 WeakPolarHBondContact O-CD 3.5Å; E660-K663 VanDerWaalsContact O-CG 3.25Å; E660-K663 WeakPolarHBondContact O-CG 3.48Å; E660-K663 PolarHBondContact O-N 3.07Å; E660-K663 WeakPolarHBondContact OE1-CE 3.2Å; E660-K663 IonicContact OE1-NZ 2.75Å; E660-K663 PolarHBondContact OE1-NZ 2.84Å; E660-A782 HydrophobicContact CB-CB 4.36Å
661	A	65.2	Low	67.9	Low	58 Å²	58	77.5 Å²	77.5	48%	0.479	41%	0.411	S	S	.	.	H	α-helix	trans	-66.1	-22.3	177.6	0	0	0	0	0	113.8	N657 Q658 K663 E664	N657-A661 PolarHBondContact O-N 2.98Å; Q658-A661 WeakPolarHBondContact O-CB 3.39Å; Q658-A661 PolarHBondContact O-N 3.17Å; A661-K663 PolarHBondContact O-N 2.89Å; A661-E664 PolarHBondContact O-N 3.44Å
662	M	62.7	Low	67.2	Low	103 Å²	103	77.6 Å²	77.6	51%	0.507	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-18.7	176	-68.9	-178.7	60.6	0	0	113.6	V659 E660 E664 T665	V659-M662 WeakPolarHBondContact O-CB 3.27Å; V659-M662 PolarHBondContact O-N 2.81Å; E660-M662 VanDerWaalsContact C-N 3.26Å; E660-M662 PolarHBondContact O-N 2.93Å; M662-E664 PolarHBondContact O-N 2.84Å; M662-T665 PolarHBondContact O-N 2.91Å; M662-T665 VanDerWaalsContact O-N 3.12Å; M662-T665 PolarHBondContact O-OG1 2.72Å
663	K	63.3	Low	66.8	Low	77 Å²	77	76 Å²	76	34%	0.335	40%	0.402	S	S	.	.	H	α-helix	trans	-51.8	-35.6	174.8	-72.5	172.9	178	177.4	0	113.6	E660 A661 T665 G666 V667 L775	E660-K663 WeakPolarHBondContact O-CB 3.45Å; E660-K663 WeakPolarHBondContact O-CD 3.5Å; E660-K663 VanDerWaalsContact O-CG 3.25Å; E660-K663 WeakPolarHBondContact O-CG 3.48Å; E660-K663 PolarHBondContact O-N 3.07Å; E660-K663 WeakPolarHBondContact OE1-CE 3.2Å; E660-K663 IonicContact OE1-NZ 2.75Å; E660-K663 PolarHBondContact OE1-NZ 2.84Å; A661-K663 PolarHBondContact O-N 2.89Å; K663-T665 VanDerWaalsContact C-N 3.26Å; K663-T665 PolarHBondContact O-N 2.9Å; K663-G666 PolarHBondContact O-N 2.95Å; K663-G666 VanDerWaalsContact O-N 3.07Å; K663-V667 PolarHBondContact O-N 3.47Å; K663-V667 VanDerWaalsContact O-N 3.15Å; K663-L775 HydrophobicContact CB-CD2 4.15Å; K663-L775 HydrophobicContact CG-CD2 4.23Å
664	E	60.5	Low	66.1	Low	156 Å²	156	77.3 Å²	77.3	73%	0.729	42%	0.417	S	S	*	.	H	α-helix	trans	-60	-37.6	-179.6	-62.6	-172.3	161	0	0	112	A661 M662 G666 V667 F668	A661-E664 PolarHBondContact O-N 3.44Å; M662-E664 PolarHBondContact O-N 2.84Å; E664-G666 VanDerWaalsContact C-N 3.31Å; E664-G666 PolarHBondContact O-N 2.96Å; E664-V667 PolarHBondContact O-N 3.08Å; E664-F668 PolarHBondContact O-N 3.28Å
665	T	60.7	Low	65.4	Low	82 Å²	82	78 Å²	78	50%	0.503	42%	0.42	S	S	.	.	H	α-helix	trans	-66.7	-32.3	176.8	69.4	0	0	0	0	112.7	M662 K663 L669	M662-T665 PolarHBondContact O-N 2.91Å; M662-T665 VanDerWaalsContact O-N 3.12Å; M662-T665 PolarHBondContact O-OG1 2.72Å; K663-T665 VanDerWaalsContact C-N 3.26Å; K663-T665 PolarHBondContact O-N 2.9Å; T665-L669 WeakPolarHBondContact O-CG 3.37Å; T665-L669 PolarHBondContact O-N 3.1Å
666	G	62.3	Low	64.8	Low	2 Å²	2	78.9 Å²	78.9	2%	0.021	43%	0.425	C	S	.	.	H	α-helix	trans	-70.5	-36.5	174.6	0	0	0	0	0	112.6	K663 E664 S670	K663-G666 PolarHBondContact O-N 2.95Å; K663-G666 VanDerWaalsContact O-N 3.07Å; E664-G666 VanDerWaalsContact C-N 3.31Å; E664-G666 PolarHBondContact O-N 2.96Å; G666-S670 PolarHBondContact O-OG 2.91Å
667	V	63	Low	64.2	Low	99 Å²	99	81 Å²	81	60%	0.6	44%	0.442	S	S	*	.	H	α-helix	trans	-68.4	-42.1	175.3	177.1	0	0	0	0	111.1	K663 E664 L669 S670 G671	K663-V667 PolarHBondContact O-N 3.47Å; K663-V667 VanDerWaalsContact O-N 3.15Å; E664-V667 PolarHBondContact O-N 3.08Å; V667-L669 PolarHBondContact O-N 3.38Å; V667-S670 PolarHBondContact O-N 3.49Å; V667-G671 PolarHBondContact O-N 3.36Å
668	F	63.2	Low	63.7	Low	141 Å²	141	80.2 Å²	80.2	62%	0.618	45%	0.447	S	S	*	.	H	α-helix	trans	-57.7	-44.5	177	176.3	-101.9	0	0	0	112.9	E664 S670 G671 L672	E664-F668 PolarHBondContact O-N 3.28Å; F668-S670 VanDerWaalsContact C-N 3.29Å; F668-S670 PolarHBondContact O-N 2.92Å; F668-G671 PolarHBondContact O-N 2.91Å; F668-L672 HydrophobicContact CD1-CD1 4.27Å; F668-L672 HydrophobicContact CE1-CD1 3.66Å; F668-L672 HydrophobicContact CZ-CD1 3.91Å
669	L	61.2	Low	63.2	Low	81 Å²	81	79.6 Å²	79.6	42%	0.424	45%	0.447	S	S	.	.	H	α-helix	trans	-63.2	-32.9	179.1	-72.5	170	0	0	0	113.2	T665 V667 L774	T665-L669 WeakPolarHBondContact O-CG 3.37Å; T665-L669 PolarHBondContact O-N 3.1Å; V667-L669 PolarHBondContact O-N 3.38Å; L669-L774 HydrophobicContact CD1-CD1 4.42Å
670	S	63.1	Low	62.9	Low	55 Å²	55	81.6 Å²	81.6	39%	0.385	45%	0.452	S	S	.	.	H	α-helix	trans	-70.6	-29.8	176.3	-62.7	0	0	0	0	113.1	G666 V667 F668	G666-S670 PolarHBondContact O-OG 2.91Å; V667-S670 PolarHBondContact O-N 3.49Å; F668-S670 VanDerWaalsContact C-N 3.29Å; F668-S670 PolarHBondContact O-N 2.92Å
671	G	64.1	Low	62.6	Low	32 Å²	32	84.5 Å²	84.5	33%	0.33	47%	0.465	S	S	.	.	H	α-helix	trans	-64	-48	176.4	0	0	0	0	0	112.6	V667 F668 V673 L674	V667-G671 PolarHBondContact O-N 3.36Å; F668-G671 PolarHBondContact O-N 2.91Å; G671-V673 PolarHBondContact O-N 2.72Å; G671-L674 WeakPolarHBondContact O-CB 3.44Å; G671-L674 PolarHBondContact O-N 2.92Å
672	L	61.8	Low	62.4	Low	86 Å²	86	88.5 Å²	88.5	45%	0.45	47%	0.474	S	S	.	.	H	α-helix	trans	-58.7	-22.6	-179.2	-77.3	163.6	0	0	0	114.4	F668	F668-L672 HydrophobicContact CD1-CD1 4.27Å; F668-L672 HydrophobicContact CE1-CD1 3.66Å; F668-L672 HydrophobicContact CZ-CD1 3.91Å
673	V	64.8	Low	62.2	Low	35 Å²	35	86 Å²	86	21%	0.212	47%	0.47	C	S	.	.	H	α-helix	trans	-75.1	-31.3	176.5	-179.8	0	0	0	0	111.7	G671 E764	G671-V673 PolarHBondContact O-N 2.72Å; V673-E764 HydrophobicContact CG1-CB 4.48Å
674	L	64.5	Low	62.2	Low	130 Å²	130	87.7 Å²	87.7	68%	0.681	47%	0.474	S	S	*	.	H	α-helix	trans	-74	-41.5	179.2	-70.6	164.1	0	0	0	111.9	G671 L676 A677 A678	G671-L674 WeakPolarHBondContact O-CB 3.44Å; G671-L674 PolarHBondContact O-N 2.92Å; L674-L676 VanDerWaalsContact C-N 3.32Å; L674-L676 PolarHBondContact O-N 2.94Å; L674-A677 PolarHBondContact O-N 3.23Å; L674-A678 PolarHBondContact O-N 3.21Å
675	D	62.1	Low	62.3	Low	106 Å²	106	84.7 Å²	84.7	57%	0.567	47%	0.467	S	S	*	.	H	α-helix	trans	-63.7	-36.9	-179.6	-63.3	-31.8	0	0	0	112.3	A677 A678 L679	D675-A677 VanDerWaalsContact C-N 3.33Å; D675-A677 PolarHBondContact O-N 3.47Å; D675-A678 PolarHBondContact O-N 2.95Å; D675-L679 PolarHBondContact O-N 2.99Å
676	L	62.3	Low	62.4	Low	112 Å²	112	82.9 Å²	82.9	59%	0.586	46%	0.464	S	S	*	.	H	α-helix	trans	-63	-36.4	175.4	-83	166.7	0	0	0	112.9	L674	L674-L676 VanDerWaalsContact C-N 3.32Å; L674-L676 PolarHBondContact O-N 2.94Å
677	A	61.4	Low	62.3	Low	44 Å²	44	84.8 Å²	84.8	36%	0.364	47%	0.474	S	S	.	.	H	α-helix	trans	-69.8	-35.4	178.6	0	0	0	0	0	112.2	L674 D675	L674-A677 PolarHBondContact O-N 3.23Å; D675-A677 VanDerWaalsContact C-N 3.33Å; D675-A677 PolarHBondContact O-N 3.47Å
678	A	62.7	Low	62.2	Low	62 Å²	62	83 Å²	83	51%	0.512	47%	0.466	S	S	.	.	H	α-helix	trans	-65.4	-50.7	179	0	0	0	0	0	112.3	L674 D675 R680 Q681 E682	L674-A678 PolarHBondContact O-N 3.21Å; D675-A678 PolarHBondContact O-N 2.95Å; A678-R680 PolarHBondContact O-N 3.42Å; A678-Q681 WeakPolarHBondContact O-CB 3.39Å; A678-Q681 PolarHBondContact O-N 3.44Å; A678-E682 PolarHBondContact O-N 3.28Å
679	L	61.8	Low	62.1	Low	117 Å²	117	79.3 Å²	79.3	61%	0.613	46%	0.461	S	S	*	.	H	α-helix	trans	-55.6	-36	179.3	-91.4	159.5	0	0	0	113.3	D675 Q681 A683	D675-L679 PolarHBondContact O-N 2.99Å; L679-Q681 VanDerWaalsContact C-N 3.34Å; L679-A683 PolarHBondContact O-N 2.67Å
680	R	62.1	Low	62	Low	65 Å²	65	81.5 Å²	81.5	25%	0.245	47%	0.473	C	S	.	.	H	α-helix	trans	-67.2	-33	178.3	-178	179.7	176.6	-169.7	-2.1	113.1	A678 D761 E764	A678-R680 PolarHBondContact O-N 3.42Å; R680-D761 IonicContact CZ-OD1 3.22Å; R680-D761 IonicContact NH1-OD1 3.33Å; R680-D761 PolarHBondContact NH1-OD1 2.93Å; R680-D761 IonicContact NH2-OD1 3.17Å; R680-D761 PolarHBondContact NH2-OD1 3.11Å; R680-E764 IonicContact NH1-OE1 3.18Å; R680-E764 PolarHBondContact NH1-OE1 2.88Å
681	Q	61.4	Low	61.9	Low	131 Å²	131	82.1 Å²	82.1	61%	0.612	47%	0.469	S	S	*	.	H	α-helix	trans	-73.1	-41.5	-179.4	-164.2	77.5	-27.3	0	0	111	A678 L679 R684	A678-Q681 WeakPolarHBondContact O-CB 3.39Å; A678-Q681 PolarHBondContact O-N 3.44Å; L679-Q681 VanDerWaalsContact C-N 3.34Å; Q681-R684 WeakPolarHBondContact O-CB 3.12Å; Q681-R684 PolarHBondContact O-N 3.4Å
682	E	61.6	Low	61.7	Low	142 Å²	142	87.9 Å²	87.9	66%	0.664	49%	0.488	S	S	*	.	H	α-helix	trans	-70.3	-39.2	-176.7	-165.8	167.7	-128.8	0	0	112.8	A678 R684 T685	A678-E682 PolarHBondContact O-N 3.28Å; E682-R684 PolarHBondContact O-N 2.97Å; E682-R684 VanDerWaalsContact O-N 3.16Å; E682-T685 PolarHBondContact O-N 3.02Å; E682-T685 PolarHBondContact O-OG1 3.47Å; E682-T685 VanDerWaalsContact O-OG1 3.1Å
683	A	58.3	Low	61.7	Low	51 Å²	51	88.5 Å²	88.5	42%	0.421	49%	0.489	S	S	.	.	H	α-helix	trans	-61.5	-22.7	172.8	0	0	0	0	0	113.5	L679	L679-A683 PolarHBondContact O-N 2.67Å
684	R	63	Low	61.4	Low	113 Å²	113	89.8 Å²	89.8	43%	0.426	49%	0.492	S	S	.	.	H	α-helix	trans	-82.8	-30.6	-174.4	-135.9	173.6	-171.1	176.3	1.3	113.3	Q681 E682 S756	Q681-R684 WeakPolarHBondContact O-CB 3.12Å; Q681-R684 PolarHBondContact O-N 3.4Å; E682-R684 PolarHBondContact O-N 2.97Å; E682-R684 VanDerWaalsContact O-N 3.16Å; R684-S756 PolarHBondContact NH2-OG 3.13Å
685	T	62.9	Low	61.2	Low	93 Å²	93	90.2 Å²	90.2	57%	0.571	49%	0.491	S	S	*	.	H	α-helix	trans	-82.5	-32.3	179.8	53.2	0	0	0	0	112.7	E682 L687 S688	E682-T685 PolarHBondContact O-N 3.02Å; E682-T685 PolarHBondContact O-OG1 3.47Å; E682-T685 VanDerWaalsContact O-OG1 3.1Å; T685-L687 VanDerWaalsContact C-N 3.33Å; T685-L687 PolarHBondContact O-N 3.08Å; T685-S688 PolarHBondContact O-OG 2.94Å
686	G	63	Low	61.3	Low	43 Å²	43	93.1 Å²	93.1	44%	0.443	49%	0.494	S	S	.	.	H	α-helix	trans	-63.7	-34.5	176.6	0	0	0	0	0	113.8
687	L	60.9	Low	61.2	Low	42 Å²	42	92.7 Å²	92.7	22%	0.22	49%	0.491	C	S	.	.	H	α-helix	trans	-70.2	-34.3	-179.1	-88.8	162.2	0	0	0	113.7	T685 L751 L755	T685-L687 VanDerWaalsContact C-N 3.33Å; T685-L687 PolarHBondContact O-N 3.08Å; L687-L751 HydrophobicContact CD1-CD2 3.99Å; L687-L755 HydrophobicContact CD1-CD1 3.48Å; L687-L755 VanDerWaalsContact CD1-CD1 3.48Å
688	S	60.4	Low	61.1	Low	63 Å²	63	94.5 Å²	94.5	44%	0.441	49%	0.492	S	S	.	.	H	α-helix	trans	-68.7	-37	178.1	37.8	0	0	0	0	113	T685 L690 Q691	T685-S688 PolarHBondContact O-OG 2.94Å; S688-L690 VanDerWaalsContact C-N 3.29Å; S688-L690 PolarHBondContact O-N 3.22Å; S688-Q691 WeakPolarHBondContact O-CB 3.3Å; S688-Q691 PolarHBondContact O-N 3.09Å; S688-Q691 VanDerWaalsContact O-N 3.13Å
689	A	60.3	Low	61	Low	63 Å²	63	97 Å²	97	52%	0.521	49%	0.494	S	S	.	.	H	α-helix	trans	-67.1	-29.2	-178.2	0	0	0	0	0	113.2	Q691	A689-Q691 VanDerWaalsContact C-N 3.28Å; A689-Q691 PolarHBondContact O-N 2.96Å
690	L	60.2	Low	60.9	Low	127 Å²	127	97.7 Å²	97.7	67%	0.665	49%	0.493	S	S	*	.	H	α-helix	trans	-70.5	-22.8	174.8	-94.5	156.1	0	0	0	113.3	S688	S688-L690 VanDerWaalsContact C-N 3.29Å; S688-L690 PolarHBondContact O-N 3.22Å
691	Q	60	Low	60.8	Low	67 Å²	67	97.7 Å²	97.7	31%	0.313	50%	0.498	S	S	.	.	H	α-helix	trans	-80.4	-34.8	-174.1	-143.9	161.7	6.8	0	0	111.7	S688 A689 Q752	S688-Q691 WeakPolarHBondContact O-CB 3.3Å; S688-Q691 PolarHBondContact O-N 3.09Å; S688-Q691 VanDerWaalsContact O-N 3.13Å; A689-Q691 VanDerWaalsContact C-N 3.28Å; A689-Q691 PolarHBondContact O-N 2.96Å; Q691-Q752 VanDerWaalsContact OE1-NE2 3.08Å
692	E	61.3	Low	60.7	Low	154 Å²	154	98 Å²	98	72%	0.72	50%	0.499	S	S	*	.	H	α-helix	trans	-71.2	-36.9	-179.8	-64.7	-172.1	130.4	0	0	114	Q694	E692-Q694 VanDerWaalsContact C-N 3.3Å; E692-Q694 PolarHBondContact O-N 2.85Å
693	E	60.3	Low	60.6	Low	99 Å²	99	99.3 Å²	99.3	46%	0.463	50%	0.498	S	S	.	.	H	α-helix	trans	-66.5	-31.7	177.6	-95.4	-71.1	119	0	0	112.3	R696 L697	E693-R696 WeakPolarHBondContact O-CB 3.34Å; E693-R696 PolarHBondContact O-N 2.88Å; E693-R696 WeakPolarHBondContact OE1-CD 3.34Å; E693-R696 IonicContact OE1-NH1 3.49Å; E693-R696 PolarHBondContact OE1-NH1 2.95Å; E693-L697 PolarHBondContact O-N 3.35Å
694	Q	59.1	Low	60.6	Low	61 Å²	61	99.9 Å²	99.9	29%	0.285	50%	0.503	S	S	.	.	H	α-helix	trans	-67.5	-41	-176.6	-169.1	172.3	-1.3	0	0	112.5	E692 R696	E692-Q694 VanDerWaalsContact C-N 3.3Å; E692-Q694 PolarHBondContact O-N 2.85Å; Q694-R696 VanDerWaalsContact C-N 3.34Å
695	E	60.6	Low	60.2	Low	140 Å²	140	99 Å²	99	65%	0.654	50%	0.504	S	S	*	.	H	α-helix	trans	-66.1	-37.6	175.4	-64.7	-161.2	143.5	0	0	112.1	L697 Q698 Q699	E695-L697 PolarHBondContact O-N 2.67Å; E695-Q698 PolarHBondContact O-N 3.24Å; E695-Q699 PolarHBondContact O-N 3.35Å
696	R	63.1	Low	59.9	Low	167 Å²	167	102.1 Å²	102.1	63%	0.63	51%	0.511	S	S	*	.	H	α-helix	trans	-63.1	-40.5	-175.9	-167.9	-176.7	-169.6	175.9	6.2	112.9	E693 Q694	E693-R696 WeakPolarHBondContact O-CB 3.34Å; E693-R696 PolarHBondContact O-N 2.88Å; E693-R696 WeakPolarHBondContact OE1-CD 3.34Å; E693-R696 IonicContact OE1-NH1 3.49Å; E693-R696 PolarHBondContact OE1-NH1 2.95Å; Q694-R696 VanDerWaalsContact C-N 3.34Å
697	L	60.2	Low	59.6	Low	103 Å²	103	107.6 Å²	107.6	54%	0.539	53%	0.526	S	S	.	.	H	α-helix	trans	-66	-38.7	175.1	-80.3	161.4	0	0	0	111.9	E693 E695 Q699 Q700	E693-L697 PolarHBondContact O-N 3.35Å; E695-L697 PolarHBondContact O-N 2.67Å; L697-Q699 VanDerWaalsContact C-N 3.32Å; L697-Q699 PolarHBondContact O-N 2.89Å; L697-Q700 PolarHBondContact O-N 2.97Å
698	Q	59.4	Low	59.3	Low	81 Å²	81	111.1 Å²	111.1	38%	0.379	54%	0.541	S	S	.	.	H	α-helix	trans	-67	-31.8	-173.4	-143.7	173.2	55.4	0	0	112.8	E695 Q700 S741	E695-Q698 PolarHBondContact O-N 3.24Å; Q698-Q700 VanDerWaalsContact C-N 3.35Å; Q698-Q700 PolarHBondContact O-N 2.87Å; Q698-S741 PolarHBondContact NE2-OG 3.27Å
699	Q	61.5	Low	58.9	Low	116 Å²	116	114.4 Å²	114.4	54%	0.542	55%	0.549	S	S	.	.	H	α-helix	trans	-69.7	-24.4	176.5	-66.5	-167.9	14.6	0	0	114.6	E695 L697	E695-Q699 PolarHBondContact O-N 3.35Å; L697-Q699 VanDerWaalsContact C-N 3.32Å; L697-Q699 PolarHBondContact O-N 2.89Å
700	Q	59.9	Low	58.6	Low	130 Å²	130	119.1 Å²	119.1	61%	0.607	56%	0.56	S	S	*	*	H	α-helix	trans	-73.4	-39.5	-178.1	-63.4	-169.1	4.5	0	0	111.7	L697 Q698 Q702 R703	L697-Q700 PolarHBondContact O-N 2.97Å; Q698-Q700 VanDerWaalsContact C-N 3.35Å; Q698-Q700 PolarHBondContact O-N 2.87Å; Q700-Q702 VanDerWaalsContact C-N 3.34Å; Q700-Q702 PolarHBondContact O-N 3.14Å; Q700-R703 PolarHBondContact O-N 2.62Å
701	I	59.3	Low	58.2	Low	66 Å²	66	115.9 Å²	115.9	34%	0.338	56%	0.557	S	S	.	*	H	α-helix	trans	-62.6	-38.1	-173.8	-62.8	174	0	0	0	111.9	R703 Q738	I701-R703 VanDerWaalsContact C-N 3.28Å; I701-R703 PolarHBondContact O-N 3.44Å; I701-Q738 HydrophobicContact CG2-CG 4.26Å
702	Q	59	Low	57.5	Low	136 Å²	136	118.8 Å²	118.8	64%	0.636	57%	0.573	S	S	*	*	H	α-helix	trans	-63	-30	-179.8	-73.9	-172.6	-22.5	0	0	113.8	Q700 Q705	Q700-Q702 VanDerWaalsContact C-N 3.34Å; Q700-Q702 PolarHBondContact O-N 3.14Å; Q702-Q705 PolarHBondContact O-N 3.37Å
703	R	61	Low	56.7	Low	170 Å²	170	118 Å²	118	64%	0.642	57%	0.573	S	S	*	*	H	α-helix	trans	-74.2	-32.5	-173.4	-64.3	-177.9	-175.3	156.3	7.3	113	Q700 I701 Q705	Q700-R703 PolarHBondContact O-N 2.62Å; I701-R703 VanDerWaalsContact C-N 3.28Å; I701-R703 PolarHBondContact O-N 3.44Å; R703-Q705 VanDerWaalsContact C-N 3.33Å
704	A	56.4	Low	56	Low	63 Å²	63	124.9 Å²	124.9	52%	0.521	60%	0.595	S	S	.	*	H	α-helix	trans	-67	-35.7	175.4	0	0	0	0	0	112.1	Q706 Q707	A704-Q706 VanDerWaalsContact C-N 3.33Å; A704-Q706 PolarHBondContact O-N 3.44Å; A704-Q707 PolarHBondContact O-N 3.43Å
705	Q	55.9	Low	55.2	Low	96 Å²	96	126.4 Å²	126.4	45%	0.449	62%	0.618	S	S	.	*	H	α-helix	trans	-66.4	-30.8	-171.6	-150.2	168.4	12	0	0	113.1	Q702 R703	Q702-Q705 PolarHBondContact O-N 3.37Å; R703-Q705 VanDerWaalsContact C-N 3.33Å
706	Q	56.8	Low	54.3	Low	157 Å²	157	126.6 Å²	126.6	73%	0.734	62%	0.622	S	S	*	*	H	α-helix	trans	-74.8	-30.5	178.3	-77.4	-172.7	-27.8	0	0	114.4	A704	A704-Q706 VanDerWaalsContact C-N 3.33Å; A704-Q706 PolarHBondContact O-N 3.44Å
707	Q	56.3	Low	53	Low	159 Å²	159	127.8 Å²	127.8	74%	0.743	63%	0.634	S	S	*	*	H	α-helix	trans	-71.7	-33.2	-174.4	-68.8	-174.8	-22.5	0	0	112.4	A704	A704-Q707 PolarHBondContact O-N 3.43Å
708	H	54.5	Low	51.8	Low	115 Å²	115	132.5 Å²	132.5	53%	0.532	65%	0.651	S	S	.	*	H	α-helix	trans	-65.7	-39.6	179.8	-169.8	66.6	0	0	0	112.5	Q710 G711	H708-Q710 PolarHBondContact O-N 3.16Å; H708-Q710 VanDerWaalsContact O-N 3.14Å; H708-G711 PolarHBondContact O-N 2.89Å
709	Q	52.7	Low	50.5	Low	132 Å²	132	134.9 Å²	134.9	62%	0.617	67%	0.666	S	S	*	*	H	α-helix	trans	-62.1	-25.2	-174	-156.1	71.2	13.6	0	0	113.9
710	Q	52.6	Low	49.1	Very low	163 Å²	163	136.2 Å²	136.2	76%	0.762	67%	0.672	S	S	*	*	H	α-helix	trans	-84.1	-20.9	-177.9	-65.6	-172.1	-8.6	0	0	113.8	H708	H708-Q710 PolarHBondContact O-N 3.16Å; H708-Q710 VanDerWaalsContact O-N 3.14Å
711	G	51.6	Low	47.8	Very low	58 Å²	58	135.6 Å²	135.6	60%	0.598	67%	0.673	S	S	*	*	H	α-helix	trans	-75.1	-33.7	-176.7	0	0	0	0	0	114.2	H708 N713	H708-G711 PolarHBondContact O-N 2.89Å; G711-N713 VanDerWaalsContact C-N 3.34Å; G711-N713 PolarHBondContact O-N 3.15Å
712	M	46.8	Very low	46.4	Very low	129 Å²	129	140 Å²	140	64%	0.635	69%	0.692	S	S	*	*	G	3₁₀ helix	trans	-76.2	-18.9	-165.5	-146.7	153.5	99.7	0	0	114.2	R714	M712-R714 PolarHBondContact O-N 3.16Å; M712-R714 VanDerWaalsContact O-N 3.12Å
713	N	44.3	Very low	45.3	Very low	136 Å²	136	139.9 Å²	139.9	73%	0.727	70%	0.695	S	S	*	*	G	3₁₀ helix	trans	-78	12.5	-176.3	-74	-17.8	0	0	0	115.3	G711	G711-N713 VanDerWaalsContact C-N 3.34Å; G711-N713 PolarHBondContact O-N 3.15Å
714	R	45.9	Very low	44.2	Very low	245 Å²	245	138.2 Å²	138.2	93%	0.925	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-113.6	1.3	178.7	-81.3	-172.7	173.4	177.6	-0.7	115.5	M712	M712-R714 PolarHBondContact O-N 3.16Å; M712-R714 VanDerWaalsContact O-N 3.12Å
715	A	41.2	Very low	43.3	Very low	92 Å²	92	142.7 Å²	142.7	76%	0.76	71%	0.713	S	S	*	*			trans	-113.8	23.5	-173.2	0	0	0	0	0	114.8
716	I	41.6	Very low	42.5	Very low	144 Å²	144	143.8 Å²	143.8	74%	0.738	73%	0.726	S	S	*	*			trans	-107.5	80.7	177.3	-52.6	176.3	0	0	0	109.6
717	Q	35.7	Very low	41.6	Very low	192 Å²	192	142.2 Å²	142.2	90%	0.897	73%	0.727	S	S	*	*			trans	-178.8	65.3	159	-106.2	165.6	8	0	0	114.9
718	F	36.6	Very low	41.1	Very low	203 Å²	203	142.1 Å²	142.1	89%	0.89	73%	0.729	S	S	*	*	S	Bend		-152.3	134.9	129.5	-147	-97.1	0	0	0	112.1
719	L	31.9	Very low	40.4	Very low	131 Å²	131	142.9 Å²	142.9	69%	0.686	73%	0.733	S	S	*	*			trans	-53.9	122.5	-164.6	-67.1	175.4	0	0	0	116.8
720	Q	31.4	Very low	40.1	Very low	144 Å²	144	141.8 Å²	141.8	67%	0.673	74%	0.735	S	S	*	*				96.8	116.9	100.4	-165.2	164.8	5.5	0	0	120.6
721	D	31.5	Very low	39.7	Very low	117 Å²	117	139.7 Å²	139.7	63%	0.626	73%	0.725	S	S	*	*			trans	70.6	119.1	148.7	-62.7	-24.3	0	0	0	122.1
722	Q	31.5	Very low	39.3	Very low	157 Å²	157	142.1 Å²	142.1	73%	0.734	72%	0.721	S	S	*	*			trans	74.7	120.3	164	-43.1	-45.2	-58.3	0	0	116.8
723	L	34.4	Very low	39.3	Very low	135 Å²	135	142.4 Å²	142.4	71%	0.707	72%	0.721	S	S	*	*			cis	-151	146.1	-4.2	-176.7	63.2	0	0	0	112.5
724	N	39.1	Very low	39.6	Very low	135 Å²	135	143.8 Å²	143.8	72%	0.722	72%	0.717	S	S	*	*			trans	-35.7	146.7	172.8	-41.5	-28.8	0	0	0	116.4
725	L	37.4	Very low	39.7	Very low	156 Å²	156	135.3 Å²	135.3	82%	0.817	70%	0.695	S	S	*	*				-156.3	-41.4	124.4	-161.5	52	0	0	0	114.3	T727	L725-T727 PolarHBondContact O-N 3.34Å
726	V	38.6	Very low	40.1	Very low	119 Å²	119	135.6 Å²	135.6	72%	0.721	68%	0.681	S	S	*	*	S	Bend	trans	-103.7	66.9	-165.9	-164.6	0	0	0	0	113.2
727	T	38.7	Very low	40.4	Very low	125 Å²	125	134 Å²	134	77%	0.767	67%	0.673	S	S	*	*	S	Bend	trans	-138.8	8.5	172.1	-10.2	0	0	0	0	114.2	L725	L725-T727 PolarHBondContact O-N 3.34Å
728	M	44.2	Very low	41.1	Very low	156 Å²	156	127.6 Å²	127.6	77%	0.768	64%	0.643	S	S	*	*	S	Bend	trans	-105.7	-28.4	-174.7	-116.7	176.8	68.5	0	0	114.6
729	E	41.2	Very low	41.9	Very low	132 Å²	132	121 Å²	121	62%	0.617	63%	0.626	S	S	*	*	H	α-helix	trans	-75.8	-29.7	-165.7	-62	177.3	133.8	0	0	113.7	Q731 Q732	E729-Q731 VanDerWaalsContact C-N 3.32Å; E729-Q731 PolarHBondContact O-N 2.85Å; E729-Q732 PolarHBondContact O-N 3.35Å
730	T	45.6	Very low	42.8	Very low	109 Å²	109	117.5 Å²	117.5	67%	0.669	62%	0.616	S	S	*	*	H	α-helix	trans	-76.9	-10.7	-174	48.9	0	0	0	0	115.1
731	Q	44.1	Very low	43.8	Very low	119 Å²	119	112.3 Å²	112.3	56%	0.556	60%	0.596	S	S	*	*	H	α-helix	trans	-92.4	-22.5	174	-80.9	-173.1	-27.8	0	0	113.9	E729	E729-Q731 VanDerWaalsContact C-N 3.32Å; E729-Q731 PolarHBondContact O-N 2.85Å
732	Q	44.2	Very low	45	Very low	108 Å²	108	115.4 Å²	115.4	51%	0.505	60%	0.598	S	S	.	*	H	α-helix	trans	-76	-41.2	-173.2	-174.3	170.7	-23.4	0	0	112.9	E729 Y734 S735 E736	E729-Q732 PolarHBondContact O-N 3.35Å; Q732-Y734 PolarHBondContact O-N 2.97Å; Q732-Y734 VanDerWaalsContact O-N 3.09Å; Q732-S735 PolarHBondContact O-N 3.34Å; Q732-S735 PolarHBondContact O-OG 3.09Å; Q732-E736 WeakPolarHBondContact CG-OE1 3.47Å; Q732-E736 PolarHBondContact NE2-OE1 2.91Å
733	H	45.5	Very low	46.1	Very low	136 Å²	136	113.1 Å²	113.1	63%	0.63	60%	0.595	S	S	*	*	H	α-helix	trans	-65	-17.8	-174.9	-67.5	-48.4	0	0	0	115.3
734	Y	50.4	Low	47.1	Very low	165 Å²	165	112.1 Å²	112.1	65%	0.647	59%	0.59	S	S	*	*	H	α-helix	trans	-87.7	-23	177.3	-79.4	-74.8	0	0	0	114.2	Q732	Q732-Y734 PolarHBondContact O-N 2.97Å; Q732-Y734 VanDerWaalsContact O-N 3.09Å
735	S	48.3	Very low	47.9	Very low	67 Å²	67	110.4 Å²	110.4	47%	0.469	58%	0.578	S	S	.	*	H	α-helix	trans	-82.2	-36	178.4	54.4	0	0	0	0	112.2	Q732 L737 Q738 A739	Q732-S735 PolarHBondContact O-N 3.34Å; Q732-S735 PolarHBondContact O-OG 3.09Å; S735-L737 VanDerWaalsContact C-N 3.33Å; S735-L737 PolarHBondContact O-N 3.21Å; S735-Q738 PolarHBondContact O-N 2.92Å; S735-A739 PolarHBondContact O-N 3.36Å
736	E	49.3	Very low	48.8	Very low	98 Å²	98	105.2 Å²	105.2	46%	0.458	56%	0.562	S	S	.	*	H	α-helix	trans	-62.7	-37.3	178.1	-67.9	173	176	0	0	112.2	Q732 Q738 A739 A740	Q732-E736 WeakPolarHBondContact CG-OE1 3.47Å; Q732-E736 PolarHBondContact NE2-OE1 2.91Å; E736-Q738 VanDerWaalsContact C-N 3.35Å; E736-Q738 PolarHBondContact O-N 3.05Å; E736-A739 WeakPolarHBondContact O-CB 3.23Å; E736-A739 PolarHBondContact O-N 3.01Å; E736-A740 PolarHBondContact O-N 3.07Å
737	L	48.5	Very low	49.7	Very low	111 Å²	111	103.5 Å²	103.5	58%	0.581	55%	0.554	S	S	*	*	H	α-helix	trans	-67.4	-31.4	178.9	-158.5	72.8	0	0	0	113.2	S735 A739	S735-L737 VanDerWaalsContact C-N 3.33Å; S735-L737 PolarHBondContact O-N 3.21Å; L737-A739 VanDerWaalsContact C-N 3.33Å
738	Q	51.6	Low	50.6	Low	57 Å²	57	99.6 Å²	99.6	27%	0.266	53%	0.529	S	S	.	.	H	α-helix	trans	-73	-24.4	174.5	-76.1	-174.4	-3.3	0	0	112.9	I701 S735 E736	I701-Q738 HydrophobicContact CG2-CG 4.26Å; S735-Q738 PolarHBondContact O-N 2.92Å; E736-Q738 VanDerWaalsContact C-N 3.35Å; E736-Q738 PolarHBondContact O-N 3.05Å
739	A	52	Low	51.2	Low	63 Å²	63	96.2 Å²	96.2	52%	0.521	51%	0.512	S	S	.	.	H	α-helix	trans	-72.4	-47	176.6	0	0	0	0	0	111.6	S735 E736 L737 S741 R742 T743	S735-A739 PolarHBondContact O-N 3.36Å; E736-A739 WeakPolarHBondContact O-CB 3.23Å; E736-A739 PolarHBondContact O-N 3.01Å; L737-A739 VanDerWaalsContact C-N 3.33Å; A739-S741 VanDerWaalsContact C-N 3.32Å; A739-S741 PolarHBondContact O-N 3.06Å; A739-R742 PolarHBondContact O-N 2.54Å; A739-T743 PolarHBondContact O-OG1 3.19Å
740	A	51.8	Low	51.8	Low	58 Å²	58	92.4 Å²	92.4	48%	0.479	50%	0.502	S	S	.	.	H	α-helix	trans	-63.1	-33.1	-178	0	0	0	0	0	113.9	E736 R742 T743	E736-A740 PolarHBondContact O-N 3.07Å; A740-R742 VanDerWaalsContact C-N 3.29Å; A740-R742 PolarHBondContact O-N 3.34Å; A740-T743 PolarHBondContact O-N 3.12Å; A740-T743 PolarHBondContact O-OG1 3.29Å
741	S	52.9	Low	52.4	Low	36 Å²	36	91.7 Å²	91.7	25%	0.252	49%	0.494	S	S	.	.	H	α-helix	trans	-62.2	-33.6	177.8	174.2	0	0	0	0	113.1	Q698 A739	Q698-S741 PolarHBondContact NE2-OG 3.27Å; A739-S741 VanDerWaalsContact C-N 3.32Å; A739-S741 PolarHBondContact O-N 3.06Å
742	R	55.2	Low	53	Low	181 Å²	181	89.7 Å²	89.7	68%	0.683	49%	0.485	S	S	*	.	H	α-helix	trans	-80.6	-21	-177	-69	-179.7	175.8	163.7	1	113.6	A739 A740 L744	A739-R742 PolarHBondContact O-N 2.54Å; A740-R742 VanDerWaalsContact C-N 3.29Å; A740-R742 PolarHBondContact O-N 3.34Å; R742-L744 VanDerWaalsContact C-N 3.29Å; R742-L744 PolarHBondContact O-N 3.34Å
743	T	55.6	Low	53.6	Low	109 Å²	109	92 Å²	92	67%	0.669	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-15.6	-177.6	-7.5	0	0	0	0	113.8	A739 A740	A739-T743 PolarHBondContact O-OG1 3.19Å; A740-T743 PolarHBondContact O-N 3.12Å; A740-T743 PolarHBondContact O-OG1 3.29Å
744	L	54.6	Low	54.2	Low	114 Å²	114	91 Å²	91	60%	0.597	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-6.7	-178.1	-84.3	164.9	0	0	0	115	R742	R742-L744 VanDerWaalsContact C-N 3.29Å; R742-L744 PolarHBondContact O-N 3.34Å
745	Q	55.6	Low	54.4	Low	99 Å²	99	86.3 Å²	86.3	46%	0.463	48%	0.481	S	S	.	.	H	α-helix	trans	-76.3	-46	-173.9	-172.4	169.7	-9.5	0	0	113.2	V748 E749	Q745-V748 PolarHBondContact O-N 3.49Å; Q745-E749 WeakPolarHBondContact CG-OE1 3.3Å; Q745-E749 PolarHBondContact NE2-OE1 3.17Å
746	G	56.9	Low	54.8	Low	47 Å²	47	86.4 Å²	86.4	49%	0.485	48%	0.481	S	S	.	.	H	α-helix	trans	-59.2	-39.8	-176.3	0	0	0	0	0	116.5	V748 A750	G746-V748 VanDerWaalsContact C-N 3.31Å; G746-V748 PolarHBondContact O-N 2.91Å; G746-A750 PolarHBondContact O-N 3.18Å
747	P	57	Low	55.2	Low	84 Å²	84	84.1 Å²	84.1	55%	0.545	48%	0.476	S	S	.	.	H	α-helix	trans	-63.6	-30.3	178.8	-26.3	36.1	0	0	0	114.7	L751	P747-L751 PolarHBondContact O-N 3.43Å
748	V	57.8	Low	55.5	Low	43 Å²	43	83.6 Å²	83.6	26%	0.261	48%	0.482	S	S	.	.	H	α-helix	trans	-73.2	-47.8	-178.2	-179.6	0	0	0	0	110.5	Q745 G746 A750 L751 Q752	Q745-V748 PolarHBondContact O-N 3.49Å; G746-V748 VanDerWaalsContact C-N 3.31Å; G746-V748 PolarHBondContact O-N 2.91Å; V748-A750 VanDerWaalsContact C-N 3.29Å; V748-A750 PolarHBondContact O-N 3.44Å; V748-L751 PolarHBondContact O-N 2.97Å; V748-L751 VanDerWaalsContact O-N 3.1Å; V748-Q752 PolarHBondContact O-N 2.82Å; V748-Q752 VanDerWaalsContact O-N 3.17Å
749	E	56.5	Low	55.7	Low	85 Å²	85	91.2 Å²	91.2	40%	0.397	51%	0.508	S	S	.	.	H	α-helix	trans	-61.4	-37	179.3	-64.9	172.9	-174.1	0	0	111.6	Q745 L751 Q752 Q753	Q745-E749 WeakPolarHBondContact CG-OE1 3.3Å; Q745-E749 PolarHBondContact NE2-OE1 3.17Å; E749-L751 VanDerWaalsContact C-N 3.33Å; E749-L751 PolarHBondContact O-N 2.82Å; E749-Q752 PolarHBondContact O-N 3.14Å; E749-Q753 PolarHBondContact O-N 3.24Å
750	A	54.9	Low	55.8	Low	51 Å²	51	91.1 Å²	91.1	42%	0.421	50%	0.503	S	S	.	.	H	α-helix	trans	-65.8	-30.2	175.8	0	0	0	0	0	113.8	G746 V748 N754	G746-A750 PolarHBondContact O-N 3.18Å; V748-A750 VanDerWaalsContact C-N 3.29Å; V748-A750 PolarHBondContact O-N 3.44Å; A750-N754 PolarHBondContact O-ND2 3.25Å
751	L	56.9	Low	56.1	Low	94 Å²	94	91.6 Å²	91.6	49%	0.492	50%	0.497	S	S	.	.	H	α-helix	trans	-80.8	-34.7	-179.9	-147.3	145.4	0	0	0	111.2	L687 P747 V748 E749 Q753 N754 L755	L687-L751 HydrophobicContact CD1-CD2 3.99Å; P747-L751 PolarHBondContact O-N 3.43Å; V748-L751 PolarHBondContact O-N 2.97Å; V748-L751 VanDerWaalsContact O-N 3.1Å; E749-L751 VanDerWaalsContact C-N 3.33Å; E749-L751 PolarHBondContact O-N 2.82Å; L751-Q753 VanDerWaalsContact C-N 3.34Å; L751-Q753 PolarHBondContact O-N 2.77Å; L751-N754 PolarHBondContact O-N 2.7Å; L751-L755 HydrophobicContact CD2-CD1 4Å; L751-L755 PolarHBondContact O-N 2.92Å
752	Q	57.4	Low	56.4	Low	78 Å²	78	92.6 Å²	92.6	36%	0.364	51%	0.508	S	S	.	.	H	α-helix	trans	-63.5	-34.5	176.7	-154.9	168.3	34	0	0	112.9	Q691 V748 E749 S756	Q691-Q752 VanDerWaalsContact OE1-NE2 3.08Å; V748-Q752 PolarHBondContact O-N 2.82Å; V748-Q752 VanDerWaalsContact O-N 3.17Å; E749-Q752 PolarHBondContact O-N 3.14Å; Q752-S756 PolarHBondContact O-OG 3.35Å; Q752-S756 VanDerWaalsContact O-OG 3.08Å
753	Q	57.6	Low	56.7	Low	155 Å²	155	88.3 Å²	88.3	72%	0.724	50%	0.502	S	S	*	.	H	α-helix	trans	-69.7	-41.6	173.9	-71.3	-170.8	-2.4	0	0	113.1	E749 L751 L755 S756	E749-Q753 PolarHBondContact O-N 3.24Å; L751-Q753 VanDerWaalsContact C-N 3.34Å; L751-Q753 PolarHBondContact O-N 2.77Å; Q753-L755 PolarHBondContact O-N 2.6Å; Q753-S756 PolarHBondContact O-N 2.98Å; Q753-S756 VanDerWaalsContact O-N 3.13Å
754	N	56.5	Low	56.9	Low	117 Å²	117	85.9 Å²	85.9	63%	0.626	48%	0.483	S	S	*	.	H	α-helix	trans	-64.6	-43.6	-175.9	-83.3	-74.7	0	0	0	112.6	A750 L751 S756 S757	A750-N754 PolarHBondContact O-ND2 3.25Å; L751-N754 PolarHBondContact O-N 2.7Å; N754-S756 PolarHBondContact O-N 2.83Å; N754-S756 VanDerWaalsContact O-N 3.12Å; N754-S757 PolarHBondContact O-N 2.73Å; N754-S757 PolarHBondContact O-OG 3.13Å
755	L	56.4	Low	57.3	Low	65 Å²	65	87.9 Å²	87.9	34%	0.34	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-9.2	175.5	-74.7	168	0	0	0	114.3	L687 L751 Q753	L687-L755 HydrophobicContact CD1-CD1 3.48Å; L687-L755 VanDerWaalsContact CD1-CD1 3.48Å; L751-L755 HydrophobicContact CD2-CD1 4Å; L751-L755 PolarHBondContact O-N 2.92Å; Q753-L755 PolarHBondContact O-N 2.6Å
756	S	56.5	Low	57.6	Low	69 Å²	69	92.4 Å²	92.4	48%	0.483	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.5	14.3	-178.1	-57.3	0	0	0	0	113.2	R684 Q752 Q753 N754	R684-S756 PolarHBondContact NH2-OG 3.13Å; Q752-S756 PolarHBondContact O-OG 3.35Å; Q752-S756 VanDerWaalsContact O-OG 3.08Å; Q753-S756 PolarHBondContact O-N 2.98Å; Q753-S756 VanDerWaalsContact O-N 3.13Å; N754-S756 PolarHBondContact O-N 2.83Å; N754-S756 VanDerWaalsContact O-N 3.12Å
757	S	56.6	Low	57.8	Low	51 Å²	51	93 Å²	93	36%	0.357	50%	0.499	S	S	.	.	S	Bend	trans	-96.2	146	-176	70	0	0	0	0	114.1	N754 R759	N754-S757 PolarHBondContact O-N 2.73Å; N754-S757 PolarHBondContact O-OG 3.13Å; S757-R759 PolarHBondContact O-N 2.84Å
758	S	55	Low	58.1	Low	100 Å²	100	91.7 Å²	91.7	70%	0.699	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	11.2	-170.8	-174.8	0	0	0	0	116.9
759	R	55.2	Low	58.4	Low	217 Å²	217	91.6 Å²	91.6	82%	0.819	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-25.9	-173.9	-86.7	-177.4	166.4	172.6	-4	114.9	S757	S757-R759 PolarHBondContact O-N 2.84Å
760	C	54.8	Low	58.7	Low	60 Å²	60	93.8 Å²	93.8	41%	0.405	50%	0.503	S	S	.	.	S	Bend	trans	-74.3	-45.6	-178.2	-59.1	0	0	0	0	112	A762 V763	C760-A762 PolarHBondContact O-N 3.01Å; C760-A762 VanDerWaalsContact O-N 3.08Å; C760-V763 WeakPolarHBondContact O-CB 3.44Å; C760-V763 PolarHBondContact O-N 2.7Å
761	D	57.7	Low	59.2	Low	68 Å²	68	91.5 Å²	91.5	36%	0.364	48%	0.484	S	S	.	.	H	α-helix	trans	-58.4	-29.8	-173.7	-41.5	-28.3	0	0	0	112.7	R680 V763 Q765	R680-D761 IonicContact CZ-OD1 3.22Å; R680-D761 IonicContact NH1-OD1 3.33Å; R680-D761 PolarHBondContact NH1-OD1 2.93Å; R680-D761 IonicContact NH2-OD1 3.17Å; R680-D761 PolarHBondContact NH2-OD1 3.11Å; D761-V763 VanDerWaalsContact C-N 3.32Å; D761-V763 PolarHBondContact O-N 3.22Å; D761-Q765 PolarHBondContact O-N 2.91Å
762	A	59.5	Low	59.6	Low	58 Å²	58	93.2 Å²	93.2	48%	0.479	49%	0.49	S	S	.	.	H	α-helix	trans	-74.9	-15.9	178.5	0	0	0	0	0	114.4	C760	C760-A762 PolarHBondContact O-N 3.01Å; C760-A762 VanDerWaalsContact O-N 3.08Å
763	V	61.4	Low	60.3	Low	91 Å²	91	97.8 Å²	97.8	55%	0.552	50%	0.504	S	S	*	.	H	α-helix	trans	-85.2	-44.6	176.8	-178.6	0	0	0	0	110.1	C760 D761 Q765 R766 S767	C760-V763 WeakPolarHBondContact O-CB 3.44Å; C760-V763 PolarHBondContact O-N 2.7Å; D761-V763 VanDerWaalsContact C-N 3.32Å; D761-V763 PolarHBondContact O-N 3.22Å; V763-Q765 PolarHBondContact O-N 3Å; V763-R766 PolarHBondContact O-N 2.87Å; V763-S767 PolarHBondContact O-N 3.19Å; V763-S767 VanDerWaalsContact O-N 3.16Å; V763-S767 PolarHBondContact O-OG 3.12Å
764	E	60.7	Low	60.8	Low	58 Å²	58	94 Å²	94	27%	0.271	49%	0.488	S	S	.	.	H	α-helix	trans	-57	-48.9	178.4	-66.1	165.3	-160.9	0	0	111.4	V673 R680 R766 S767 S768	V673-E764 HydrophobicContact CG1-CB 4.48Å; R680-E764 IonicContact NH1-OE1 3.18Å; R680-E764 PolarHBondContact NH1-OE1 2.88Å; E764-R766 PolarHBondContact O-N 3.28Å; E764-S767 PolarHBondContact O-N 3.04Å; E764-S768 PolarHBondContact O-N 3.17Å
765	Q	62.3	Low	61.5	Low	156 Å²	156	91.1 Å²	91.1	73%	0.729	47%	0.472	S	S	*	.	H	α-helix	trans	-63.6	-36.6	178.8	-70.6	-168.9	-8.3	0	0	113.6	D761 V763 S769	D761-Q765 PolarHBondContact O-N 2.91Å; V763-Q765 PolarHBondContact O-N 3Å; Q765-S769 PolarHBondContact O-N 2.94Å
766	R	62.6	Low	62.3	Low	194 Å²	194	91.5 Å²	91.5	73%	0.732	48%	0.48	S	S	*	.	H	α-helix	trans	-65.5	-49.4	178.3	-102	-177.9	176.9	156.6	1.2	111.4	V763 E764 S768 S769 Q770	V763-R766 PolarHBondContact O-N 2.87Å; E764-R766 PolarHBondContact O-N 3.28Å; R766-S768 VanDerWaalsContact C-N 3.34Å; R766-S768 PolarHBondContact O-N 2.82Å; R766-S769 PolarHBondContact O-N 3.41Å; R766-S769 PolarHBondContact O-OG 2.9Å; R766-Q770 PolarHBondContact O-N 2.61Å
767	S	60.7	Low	63.2	Low	59 Å²	59	91.5 Å²	91.5	41%	0.413	48%	0.48	S	S	.	.	H	α-helix	trans	-58.9	-45.1	-178.9	-59.7	0	0	0	0	111.8	V763 E764 Q770 A771	V763-S767 PolarHBondContact O-N 3.19Å; V763-S767 VanDerWaalsContact O-N 3.16Å; V763-S767 PolarHBondContact O-OG 3.12Å; E764-S767 PolarHBondContact O-N 3.04Å; S767-Q770 PolarHBondContact O-N 3.45Å; S767-A771 PolarHBondContact O-N 3.18Å
768	S	64.2	Low	63.9	Low	56 Å²	56	89.7 Å²	89.7	39%	0.392	47%	0.467	S	S	.	.	H	α-helix	trans	-57.4	-50.9	175.2	-176.4	0	0	0	0	112.1	E764 R766 Q770 A771 E772	E764-S768 PolarHBondContact O-N 3.17Å; R766-S768 VanDerWaalsContact C-N 3.34Å; R766-S768 PolarHBondContact O-N 2.82Å; S768-Q770 PolarHBondContact O-N 2.84Å; S768-A771 PolarHBondContact O-N 3.21Å; S768-A771 VanDerWaalsContact O-N 3.13Å; S768-E772 PolarHBondContact O-N 3.04Å
769	S	62.5	Low	64.8	Low	41 Å²	41	87 Å²	87	29%	0.287	45%	0.449	S	S	.	.	H	α-helix	trans	-63.1	-14.9	-178.9	77.2	0	0	0	0	115.2	Q765 R766 R773	Q765-S769 PolarHBondContact O-N 2.94Å; R766-S769 PolarHBondContact O-N 3.41Å; R766-S769 PolarHBondContact O-OG 2.9Å; S769-R773 WeakPolarHBondContact O-CG 3.49Å; S769-R773 PolarHBondContact O-NE 2.67Å
770	Q	64.4	Low	65.8	Low	132 Å²	132	80.3 Å²	80.3	62%	0.617	44%	0.435	S	S	*	.	H	α-helix	trans	-92.5	-32	179.1	-168.9	164.7	-18.9	0	0	112.1	R766 S767 S768 L774	R766-Q770 PolarHBondContact O-N 2.61Å; S767-Q770 PolarHBondContact O-N 3.45Å; S768-Q770 PolarHBondContact O-N 2.84Å; Q770-L774 PolarHBondContact O-N 2.91Å
771	A	63.7	Low	66.9	Low	3 Å²	3	81.9 Å²	81.9	3%	0.025	44%	0.439	C	S	.	.	H	α-helix	trans	-67.4	-44.7	174.7	0	0	0	0	0	112.2	S767 S768 R773 L774 L775	S767-A771 PolarHBondContact O-N 3.18Å; S768-A771 PolarHBondContact O-N 3.21Å; S768-A771 VanDerWaalsContact O-N 3.13Å; A771-R773 VanDerWaalsContact C-N 3.27Å; A771-R773 PolarHBondContact O-N 3.01Å; A771-L774 PolarHBondContact O-N 3.26Å; A771-L774 VanDerWaalsContact O-N 3.14Å; A771-L775 PolarHBondContact O-N 3.13Å
772	E	66.9	Low	67.9	Low	130 Å²	130	78.7 Å²	78.7	61%	0.607	42%	0.422	S	S	*	.	H	α-helix	trans	-60.2	-35.1	179.6	-65.2	-175.5	145.3	0	0	113	S768 S776	S768-E772 PolarHBondContact O-N 3.04Å; E772-S776 WeakPolarHBondContact O-CB 3.38Å; E772-S776 PolarHBondContact O-N 2.91Å; E772-S776 VanDerWaalsContact O-N 3.13Å; E772-S776 PolarHBondContact O-OG 3.11Å
773	R	70.5	Confident	68.8	Low	174 Å²	174	79.4 Å²	79.4	66%	0.657	42%	0.424	S	S	*	.	H	α-helix	trans	-70.9	-33.8	177.4	-67.7	179.8	-165	172.2	6.9	112.9	S769 A771 S776 S777	S769-R773 WeakPolarHBondContact O-CG 3.49Å; S769-R773 PolarHBondContact O-NE 2.67Å; A771-R773 VanDerWaalsContact C-N 3.27Å; A771-R773 PolarHBondContact O-N 3.01Å; R773-S776 WeakPolarHBondContact CA-OG 3.4Å; R773-S776 PolarHBondContact O-OG 3.36Å; R773-S777 WeakPolarHBondContact O-CB 2.99Å; R773-S777 PolarHBondContact O-N 2.71Å; R773-S777 VanDerWaalsContact O-N 3.09Å; R773-S777 PolarHBondContact O-OG 3.08Å
774	L	69	Low	69.7	Low	76 Å²	76	78.3 Å²	78.3	40%	0.398	42%	0.42	S	S	.	.	H	α-helix	trans	-69.4	-43.7	176.2	-76.1	164.3	0	0	0	111	L669 Q770 A771 S777 S778	L669-L774 HydrophobicContact CD1-CD1 4.42Å; Q770-L774 PolarHBondContact O-N 2.91Å; A771-L774 PolarHBondContact O-N 3.26Å; A771-L774 VanDerWaalsContact O-N 3.14Å; L774-S777 PolarHBondContact O-OG 2.78Å; L774-S778 VanDerWaalsContact O-CB 3.31Å; L774-S778 WeakPolarHBondContact O-CB 3.42Å; L774-S778 PolarHBondContact O-N 3.47Å
775	L	71.9	Confident	70.6	Confident	56 Å²	56	77.9 Å²	77.9	29%	0.293	42%	0.419	S	S	.	.	H	α-helix	trans	-64	-40.9	178.3	-69.8	166.2	0	0	0	112.9	K663 A771 S779	K663-L775 HydrophobicContact CB-CD2 4.15Å; K663-L775 HydrophobicContact CG-CD2 4.23Å; A771-L775 PolarHBondContact O-N 3.13Å; L775-S779 PolarHBondContact O-N 2.91Å; L775-S779 PolarHBondContact O-OG 3.23Å
776	S	72.9	Confident	71.5	Confident	73 Å²	73	71.8 Å²	71.8	51%	0.51	39%	0.391	S	S	.	.	H	α-helix	trans	-75.7	-34	179.5	48.7	0	0	0	0	113.9	E772 R773 S779 S780	E772-S776 WeakPolarHBondContact O-CB 3.38Å; E772-S776 PolarHBondContact O-N 2.91Å; E772-S776 VanDerWaalsContact O-N 3.13Å; E772-S776 PolarHBondContact O-OG 3.11Å; R773-S776 WeakPolarHBondContact CA-OG 3.4Å; R773-S776 PolarHBondContact O-OG 3.36Å; S776-S779 PolarHBondContact O-OG 2.86Å; S776-S780 PolarHBondContact O-N 2.82Å
777	S	74.4	Confident	72.4	Confident	69 Å²	69	68.3 Å²	68.3	48%	0.483	38%	0.383	S	S	.	.	H	α-helix	trans	-75.5	-42.5	176.6	53.1	0	0	0	0	113.1	R773 L774 S779 S780 L781	R773-S777 WeakPolarHBondContact O-CB 2.99Å; R773-S777 PolarHBondContact O-N 2.71Å; R773-S777 VanDerWaalsContact O-N 3.09Å; R773-S777 PolarHBondContact O-OG 3.08Å; L774-S777 PolarHBondContact O-OG 2.78Å; S777-S779 PolarHBondContact O-N 2.91Å; S777-S780 PolarHBondContact O-N 3.33Å; S777-L781 PolarHBondContact O-N 3.05Å; S777-L781 VanDerWaalsContact O-N 3.15Å
778	S	72.5	Confident	73.2	Confident	12 Å²	12	67.3 Å²	67.3	8%	0.084	38%	0.378	C	S	.	.	H	α-helix	trans	-58.8	-46.6	176	154.8	0	0	0	0	112.2	V659 L774 L781 A782	V659-S778 PolarHBondContact O-OG 2.89Å; L774-S778 VanDerWaalsContact O-CB 3.31Å; L774-S778 WeakPolarHBondContact O-CB 3.42Å; L774-S778 PolarHBondContact O-N 3.47Å; S778-L781 PolarHBondContact O-N 3.38Å; S778-A782 PolarHBondContact O-N 3.33Å
779	S	73.5	Confident	73.9	Confident	45 Å²	45	64.9 Å²	64.9	32%	0.315	36%	0.362	S	S	.	.	H	α-helix	trans	-67.7	-37.2	-179	48.9	0	0	0	0	113.7	L775 S776 S777 S783	L775-S779 PolarHBondContact O-N 2.91Å; L775-S779 PolarHBondContact O-OG 3.23Å; S776-S779 PolarHBondContact O-OG 2.86Å; S777-S779 PolarHBondContact O-N 2.91Å; S779-S783 WeakPolarHBondContact O-CB 3.49Å; S779-S783 PolarHBondContact O-N 2.99Å
780	S	76.4	Confident	74.8	Confident	75 Å²	75	67.3 Å²	67.3	52%	0.524	37%	0.368	S	S	.	.	H	α-helix	trans	-62.8	-42.4	173.9	-174.2	0	0	0	0	112	S776 S777 S784	S776-S780 PolarHBondContact O-N 2.82Å; S777-S780 PolarHBondContact O-N 3.33Å; S780-S784 PolarHBondContact O-N 2.92Å; S780-S784 VanDerWaalsContact O-N 3.11Å; S780-S784 PolarHBondContact O-OG 3.38Å
781	L	77.8	Confident	75.6	Confident	94 Å²	94	66.3 Å²	66.3	49%	0.492	36%	0.364	S	S	.	.	H	α-helix	trans	-68	-45.6	-179.6	-174.3	62.2	0	0	0	112.4	V659 S777 S778 S784 L785	V659-L781 HydrophobicContact CG1-CB 4.36Å; V659-L781 HydrophobicContact CG1-CD2 4.18Å; V659-L781 HydrophobicContact CG1-CG 4.38Å; S777-L781 PolarHBondContact O-N 3.05Å; S777-L781 VanDerWaalsContact O-N 3.15Å; S778-L781 PolarHBondContact O-N 3.38Å; L781-S784 PolarHBondContact O-N 2.96Å; L781-L785 HydrophobicContact CD1-CD1 4.47Å; L781-L785 HydrophobicContact CG-CD1 4.19Å; L781-L785 WeakPolarHBondContact O-CG 3.21Å; L781-L785 PolarHBondContact O-N 3.14Å
782	A	77.8	Confident	76.3	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-60.2	-45.8	177.3	0	0	0	0	0	112	V659 E660 S778 S784 L785 H786	V659-A782 HydrophobicContact CG1-CB 4.25Å; E660-A782 HydrophobicContact CB-CB 4.36Å; S778-A782 PolarHBondContact O-N 3.33Å; A782-S784 PolarHBondContact O-N 3.13Å; A782-L785 PolarHBondContact O-N 3.2Å; A782-H786 WeakPolarHBondContact O-CB 3.35Å; A782-H786 PolarHBondContact O-N 2.96Å
783	S	79.7	Confident	77	Confident	74 Å²	74	66.6 Å²	66.6	52%	0.517	36%	0.363	S	S	.	.	H	α-helix	trans	-57.7	-47.1	175.5	-173.4	0	0	0	0	112.4	S779 L785 H786 Q787	S779-S783 WeakPolarHBondContact O-CB 3.49Å; S779-S783 PolarHBondContact O-N 2.99Å; S783-L785 PolarHBondContact O-N 3.1Å; S783-H786 PolarHBondContact O-N 2.93Å; S783-Q787 PolarHBondContact O-N 2.88Å
784	S	80.1	Confident	77.6	Confident	68 Å²	68	61.3 Å²	61.3	48%	0.476	35%	0.35	S	S	.	.	H	α-helix	trans	-62.6	-42.8	179.6	-55.3	0	0	0	0	112.3	S780 L781 A782 Q787 A788	S780-S784 PolarHBondContact O-N 2.92Å; S780-S784 VanDerWaalsContact O-N 3.11Å; S780-S784 PolarHBondContact O-OG 3.38Å; L781-S784 PolarHBondContact O-N 2.96Å; A782-S784 PolarHBondContact O-N 3.13Å; S784-Q787 PolarHBondContact O-N 3.39Å; S784-A788 PolarHBondContact O-N 2.99Å; S784-A788 VanDerWaalsContact O-N 3.07Å
785	L	79.7	Confident	78.2	Confident	48 Å²	48	62.7 Å²	62.7	25%	0.251	36%	0.357	S	S	.	.	H	α-helix	trans	-65.5	-43.3	176.8	-72.7	167.9	0	0	0	111.8	A656 L781 A782 S783 Q787 A788 A789	A656-L785 HydrophobicContact CB-CB 3.75Å; A656-L785 HydrophobicContact CB-CD1 4.29Å; L781-L785 HydrophobicContact CD1-CD1 4.47Å; L781-L785 HydrophobicContact CG-CD1 4.19Å; L781-L785 WeakPolarHBondContact O-CG 3.21Å; L781-L785 PolarHBondContact O-N 3.14Å; A782-L785 PolarHBondContact O-N 3.2Å; S783-L785 PolarHBondContact O-N 3.1Å; L785-Q787 VanDerWaalsContact C-N 3.34Å; L785-Q787 PolarHBondContact O-N 3.1Å; L785-A788 PolarHBondContact O-N 3.2Å; L785-A789 WeakPolarHBondContact O-CB 3.5Å; L785-A789 PolarHBondContact O-N 3.01Å
786	H	80.8	Confident	78.7	Confident	29 Å²	29	61.5 Å²	61.5	13%	0.134	35%	0.351	C	S	.	.	H	α-helix	trans	-63	-37.2	176.3	-86.8	-13.3	0	0	0	113.3	R653 A656 N657 A782 S783 Q790	R653-H786 VanDerWaalsContact CD-CE1 3.46Å; R653-H786 WeakPolarHBondContact CD-CE1 3.37Å; R653-H786 PolarHBondContact NE-NE2 2.81Å; R653-H786 PolarHBondContact O-NE2 2.75Å; A656-H786 WeakPolarHBondContact CB-CE1 3.32Å; A656-H786 WeakPolarHBondContact CB-ND1 3.48Å; A656-H786 WeakPolarHBondContact CB-NE2 3.4Å; N657-H786 PolarHBondContact N-NE2 2.83Å; N657-H786 PolarHBondContact OD1-NE2 3.43Å; A782-H786 WeakPolarHBondContact O-CB 3.35Å; A782-H786 PolarHBondContact O-N 2.96Å; S783-H786 PolarHBondContact O-N 2.93Å; H786-Q790 WeakPolarHBondContact O-CB 3.33Å; H786-Q790 PolarHBondContact O-N 3.43Å
787	Q	81.4	Confident	79.1	Confident	120 Å²	120	62 Å²	62	56%	0.561	35%	0.346	S	S	*	.	H	α-helix	trans	-67.2	-46.2	175.5	-175.1	172.7	-5.5	0	0	111.5	S783 S784 L785 Q790 Q791	S783-Q787 PolarHBondContact O-N 2.88Å; S784-Q787 PolarHBondContact O-N 3.39Å; L785-Q787 VanDerWaalsContact C-N 3.34Å; L785-Q787 PolarHBondContact O-N 3.1Å; Q787-Q790 PolarHBondContact O-N 3.19Å; Q787-Q791 WeakPolarHBondContact O-CG 3.3Å; Q787-Q791 PolarHBondContact O-N 3.06Å
788	A	76.9	Confident	79.5	Confident	39 Å²	39	63.3 Å²	63.3	32%	0.322	34%	0.344	S	S	.	.	H	α-helix	trans	-62.2	-48.1	178.8	0	0	0	0	0	112.4	S784 L785 Q790 Q791 N792	S784-A788 PolarHBondContact O-N 2.99Å; S784-A788 VanDerWaalsContact O-N 3.07Å; L785-A788 PolarHBondContact O-N 3.2Å; A788-Q790 VanDerWaalsContact C-N 3.32Å; A788-Q790 PolarHBondContact O-N 2.91Å; A788-Q791 PolarHBondContact O-N 3.33Å; A788-N792 WeakPolarHBondContact O-CB 3.23Å; A788-N792 VanDerWaalsContact O-CG 3.31Å; A788-N792 PolarHBondContact O-N 3.31Å
789	A	80	Confident	79.9	Confident	5 Å²	5	67.7 Å²	67.7	4%	0.041	36%	0.364	C	S	.	.	H	α-helix	trans	-60.5	-39.8	178.8	0	0	0	0	0	112.4	L785 R793	L785-A789 WeakPolarHBondContact O-CB 3.5Å; L785-A789 PolarHBondContact O-N 3.01Å; A789-R793 WeakPolarHBondContact O-CB 3.33Å; A789-R793 PolarHBondContact O-N 2.79Å
790	Q	79.6	Confident	80.2	Confident	91 Å²	91	67.4 Å²	67.4	43%	0.425	36%	0.362	S	S	.	.	H	α-helix	trans	-70	-37.2	178.5	-177	70.8	-26.7	0	0	112.6	H786 Q787 A788 R793 V794	H786-Q790 WeakPolarHBondContact O-CB 3.33Å; H786-Q790 PolarHBondContact O-N 3.43Å; Q787-Q790 PolarHBondContact O-N 3.19Å; A788-Q790 VanDerWaalsContact C-N 3.32Å; A788-Q790 PolarHBondContact O-N 2.91Å; Q790-R793 VanDerWaalsContact OE1-NE 3.17Å; Q790-V794 PolarHBondContact O-N 2.84Å
791	Q	81.5	Confident	80.5	Confident	111 Å²	111	65.4 Å²	65.4	52%	0.519	35%	0.354	S	S	.	.	H	α-helix	trans	-67.6	-44	175.3	-74.1	179.2	-28.4	0	0	111.6	Q787 A788 R793 V794 L795	Q787-Q791 WeakPolarHBondContact O-CG 3.3Å; Q787-Q791 PolarHBondContact O-N 3.06Å; A788-Q791 PolarHBondContact O-N 3.33Å; Q791-R793 PolarHBondContact O-N 2.8Å; Q791-V794 PolarHBondContact O-N 2.8Å; Q791-L795 PolarHBondContact O-N 2.81Å
792	N	79.7	Confident	80.8	Confident	65 Å²	65	68.1 Å²	68.1	35%	0.348	36%	0.358	S	S	.	.	H	α-helix	trans	-64.4	-39.2	178.3	-69.5	-14.2	0	0	0	112.4	M649 A788 V794 L795 L796	M649-N792 HydrophobicContact CG-CB 4.04Å; M649-N792 HydrophobicContact SD-CB 3.44Å; M649-N792 WeakPolarHBondContact SD-CB 3.24Å; M649-N792 PolarHBondContact SD-ND2 2.83Å; M649-N792 VanDerWaalsContact SD-ND2 3.41Å; A788-N792 WeakPolarHBondContact O-CB 3.23Å; A788-N792 VanDerWaalsContact O-CG 3.31Å; A788-N792 PolarHBondContact O-N 3.31Å; N792-V794 PolarHBondContact O-N 3.12Å; N792-L795 PolarHBondContact O-N 2.91Å; N792-L796 WeakPolarHBondContact O-CG 3.35Å; N792-L796 PolarHBondContact O-N 3.35Å
793	R	82	Confident	81.1	Confident	74 Å²	74	68.8 Å²	68.8	28%	0.279	36%	0.362	S	S	.	.	H	α-helix	trans	-59	-45.9	177.5	-173.7	-177.1	60.7	74.4	12.6	112.4	A789 Q790 Q791 L795 L796 E797	A789-R793 WeakPolarHBondContact O-CB 3.33Å; A789-R793 PolarHBondContact O-N 2.79Å; Q790-R793 VanDerWaalsContact OE1-NE 3.17Å; Q791-R793 PolarHBondContact O-N 2.8Å; R793-L795 VanDerWaalsContact C-N 3.33Å; R793-L795 PolarHBondContact O-N 3.41Å; R793-L796 PolarHBondContact O-N 3.45Å; R793-E797 WeakPolarHBondContact CG-OE1 3.22Å; R793-E797 IonicContact CZ-OE1 3.2Å; R793-E797 IonicContact CZ-OE2 2.81Å; R793-E797 IonicContact NH1-OE1 3.28Å; R793-E797 PolarHBondContact NH1-OE1 3.45Å; R793-E797 IonicContact NH1-OE2 2.83Å; R793-E797 PolarHBondContact NH1-OE2 2.83Å; R793-E797 WeakPolarHBondContact O-CG 3.4Å; R793-E797 PolarHBondContact O-N 2.77Å
794	V	82.5	Confident	81.3	Confident	63 Å²	63	68.6 Å²	68.6	38%	0.382	36%	0.361	S	S	.	.	H	α-helix	trans	-63.8	-38.9	179.4	176	0	0	0	0	111.5	Q790 Q791 N792 E797 E798	Q790-V794 PolarHBondContact O-N 2.84Å; Q791-V794 PolarHBondContact O-N 2.8Å; N792-V794 PolarHBondContact O-N 3.12Å; V794-E797 PolarHBondContact O-N 3.27Å; V794-E798 PolarHBondContact O-N 3.13Å
795	L	80.8	Confident	81.5	Confident	105 Å²	105	71.1 Å²	71.1	55%	0.55	37%	0.369	S	S	.	.	H	α-helix	trans	-66.7	-36	175.9	-68.5	170.9	0	0	0	112.6	Q791 N792 R793 M799	Q791-L795 PolarHBondContact O-N 2.81Å; N792-L795 PolarHBondContact O-N 2.91Å; R793-L795 VanDerWaalsContact C-N 3.33Å; R793-L795 PolarHBondContact O-N 3.41Å; L795-M799 WeakPolarHBondContact O-CB 3.47Å; L795-M799 VanDerWaalsContact O-CG 3.27Å; L795-M799 WeakPolarHBondContact O-CG 3.4Å; L795-M799 PolarHBondContact O-N 2.84Å
796	L	82.6	Confident	81.8	Confident	31 Å²	31	73.1 Å²	73.1	16%	0.162	38%	0.38	C	S	.	.	H	α-helix	trans	-67.9	-41.2	173.9	-72	166.7	0	0	0	111.8	L645 M649 N792 R793 M799 S800	L645-L796 HydrophobicContact CB-CD1 3.98Å; L645-L796 HydrophobicContact CB-CD2 3.81Å; L645-L796 HydrophobicContact CD1-CD2 4.11Å; M649-L796 HydrophobicContact CG-CD1 3.9Å; N792-L796 WeakPolarHBondContact O-CG 3.35Å; N792-L796 PolarHBondContact O-N 3.35Å; R793-L796 PolarHBondContact O-N 3.45Å; L796-M799 PolarHBondContact O-N 2.95Å; L796-S800 WeakPolarHBondContact O-CB 3.32Å; L796-S800 PolarHBondContact O-N 2.83Å
797	E	81.5	Confident	82.2	Confident	85 Å²	85	74.6 Å²	74.6	40%	0.397	39%	0.386	S	S	.	.	H	α-helix	trans	-62.1	-44.7	175.9	-74.5	166.7	-179.3	0	0	111.6	R793 V794 G801	R793-E797 WeakPolarHBondContact CG-OE1 3.22Å; R793-E797 IonicContact CZ-OE1 3.2Å; R793-E797 IonicContact CZ-OE2 2.81Å; R793-E797 IonicContact NH1-OE1 3.28Å; R793-E797 PolarHBondContact NH1-OE1 3.45Å; R793-E797 IonicContact NH1-OE2 2.83Å; R793-E797 PolarHBondContact NH1-OE2 2.83Å; R793-E797 WeakPolarHBondContact O-CG 3.4Å; R793-E797 PolarHBondContact O-N 2.77Å; V794-E797 PolarHBondContact O-N 3.27Å; E797-G801 PolarHBondContact O-N 3.33Å; E797-G801 VanDerWaalsContact O-N 3.15Å
798	E	82.3	Confident	82.4	Confident	95 Å²	95	70.9 Å²	70.9	44%	0.444	38%	0.38	S	S	.	.	H	α-helix	trans	-62.8	-41.5	172.9	-79.3	-164.4	-140.8	0	0	113.1	V794 R802	V794-E798 PolarHBondContact O-N 3.13Å; E798-R802 VanDerWaalsContact O-CG 3.28Å; E798-R802 WeakPolarHBondContact O-CG 3.31Å; E798-R802 PolarHBondContact O-N 3.25Å; E798-R802 VanDerWaalsContact O-N 3.13Å; E798-R802 IonicContact OE2-CZ 3.59Å; E798-R802 IonicContact OE2-NE 2.87Å; E798-R802 IonicContact OE2-NH2 3.94Å; E798-R802 PolarHBondContact OE2-NH2 3.02Å
799	M	80.8	Confident	82.9	Confident	104 Å²	104	71.7 Å²	71.7	51%	0.512	39%	0.387	S	S	.	.	H	α-helix	trans	-67.1	-43.4	179.3	-78.8	-62.8	-58.2	0	0	112.1	L795 L796 G801 R802 C803	L795-M799 WeakPolarHBondContact O-CB 3.47Å; L795-M799 VanDerWaalsContact O-CG 3.27Å; L795-M799 WeakPolarHBondContact O-CG 3.4Å; L795-M799 PolarHBondContact O-N 2.84Å; L796-M799 PolarHBondContact O-N 2.95Å; M799-G801 PolarHBondContact O-N 3.41Å; M799-R802 PolarHBondContact O-N 2.92Å; M799-C803 WeakPolarHBondContact O-CB 3.23Å; M799-C803 PolarHBondContact O-N 2.71Å; M799-C803 PolarHBondContact O-SG 3.42Å; M799-C803 VanDerWaalsContact O-SG 3.38Å
800	S	81.3	Confident	83.3	Confident	39 Å²	39	72.5 Å²	72.5	27%	0.273	39%	0.392	S	S	.	.	H	α-helix	trans	-62.1	-43.2	178.3	-169.4	0	0	0	0	111.5	L796 C803 S804	L796-S800 WeakPolarHBondContact O-CB 3.32Å; L796-S800 PolarHBondContact O-N 2.83Å; S800-C803 PolarHBondContact O-N 3.11Å; S800-S804 PolarHBondContact O-N 3.26Å
801	G	82.4	Confident	83.7	Confident	34 Å²	34	70.2 Å²	70.2	35%	0.351	39%	0.386	S	S	.	.	H	α-helix	trans	-57.1	-52.8	173.2	0	0	0	0	0	112.8	E797 M799 C803 S804 D805	E797-G801 PolarHBondContact O-N 3.33Å; E797-G801 VanDerWaalsContact O-N 3.15Å; M799-G801 PolarHBondContact O-N 3.41Å; G801-C803 VanDerWaalsContact C-N 3.3Å; G801-C803 PolarHBondContact O-N 3.37Å; G801-S804 WeakPolarHBondContact O-CB 3.27Å; G801-S804 PolarHBondContact O-N 3.31Å; G801-D805 PolarHBondContact O-N 2.74Å
802	R	83.4	Confident	84	Confident	150 Å²	150	66.1 Å²	66.1	57%	0.566	37%	0.373	S	S	*	.	H	α-helix	trans	-61.4	-35.7	178.9	-66.4	172.5	-162.8	-157	9.2	112.9	E798 M799 L806	E798-R802 VanDerWaalsContact O-CG 3.28Å; E798-R802 WeakPolarHBondContact O-CG 3.31Å; E798-R802 PolarHBondContact O-N 3.25Å; E798-R802 VanDerWaalsContact O-N 3.13Å; E798-R802 IonicContact OE2-CZ 3.59Å; E798-R802 IonicContact OE2-NE 2.87Å; E798-R802 IonicContact OE2-NH2 3.94Å; E798-R802 PolarHBondContact OE2-NH2 3.02Å; M799-R802 PolarHBondContact O-N 2.92Å; R802-L806 VanDerWaalsContact O-CB 3.3Å; R802-L806 WeakPolarHBondContact O-CB 3.42Å; R802-L806 PolarHBondContact O-N 3.19Å
803	C	83.6	Confident	84.4	Confident	15 Å²	15	67.1 Å²	67.1	10%	0.101	38%	0.378	C	S	.	.	H	α-helix	trans	-67.8	-36.8	174.1	-74.7	0	0	0	0	112.3	M799 S800 G801 H807	M799-C803 WeakPolarHBondContact O-CB 3.23Å; M799-C803 PolarHBondContact O-N 2.71Å; M799-C803 PolarHBondContact O-SG 3.42Å; M799-C803 VanDerWaalsContact O-SG 3.38Å; S800-C803 PolarHBondContact O-N 3.11Å; G801-C803 VanDerWaalsContact C-N 3.3Å; G801-C803 PolarHBondContact O-N 3.37Å; C803-H807 VanDerWaalsContact O-CB 3.26Å; C803-H807 WeakPolarHBondContact O-CB 3.48Å; C803-H807 PolarHBondContact O-N 2.74Å
804	S	83.8	Confident	84.7	Confident	69 Å²	69	64.8 Å²	64.8	48%	0.483	37%	0.372	S	S	.	.	H	α-helix	trans	-66	-46.9	174.4	-170.7	0	0	0	0	112	S800 G801 L806 H807 G808	S800-S804 PolarHBondContact O-N 3.26Å; G801-S804 WeakPolarHBondContact O-CB 3.27Å; G801-S804 PolarHBondContact O-N 3.31Å; S804-L806 VanDerWaalsContact C-N 3.34Å; S804-L806 PolarHBondContact O-N 3.08Å; S804-H807 PolarHBondContact O-N 3.39Å; S804-G808 PolarHBondContact O-N 3.08Å
805	D	85.3	Confident	84.9	Confident	121 Å²	121	66.3 Å²	66.3	65%	0.647	38%	0.378	S	S	*	.	H	α-helix	trans	-59.7	-44.6	177	-69.5	-26.5	0	0	0	111.4	G801 G808 A809	G801-D805 PolarHBondContact O-N 2.74Å; D805-G808 PolarHBondContact O-N 2.82Å; D805-A809 WeakPolarHBondContact O-CB 3.48Å; D805-A809 PolarHBondContact O-N 2.69Å
806	L	85.9	Confident	85.3	Confident	91 Å²	91	68.7 Å²	68.7	48%	0.476	38%	0.38	S	S	.	.	H	α-helix	trans	-66.8	-39.9	178.6	-176.1	58.4	0	0	0	112.3	L635 R802 S804 A809 V810	L635-L806 HydrophobicContact CD1-CD2 4.46Å; L635-L806 HydrophobicContact CD1-CG 4.06Å; L635-L806 HydrophobicContact CD2-CD2 3.78Å; L635-L806 HydrophobicContact CD2-CG 4.21Å; R802-L806 VanDerWaalsContact O-CB 3.3Å; R802-L806 WeakPolarHBondContact O-CB 3.42Å; R802-L806 PolarHBondContact O-N 3.19Å; S804-L806 VanDerWaalsContact C-N 3.34Å; S804-L806 PolarHBondContact O-N 3.08Å; L806-A809 PolarHBondContact O-N 2.71Å; L806-V810 HydrophobicContact CD1-CG2 4.31Å; L806-V810 WeakPolarHBondContact O-CG2 3.21Å; L806-V810 PolarHBondContact O-N 3.09Å
807	H	89.4	Confident	85.5	Confident	59 Å²	59	68.6 Å²	68.6	27%	0.273	38%	0.379	S	S	.	.	H	α-helix	trans	-63.2	-44.5	175.6	-177	96.4	0	0	0	111.4	L635 C803 S804 V810 S811	L635-H807 HydrophobicContact CB-CB 4.41Å; L635-H807 HydrophobicContact CD1-CB 4.24Å; C803-H807 VanDerWaalsContact O-CB 3.26Å; C803-H807 WeakPolarHBondContact O-CB 3.48Å; C803-H807 PolarHBondContact O-N 2.74Å; S804-H807 PolarHBondContact O-N 3.39Å; H807-V810 PolarHBondContact O-N 2.85Å; H807-S811 PolarHBondContact O-N 3.35Å
808	G	86	Confident	85.8	Confident	42 Å²	42	66.5 Å²	66.5	43%	0.433	38%	0.377	S	S	.	.	H	α-helix	trans	-62.4	-42.2	173.9	0	0	0	0	0	113	S804 D805 G812	S804-G808 PolarHBondContact O-N 3.08Å; D805-G808 PolarHBondContact O-N 2.82Å; G808-G812 PolarHBondContact O-N 3.17Å
809	A	87.3	Confident	86.2	Confident	56 Å²	56	67.3 Å²	67.3	46%	0.463	38%	0.38	S	S	.	.	H	α-helix	trans	-64.8	-38	177.4	0	0	0	0	0	113.2	D805 L806 L813	D805-A809 WeakPolarHBondContact O-CB 3.48Å; D805-A809 PolarHBondContact O-N 2.69Å; L806-A809 PolarHBondContact O-N 2.71Å; A809-L813 WeakPolarHBondContact O-CB 3.48Å; A809-L813 PolarHBondContact O-N 3.24Å
810	V	87.8	Confident	86.6	Confident	23 Å²	23	68.4 Å²	68.4	14%	0.139	38%	0.379	C	S	.	.	H	α-helix	trans	-71.6	-45.6	175.9	172.1	0	0	0	0	111.3	L627 L632 L635 L806 H807 G812 L813 V814	L627-V810 HydrophobicContact CB-CG1 4.3Å; L627-V810 HydrophobicContact CD2-CG1 4.38Å; L632-V810 HydrophobicContact CD2-CB 3.83Å; L632-V810 HydrophobicContact CD2-CG1 3.61Å; L632-V810 HydrophobicContact CG-CG1 3.92Å; L635-V810 HydrophobicContact CD1-CG2 4.4Å; L806-V810 HydrophobicContact CD1-CG2 4.31Å; L806-V810 WeakPolarHBondContact O-CG2 3.21Å; L806-V810 PolarHBondContact O-N 3.09Å; H807-V810 PolarHBondContact O-N 2.85Å; V810-G812 PolarHBondContact O-N 3.36Å; V810-L813 WeakPolarHBondContact O-CA 3.39Å; V810-L813 WeakPolarHBondContact O-CB 3.48Å; V810-L813 PolarHBondContact O-N 3.47Å; V810-V814 PolarHBondContact O-N 3.42Å; V810-V814 VanDerWaalsContact O-N 3.11Å
811	S	87.9	Confident	87	Confident	43 Å²	43	66.6 Å²	66.6	30%	0.301	37%	0.366	S	S	.	.	H	α-helix	trans	-57.9	-51.6	176.9	-169.7	0	0	0	0	110.8	H807 L813 V814 D815	H807-S811 PolarHBondContact O-N 3.35Å; S811-L813 PolarHBondContact O-N 2.93Å; S811-V814 WeakPolarHBondContact O-CB 3.12Å; S811-V814 PolarHBondContact O-N 3.36Å; S811-D815 PolarHBondContact O-N 3.45Å; S811-D815 VanDerWaalsContact O-N 3.1Å
812	G	87.6	Confident	87.3	Confident	25 Å²	25	67.7 Å²	67.7	26%	0.258	37%	0.369	S	S	.	.	H	α-helix	trans	-67.1	-3	176.1	0	0	0	0	0	114.5	G808 V810 R816	G808-G812 PolarHBondContact O-N 3.17Å; V810-G812 PolarHBondContact O-N 3.36Å; G812-R816 PolarHBondContact O-NE 3.39Å; G812-R816 PolarHBondContact O-NH2 2.85Å; G812-R816 VanDerWaalsContact O-NH2 3.12Å
813	L	88.1	Confident	87.7	Confident	86 Å²	86	66.4 Å²	66.4	45%	0.45	36%	0.363	S	S	.	.	H	α-helix	trans	-91.1	-40.7	168.4	-158.3	153.5	0	0	0	110.8	L627 A809 V810 S811 D815 R816 D817	L627-L813 HydrophobicContact CD1-CD2 3.69Å; A809-L813 WeakPolarHBondContact O-CB 3.48Å; A809-L813 PolarHBondContact O-N 3.24Å; V810-L813 WeakPolarHBondContact O-CA 3.39Å; V810-L813 WeakPolarHBondContact O-CB 3.48Å; V810-L813 PolarHBondContact O-N 3.47Å; S811-L813 PolarHBondContact O-N 2.93Å; L813-D815 PolarHBondContact O-N 2.61Å; L813-R816 PolarHBondContact O-N 2.97Å; L813-D817 PolarHBondContact O-N 2.91Å
814	V	88.3	Confident	87.9	Confident	25 Å²	25	67.5 Å²	67.5	15%	0.152	37%	0.37	C	S	.	.	H	α-helix	trans	-56.7	-48.4	171.6	177.3	0	0	0	0	111.1	L627 A628 V810 S811 R816 D817 A818	L627-V814 HydrophobicContact CB-CG2 3.45Å; L627-V814 VanDerWaalsContact CB-CG2 3.45Å; L627-V814 HydrophobicContact CD1-CG2 3.92Å; L627-V814 HydrophobicContact CG-CG2 4.35Å; A628-V814 HydrophobicContact CB-CG1 4.48Å; A628-V814 HydrophobicContact CB-CG2 4.43Å; V810-V814 PolarHBondContact O-N 3.42Å; V810-V814 VanDerWaalsContact O-N 3.11Å; S811-V814 WeakPolarHBondContact O-CB 3.12Å; S811-V814 PolarHBondContact O-N 3.36Å; V814-R816 VanDerWaalsContact C-N 3.31Å; V814-R816 PolarHBondContact O-N 3.39Å; V814-D817 PolarHBondContact O-N 3.33Å; V814-A818 PolarHBondContact O-N 3.14Å
815	D	86.8	Confident	88.2	Confident	95 Å²	95	67 Å²	67	51%	0.508	36%	0.357	S	S	.	.	H	α-helix	trans	-60.3	-40.7	-179	-60.7	-43	0	0	0	111.9	S811 L813 E819	S811-D815 PolarHBondContact O-N 3.45Å; S811-D815 VanDerWaalsContact O-N 3.1Å; L813-D815 PolarHBondContact O-N 2.61Å; D815-E819 PolarHBondContact O-N 2.74Å
816	R	88.6	Confident	88.4	Confident	155 Å²	155	67.6 Å²	67.6	59%	0.585	36%	0.356	S	S	*	.	H	α-helix	trans	-71.7	-36.3	178.8	-80.5	-178.3	-68.6	159.3	3.5	113.2	G812 L813 V814 W820	G812-R816 PolarHBondContact O-NE 3.39Å; G812-R816 PolarHBondContact O-NH2 2.85Å; G812-R816 VanDerWaalsContact O-NH2 3.12Å; L813-R816 PolarHBondContact O-N 2.97Å; V814-R816 VanDerWaalsContact C-N 3.31Å; V814-R816 PolarHBondContact O-N 3.39Å; R816-W820 VanDerWaalsContact O-CB 3.28Å; R816-W820 WeakPolarHBondContact O-CB 3.33Å; R816-W820 PolarHBondContact O-N 2.92Å
817	D	87.8	Confident	88.5	Confident	29 Å²	29	68.6 Å²	68.6	16%	0.155	36%	0.359	C	S	.	.	H	α-helix	trans	-66.4	-42.3	174.3	-173.7	90.8	0	0	0	110.9	H619 V623 L813 V814 E819 W820 T821	H619-D817 IonicContact CD2-OD1 3.2Å; H619-D817 IonicContact CD2-OD2 3.96Å; H619-D817 IonicContact CE1-OD1 2.78Å; H619-D817 IonicContact NE2-OD1 3.48Å; H619-D817 PolarHBondContact NE2-OD1 2.8Å; H619-D817 IonicContact NE2-OD2 3.19Å; H619-D817 PolarHBondContact NE2-OD2 2.97Å; V623-D817 HydrophobicContact CG1-CB 4.22Å; L813-D817 PolarHBondContact O-N 2.91Å; V814-D817 PolarHBondContact O-N 3.33Å; D817-E819 PolarHBondContact O-N 3.01Å; D817-W820 PolarHBondContact O-N 2.99Å; D817-T821 WeakPolarHBondContact O-CB 3.42Å; D817-T821 PolarHBondContact O-N 3.45Å; D817-T821 PolarHBondContact O-OG1 2.91Å; D817-T821 PolarHBondContact OD2-OG1 3.49Å
818	A	87.3	Confident	88.4	Confident	41 Å²	41	67 Å²	67	34%	0.339	36%	0.355	S	S	.	.	H	α-helix	trans	-60.1	-47.2	174.6	0	0	0	0	0	112.4	V814 W820 S822	V814-A818 PolarHBondContact O-N 3.14Å; A818-W820 VanDerWaalsContact C-N 3.34Å; A818-W820 PolarHBondContact O-N 3.4Å; A818-S822 WeakPolarHBondContact O-CB 3.32Å; A818-S822 PolarHBondContact O-N 3.39Å
819	E	90	Very high	88.5	Confident	112 Å²	112	66.2 Å²	66.2	52%	0.523	35%	0.345	S	S	.	.	H	α-helix	trans	-63.2	-37.5	174.3	-70.4	-169.4	172.9	0	0	112.9	D815 D817 R823	D815-E819 PolarHBondContact O-N 2.74Å; D817-E819 PolarHBondContact O-N 3.01Å; E819-R823 WeakPolarHBondContact O-CB 3.4Å; E819-R823 WeakPolarHBondContact O-CG 3.47Å; E819-R823 PolarHBondContact O-N 3.16Å; E819-R823 PolarHBondContact O-NE 3.26Å; E819-R823 IonicContact OE2-CZ 2.67Å; E819-R823 IonicContact OE2-NH1 2.98Å; E819-R823 IonicContact OE2-NH2 3.52Å; E819-R823 PolarHBondContact OE2-NH2 3.47Å
820	W	90.5	Very high	88.6	Confident	127 Å²	127	69.2 Å²	69.2	48%	0.481	35%	0.349	S	S	.	.	H	α-helix	trans	-68.6	-46.8	180	174.7	81.1	0	0	0	111.1	R816 D817 A818 S822 R823 T824	R816-W820 VanDerWaalsContact O-CB 3.28Å; R816-W820 WeakPolarHBondContact O-CB 3.33Å; R816-W820 PolarHBondContact O-N 2.92Å; D817-W820 PolarHBondContact O-N 2.99Å; A818-W820 VanDerWaalsContact C-N 3.34Å; A818-W820 PolarHBondContact O-N 3.4Å; W820-S822 PolarHBondContact O-N 2.84Å; W820-R823 PolarHBondContact O-N 3.19Å; W820-T824 HydrophobicContact CZ2-CG2 4.46Å; W820-T824 WeakPolarHBondContact O-CB 3.19Å; W820-T824 PolarHBondContact O-N 2.71Å; W820-T824 PolarHBondContact O-OG1 3.28Å
821	T	89.3	Confident	88.6	Confident	0 Å²	0	76.2 Å²	76.2	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-63	-42.6	178.6	-60.9	0	0	0	0	110.9	L616 Q620 D817 T824 R825	L616-T821 HydrophobicContact CB-CG2 4.27Å; L616-T821 HydrophobicContact CD2-CG2 4.46Å; L616-T821 WeakPolarHBondContact O-CG2 3.39Å; Q620-T821 HydrophobicContact CB-CG2 4.2Å; D817-T821 WeakPolarHBondContact O-CB 3.42Å; D817-T821 PolarHBondContact O-N 3.45Å; D817-T821 PolarHBondContact O-OG1 2.91Å; D817-T821 PolarHBondContact OD2-OG1 3.49Å; T821-T824 PolarHBondContact O-N 3.14Å; T821-R825 VanDerWaalsContact O-CB 3.29Å; T821-R825 WeakPolarHBondContact O-CB 3.42Å; T821-R825 PolarHBondContact O-N 2.87Å
822	S	89.1	Confident	88.7	Confident	58 Å²	58	74.6 Å²	74.6	41%	0.406	36%	0.362	S	S	.	.	H	α-helix	trans	-60.6	-50.2	175.8	-164.5	0	0	0	0	112.4	A818 W820 T824 R825 E826	A818-S822 WeakPolarHBondContact O-CB 3.32Å; A818-S822 PolarHBondContact O-N 3.39Å; W820-S822 PolarHBondContact O-N 2.84Å; S822-T824 VanDerWaalsContact C-N 3.3Å; S822-T824 PolarHBondContact O-N 3.08Å; S822-R825 WeakPolarHBondContact O-CB 3.36Å; S822-R825 PolarHBondContact O-N 2.9Å; S822-E826 PolarHBondContact O-N 3.21Å; S822-E826 VanDerWaalsContact O-N 3.08Å
823	R	90.9	Very high	88.8	Confident	122 Å²	122	77.6 Å²	77.6	46%	0.46	37%	0.37	S	S	.	.	H	α-helix	trans	-62	-37.1	177.7	-75	176.7	-73.7	-157.8	-6.3	112.5	E819 W820 Q827	E819-R823 WeakPolarHBondContact O-CB 3.4Å; E819-R823 WeakPolarHBondContact O-CG 3.47Å; E819-R823 PolarHBondContact O-N 3.16Å; E819-R823 PolarHBondContact O-NE 3.26Å; E819-R823 IonicContact OE2-CZ 2.67Å; E819-R823 IonicContact OE2-NH1 2.98Å; E819-R823 IonicContact OE2-NH2 3.52Å; E819-R823 PolarHBondContact OE2-NH2 3.47Å; W820-R823 PolarHBondContact O-N 3.19Å; R823-Q827 WeakPolarHBondContact O-CG 3.46Å; R823-Q827 PolarHBondContact O-N 3.32Å; R823-Q827 VanDerWaalsContact O-N 3.1Å
824	T	88.2	Confident	88.8	Confident	38 Å²	38	77.4 Å²	77.4	23%	0.233	37%	0.369	C	S	.	.	H	α-helix	trans	-70	-40	178.5	-55.1	0	0	0	0	111.2	L616 W820 T821 S822 Q827 A828	L616-T824 HydrophobicContact CD1-CG2 4.14Å; L616-T824 HydrophobicContact CD2-CG2 4.03Å; W820-T824 HydrophobicContact CZ2-CG2 4.46Å; W820-T824 WeakPolarHBondContact O-CB 3.19Å; W820-T824 PolarHBondContact O-N 2.71Å; W820-T824 PolarHBondContact O-OG1 3.28Å; T821-T824 PolarHBondContact O-N 3.14Å; S822-T824 VanDerWaalsContact C-N 3.3Å; S822-T824 PolarHBondContact O-N 3.08Å; T824-Q827 PolarHBondContact O-N 3Å; T824-A828 WeakPolarHBondContact O-CB 3.43Å; T824-A828 PolarHBondContact O-N 2.95Å
825	R	90.1	Very high	88.8	Confident	59 Å²	59	81.3 Å²	81.3	22%	0.223	39%	0.385	C	S	.	.	H	α-helix	trans	-59.9	-45.6	174.9	-168.5	-174.5	-106.4	127.6	-12.8	111.6	L613 L616 E617 T821 S822 A829	L613-R825 HydrophobicContact CD2-CG 3.48Å; L613-R825 VanDerWaalsContact CD2-CG 3.48Å; L616-R825 HydrophobicContact CD1-CB 4.2Å; E617-R825 VanDerWaalsContact CB-NH2 3.3Å; E617-R825 VanDerWaalsContact CG-NH2 3.33Å; E617-R825 IonicContact OE2-CZ 2.71Å; E617-R825 IonicContact OE2-NH2 2.71Å; E617-R825 PolarHBondContact OE2-NH2 2.97Å; T821-R825 VanDerWaalsContact O-CB 3.29Å; T821-R825 WeakPolarHBondContact O-CB 3.42Å; T821-R825 PolarHBondContact O-N 2.87Å; S822-R825 WeakPolarHBondContact O-CB 3.36Å; S822-R825 PolarHBondContact O-N 2.9Å; R825-A829 WeakPolarHBondContact O-CB 3.37Å; R825-A829 PolarHBondContact O-N 3.16Å; R825-A829 VanDerWaalsContact O-N 3.1Å
826	E	89.2	Confident	88.9	Confident	133 Å²	133	77.2 Å²	77.2	62%	0.621	36%	0.364	S	S	*	.	H	α-helix	trans	-63.4	-47.8	175.9	-71.7	178.7	165.7	0	0	112.6	S822 A828 A829 H830	S822-E826 PolarHBondContact O-N 3.21Å; S822-E826 VanDerWaalsContact O-N 3.08Å; E826-A828 VanDerWaalsContact C-N 3.33Å; E826-A828 PolarHBondContact O-N 3.45Å; E826-A829 PolarHBondContact O-N 2.95Å; E826-H830 PolarHBondContact O-N 3.21Å
827	Q	88.9	Confident	89	Confident	113 Å²	113	72.7 Å²	72.7	53%	0.528	35%	0.353	S	S	.	.	H	α-helix	trans	-64.7	-35.9	-179.9	-72.4	179.1	26.7	0	0	112.8	R823 T824 R831	R823-Q827 WeakPolarHBondContact O-CG 3.46Å; R823-Q827 PolarHBondContact O-N 3.32Å; R823-Q827 VanDerWaalsContact O-N 3.1Å; T824-Q827 PolarHBondContact O-N 3Å; Q827-R831 WeakPolarHBondContact O-CG 3.42Å; Q827-R831 PolarHBondContact O-N 3.47Å; Q827-R831 VanDerWaalsContact O-N 3.14Å
828	A	87.1	Confident	89.1	Confident	25 Å²	25	75.7 Å²	75.7	21%	0.207	37%	0.369	C	S	.	.	H	α-helix	trans	-64.6	-47.2	173.5	0	0	0	0	0	111.8	L612 T824 E826 H830 R831 A832	L612-A828 HydrophobicContact CD2-CB 3.64Å; T824-A828 WeakPolarHBondContact O-CB 3.43Å; T824-A828 PolarHBondContact O-N 2.95Å; E826-A828 VanDerWaalsContact C-N 3.33Å; E826-A828 PolarHBondContact O-N 3.45Å; A828-H830 PolarHBondContact O-N 2.89Å; A828-R831 PolarHBondContact O-N 3.47Å; A828-A832 WeakPolarHBondContact O-CB 3.32Å; A828-A832 PolarHBondContact O-N 2.91Å; A828-A832 VanDerWaalsContact O-N 3.11Å
829	A	88.2	Confident	89.1	Confident	26 Å²	26	75.4 Å²	75.4	22%	0.215	36%	0.361	C	S	.	.	H	α-helix	trans	-62.1	-41.5	178.5	0	0	0	0	0	112.4	R825 E826 Q833	R825-A829 WeakPolarHBondContact O-CB 3.37Å; R825-A829 PolarHBondContact O-N 3.16Å; R825-A829 VanDerWaalsContact O-N 3.1Å; E826-A829 PolarHBondContact O-N 2.95Å; A829-Q833 PolarHBondContact O-N 3.02Å; A829-Q833 VanDerWaalsContact O-N 3.1Å
830	H	89.6	Confident	89	Confident	118 Å²	118	74.7 Å²	74.7	55%	0.546	36%	0.357	S	S	.	.	H	α-helix	trans	-63.2	-51.5	177.5	-162.2	-56.1	0	0	0	111.6	E826 A828 A832 Q833 D834	E826-H830 PolarHBondContact O-N 3.21Å; A828-H830 PolarHBondContact O-N 2.89Å; H830-A832 VanDerWaalsContact C-N 3.31Å; H830-A832 PolarHBondContact O-N 2.89Å; H830-Q833 WeakPolarHBondContact O-CA 3.48Å; H830-Q833 WeakPolarHBondContact O-CB 3.33Å; H830-Q833 PolarHBondContact O-N 2.85Å; H830-D834 IonicContact CE1-OD1 3.66Å; H830-D834 PolarHBondContact CE1-OD1 3.25Å; H830-D834 IonicContact CE1-OD2 2.82Å; H830-D834 PolarHBondContact CE1-OD2 3.39Å; H830-D834 IonicContact CG-OD2 2.73Å; H830-D834 VanDerWaalsContact ND1-CG 3.32Å; H830-D834 IonicContact ND1-OD1 3.42Å; H830-D834 PolarHBondContact ND1-OD1 3.45Å; H830-D834 IonicContact ND1-OD2 2.62Å; H830-D834 PolarHBondContact ND1-OD2 2.87Å; H830-D834 VanDerWaalsContact O-CG 3.27Å; H830-D834 PolarHBondContact O-N 3.4Å; H830-D834 VanDerWaalsContact O-OD2 3.07Å
831	R	87.8	Confident	89	Confident	171 Å²	171	73.4 Å²	73.4	65%	0.645	36%	0.357	S	S	*	.	H	α-helix	trans	-60.7	-37.8	-179.4	-73.5	177.3	179.7	177.2	3.4	113.2	Q827 A828 Q833 D834 Q835	Q827-R831 WeakPolarHBondContact O-CG 3.42Å; Q827-R831 PolarHBondContact O-N 3.47Å; Q827-R831 VanDerWaalsContact O-N 3.14Å; A828-R831 PolarHBondContact O-N 3.47Å; R831-Q833 VanDerWaalsContact C-N 3.32Å; R831-D834 PolarHBondContact O-N 2.68Å; R831-Q835 WeakPolarHBondContact O-CG 3.4Å; R831-Q835 PolarHBondContact O-N 3.49Å; R831-Q835 VanDerWaalsContact O-N 3.11Å
832	A	88.6	Confident	88.9	Confident	9 Å²	9	76.8 Å²	76.8	7%	0.074	37%	0.374	C	S	.	.	H	α-helix	trans	-66.6	-35.1	174.4	0	0	0	0	0	111.8	T605 R609 A828 H830 L836	T605-A832 HydrophobicContact CG2-CB 4.29Å; R609-A832 HydrophobicContact CB-CB 3.93Å; R609-A832 HydrophobicContact CG-CB 4.03Å; A828-A832 WeakPolarHBondContact O-CB 3.32Å; A828-A832 PolarHBondContact O-N 2.91Å; A828-A832 VanDerWaalsContact O-N 3.11Å; H830-A832 VanDerWaalsContact C-N 3.31Å; H830-A832 PolarHBondContact O-N 2.89Å; A832-L836 WeakPolarHBondContact O-CG 3.32Å; A832-L836 PolarHBondContact O-N 3.25Å
833	Q	90.1	Very high	88.8	Confident	88 Å²	88	74.8 Å²	74.8	41%	0.411	36%	0.361	S	S	.	.	H	α-helix	trans	-68.8	-43.3	174.7	-164.5	63.5	43.2	0	0	112.1	A829 H830 R831 Q835 L836 V837	A829-Q833 PolarHBondContact O-N 3.02Å; A829-Q833 VanDerWaalsContact O-N 3.1Å; H830-Q833 WeakPolarHBondContact O-CA 3.48Å; H830-Q833 WeakPolarHBondContact O-CB 3.33Å; H830-Q833 PolarHBondContact O-N 2.85Å; R831-Q833 VanDerWaalsContact C-N 3.32Å; Q833-Q835 VanDerWaalsContact C-N 3.3Å; Q833-Q835 PolarHBondContact O-N 3.46Å; Q833-L836 PolarHBondContact O-N 2.87Å; Q833-V837 WeakPolarHBondContact O-CG2 3.31Å; Q833-V837 PolarHBondContact O-N 2.71Å; Q833-V837 VanDerWaalsContact O-N 3.07Å
834	D	88.7	Confident	88.7	Confident	82 Å²	82	75.9 Å²	75.9	44%	0.439	37%	0.372	S	S	.	.	H	α-helix	trans	-58.8	-41.8	176.4	-59	-45.4	0	0	0	111.4	H830 R831 L838	H830-D834 IonicContact CE1-OD1 3.66Å; H830-D834 PolarHBondContact CE1-OD1 3.25Å; H830-D834 IonicContact CE1-OD2 2.82Å; H830-D834 PolarHBondContact CE1-OD2 3.39Å; H830-D834 IonicContact CG-OD2 2.73Å; H830-D834 VanDerWaalsContact ND1-CG 3.32Å; H830-D834 IonicContact ND1-OD1 3.42Å; H830-D834 PolarHBondContact ND1-OD1 3.45Å; H830-D834 IonicContact ND1-OD2 2.62Å; H830-D834 PolarHBondContact ND1-OD2 2.87Å; H830-D834 VanDerWaalsContact O-CG 3.27Å; H830-D834 PolarHBondContact O-N 3.4Å; H830-D834 VanDerWaalsContact O-OD2 3.07Å; R831-D834 PolarHBondContact O-N 2.68Å; D834-L838 PolarHBondContact O-N 2.88Å; D834-L838 VanDerWaalsContact O-N 3.14Å
835	Q	87.3	Confident	88.7	Confident	106 Å²	106	80.5 Å²	80.5	50%	0.495	39%	0.391	S	S	.	.	H	α-helix	trans	-64.4	-41.4	175.9	-78	-173.7	-21.2	0	0	112.8	T605 R831 Q833 L838 M839	T605-Q835 HydrophobicContact CG2-CB 4.19Å; R831-Q835 WeakPolarHBondContact O-CG 3.4Å; R831-Q835 PolarHBondContact O-N 3.49Å; R831-Q835 VanDerWaalsContact O-N 3.11Å; Q833-Q835 VanDerWaalsContact C-N 3.3Å; Q833-Q835 PolarHBondContact O-N 3.46Å; Q835-L838 PolarHBondContact O-N 2.98Å; Q835-M839 WeakPolarHBondContact O-CG 3.31Å; Q835-M839 PolarHBondContact O-N 3.03Å
836	L	90.6	Very high	88.4	Confident	9 Å²	9	78.4 Å²	78.4	5%	0.047	39%	0.386	C	S	.	.	H	α-helix	trans	-64.8	-43.1	178.2	-71.6	171.1	0	0	0	111.8	E602 T605 R606 A832 Q833 L838 M839 E840	E602-L836 HydrophobicContact CB-CD2 3.75Å; E602-L836 HydrophobicContact CG-CD2 3.91Å; T605-L836 HydrophobicContact CG2-CD2 4.21Å; T605-L836 HydrophobicContact CG2-CG 4.11Å; R606-L836 HydrophobicContact CG-CD1 4.15Å; R606-L836 HydrophobicContact CG-CD2 4.28Å; A832-L836 WeakPolarHBondContact O-CG 3.32Å; A832-L836 PolarHBondContact O-N 3.25Å; Q833-L836 PolarHBondContact O-N 2.87Å; L836-L838 VanDerWaalsContact C-N 3.3Å; L836-L838 PolarHBondContact O-N 3.42Å; L836-M839 WeakPolarHBondContact O-CB 3.38Å; L836-M839 PolarHBondContact O-N 3.39Å; L836-M839 VanDerWaalsContact O-N 3.12Å; L836-E840 WeakPolarHBondContact O-CG 3.36Å; L836-E840 PolarHBondContact O-N 3.19Å
837	V	90.9	Very high	88.3	Confident	60 Å²	60	75.7 Å²	75.7	36%	0.364	37%	0.373	S	S	.	.	H	α-helix	trans	-62.5	-37.8	176.4	174.1	0	0	0	0	111.6	Q833 E840 Q841	Q833-V837 WeakPolarHBondContact O-CG2 3.31Å; Q833-V837 PolarHBondContact O-N 2.71Å; Q833-V837 VanDerWaalsContact O-N 3.07Å; V837-E840 PolarHBondContact O-N 3.34Å; V837-Q841 WeakPolarHBondContact O-CG 3.48Å; V837-Q841 PolarHBondContact O-N 2.99Å; V837-Q841 VanDerWaalsContact O-N 3.12Å
838	L	88.5	Confident	88.3	Confident	92 Å²	92	74.2 Å²	74.2	48%	0.482	38%	0.375	S	S	.	.	H	α-helix	trans	-67.5	-35.4	174.6	-175.3	65.7	0	0	0	112.4	D834 Q835 L836 L842	D834-L838 PolarHBondContact O-N 2.88Å; D834-L838 VanDerWaalsContact O-N 3.14Å; Q835-L838 PolarHBondContact O-N 2.98Å; L836-L838 VanDerWaalsContact C-N 3.3Å; L836-L838 PolarHBondContact O-N 3.42Å; L838-L842 HydrophobicContact CG-CD1 4.46Å; L838-L842 WeakPolarHBondContact O-CG 3.39Å; L838-L842 PolarHBondContact O-N 3.14Å
839	M	88.4	Confident	88.3	Confident	36 Å²	36	78.5 Å²	78.5	18%	0.177	39%	0.394	C	S	.	.	H	α-helix	trans	-66.2	-45.6	174.7	-74.6	-48.7	97.7	0	0	111.6	V598 H601 E602 Q835 L836 Q841 L842 A843	V598-M839 HydrophobicContact CG1-CB 3.79Å; V598-M839 HydrophobicContact CG1-CG 4.41Å; V598-M839 WeakPolarHBondContact CG1-O 3.31Å; V598-M839 HydrophobicContact CG1-SD 4.36Å; H601-M839 HydrophobicContact CB-SD 4.23Å; E602-M839 HydrophobicContact CG-CB 3.76Å; E602-M839 HydrophobicContact CG-CG 4.19Å; Q835-M839 WeakPolarHBondContact O-CG 3.31Å; Q835-M839 PolarHBondContact O-N 3.03Å; L836-M839 WeakPolarHBondContact O-CB 3.38Å; L836-M839 PolarHBondContact O-N 3.39Å; L836-M839 VanDerWaalsContact O-N 3.12Å; M839-Q841 VanDerWaalsContact C-N 3.35Å; M839-Q841 PolarHBondContact O-N 3.33Å; M839-L842 HydrophobicContact CE-CD1 3.75Å; M839-L842 PolarHBondContact O-N 3.2Å; M839-A843 PolarHBondContact O-N 3.06Å; M839-A843 VanDerWaalsContact O-N 3.09Å
840	E	88.2	Confident	88.3	Confident	96 Å²	96	79.2 Å²	79.2	45%	0.449	39%	0.393	S	S	.	.	H	α-helix	trans	-57.2	-46.2	175.9	-71.5	170.4	176.2	0	0	111.3	L836 V837 L842 A843 E844	L836-E840 WeakPolarHBondContact O-CG 3.36Å; L836-E840 PolarHBondContact O-N 3.19Å; V837-E840 PolarHBondContact O-N 3.34Å; E840-L842 PolarHBondContact O-N 3.46Å; E840-A843 WeakPolarHBondContact O-CB 3.26Å; E840-A843 PolarHBondContact O-N 2.96Å; E840-E844 PolarHBondContact O-N 3.1Å
841	Q	89.4	Confident	88.2	Confident	101 Å²	101	78.8 Å²	78.8	47%	0.472	39%	0.391	S	S	.	.	H	α-helix	trans	-59.2	-43.7	176.3	-73	171.1	3.9	0	0	112.9	V837 M839 A843 E844 E845	V837-Q841 WeakPolarHBondContact O-CG 3.48Å; V837-Q841 PolarHBondContact O-N 2.99Å; V837-Q841 VanDerWaalsContact O-N 3.12Å; M839-Q841 VanDerWaalsContact C-N 3.35Å; M839-Q841 PolarHBondContact O-N 3.33Å; Q841-A843 VanDerWaalsContact C-N 3.3Å; Q841-A843 PolarHBondContact O-N 3.07Å; Q841-E844 PolarHBondContact O-N 3.03Å; Q841-E845 WeakPolarHBondContact O-CG 3.35Å; Q841-E845 PolarHBondContact O-N 3.5Å
842	L	86.5	Confident	88.3	Confident	70 Å²	70	71.9 Å²	71.9	37%	0.366	37%	0.373	S	S	.	.	H	α-helix	trans	-65.3	-31.9	177.8	-71.9	167.9	0	0	0	112.7	L838 M839 E840 A846	L838-L842 HydrophobicContact CG-CD1 4.46Å; L838-L842 WeakPolarHBondContact O-CG 3.39Å; L838-L842 PolarHBondContact O-N 3.14Å; M839-L842 HydrophobicContact CE-CD1 3.75Å; M839-L842 PolarHBondContact O-N 3.2Å; E840-L842 PolarHBondContact O-N 3.46Å; L842-A846 WeakPolarHBondContact O-CB 3.48Å; L842-A846 PolarHBondContact O-N 3.28Å; L842-A846 VanDerWaalsContact O-N 3.07Å
843	A	88.1	Confident	88.2	Confident	16 Å²	16	73.3 Å²	73.3	13%	0.132	38%	0.381	C	S	.	.	H	α-helix	trans	-69.9	-39.7	173.4	0	0	0	0	0	112.3	V598 M839 E840 Q841 Q847	V598-A843 HydrophobicContact CG1-CB 4.28Å; M839-A843 PolarHBondContact O-N 3.06Å; M839-A843 VanDerWaalsContact O-N 3.09Å; E840-A843 WeakPolarHBondContact O-CB 3.26Å; E840-A843 PolarHBondContact O-N 2.96Å; Q841-A843 VanDerWaalsContact C-N 3.3Å; Q841-A843 PolarHBondContact O-N 3.07Å; A843-Q847 WeakPolarHBondContact O-CB 3.34Å; A843-Q847 PolarHBondContact O-N 3.31Å; A843-Q847 VanDerWaalsContact O-N 3.11Å
844	E	88.3	Confident	88	Confident	146 Å²	146	73.2 Å²	73.2	68%	0.682	38%	0.381	S	S	*	.	H	α-helix	trans	-65.2	-44.4	173.9	-68.8	-164.4	148.4	0	0	112	E840 Q841 A846 Q847 S848	E840-E844 PolarHBondContact O-N 3.1Å; Q841-E844 PolarHBondContact O-N 3.03Å; E844-A846 PolarHBondContact O-N 2.71Å; E844-Q847 PolarHBondContact O-N 3Å; E844-S848 WeakPolarHBondContact O-CB 2.98Å; E844-S848 PolarHBondContact O-N 3.38Å
845	E	88	Confident	88	Confident	134 Å²	134	73.1 Å²	73.1	63%	0.626	38%	0.383	S	S	*	.	H	α-helix	trans	-60.6	-44.5	176	-74.6	-170.5	164.9	0	0	112.1	Q841 Q847 S848 L849	Q841-E845 WeakPolarHBondContact O-CG 3.35Å; Q841-E845 PolarHBondContact O-N 3.5Å; E845-Q847 VanDerWaalsContact C-N 3.31Å; E845-Q847 PolarHBondContact O-N 2.93Å; E845-S848 PolarHBondContact O-N 2.87Å; E845-L849 WeakPolarHBondContact O-CB 3.4Å; E845-L849 PolarHBondContact O-N 3.28Å
846	A	85	Confident	88	Confident	15 Å²	15	76.5 Å²	76.5	12%	0.124	39%	0.391	C	S	.	.	H	α-helix	trans	-62.6	-36.7	176.7	0	0	0	0	0	112.6	C594 L842 E844 H850	C594-A846 HydrophobicContact CB-CB 4.26Å; L842-A846 WeakPolarHBondContact O-CB 3.48Å; L842-A846 PolarHBondContact O-N 3.28Å; L842-A846 VanDerWaalsContact O-N 3.07Å; E844-A846 PolarHBondContact O-N 2.71Å; A846-H850 PolarHBondContact O-N 3.03Å
847	Q	87.3	Confident	87.7	Confident	77 Å²	77	76.8 Å²	76.8	36%	0.36	40%	0.396	S	S	.	.	H	α-helix	trans	-72.5	-40.9	175.7	-177.4	164.7	-45.2	0	0	112.3	A843 E844 E845 H850 Q851	A843-Q847 WeakPolarHBondContact O-CB 3.34Å; A843-Q847 PolarHBondContact O-N 3.31Å; A843-Q847 VanDerWaalsContact O-N 3.11Å; E844-Q847 PolarHBondContact O-N 3Å; E845-Q847 VanDerWaalsContact C-N 3.31Å; E845-Q847 PolarHBondContact O-N 2.93Å; Q847-H850 PolarHBondContact O-N 3.11Å; Q847-Q851 PolarHBondContact O-N 3.16Å
848	S	88.7	Confident	87.4	Confident	81 Å²	81	75.4 Å²	75.4	57%	0.566	39%	0.391	S	S	*	.	H	α-helix	trans	-60.7	-43.5	174.7	-176.7	0	0	0	0	111.5	E844 E845 H850 Q851 G852	E844-S848 WeakPolarHBondContact O-CB 2.98Å; E844-S848 PolarHBondContact O-N 3.38Å; E845-S848 PolarHBondContact O-N 2.87Å; S848-H850 PolarHBondContact O-N 3.4Å; S848-Q851 PolarHBondContact O-N 3.14Å; S848-G852 PolarHBondContact O-N 3.45Å
849	L	85.4	Confident	87.4	Confident	115 Å²	115	77 Å²	77	60%	0.602	40%	0.396	S	S	*	.	H	α-helix	trans	-60.1	-45.5	174.7	179.2	61.7	0	0	0	112.1	E845 G852 V853	E845-L849 WeakPolarHBondContact O-CB 3.4Å; E845-L849 PolarHBondContact O-N 3.28Å; L849-G852 PolarHBondContact O-N 2.99Å; L849-V853 HydrophobicContact CD1-CG2 4.32Å; L849-V853 WeakPolarHBondContact O-CG2 3.18Å; L849-V853 PolarHBondContact O-N 2.81Å
850	H	88.4	Confident	87.2	Confident	42 Å²	42	84.7 Å²	84.7	19%	0.194	42%	0.423	C	S	.	.	H	α-helix	trans	-60.7	-50.7	178.3	175.4	13.7	0	0	0	112	V587 A591 A846 Q847 S848 G852 V853 E854	V587-H850 HydrophobicContact CG1-CB 4.44Å; A591-H850 HydrophobicContact CB-CB 4.02Å; A846-H850 PolarHBondContact O-N 3.03Å; Q847-H850 PolarHBondContact O-N 3.11Å; S848-H850 PolarHBondContact O-N 3.4Å; H850-G852 VanDerWaalsContact C-N 3.31Å; H850-G852 PolarHBondContact O-N 3.45Å; H850-V853 PolarHBondContact O-N 3.3Å; H850-E854 VanDerWaalsContact CE1-CD 3.41Å; H850-E854 IonicContact CE1-OE1 3.35Å; H850-E854 PolarHBondContact CE1-OE1 3.17Å; H850-E854 VanDerWaalsContact CE1-OE1 3.3Å; H850-E854 IonicContact CE1-OE2 2.6Å; H850-E854 PolarHBondContact O-N 2.94Å
851	Q	88.5	Confident	87.2	Confident	109 Å²	109	81.7 Å²	81.7	51%	0.509	41%	0.41	S	S	.	.	H	α-helix	trans	-63.8	-36.9	177.5	-68.5	-177.2	-7.7	0	0	112	Q847 S848 V853 E854 T855	Q847-Q851 PolarHBondContact O-N 3.16Å; S848-Q851 PolarHBondContact O-N 3.14Å; Q851-V853 VanDerWaalsContact C-N 3.34Å; Q851-V853 PolarHBondContact O-N 3.25Å; Q851-E854 PolarHBondContact O-N 3.13Å; Q851-T855 WeakPolarHBondContact O-CB 3.35Å; Q851-T855 WeakPolarHBondContact O-CG2 3.39Å; Q851-T855 PolarHBondContact O-N 2.97Å; Q851-T855 PolarHBondContact O-OG1 2.96Å
852	G	88.5	Confident	87.1	Confident	26 Å²	26	84.9 Å²	84.9	27%	0.268	42%	0.418	S	S	.	.	H	α-helix	trans	-65.5	-32.4	175.4	0	0	0	0	0	113.8	S848 L849 H850 T855 R856	S848-G852 PolarHBondContact O-N 3.45Å; L849-G852 PolarHBondContact O-N 2.99Å; H850-G852 VanDerWaalsContact C-N 3.31Å; H850-G852 PolarHBondContact O-N 3.45Å; G852-T855 PolarHBondContact O-OG1 2.9Å; G852-R856 VanDerWaalsContact O-CB 3.26Å; G852-R856 WeakPolarHBondContact O-CB 3.39Å; G852-R856 WeakPolarHBondContact O-CD 3.41Å; G852-R856 WeakPolarHBondContact O-CG 3.46Å; G852-R856 PolarHBondContact O-N 2.96Å
853	V	86.8	Confident	87.1	Confident	38 Å²	38	84 Å²	84	23%	0.23	42%	0.421	C	S	.	.	H	α-helix	trans	-77.8	-40.1	174.1	169.5	0	0	0	0	111.7	V583 Q584 V587 L849 H850 Q851 G857	V583-V853 HydrophobicContact CG1-CG1 4.27Å; Q584-V853 HydrophobicContact CG-CG1 4.4Å; V587-V853 HydrophobicContact CB-CG1 4.24Å; V587-V853 HydrophobicContact CG1-CB 4.13Å; V587-V853 HydrophobicContact CG1-CG1 4.32Å; V587-V853 HydrophobicContact CG1-CG2 4.16Å; V587-V853 HydrophobicContact CG2-CG1 4.16Å; V587-V853 HydrophobicContact CG2-CG2 4.43Å; L849-V853 HydrophobicContact CD1-CG2 4.32Å; L849-V853 WeakPolarHBondContact O-CG2 3.18Å; L849-V853 PolarHBondContact O-N 2.81Å; H850-V853 PolarHBondContact O-N 3.3Å; Q851-V853 VanDerWaalsContact C-N 3.34Å; Q851-V853 PolarHBondContact O-N 3.25Å; V853-G857 WeakPolarHBondContact O-CA 3.31Å; V853-G857 PolarHBondContact O-N 3.19Å
854	E	86.6	Confident	86.9	Confident	87 Å²	87	84.6 Å²	84.6	41%	0.407	43%	0.426	S	S	.	.	H	α-helix	trans	-61.8	-54.6	176.2	-74.2	-167.4	143.5	0	0	112	Q584 H850 Q851 G857 A858	Q584-E854 PolarHBondContact NE2-O 2.95Å; H850-E854 VanDerWaalsContact CE1-CD 3.41Å; H850-E854 IonicContact CE1-OE1 3.35Å; H850-E854 PolarHBondContact CE1-OE1 3.17Å; H850-E854 VanDerWaalsContact CE1-OE1 3.3Å; H850-E854 IonicContact CE1-OE2 2.6Å; H850-E854 PolarHBondContact O-N 2.94Å; Q851-E854 PolarHBondContact O-N 3.13Å; E854-G857 PolarHBondContact O-N 3.03Å; E854-A858 PolarHBondContact O-N 3.49Å
855	T	88.6	Confident	86.8	Confident	79 Å²	79	81.3 Å²	81.3	49%	0.485	41%	0.41	S	S	.	.	H	α-helix	trans	-59	-55	-178.4	48.9	0	0	0	0	111.8	Q851 G852 G857 A858 E859	Q851-T855 WeakPolarHBondContact O-CB 3.35Å; Q851-T855 WeakPolarHBondContact O-CG2 3.39Å; Q851-T855 PolarHBondContact O-N 2.97Å; Q851-T855 PolarHBondContact O-OG1 2.96Å; G852-T855 PolarHBondContact O-OG1 2.9Å; T855-G857 VanDerWaalsContact C-N 3.29Å; T855-G857 PolarHBondContact O-N 3.07Å; T855-A858 PolarHBondContact O-N 3.44Å; T855-E859 WeakPolarHBondContact O-CG 3.24Å; T855-E859 PolarHBondContact O-N 3.28Å
856	R	86.7	Confident	86.7	Confident	178 Å²	178	78.1 Å²	78.1	67%	0.672	41%	0.407	S	S	*	.	H	α-helix	trans	-64.8	-32.9	179	-66.3	176.7	175.2	-173.6	0.5	112.5	G852 R860	G852-R856 VanDerWaalsContact O-CB 3.26Å; G852-R856 WeakPolarHBondContact O-CB 3.39Å; G852-R856 WeakPolarHBondContact O-CD 3.41Å; G852-R856 WeakPolarHBondContact O-CG 3.46Å; G852-R856 PolarHBondContact O-N 2.96Å; R856-R860 VanDerWaalsContact O-CB 3.28Å; R856-R860 WeakPolarHBondContact O-CB 3.47Å; R856-R860 WeakPolarHBondContact O-CG 3.13Å; R856-R860 PolarHBondContact O-N 3.18Å
857	G	84	Confident	86.7	Confident	14 Å²	14	81.5 Å²	81.5	14%	0.144	42%	0.423	C	S	.	.	H	α-helix	trans	-62.1	-49.6	173.8	0	0	0	0	0	111.7	V853 E854 T855 R860 L861	V853-G857 WeakPolarHBondContact O-CA 3.31Å; V853-G857 PolarHBondContact O-N 3.19Å; E854-G857 PolarHBondContact O-N 3.03Å; T855-G857 VanDerWaalsContact C-N 3.29Å; T855-G857 PolarHBondContact O-N 3.07Å; G857-R860 PolarHBondContact O-N 3.2Å; G857-L861 WeakPolarHBondContact O-CB 3.29Å; G857-L861 PolarHBondContact O-N 3.19Å
858	A	86.2	Confident	86.6	Confident	32 Å²	32	79.3 Å²	79.3	26%	0.264	41%	0.413	S	S	.	.	H	α-helix	trans	-65.1	-39.5	177.8	0	0	0	0	0	113	E854 T855 R862	E854-A858 PolarHBondContact O-N 3.49Å; T855-A858 PolarHBondContact O-N 3.44Å; A858-R862 WeakPolarHBondContact O-CG 3.33Å; A858-R862 PolarHBondContact O-N 3.17Å; A858-R862 VanDerWaalsContact O-N 3.16Å
859	E	87.9	Confident	86.4	Confident	126 Å²	126	78.8 Å²	78.8	59%	0.589	41%	0.41	S	S	*	.	H	α-helix	trans	-62.7	-46.4	173.9	-73.2	176.4	166.8	0	0	112.1	T855 L861 A863	T855-E859 WeakPolarHBondContact O-CG 3.24Å; T855-E859 PolarHBondContact O-N 3.28Å; E859-L861 VanDerWaalsContact C-N 3.35Å; E859-A863 WeakPolarHBondContact O-CB 3.36Å; E859-A863 PolarHBondContact O-N 3.45Å
860	R	84.4	Confident	86.4	Confident	197 Å²	197	75.4 Å²	75.4	74%	0.743	40%	0.402	S	S	*	.	H	α-helix	trans	-68.2	-33.9	179.8	-71.2	-70.5	179.3	172.3	-0.5	112.5	R856 G857 A863 A864	R856-R860 VanDerWaalsContact O-CB 3.28Å; R856-R860 WeakPolarHBondContact O-CB 3.47Å; R856-R860 WeakPolarHBondContact O-CG 3.13Å; R856-R860 PolarHBondContact O-N 3.18Å; G857-R860 PolarHBondContact O-N 3.2Å; R860-A863 PolarHBondContact O-N 3.26Å; R860-A864 WeakPolarHBondContact O-CB 3.46Å; R860-A864 PolarHBondContact O-N 3.28Å
861	L	87	Confident	86.2	Confident	33 Å²	33	79.2 Å²	79.2	17%	0.173	42%	0.415	C	S	.	.	H	α-helix	trans	-64.1	-52.7	175	-173.9	62.9	0	0	0	111	V576 E577 G857 E859 A863 A864 E865	V576-L861 HydrophobicContact CG1-CD1 3.88Å; E577-L861 HydrophobicContact CG-CD1 3.96Å; E577-L861 HydrophobicContact CG-CD2 4.44Å; G857-L861 WeakPolarHBondContact O-CB 3.29Å; G857-L861 PolarHBondContact O-N 3.19Å; E859-L861 VanDerWaalsContact C-N 3.35Å; L861-A863 VanDerWaalsContact C-N 3.28Å; L861-A863 PolarHBondContact O-N 3.26Å; L861-A864 WeakPolarHBondContact O-CB 3.48Å; L861-A864 PolarHBondContact O-N 3.33Å; L861-E865 WeakPolarHBondContact O-CG 3.45Å; L861-E865 PolarHBondContact O-N 3.13Å
862	R	87.9	Confident	85.9	Confident	167 Å²	167	76.8 Å²	76.8	63%	0.63	40%	0.404	S	S	*	.	H	α-helix	trans	-58.9	-37.1	175.6	-66.4	176.7	-159.5	156.4	6.8	113.1	A858 A866	A858-R862 WeakPolarHBondContact O-CG 3.33Å; A858-R862 PolarHBondContact O-N 3.17Å; A858-R862 VanDerWaalsContact O-N 3.16Å; R862-A866 WeakPolarHBondContact O-CB 3.5Å; R862-A866 PolarHBondContact O-N 3.43Å; R862-A866 VanDerWaalsContact O-N 3.07Å
863	A	86.9	Confident	85.8	Confident	52 Å²	52	78.3 Å²	78.3	43%	0.43	40%	0.404	S	S	.	.	H	α-helix	trans	-65	-42.8	175.1	0	0	0	0	0	111.5	E859 R860 L861 A866 D867	E859-A863 WeakPolarHBondContact O-CB 3.36Å; E859-A863 PolarHBondContact O-N 3.45Å; R860-A863 PolarHBondContact O-N 3.26Å; L861-A863 VanDerWaalsContact C-N 3.28Å; L861-A863 PolarHBondContact O-N 3.26Å; A863-A866 PolarHBondContact O-N 2.99Å; A863-D867 WeakPolarHBondContact O-CB 3.35Å; A863-D867 PolarHBondContact O-N 3.09Å
864	A	83.3	Confident	85.8	Confident	29 Å²	29	82.5 Å²	82.5	24%	0.24	42%	0.421	C	S	.	.	H	α-helix	trans	-66.5	-40.3	176.1	0	0	0	0	0	112.5	R860 L861 D867 L868	R860-A864 WeakPolarHBondContact O-CB 3.46Å; R860-A864 PolarHBondContact O-N 3.28Å; L861-A864 WeakPolarHBondContact O-CB 3.48Å; L861-A864 PolarHBondContact O-N 3.33Å; A864-D867 PolarHBondContact O-N 3.42Å; A864-L868 VanDerWaalsContact O-CB 3.28Å; A864-L868 WeakPolarHBondContact O-CB 3.35Å; A864-L868 WeakPolarHBondContact O-CD1 3.46Å; A864-L868 WeakPolarHBondContact O-CG 3.43Å; A864-L868 PolarHBondContact O-N 3.3Å
865	E	86	Confident	85.6	Confident	76 Å²	76	81.9 Å²	81.9	36%	0.355	42%	0.421	S	S	.	.	H	α-helix	trans	-55	-50.1	172.2	-72	164.5	-163.9	0	0	111.5	L573 L861 L868 S869	L573-E865 HydrophobicContact CD2-CG 4.16Å; L861-E865 WeakPolarHBondContact O-CG 3.45Å; L861-E865 PolarHBondContact O-N 3.13Å; E865-L868 PolarHBondContact O-N 2.83Å; E865-S869 VanDerWaalsContact O-CB 3.23Å; E865-S869 WeakPolarHBondContact O-CB 3.23Å; E865-S869 PolarHBondContact O-N 3.08Å
866	A	86.9	Confident	85.6	Confident	67 Å²	67	83.8 Å²	83.8	55%	0.554	42%	0.419	S	S	*	.	H	α-helix	trans	-63.3	-45.6	178.9	0	0	0	0	0	112.4	R862 A863 L868 S869 G870	R862-A866 WeakPolarHBondContact O-CB 3.5Å; R862-A866 PolarHBondContact O-N 3.43Å; R862-A866 VanDerWaalsContact O-N 3.07Å; A863-A866 PolarHBondContact O-N 2.99Å; A866-L868 PolarHBondContact O-N 3.26Å; A866-S869 PolarHBondContact O-N 3.01Å; A866-G870 PolarHBondContact O-N 2.67Å
867	D	85.3	Confident	85.7	Confident	87 Å²	87	82.8 Å²	82.8	47%	0.465	42%	0.415	S	S	.	.	H	α-helix	trans	-62.3	-41.7	178.3	-117.4	45.4	0	0	0	112.2	A863 A864 R871	A863-D867 WeakPolarHBondContact O-CB 3.35Å; A863-D867 PolarHBondContact O-N 3.09Å; A864-D867 PolarHBondContact O-N 3.42Å; D867-R871 WeakPolarHBondContact O-CG 3.4Å; D867-R871 PolarHBondContact O-N 3.28Å; D867-R871 VanDerWaalsContact O-N 3.12Å; D867-R871 IonicContact OD2-CZ 3.48Å; D867-R871 IonicContact OD2-NH1 3.46Å; D867-R871 PolarHBondContact OD2-NH1 3.3Å; D867-R871 IonicContact OD2-NH2 3.47Å; D867-R871 PolarHBondContact OD2-NH2 3.32Å
868	L	84	Confident	85.8	Confident	31 Å²	31	86.5 Å²	86.5	16%	0.162	44%	0.435	C	S	.	.	H	α-helix	trans	-74.2	-39.1	179.7	-74.9	162.6	0	0	0	111.6	L569 L573 A864 E865 A866 R871 Q872	L569-L868 HydrophobicContact CD2-CD2 3.76Å; L573-L868 HydrophobicContact CD2-CB 4.09Å; L573-L868 HydrophobicContact CD2-CD1 3.49Å; L573-L868 VanDerWaalsContact CD2-CD1 3.49Å; L573-L868 HydrophobicContact CD2-CG 4.42Å; L573-L868 HydrophobicContact CG-CB 4.41Å; L573-L868 HydrophobicContact CG-CD1 3.92Å; A864-L868 VanDerWaalsContact O-CB 3.28Å; A864-L868 WeakPolarHBondContact O-CB 3.35Å; A864-L868 WeakPolarHBondContact O-CD1 3.46Å; A864-L868 WeakPolarHBondContact O-CG 3.43Å; A864-L868 PolarHBondContact O-N 3.3Å; E865-L868 PolarHBondContact O-N 2.83Å; A866-L868 PolarHBondContact O-N 3.26Å; L868-R871 PolarHBondContact O-N 3.22Å; L868-Q872 WeakPolarHBondContact O-CB 3.32Å; L868-Q872 PolarHBondContact O-N 2.95Å
869	S	84.8	Confident	85.9	Confident	70 Å²	70	86 Å²	86	49%	0.49	43%	0.427	S	S	.	.	H	α-helix	trans	-63.4	-43.9	173.8	-173.1	0	0	0	0	111.8	E865 A866 Q872 E873	E865-S869 VanDerWaalsContact O-CB 3.23Å; E865-S869 WeakPolarHBondContact O-CB 3.23Å; E865-S869 PolarHBondContact O-N 3.08Å; A866-S869 PolarHBondContact O-N 3.01Å; S869-Q872 WeakPolarHBondContact O-CB 3.44Å; S869-Q872 PolarHBondContact O-N 3.49Å; S869-E873 PolarHBondContact O-N 2.82Å
870	G	85.8	Confident	85.9	Confident	43 Å²	43	82 Å²	82	44%	0.443	41%	0.412	S	S	.	.	H	α-helix	trans	-59.4	-47.6	174.6	0	0	0	0	0	112.5	A866 Q872 E873 E874	A866-G870 PolarHBondContact O-N 2.67Å; G870-Q872 VanDerWaalsContact C-N 3.35Å; G870-Q872 PolarHBondContact O-N 3.29Å; G870-E873 PolarHBondContact O-N 3.44Å; G870-E874 PolarHBondContact O-N 3.28Å
871	R	83.4	Confident	86.1	Confident	122 Å²	122	75.2 Å²	75.2	46%	0.46	40%	0.397	S	S	.	.	H	α-helix	trans	-65.3	-33.9	175.4	-72.2	-179.9	-173	105.3	10.9	113	D867 L868 N875	D867-R871 WeakPolarHBondContact O-CG 3.4Å; D867-R871 PolarHBondContact O-N 3.28Å; D867-R871 VanDerWaalsContact O-N 3.12Å; D867-R871 IonicContact OD2-CZ 3.48Å; D867-R871 IonicContact OD2-NH1 3.46Å; D867-R871 PolarHBondContact OD2-NH1 3.3Å; D867-R871 IonicContact OD2-NH2 3.47Å; D867-R871 PolarHBondContact OD2-NH2 3.32Å; L868-R871 PolarHBondContact O-N 3.22Å; R871-N875 WeakPolarHBondContact O-CB 3.47Å; R871-N875 PolarHBondContact O-N 3.27Å; R871-N875 PolarHBondContact O-ND2 3.22Å
872	Q	83.5	Confident	86.1	Confident	58 Å²	58	77.9 Å²	77.9	27%	0.271	41%	0.411	S	S	.	.	H	α-helix	trans	-62.9	-47.9	175	-174.8	-178.7	-11.8	0	0	110.6	L569 L868 S869 G870 N875 R876	L569-Q872 HydrophobicContact CD1-CB 3.89Å; L569-Q872 HydrophobicContact CD1-CG 4.1Å; L868-Q872 WeakPolarHBondContact O-CB 3.32Å; L868-Q872 PolarHBondContact O-N 2.95Å; S869-Q872 WeakPolarHBondContact O-CB 3.44Å; S869-Q872 PolarHBondContact O-N 3.49Å; G870-Q872 VanDerWaalsContact C-N 3.35Å; G870-Q872 PolarHBondContact O-N 3.29Å; Q872-N875 PolarHBondContact O-N 3.25Å; Q872-R876 VanDerWaalsContact O-CB 3.29Å; Q872-R876 WeakPolarHBondContact O-CB 3.18Å; Q872-R876 PolarHBondContact O-N 2.83Å
873	E	85.3	Confident	86.1	Confident	59 Å²	59	72.9 Å²	72.9	28%	0.276	40%	0.395	S	S	.	.	H	α-helix	trans	-67.1	-37.8	-179.4	176.4	59.7	-172.9	0	0	112.6	S869 G870 R876 R877	S869-E873 PolarHBondContact O-N 2.82Å; G870-E873 PolarHBondContact O-N 3.44Å; E873-R876 IonicContact OE1-CZ 3.7Å; E873-R876 IonicContact OE1-NH2 2.72Å; E873-R876 PolarHBondContact OE1-NH2 3.18Å; E873-R876 IonicContact OE2-CZ 2.69Å; E873-R876 IonicContact OE2-NE 2.73Å; E873-R876 PolarHBondContact OE2-NE 3.49Å; E873-R876 IonicContact OE2-NH2 3.3Å; E873-R876 PolarHBondContact OE2-NH2 2.73Å; E873-R877 VanDerWaalsContact O-CG 3.27Å; E873-R877 WeakPolarHBondContact O-CG 3.32Å; E873-R877 PolarHBondContact O-N 3.14Å; E873-R877 VanDerWaalsContact O-N 3.1Å; E873-R877 IonicContact OE1-CZ 2.77Å; E873-R877 IonicContact OE1-NE 3.88Å; E873-R877 PolarHBondContact OE1-NE 2.93Å; E873-R877 IonicContact OE1-NH2 3.35Å; E873-R877 PolarHBondContact OE1-NH2 3.32Å
874	E	86.4	Confident	86.1	Confident	126 Å²	126	77 Å²	77	59%	0.589	41%	0.406	S	S	*	.	H	α-helix	trans	-63.3	-51.7	173.2	-175.9	176	-150.9	0	0	111.9	G870 R876 R877 V878	G870-E874 PolarHBondContact O-N 3.28Å; E874-R876 VanDerWaalsContact C-N 3.29Å; E874-R876 PolarHBondContact O-N 3.39Å; E874-R877 PolarHBondContact O-N 2.97Å; E874-V878 WeakPolarHBondContact O-CG2 3.45Å; E874-V878 PolarHBondContact O-N 3.16Å; E874-V878 VanDerWaalsContact O-N 3.09Å
875	N	84.3	Confident	86.3	Confident	74 Å²	74	80.4 Å²	80.4	40%	0.396	42%	0.417	S	S	.	.	H	α-helix	trans	-59.7	-39.9	177.8	-80.9	-70.9	0	0	0	112	R871 Q872 V878 L879	R871-N875 WeakPolarHBondContact O-CB 3.47Å; R871-N875 PolarHBondContact O-N 3.27Å; R871-N875 PolarHBondContact O-ND2 3.22Å; Q872-N875 PolarHBondContact O-N 3.25Å; N875-V878 PolarHBondContact O-N 3.27Å; N875-L879 WeakPolarHBondContact O-CB 3.29Å; N875-L879 WeakPolarHBondContact O-CG 3.4Å; N875-L879 PolarHBondContact O-N 3.37Å
876	R	86.9	Confident	86.4	Confident	118 Å²	118	77.5 Å²	77.5	45%	0.445	40%	0.404	S	S	.	.	H	α-helix	trans	-59	-48.5	176.3	-169.8	-177.8	71.1	81.1	-0.8	111.2	L562 Q872 E873 E874 V878 L879 T880	L562-R876 HydrophobicContact CD2-CG 4.26Å; Q872-R876 VanDerWaalsContact O-CB 3.29Å; Q872-R876 WeakPolarHBondContact O-CB 3.18Å; Q872-R876 PolarHBondContact O-N 2.83Å; E873-R876 IonicContact OE1-CZ 3.7Å; E873-R876 IonicContact OE1-NH2 2.72Å; E873-R876 PolarHBondContact OE1-NH2 3.18Å; E873-R876 IonicContact OE2-CZ 2.69Å; E873-R876 IonicContact OE2-NE 2.73Å; E873-R876 PolarHBondContact OE2-NE 3.49Å; E873-R876 IonicContact OE2-NH2 3.3Å; E873-R876 PolarHBondContact OE2-NH2 2.73Å; E874-R876 VanDerWaalsContact C-N 3.29Å; E874-R876 PolarHBondContact O-N 3.39Å; R876-V878 PolarHBondContact O-N 2.89Å; R876-L879 PolarHBondContact O-N 3.41Å; R876-T880 PolarHBondContact O-N 3.12Å; R876-T880 PolarHBondContact O-OG1 2.88Å; R876-T880 VanDerWaalsContact O-OG1 3.1Å
877	R	89	Confident	86.3	Confident	158 Å²	158	76.3 Å²	76.3	60%	0.596	40%	0.399	S	S	*	.	H	α-helix	trans	-59.6	-46.6	178	-71.3	168.1	-172.9	-171.4	5	112.4	E873 E874 A881	E873-R877 VanDerWaalsContact O-CG 3.27Å; E873-R877 WeakPolarHBondContact O-CG 3.32Å; E873-R877 PolarHBondContact O-N 3.14Å; E873-R877 VanDerWaalsContact O-N 3.1Å; E873-R877 IonicContact OE1-CZ 2.77Å; E873-R877 IonicContact OE1-NE 3.88Å; E873-R877 PolarHBondContact OE1-NE 2.93Å; E873-R877 IonicContact OE1-NH2 3.35Å; E873-R877 PolarHBondContact OE1-NH2 3.32Å; E874-R877 PolarHBondContact O-N 2.97Å; R877-A881 WeakPolarHBondContact O-CB 3.47Å; R877-A881 PolarHBondContact O-N 3.26Å
878	V	87.5	Confident	86.5	Confident	92 Å²	92	75.3 Å²	75.3	56%	0.558	40%	0.398	S	S	*	.	H	α-helix	trans	-63.8	-43.3	-179.8	174.6	0	0	0	0	111.5	E874 N875 R876 L882	E874-V878 WeakPolarHBondContact O-CG2 3.45Å; E874-V878 PolarHBondContact O-N 3.16Å; E874-V878 VanDerWaalsContact O-N 3.09Å; N875-V878 PolarHBondContact O-N 3.27Å; R876-V878 PolarHBondContact O-N 2.89Å; V878-L882 PolarHBondContact O-N 3.37Å; V878-L882 VanDerWaalsContact O-N 3.09Å
879	L	87.7	Confident	86.6	Confident	20 Å²	20	77 Å²	77	11%	0.105	41%	0.408	C	S	.	.	H	α-helix	trans	-69.6	-40.1	179.7	-71.8	170.3	0	0	0	112.4	V558 L561 L562 N875 R876 L882 Q883	V558-L879 HydrophobicContact CG1-CB 4.18Å; V558-L879 HydrophobicContact CG1-CD2 4.28Å; V558-L879 WeakPolarHBondContact CG1-O 3.49Å; L561-L879 HydrophobicContact CB-CD1 4.29Å; L561-L879 HydrophobicContact CB-CD2 4.47Å; L562-L879 HydrophobicContact CD1-CB 4.43Å; L562-L879 HydrophobicContact CD2-CB 3.67Å; L562-L879 HydrophobicContact CD2-CD1 3.89Å; L562-L879 HydrophobicContact CD2-CG 4.44Å; L562-L879 HydrophobicContact CG-CB 3.9Å; L562-L879 HydrophobicContact CG-CD1 4.03Å; N875-L879 WeakPolarHBondContact O-CB 3.29Å; N875-L879 WeakPolarHBondContact O-CG 3.4Å; N875-L879 PolarHBondContact O-N 3.37Å; R876-L879 PolarHBondContact O-N 3.41Å; L879-L882 PolarHBondContact O-N 3.49Å; L879-Q883 PolarHBondContact O-N 3.15Å
880	T	88.5	Confident	86.7	Confident	43 Å²	43	79 Å²	79	26%	0.264	41%	0.405	S	S	.	.	H	α-helix	trans	-63.8	-42.9	173.9	-59.3	0	0	0	0	111.9	R876 L882 Q883 E884	R876-T880 PolarHBondContact O-N 3.12Å; R876-T880 PolarHBondContact O-OG1 2.88Å; R876-T880 VanDerWaalsContact O-OG1 3.1Å; T880-L882 VanDerWaalsContact C-N 3.3Å; T880-L882 PolarHBondContact O-N 2.69Å; T880-Q883 WeakPolarHBondContact O-CB 3.25Å; T880-Q883 PolarHBondContact O-N 2.9Å; T880-Q883 VanDerWaalsContact O-N 3.09Å; T880-E884 PolarHBondContact O-N 3.41Å
881	A	88.5	Confident	86.8	Confident	54 Å²	54	79.6 Å²	79.6	45%	0.446	41%	0.405	S	S	.	.	H	α-helix	trans	-61.8	-37.3	175.9	0	0	0	0	0	112.6	R877 Q883 E884 Q885	R877-A881 WeakPolarHBondContact O-CB 3.47Å; R877-A881 PolarHBondContact O-N 3.26Å; A881-Q883 VanDerWaalsContact C-N 3.35Å; A881-E884 PolarHBondContact O-N 2.84Å; A881-Q885 PolarHBondContact O-N 2.84Å
882	L	87.2	Confident	87	Confident	89 Å²	89	76.4 Å²	76.4	47%	0.466	40%	0.399	S	S	.	.	H	α-helix	trans	-67.2	-35	173.8	-176.1	62.1	0	0	0	112.3	V558 V878 L879 T880 T886	V558-L882 HydrophobicContact CG2-CD2 3.92Å; V558-L882 HydrophobicContact CG2-CG 4.3Å; V878-L882 PolarHBondContact O-N 3.37Å; V878-L882 VanDerWaalsContact O-N 3.09Å; L879-L882 PolarHBondContact O-N 3.49Å; T880-L882 VanDerWaalsContact C-N 3.3Å; T880-L882 PolarHBondContact O-N 2.69Å; L882-T886 WeakPolarHBondContact O-CB 3.35Å; L882-T886 PolarHBondContact O-N 3.1Å; L882-T886 PolarHBondContact O-OG1 2.73Å
883	Q	87	Confident	87.1	Confident	62 Å²	62	75.8 Å²	75.8	29%	0.29	40%	0.397	S	S	.	.	H	α-helix	trans	-66.5	-43.8	175.4	-166.2	170.3	23.8	0	0	111.6	V558 D559 L879 T880 A881 T886 G887	V558-Q883 HydrophobicContact CG1-CB 4.12Å; D559-Q883 PolarHBondContact OD1-NE2 2.84Å; D559-Q883 PolarHBondContact OD2-NE2 3.17Å; L879-Q883 PolarHBondContact O-N 3.15Å; T880-Q883 WeakPolarHBondContact O-CB 3.25Å; T880-Q883 PolarHBondContact O-N 2.9Å; T880-Q883 VanDerWaalsContact O-N 3.09Å; A881-Q883 VanDerWaalsContact C-N 3.35Å; Q883-T886 PolarHBondContact O-N 3.37Å; Q883-G887 PolarHBondContact O-N 2.73Å
884	E	87.8	Confident	87.2	Confident	140 Å²	140	77.5 Å²	77.5	65%	0.654	41%	0.405	S	S	*	.	H	α-helix	trans	-61.2	-46.7	174.2	-70.6	176.4	176.3	0	0	111.7	T880 A881 T886 G887 S888	T880-E884 PolarHBondContact O-N 3.41Å; A881-E884 PolarHBondContact O-N 2.84Å; E884-T886 PolarHBondContact O-N 3.49Å; E884-G887 PolarHBondContact O-N 2.74Å; E884-S888 PolarHBondContact O-N 3.05Å
885	Q	87.1	Confident	87.3	Confident	99 Å²	99	78.6 Å²	78.6	46%	0.463	40%	0.404	S	S	.	.	H	α-helix	trans	-60.2	-44.5	175.3	-176	62.3	43.1	0	0	111.9	A881 G887 S888 D889	A881-Q885 PolarHBondContact O-N 2.84Å; Q885-G887 PolarHBondContact O-N 3.31Å; Q885-S888 WeakPolarHBondContact O-CB 3.29Å; Q885-S888 PolarHBondContact O-N 3.42Å; Q885-D889 PolarHBondContact NE2-OD1 2.97Å; Q885-D889 PolarHBondContact O-N 2.81Å
886	T	86.6	Confident	87.4	Confident	15 Å²	15	79.6 Å²	79.6	9%	0.092	41%	0.406	C	S	.	.	H	α-helix	trans	-60.2	-34.9	177.3	-57.5	0	0	0	0	111.7	L551 L882 Q883 E884 R890	L551-T886 HydrophobicContact CB-CG2 4.45Å; L551-T886 HydrophobicContact CD2-CG2 4.09Å; L882-T886 WeakPolarHBondContact O-CB 3.35Å; L882-T886 PolarHBondContact O-N 3.1Å; L882-T886 PolarHBondContact O-OG1 2.73Å; Q883-T886 PolarHBondContact O-N 3.37Å; E884-T886 PolarHBondContact O-N 3.49Å; T886-R890 WeakPolarHBondContact O-CB 3.21Å; T886-R890 PolarHBondContact O-N 3.38Å
887	G	86.3	Confident	87.4	Confident	43 Å²	43	78.1 Å²	78.1	44%	0.443	40%	0.401	S	S	.	.	H	α-helix	trans	-67.6	-41.4	172.3	0	0	0	0	0	113.4	Q883 E884 Q885 R890 A891	Q883-G887 PolarHBondContact O-N 2.73Å; E884-G887 PolarHBondContact O-N 2.74Å; Q885-G887 PolarHBondContact O-N 3.31Å; G887-R890 WeakPolarHBondContact O-CB 3.42Å; G887-R890 PolarHBondContact O-N 2.95Å; G887-A891 PolarHBondContact O-N 2.99Å
888	S	88.3	Confident	87.3	Confident	65 Å²	65	73.2 Å²	73.2	46%	0.455	39%	0.393	S	S	.	.	H	α-helix	trans	-63.1	-50	175.6	-169.6	0	0	0	0	112	E884 Q885 R890 A891 V892	E884-S888 PolarHBondContact O-N 3.05Å; Q885-S888 WeakPolarHBondContact O-CB 3.29Å; Q885-S888 PolarHBondContact O-N 3.42Å; S888-R890 PolarHBondContact O-N 2.98Å; S888-A891 PolarHBondContact O-N 3.42Å; S888-V892 PolarHBondContact O-N 3.14Å; S888-V892 VanDerWaalsContact O-N 3.1Å
889	D	85.9	Confident	87.4	Confident	67 Å²	67	73.3 Å²	73.3	36%	0.358	39%	0.388	S	S	.	.	H	α-helix	trans	-59.5	-37.3	179.6	-67.3	-21.4	0	0	0	111.7	Q885 V892 L893	Q885-D889 PolarHBondContact NE2-OD1 2.97Å; Q885-D889 PolarHBondContact O-N 2.81Å; D889-V892 PolarHBondContact O-N 3.11Å; D889-L893 WeakPolarHBondContact O-CG 3.42Å; D889-L893 PolarHBondContact O-N 3.48Å
890	R	87.5	Confident	87.4	Confident	113 Å²	113	76.6 Å²	76.6	43%	0.426	41%	0.405	S	S	.	.	H	α-helix	trans	-60	-47.2	173.6	-175.2	178.1	172.5	166.3	-1.9	112.1	L551 T886 G887 S888 V892 L893 E894	L551-R890 HydrophobicContact CD1-CB 3.86Å; L551-R890 HydrophobicContact CD1-CG 4.33Å; T886-R890 WeakPolarHBondContact O-CB 3.21Å; T886-R890 PolarHBondContact O-N 3.38Å; G887-R890 WeakPolarHBondContact O-CB 3.42Å; G887-R890 PolarHBondContact O-N 2.95Å; S888-R890 PolarHBondContact O-N 2.98Å; R890-V892 VanDerWaalsContact C-N 3.3Å; R890-V892 PolarHBondContact O-N 2.85Å; R890-L893 PolarHBondContact O-N 2.92Å; R890-E894 IonicContact CZ-OE1 2.76Å; R890-E894 IonicContact NE-OE1 2.73Å; R890-E894 PolarHBondContact NE-OE1 3.47Å; R890-E894 IonicContact NH2-OE1 2.92Å; R890-E894 PolarHBondContact NH2-OE1 3.33Å; R890-E894 PolarHBondContact O-N 3.45Å
891	A	87.5	Confident	87.4	Confident	54 Å²	54	77.6 Å²	77.6	45%	0.446	41%	0.407	S	S	.	.	H	α-helix	trans	-65.3	-33.3	-179.8	0	0	0	0	0	112.4	G887 S888 R895	G887-A891 PolarHBondContact O-N 2.99Å; S888-A891 PolarHBondContact O-N 3.42Å; A891-R895 PolarHBondContact O-N 3.15Å
892	V	88.4	Confident	87.4	Confident	56 Å²	56	82 Å²	82	34%	0.339	42%	0.418	S	S	.	.	H	α-helix	trans	-67.6	-46.6	173.7	176	0	0	0	0	111.3	S888 D889 R890 R895 Q896	S888-V892 PolarHBondContact O-N 3.14Å; S888-V892 VanDerWaalsContact O-N 3.1Å; D889-V892 PolarHBondContact O-N 3.11Å; R890-V892 VanDerWaalsContact C-N 3.3Å; R890-V892 PolarHBondContact O-N 2.85Å; V892-R895 PolarHBondContact O-N 3.27Å; V892-Q896 PolarHBondContact O-N 3.46Å
893	L	86.3	Confident	87.5	Confident	44 Å²	44	84.4 Å²	84.4	23%	0.23	43%	0.427	C	S	.	.	H	α-helix	trans	-68.6	-36.4	179.9	-71	179.6	0	0	0	113.3	Q547 L551 D889 R890 R895 Q896 R897	Q547-L893 HydrophobicContact CB-CD1 4.25Å; Q547-L893 HydrophobicContact CG-CD1 4.47Å; L551-L893 HydrophobicContact CD1-CD1 3.95Å; D889-L893 WeakPolarHBondContact O-CG 3.42Å; D889-L893 PolarHBondContact O-N 3.48Å; R890-L893 PolarHBondContact O-N 2.92Å; L893-R895 VanDerWaalsContact C-N 3.28Å; L893-R895 PolarHBondContact O-N 2.82Å; L893-Q896 PolarHBondContact O-N 3.36Å; L893-R897 VanDerWaalsContact O-CB 3.29Å; L893-R897 WeakPolarHBondContact O-CB 3.27Å; L893-R897 PolarHBondContact O-N 3.15Å
894	E	86.1	Confident	87.5	Confident	95 Å²	95	82.4 Å²	82.4	44%	0.444	42%	0.419	S	S	.	.	H	α-helix	trans	-64.5	-33.8	174.5	-73.4	-174.5	-164.2	0	0	111.5	R890 A898	R890-E894 IonicContact CZ-OE1 2.76Å; R890-E894 IonicContact NE-OE1 2.73Å; R890-E894 PolarHBondContact NE-OE1 3.47Å; R890-E894 IonicContact NH2-OE1 2.92Å; R890-E894 PolarHBondContact NH2-OE1 3.33Å; R890-E894 PolarHBondContact O-N 3.45Å; E894-A898 PolarHBondContact O-N 3.25Å
895	R	88.6	Confident	87.5	Confident	150 Å²	150	78.4 Å²	78.4	57%	0.566	40%	0.4	S	S	*	.	H	α-helix	trans	-68.2	-53.1	172.2	-169.6	-171.7	-61	129.3	6.7	112.7	A891 V892 L893 R897 A898 E899	A891-R895 PolarHBondContact O-N 3.15Å; V892-R895 PolarHBondContact O-N 3.27Å; L893-R895 VanDerWaalsContact C-N 3.28Å; L893-R895 PolarHBondContact O-N 2.82Å; R895-R897 PolarHBondContact O-N 2.88Å; R895-A898 WeakPolarHBondContact O-CB 3.15Å; R895-A898 PolarHBondContact O-N 3.43Å; R895-E899 WeakPolarHBondContact CG-OE1 3.28Å; R895-E899 PolarHBondContact O-N 3.37Å; R895-E899 VanDerWaalsContact O-N 3.13Å
896	Q	86.4	Confident	87.6	Confident	94 Å²	94	76.2 Å²	76.2	44%	0.439	40%	0.399	S	S	.	.	H	α-helix	trans	-57.7	-35.2	179.1	-72.5	179.1	-8.4	0	0	112.2	V892 L893 L900	V892-Q896 PolarHBondContact O-N 3.46Å; L893-Q896 PolarHBondContact O-N 3.36Å; Q896-L900 WeakPolarHBondContact O-CB 3.41Å; Q896-L900 WeakPolarHBondContact O-CG 3.28Å; Q896-L900 PolarHBondContact O-N 3.49Å
897	R	86.9	Confident	87.6	Confident	88 Å²	88	76.4 Å²	76.4	33%	0.332	40%	0.404	S	S	.	.	H	α-helix	trans	-63	-40.7	174.1	177.9	-178	168.2	-170.9	-5	112.4	V540 L893 R895 Q901	V540-R897 HydrophobicContact CG1-CG 4.33Å; L893-R897 VanDerWaalsContact O-CB 3.29Å; L893-R897 WeakPolarHBondContact O-CB 3.27Å; L893-R897 PolarHBondContact O-N 3.15Å; R895-R897 PolarHBondContact O-N 2.88Å; R897-Q901 VanDerWaalsContact O-CG 3.29Å; R897-Q901 WeakPolarHBondContact O-CG 3.25Å; R897-Q901 PolarHBondContact O-N 3.38Å; R897-Q901 VanDerWaalsContact O-N 3.08Å
898	A	87.2	Confident	87.7	Confident	54 Å²	54	76.2 Å²	76.2	45%	0.446	39%	0.39	S	S	.	.	H	α-helix	trans	-65.5	-48.4	178	0	0	0	0	0	111.1	E894 R895 L900 Q901 E902	E894-A898 PolarHBondContact O-N 3.25Å; R895-A898 WeakPolarHBondContact O-CB 3.15Å; R895-A898 PolarHBondContact O-N 3.43Å; A898-L900 VanDerWaalsContact C-N 3.33Å; A898-L900 PolarHBondContact O-N 3.36Å; A898-Q901 PolarHBondContact O-N 3.17Å; A898-E902 PolarHBondContact O-N 3.11Å
899	E	88.9	Confident	87.6	Confident	95 Å²	95	78.8 Å²	78.8	44%	0.444	40%	0.395	S	S	.	.	H	α-helix	trans	-55.3	-45	176.7	-65.7	165.1	-172.6	0	0	111.9	R895 E902 Q903	R895-E899 WeakPolarHBondContact CG-OE1 3.28Å; R895-E899 PolarHBondContact O-N 3.37Å; R895-E899 VanDerWaalsContact O-N 3.13Å; E899-E902 PolarHBondContact O-N 3.25Å; E899-Q903 WeakPolarHBondContact O-CG 3.48Å; E899-Q903 PolarHBondContact O-N 3.46Å; E899-Q903 VanDerWaalsContact O-N 3.07Å
900	L	87.8	Confident	87.6	Confident	89 Å²	89	81.3 Å²	81.3	47%	0.466	41%	0.408	S	S	.	.	H	α-helix	trans	-68	-32.3	176.7	-73.1	171.2	0	0	0	113.4	V540 Q896 A898 V904	V540-L900 HydrophobicContact CG1-CB 4.31Å; V540-L900 HydrophobicContact CG2-CB 4.45Å; Q896-L900 WeakPolarHBondContact O-CB 3.41Å; Q896-L900 WeakPolarHBondContact O-CG 3.28Å; Q896-L900 PolarHBondContact O-N 3.49Å; A898-L900 VanDerWaalsContact C-N 3.33Å; A898-L900 PolarHBondContact O-N 3.36Å; L900-V904 WeakPolarHBondContact O-CB 3.29Å; L900-V904 VanDerWaalsContact O-CG2 3.26Å; L900-V904 WeakPolarHBondContact O-CG2 3.26Å; L900-V904 PolarHBondContact O-N 2.76Å
901	Q	88.3	Confident	87.5	Confident	64 Å²	64	77.2 Å²	77.2	30%	0.299	40%	0.395	S	S	.	.	H	α-helix	trans	-71.8	-38.1	175.5	-74.6	-174.7	-48.7	0	0	111.8	V540 R897 A898 V904 E905	V540-Q901 HydrophobicContact CG1-CG 3.75Å; R897-Q901 VanDerWaalsContact O-CG 3.29Å; R897-Q901 WeakPolarHBondContact O-CG 3.25Å; R897-Q901 PolarHBondContact O-N 3.38Å; R897-Q901 VanDerWaalsContact O-N 3.08Å; A898-Q901 PolarHBondContact O-N 3.17Å; Q901-V904 PolarHBondContact O-N 2.89Å; Q901-E905 PolarHBondContact O-N 2.95Å
902	E	90	Very high	87.4	Confident	145 Å²	145	79.6 Å²	79.6	68%	0.678	39%	0.393	S	S	*	.	H	α-helix	trans	-63	-49.2	174.9	-173.5	174.4	-173.1	0	0	111.6	A898 E899 V904 E905 A906	A898-E902 PolarHBondContact O-N 3.11Å; E899-E902 PolarHBondContact O-N 3.25Å; E902-V904 VanDerWaalsContact C-N 3.33Å; E902-V904 PolarHBondContact O-N 3.36Å; E902-E905 PolarHBondContact O-N 3.28Å; E902-A906 WeakPolarHBondContact O-CB 3.34Å; E902-A906 PolarHBondContact O-N 2.75Å
903	Q	88.2	Confident	87.3	Confident	141 Å²	141	79 Å²	79	66%	0.659	39%	0.391	S	S	*	.	H	α-helix	trans	-61.4	-38	177.8	-71.3	-173.3	8.2	0	0	113.3	E899 G907	E899-Q903 WeakPolarHBondContact O-CG 3.48Å; E899-Q903 PolarHBondContact O-N 3.46Å; E899-Q903 VanDerWaalsContact O-N 3.07Å; Q903-G907 PolarHBondContact O-N 3.16Å
904	V	88.3	Confident	87.2	Confident	19 Å²	19	80.6 Å²	80.6	12%	0.115	40%	0.396	C	S	.	.	H	α-helix	trans	-65.8	-40.2	177.6	164.8	0	0	0	0	111.7	F533 M536 Q537 L900 Q901 E902 R908	F533-V904 HydrophobicContact CD1-CG1 4.36Å; F533-V904 WeakPolarHBondContact CD1-O 3.49Å; M536-V904 HydrophobicContact CB-CG2 4.27Å; Q537-V904 HydrophobicContact CB-CG1 4.03Å; L900-V904 WeakPolarHBondContact O-CB 3.29Å; L900-V904 VanDerWaalsContact O-CG2 3.26Å; L900-V904 WeakPolarHBondContact O-CG2 3.26Å; L900-V904 PolarHBondContact O-N 2.76Å; Q901-V904 PolarHBondContact O-N 2.89Å; E902-V904 VanDerWaalsContact C-N 3.33Å; E902-V904 PolarHBondContact O-N 3.36Å; V904-R908 WeakPolarHBondContact O-CB 3.36Å; V904-R908 PolarHBondContact O-N 3.28Å
905	E	87.8	Confident	87	Confident	56 Å²	56	77.5 Å²	77.5	26%	0.262	38%	0.382	S	S	.	.	H	α-helix	trans	-77	-37.3	178.7	-163.6	60.4	-137.3	0	0	111.8	Q537 Q901 E902 R908 Q909	Q537-E905 PolarHBondContact NE2-OE2 2.66Å; Q901-E905 PolarHBondContact O-N 2.95Å; E902-E905 PolarHBondContact O-N 3.28Å; E905-R908 WeakPolarHBondContact O-CB 3.27Å; E905-R908 PolarHBondContact O-N 3.43Å; E905-R908 IonicContact OE2-NH1 3.49Å; E905-Q909 WeakPolarHBondContact O-CG 3.33Å; E905-Q909 PolarHBondContact O-N 3.27Å
906	A	88.8	Confident	86.5	Confident	53 Å²	53	79.5 Å²	79.5	44%	0.438	39%	0.39	S	S	.	.	H	α-helix	trans	-60.7	-46.1	173.4	0	0	0	0	0	112.1	E902 R908 Q909 L910	E902-A906 WeakPolarHBondContact O-CB 3.34Å; E902-A906 PolarHBondContact O-N 2.75Å; A906-R908 VanDerWaalsContact C-N 3.28Å; A906-R908 PolarHBondContact O-N 2.87Å; A906-Q909 PolarHBondContact O-N 3.49Å; A906-L910 PolarHBondContact O-N 3.44Å
907	G	85.9	Confident	86	Confident	20 Å²	20	79.7 Å²	79.7	21%	0.206	39%	0.394	C	S	.	.	H	α-helix	trans	-62	-34.8	174.8	0	0	0	0	0	113.1	F533 Q903 V911	F533-G907 VanDerWaalsContact CZ-O 3.32Å; F533-G907 WeakPolarHBondContact CZ-O 3.45Å; Q903-G907 PolarHBondContact O-N 3.16Å; G907-V911 PolarHBondContact O-N 3.39Å
908	R	87.8	Confident	85.4	Confident	38 Å²	38	82 Å²	82	14%	0.143	41%	0.409	C	S	.	.	H	α-helix	trans	-68.4	-38.7	174.9	-167.9	-171.9	-164.4	169.6	10	112.4	D530 F533 V904 E905 A906 R912	D530-R908 IonicContact OD1-CZ 3.61Å; D530-R908 IonicContact OD1-NE 2.68Å; D530-R908 PolarHBondContact OD1-NE 3.29Å; D530-R908 IonicContact OD1-NH2 3.25Å; D530-R908 PolarHBondContact OD1-NH2 3.03Å; F533-R908 HydrophobicContact CB-CB 4.33Å; F533-R908 HydrophobicContact CB-CG 4.2Å; F533-R908 HydrophobicContact CD1-CB 4.19Å; F533-R908 HydrophobicContact CD2-CB 4.12Å; F533-R908 HydrophobicContact CD2-CG 4.19Å; F533-R908 HydrophobicContact CG-CB 3.97Å; F533-R908 HydrophobicContact CG-CG 4.21Å; V904-R908 WeakPolarHBondContact O-CB 3.36Å; V904-R908 PolarHBondContact O-N 3.28Å; E905-R908 WeakPolarHBondContact O-CB 3.27Å; E905-R908 PolarHBondContact O-N 3.43Å; E905-R908 IonicContact OE2-NH1 3.49Å; A906-R908 VanDerWaalsContact C-N 3.28Å; A906-R908 PolarHBondContact O-N 2.87Å; R908-R912 WeakPolarHBondContact O-CG 3.38Å; R908-R912 PolarHBondContact O-N 2.82Å
909	Q	86.6	Confident	84.7	Confident	119 Å²	119	82.7 Å²	82.7	56%	0.556	40%	0.404	S	S	*	.	H	α-helix	trans	-65.5	-43.5	175.7	-71	175.4	25.4	0	0	111.2	E905 A906 V911 R912 S913	E905-Q909 WeakPolarHBondContact O-CG 3.33Å; E905-Q909 PolarHBondContact O-N 3.27Å; A906-Q909 PolarHBondContact O-N 3.49Å; Q909-V911 PolarHBondContact O-N 2.77Å; Q909-R912 WeakPolarHBondContact O-CA 3.33Å; Q909-R912 WeakPolarHBondContact O-CB 3.38Å; Q909-R912 PolarHBondContact O-N 2.83Å; Q909-S913 PolarHBondContact O-N 3.5Å
910	L	87.3	Confident	83.6	Confident	121 Å²	121	86.3 Å²	86.3	63%	0.634	42%	0.421	S	S	*	.	H	α-helix	trans	-58.2	-42.3	177.6	-176.2	66.4	0	0	0	113	A906 R912 S913 F914	A906-L910 PolarHBondContact O-N 3.44Å; L910-R912 VanDerWaalsContact C-N 3.26Å; L910-R912 PolarHBondContact O-N 3.05Å; L910-S913 PolarHBondContact O-N 2.96Å; L910-S913 PolarHBondContact O-OG 3.16Å; L910-F914 WeakPolarHBondContact O-CB 3.33Å; L910-F914 PolarHBondContact O-N 2.87Å; L910-F914 VanDerWaalsContact O-N 3.08Å
911	V	85.4	Confident	82.6	Confident	26 Å²	26	90.4 Å²	90.4	16%	0.158	44%	0.438	C	S	.	.	H	α-helix	trans	-68.6	-27.5	176.1	173.4	0	0	0	0	112	F525 M529 F533 G907 Q909 L915	F525-V911 HydrophobicContact CE1-CG1 4.28Å; M529-V911 HydrophobicContact CB-CG1 3.91Å; M529-V911 HydrophobicContact CE-CG2 3.97Å; M529-V911 HydrophobicContact CG-CG1 4.2Å; F533-V911 HydrophobicContact CE2-CB 4.35Å; F533-V911 HydrophobicContact CE2-CG2 3.91Å; F533-V911 HydrophobicContact CZ-CG2 4.36Å; G907-V911 PolarHBondContact O-N 3.39Å; Q909-V911 PolarHBondContact O-N 2.77Å; V911-L915 HydrophobicContact CG1-CD1 3.98Å; V911-L915 WeakPolarHBondContact O-CB 3.46Å; V911-L915 WeakPolarHBondContact O-CD1 3.47Å; V911-L915 WeakPolarHBondContact O-CG 3.29Å; V911-L915 PolarHBondContact O-N 3.13Å; V911-L915 VanDerWaalsContact O-N 3.13Å
912	R	84.8	Confident	81.4	Confident	104 Å²	104	92.4 Å²	92.4	39%	0.392	45%	0.451	S	S	.	.	H	α-helix	trans	-79.7	-27.6	178.4	-74.6	171.9	170.4	-176.9	-5.2	114.1	D530 R908 Q909 L910	D530-R912 IonicContact OD1-CZ 3.62Å; D530-R912 IonicContact OD1-NH2 3.6Å; D530-R912 PolarHBondContact OD1-NH2 2.67Å; D530-R912 IonicContact OD2-CZ 2.74Å; D530-R912 IonicContact OD2-NE 2.62Å; D530-R912 PolarHBondContact OD2-NE 3.09Å; D530-R912 IonicContact OD2-NH2 3.92Å; D530-R912 PolarHBondContact OD2-NH2 2.74Å; R908-R912 WeakPolarHBondContact O-CG 3.38Å; R908-R912 PolarHBondContact O-N 2.82Å; Q909-R912 WeakPolarHBondContact O-CA 3.33Å; Q909-R912 WeakPolarHBondContact O-CB 3.38Å; Q909-R912 PolarHBondContact O-N 2.83Å; L910-R912 VanDerWaalsContact C-N 3.26Å; L910-R912 PolarHBondContact O-N 3.05Å
913	S	85.1	Confident	80.2	Confident	43 Å²	43	90.8 Å²	90.8	30%	0.301	45%	0.451	S	S	.	.	H	α-helix	trans	-74.5	-48.3	167.4	52.2	0	0	0	0	110.7	Q909 L910 L915 R916 D917	Q909-S913 PolarHBondContact O-N 3.5Å; L910-S913 PolarHBondContact O-N 2.96Å; L910-S913 PolarHBondContact O-OG 3.16Å; S913-L915 VanDerWaalsContact C-N 3.3Å; S913-L915 PolarHBondContact O-N 3.47Å; S913-R916 PolarHBondContact O-N 3.34Å; S913-D917 WeakPolarHBondContact CA-OD2 3.39Å; S913-D917 WeakPolarHBondContact CB-OD2 3.5Å; S913-D917 WeakPolarHBondContact O-CB 3.5Å; S913-D917 PolarHBondContact O-N 3.21Å
914	F	84.1	Confident	78.9	Confident	79 Å²	79	89.3 Å²	89.3	35%	0.346	45%	0.453	S	S	.	.	I	π-helix	trans	-50.5	-47.7	176.3	176	-97.3	0	0	0	112.8	F525 L910 R916 E918 L919	F525-F914 HydrophobicContact CE1-CD1 4.46Å; F525-F914 HydrophobicContact CE1-CE1 4.42Å; L910-F914 WeakPolarHBondContact O-CB 3.33Å; L910-F914 PolarHBondContact O-N 2.87Å; L910-F914 VanDerWaalsContact O-N 3.08Å; F914-R916 PolarHBondContact O-N 3.2Å; F914-E918 HydrophobicContact CD2-CB 4.16Å; F914-E918 HydrophobicContact CD2-CG 4.37Å; F914-E918 WeakPolarHBondContact CD2-OE2 3.48Å; F914-E918 HydrophobicContact CE2-CB 4.3Å; F914-E918 WeakPolarHBondContact CE2-OE2 3.46Å; F914-E918 PolarHBondContact O-N 3.36Å; F914-L919 HydrophobicContact CE1-CD1 4.14Å
915	L	82	Confident	77.7	Confident	29 Å²	29	94.3 Å²	94.3	15%	0.152	48%	0.484	C	S	.	.	I	π-helix	trans	-66.7	-13	179.2	-82.6	170.6	0	0	0	115.4	Q522 F525 V911 S913 L919	Q522-L915 HydrophobicContact CG-CD2 3.82Å; Q522-L915 PolarHBondContact NE2-O 2.93Å; F525-L915 HydrophobicContact CD1-CD2 4.16Å; V911-L915 HydrophobicContact CG1-CD1 3.98Å; V911-L915 WeakPolarHBondContact O-CB 3.46Å; V911-L915 WeakPolarHBondContact O-CD1 3.47Å; V911-L915 WeakPolarHBondContact O-CG 3.29Å; V911-L915 PolarHBondContact O-N 3.13Å; V911-L915 VanDerWaalsContact O-N 3.13Å; S913-L915 VanDerWaalsContact C-N 3.3Å; S913-L915 PolarHBondContact O-N 3.47Å; L915-L919 HydrophobicContact CD2-CD1 4.35Å
916	R	78.5	Confident	76.2	Confident	192 Å²	192	95 Å²	95	73%	0.725	51%	0.506	S	S	*	.	I	π-helix	trans	-109.9	-45.1	-175.8	-176.7	-168.1	-60.6	-175.4	1.1	112.4	S913 F914	S913-R916 PolarHBondContact O-N 3.34Å; F914-R916 PolarHBondContact O-N 3.2Å
917	D	76.5	Confident	74.7	Confident	98 Å²	98	100 Å²	100	52%	0.524	53%	0.525	S	S	.	.	I	π-helix	trans	-102.8	-30.6	-160.6	-52.6	-41.9	0	0	0	112	S913	S913-D917 WeakPolarHBondContact CA-OD2 3.39Å; S913-D917 WeakPolarHBondContact CB-OD2 3.5Å; S913-D917 WeakPolarHBondContact O-CB 3.5Å; S913-D917 PolarHBondContact O-N 3.21Å
918	E	74.9	Confident	73.3	Confident	136 Å²	136	104.5 Å²	104.5	64%	0.636	55%	0.548	S	S	*	.	I	π-helix	trans	-95.5	-22.9	179.8	-67.4	177.8	-129.4	0	0	113.4	F914 Q920	F914-E918 HydrophobicContact CD2-CB 4.16Å; F914-E918 HydrophobicContact CD2-CG 4.37Å; F914-E918 WeakPolarHBondContact CD2-OE2 3.48Å; F914-E918 HydrophobicContact CE2-CB 4.3Å; F914-E918 WeakPolarHBondContact CE2-OE2 3.46Å; F914-E918 PolarHBondContact O-N 3.36Å; E918-Q920 PolarHBondContact O-N 3.41Å
919	L	71.3	Confident	71.8	Confident	69 Å²	69	108 Å²	108	36%	0.361	58%	0.575	S	S	.	*			trans	-100.8	76.7	-167.8	-134.1	163.3	0	0	0	112.1	Q522 F914 L915	Q522-L919 HydrophobicContact CG-CD1 4.09Å; F914-L919 HydrophobicContact CE1-CD1 4.14Å; L915-L919 HydrophobicContact CD2-CD1 4.35Å
920	Q	65.6	Low	70.5	Confident	171 Å²	171	111.5 Å²	111.5	80%	0.799	59%	0.592	S	S	*	*			trans	-79.3	154.6	-173.6	-59.4	-174.8	4.7	0	0	114	E918	E918-Q920 PolarHBondContact O-N 3.41Å
921	Q	66.5	Low	69.2	Low	176 Å²	176	117 Å²	117	82%	0.822	60%	0.604	S	S	*	*			trans	-88.9	145.3	172.7	-68.2	-176.8	-14.7	0	0	111.4	V923	Q921-V923 PolarHBondContact O-N 3.34Å
922	D	64.8	Low	68.2	Low	105 Å²	105	122.7 Å²	122.7	56%	0.561	62%	0.623	S	S	*	*			trans	-76.9	108	177	179.3	-25.6	0	0	0	110.3	K511	K511-D922 WeakPolarHBondContact CE-OD2 3.34Å; K511-D922 IonicContact NZ-OD1 3.53Å; K511-D922 PolarHBondContact NZ-OD1 3.31Å; K511-D922 IonicContact NZ-OD2 2.66Å; K511-D922 PolarHBondContact NZ-OD2 3.31Å
923	V	64.3	Low	67	Low	112 Å²	112	126.3 Å²	126.3	68%	0.679	64%	0.644	S	S	*	*			trans	-92.9	127.3	-177.7	-176.2	0	0	0	0	110.1	Q921 T925	Q921-V923 PolarHBondContact O-N 3.34Å; V923-T925 PolarHBondContact O-N 2.67Å
924	P	60.3	Low	66.1	Low	109 Å²	109	127.2 Å²	127.2	71%	0.708	64%	0.643	S	S	*	*			trans	-64.3	119.4	-175.4	25	-34.4	0	0	0	112.7	G926	P924-G926 PolarHBondContact O-N 3.14Å; P924-G926 VanDerWaalsContact O-N 3.1Å
925	T	62.4	Low	65.1	Low	125 Å²	125	130.3 Å²	130.3	77%	0.767	67%	0.668	S	S	*	*			trans	-76.9	10.6	-173.2	54.2	0	0	0	0	115.5	V923 L927	V923-T925 PolarHBondContact O-N 2.67Å; T925-L927 PolarHBondContact O-N 3.3Å
926	G	57.8	Low	64.4	Low	69 Å²	69	134.5 Å²	134.5	71%	0.711	68%	0.682	S	S	*	*	S	Bend	trans	72.6	-12.4	174.3	0	0	0	0	0	117.2	P924 T928	P924-G926 PolarHBondContact O-N 3.14Å; P924-G926 VanDerWaalsContact O-N 3.1Å; G926-T928 VanDerWaalsContact C-N 3.32Å; G926-T928 PolarHBondContact O-N 3.23Å
927	L	56.9	Low	63.4	Low	160 Å²	160	127.7 Å²	127.7	84%	0.838	66%	0.663	S	S	*	*			trans	-80.5	69.9	-177	-65.9	175.3	0	0	0	113.1	T925	T925-L927 PolarHBondContact O-N 3.3Å
928	T	57.2	Low	62.8	Low	113 Å²	113	133 Å²	133	69%	0.693	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-82.7	138.3	170.7	-52.5	0	0	0	0	110.5	G926	G926-T928 VanDerWaalsContact C-N 3.32Å; G926-T928 PolarHBondContact O-N 3.23Å
929	P	55.1	Low	61.9	Low	111 Å²	111	132.8 Å²	132.8	72%	0.721	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-58.8	148.7	178.8	-25.4	35.1	0	0	0	113.9
930	Q	59.9	Low	61.4	Low	193 Å²	193	134.7 Å²	134.7	90%	0.902	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-67.6	148.8	176.1	-73.1	-174.8	-15.6	0	0	112.1	R932	Q930-R932 PolarHBondContact O-N 3.48Å
931	R	59.4	Low	60.8	Low	237 Å²	237	135 Å²	135	89%	0.894	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-68.6	123	-179.8	-176.4	-178.6	-176.9	-177.2	1.3	110.9
932	R	64	Low	60.2	Low	146 Å²	146	136.3 Å²	136.3	55%	0.551	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-80.1	141	173.4	-168	174.1	179.6	-160.1	-5.6	110.7	E496 D500 Q930 F934	E496-R932 IonicContact OE2-NH2 3.69Å; D500-R932 IonicContact OD2-NH1 3.53Å; Q930-R932 PolarHBondContact O-N 3.48Å; R932-F934 HydrophobicContact CB-CE2 4.4Å; R932-F934 HydrophobicContact CG-CE2 4.47Å; R932-F934 HydrophobicContact CG-CZ 4.39Å
933	E	60.8	Low	59.6	Low	179 Å²	179	134.8 Å²	134.8	84%	0.836	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-100.9	147	171.9	-62.1	-164.8	150.4	0	0	110.7
934	F	66.6	Low	59.2	Low	62 Å²	62	132.7 Å²	132.7	27%	0.272	69%	0.694	S	S	.	*			trans	-124	140.3	-177.2	-64.8	-90.7	0	0	0	110.3	E496 R932	E496-F934 HydrophobicContact CB-CE1 3.97Å; R932-F934 HydrophobicContact CB-CE2 4.4Å; R932-F934 HydrophobicContact CG-CE2 4.47Å; R932-F934 HydrophobicContact CG-CZ 4.39Å
935	V	61.7	Low	59	Low	144 Å²	144	129.8 Å²	129.8	87%	0.873	68%	0.676	S	S	*	*			trans	-113.5	137.3	-175.3	-177.4	0	0	0	0	109.8
936	Y	67.1	Low	58.6	Low	117 Å²	117	129.9 Å²	129.9	46%	0.459	66%	0.663	S	S	.	*			trans	-151.2	156	-175.1	56.8	-92.5	0	0	0	114	L490 R938	L490-Y936 HydrophobicContact CD2-CD2 3.72Å; L490-Y936 HydrophobicContact CD2-CG 3.99Å; Y936-R938 HydrophobicContact CE2-CG 4.47Å
937	P	58.8	Low	58.6	Low	49 Å²	49	130.5 Å²	130.5	32%	0.318	66%	0.656	S	S	.	*			trans	-67.6	156.8	-179.4	-19	32.7	0	0	0	114.2	Q489	Q489-P937 HydrophobicContact CB-CG 4.35Å
938	R	62.8	Low	58.5	Low	210 Å²	210	128.6 Å²	128.6	79%	0.792	64%	0.643	S	S	*	*			trans	-133.7	7.1	-174.7	-63.9	-171.3	177.9	-172.5	-0.5	116.4	Y936	Y936-R938 HydrophobicContact CE2-CG 4.47Å
939	V	57.4	Low	58.5	Low	132 Å²	132	125.7 Å²	125.7	80%	0.8	62%	0.623	S	S	*	*			trans	-136.3	135.5	-178.1	-175.4	0	0	0	0	109.9
940	L	59.1	Low	58.4	Low	109 Å²	109	124.7 Å²	124.7	57%	0.571	61%	0.608	S	S	*	*			trans	-127.3	148.8	-178.9	-64.4	172.5	0	0	0	110.6	L483 A486	L483-L940 HydrophobicContact CD2-CD1 4.49Å; L483-L940 HydrophobicContact CD2-CD2 4.16Å; A486-L940 HydrophobicContact CB-CD2 3.75Å
941	K	53.6	Low	58.1	Low	178 Å²	178	121.3 Å²	121.3	77%	0.774	60%	0.596	S	S	*	*			trans	-89.9	165	173.1	-69.8	-177.9	178.1	178.4	0	111.1
942	K	54.5	Low	57.9	Low	202 Å²	202	115.3 Å²	115.3	88%	0.878	58%	0.577	S	S	*	*			trans	-129	144.8	-175	-163.4	179.3	-177.4	-174.1	0	110.9
943	S	52.4	Low	57.2	Low	73 Å²	73	111.8 Å²	111.8	51%	0.51	57%	0.567	S	S	.	*			trans	-93.9	163.3	-177.5	45.8	0	0	0	0	114.1
944	G	54.8	Low	56.7	Low	69 Å²	69	107.4 Å²	107.4	71%	0.711	56%	0.555	S	S	*	*			trans	-86.4	-168.9	171.8	0	0	0	0	0	114
945	S	57.1	Low	55.8	Low	47 Å²	47	112 Å²	112	33%	0.329	58%	0.578	S	S	.	*			trans	-102.3	153.7	-169.2	74.3	0	0	0	0	115	S947 E948	S945-S947 PolarHBondContact O-N 3.37Å; S945-S947 PolarHBondContact OG-OG 3.15Å; S945-E948 WeakPolarHBondContact CA-OE2 3.49Å; S945-E948 VanDerWaalsContact CB-OE2 3.28Å; S945-E948 WeakPolarHBondContact CB-OE2 3.42Å; S945-E948 PolarHBondContact N-OE2 3.22Å; S945-E948 PolarHBondContact O-N 3.5Å; S945-E948 VanDerWaalsContact O-N 3.1Å; S945-E948 VanDerWaalsContact OG-CD 3.3Å; S945-E948 WeakPolarHBondContact OG-CG 3.43Å; S945-E948 PolarHBondContact OG-OE2 3.29Å
946	R	54.7	Low	55.4	Low	128 Å²	128	109.9 Å²	109.9	48%	0.483	57%	0.565	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.7	-25	-178.8	-171.8	166.9	173.2	147.3	-5	113.3	E469 I472	E469-R946 IonicContact OE1-CZ 3.62Å; E469-R946 IonicContact OE1-NH1 2.72Å; E469-R946 PolarHBondContact OE1-NH1 2.9Å; E469-R946 IonicContact OE1-NH2 2.9Å; E469-R946 PolarHBondContact OE1-NH2 3.48Å; E469-R946 IonicContact OE2-NH1 3.62Å; E469-R946 PolarHBondContact OE2-NH1 2.8Å; E469-R946 IonicContact OE2-NH2 3.37Å; I472-R946 VanDerWaalsContact CD1-NH2 3.3Å
947	S	56.1	Low	54.3	Low	81 Å²	81	109.7 Å²	109.7	57%	0.566	57%	0.572	S	S	*	*	H	α-helix	trans	-66	-40.8	172.9	24.9	0	0	0	0	113.2	S945 L949 H950	S945-S947 PolarHBondContact O-N 3.37Å; S945-S947 PolarHBondContact OG-OG 3.15Å; S947-L949 PolarHBondContact O-N 2.64Å; S947-H950 PolarHBondContact O-N 2.71Å
948	E	56.2	Low	53.6	Low	121 Å²	121	115.5 Å²	115.5	57%	0.565	60%	0.595	S	S	*	*	H	α-helix	trans	-73.1	-8.5	-177.3	-64.2	160.9	117	0	0	113.1	S945	S945-E948 WeakPolarHBondContact CA-OE2 3.49Å; S945-E948 VanDerWaalsContact CB-OE2 3.28Å; S945-E948 WeakPolarHBondContact CB-OE2 3.42Å; S945-E948 PolarHBondContact N-OE2 3.22Å; S945-E948 PolarHBondContact O-N 3.5Å; S945-E948 VanDerWaalsContact O-N 3.1Å; S945-E948 VanDerWaalsContact OG-CD 3.3Å; S945-E948 WeakPolarHBondContact OG-CG 3.43Å; S945-E948 PolarHBondContact OG-OE2 3.29Å
949	L	55.6	Low	52.6	Low	51 Å²	51	111.6 Å²	111.6	27%	0.267	59%	0.594	S	S	.	*	H	α-helix	trans	-94.9	-30.5	176.6	-66.2	175.3	0	0	0	112.8	E475 S947 K952	E475-L949 HydrophobicContact CB-CD2 4.2Å; E475-L949 HydrophobicContact CG-CD2 4.42Å; E475-L949 WeakPolarHBondContact OE2-CD2 3.06Å; S947-L949 PolarHBondContact O-N 2.64Å; L949-K952 HydrophobicContact CD2-CD 4.46Å; L949-K952 PolarHBondContact O-N 2.97Å
950	H	53.9	Low	51.5	Low	90 Å²	90	110.1 Å²	110.1	42%	0.417	59%	0.59	S	S	.	*	H	α-helix	trans	-67.6	-41	176.3	-87.3	-73.3	0	0	0	112.2	S947 K952 Q953 S954	S947-H950 PolarHBondContact O-N 2.71Å; H950-K952 PolarHBondContact O-N 2.58Å; H950-Q953 WeakPolarHBondContact O-CB 3.46Å; H950-Q953 PolarHBondContact O-N 3.21Å; H950-S954 PolarHBondContact O-N 3.37Å
951	D	53.8	Low	50.3	Low	122 Å²	122	109.6 Å²	109.6	65%	0.652	60%	0.595	S	S	*	*	H	α-helix	trans	-62.1	-26.4	178.4	-76.2	-21.5	0	0	0	113.1
952	K	54.1	Low	49.3	Very low	112 Å²	112	109 Å²	109	49%	0.487	60%	0.6	S	S	.	*	H	α-helix	trans	-68.9	-37.9	172.5	-68.6	-174.8	-178.5	-179.5	0	112.3	E475 L949 H950 Q955	E475-K952 IonicContact OE1-NZ 3.85Å; E475-K952 IonicContact OE2-NZ 3.77Å; E475-K952 PolarHBondContact OE2-NZ 3.2Å; L949-K952 HydrophobicContact CD2-CD 4.46Å; L949-K952 PolarHBondContact O-N 2.97Å; H950-K952 PolarHBondContact O-N 2.58Å; K952-Q955 PolarHBondContact O-N 3.1Å
953	Q	50.5	Low	48.2	Very low	72 Å²	72	106.2 Å²	106.2	34%	0.336	60%	0.599	S	S	.	*	H	α-helix	trans	-67	-45.5	-176	-168.1	172	-0.5	0	0	110.5	F471 H950 Q955 V956	F471-Q953 HydrophobicContact CE1-CB 4.32Å; F471-Q953 VanDerWaalsContact CE1-CD 3.4Å; F471-Q953 HydrophobicContact CE1-CG 3.84Å; F471-Q953 HydrophobicContact CZ-CG 4.23Å; H950-Q953 WeakPolarHBondContact O-CB 3.46Å; H950-Q953 PolarHBondContact O-N 3.21Å; Q953-Q955 PolarHBondContact O-N 3.01Å; Q953-Q955 VanDerWaalsContact O-N 3.07Å; Q953-V956 PolarHBondContact O-N 3.44Å
954	S	51	Low	47.1	Very low	86 Å²	86	109.3 Å²	109.3	60%	0.601	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	-6.9	178.7	-57.8	0	0	0	0	115.4	H950	H950-S954 PolarHBondContact O-N 3.37Å
955	Q	47.3	Very low	45.9	Very low	159 Å²	159	110.6 Å²	110.6	74%	0.743	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	-13.6	171.1	-71	-170.5	-2.8	0	0	113.8	K952 Q953	K952-Q955 PolarHBondContact O-N 3.1Å; Q953-Q955 PolarHBondContact O-N 3.01Å; Q953-Q955 VanDerWaalsContact O-N 3.07Å
956	V	51.8	Low	44.5	Very low	99 Å²	99	118.2 Å²	118.2	60%	0.6	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	-32.9	-178.5	-179.8	0	0	0	0	111.9	Q953 Q958	Q953-V956 PolarHBondContact O-N 3.44Å; V956-Q958 PolarHBondContact O-N 3.03Å
957	D	44.7	Very low	43.1	Very low	114 Å²	114	120.3 Å²	120.3	61%	0.61	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	-2.9	-173.8	-67.1	-35.5	0	0	0	115.7
958	Q	43.9	Very low	41.9	Very low	171 Å²	171	120.6 Å²	120.6	80%	0.799	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99	-0.5	-179.2	-71.2	-165	-6.4	0	0	115.5	V956	V956-Q958 PolarHBondContact O-N 3.03Å
959	V	42.5	Very low	40.6	Very low	127 Å²	127	121.4 Å²	121.4	77%	0.77	66%	0.658	S	S	*	*	S	Bend	trans	-113.4	-14.7	-168.4	-174.3	0	0	0	0	114.3
960	S	34.9	Very low	40.1	Very low	102 Å²	102	123.8 Å²	123.8	71%	0.713	68%	0.677	S	S	*	*	S	Bend	trans	-109.3	12.7	-168.6	45	0	0	0	0	115.9
961	S	32.3	Very low	39.1	Very low	97 Å²	97	126.1 Å²	126.1	68%	0.678	70%	0.697	S	S	*	*	S	Bend	trans	-116	47.8	-175.3	58.8	0	0	0	0	115.3
962	L	33.5	Very low	37.9	Very low	167 Å²	167	125.7 Å²	125.7	87%	0.874	70%	0.702	S	S	*	*	S	Bend	trans	-161	48	169.5	-116	173.2	0	0	0	118.5
963	T	30.5	Very low	36.7	Very low	142 Å²	142	127.3 Å²	127.3	87%	0.871	72%	0.715	S	S	*	*			trans	-153.2	113.6	154.8	31.8	0	0	0	0	112
964	V	30.3	Very low	35.8	Very low	139 Å²	139	132 Å²	132	84%	0.842	74%	0.737	S	S	*	*			trans	-147.9	159.4	179.4	174.9	0	0	0	0	109.3
965	S	28.7	Very low	34.8	Very low	96 Å²	96	134 Å²	134	67%	0.671	74%	0.741	S	S	*	*			trans	76.6	138.7	-179.4	79.1	0	0	0	0	114.9
966	W	27.8	Very low	33.9	Very low	206 Å²	206	131.3 Å²	131.3	78%	0.78	74%	0.74	S	S	*	*			cis	-133	166.1	1.4	-55.8	63	0	0	0	107.9
967	F	26.5	Very low	33	Very low	172 Å²	172	134.2 Å²	134.2	75%	0.754	75%	0.751	S	S	*	*			cis	-125.7	176.6	8.8	-74.4	-91	0	0	0	108.6
968	S	29.6	Very low	32.3	Very low	87 Å²	87	136.9 Å²	136.9	61%	0.608	76%	0.76	S	S	*	*			cis	71.8	125.5	35.2	-78.3	0	0	0	0	114.6
969	D	28.7	Very low	31.7	Very low	138 Å²	138	136.1 Å²	136.1	74%	0.738	76%	0.762	S	S	*	*			cis	-161.9	176.4	9.4	-94.2	-14.9	0	0	0	109.6
970	P	45.8	Very low	31.2	Very low	102 Å²	102	137 Å²	137	66%	0.662	76%	0.762	S	S	*	*			cis	-143.7	172	-39.9	41.2	-24.6	0	0	0	115.7
971	V	32.1	Very low	30.6	Very low	138 Å²	138	141.2 Å²	141.2	84%	0.836	77%	0.768	S	S	*	*			trans	68.4	142.6	146.9	161.8	0	0	0	0	118.5
972	C	28.4	Very low	30.3	Very low	113 Å²	113	141.2 Å²	141.2	76%	0.764	77%	0.768	S	S	*	*			cis	-142.4	-178.9	9.5	-148.2	0	0	0	0	113.8
973	L	29.9	Very low	29.9	Very low	147 Å²	147	138 Å²	138	77%	0.77	76%	0.76	S	S	*	*			trans	-79.3	179.3	170.3	-61	139.8	0	0	0	111
974	Q	30.8	Very low	29.6	Very low	170 Å²	170	136.7 Å²	136.7	79%	0.794	75%	0.754	S	S	*	*			cis	-158.2	177.9	22.6	-158.5	163.3	-11.5	0	0	113.4
975	D	30.1	Very low	29.2	Very low	127 Å²	127	134.8 Å²	134.8	68%	0.679	75%	0.747	S	S	*	*			trans	-72.6	172.6	-160.9	-47	-81.3	0	0	0	120.6
976	S	29.3	Very low	29.2	Very low	104 Å²	104	138.7 Å²	138.7	73%	0.727	76%	0.755	S	S	*	*			trans	89.6	111.2	146.4	-65.1	0	0	0	0	121.7
977	L	32.5	Very low	29.2	Very low	160 Å²	160	133.5 Å²	133.5	84%	0.838	75%	0.75	S	S	*	*				31.9	135.9	106.5	-55.8	175.1	0	0	0	117.4
978	E	30.9	Very low	29.4	Very low	169 Å²	169	133.5 Å²	133.5	79%	0.79	76%	0.757	S	S	*	*			cis	-143.7	153.6	23.9	-65.7	-179.5	137.8	0	0	112.8
979	D	30.8	Very low	29.2	Very low	156 Å²	156	133.6 Å²	133.6	83%	0.834	76%	0.763	S	S	*	*			trans	-81.1	160.4	158.2	-40.4	-62.9	0	0	0	109.5
980	D	31.7	Very low	29.2	Very low	146 Å²	146	131.8 Å²	131.8	78%	0.781	77%	0.768	S	S	*	*			cis	-156.5	160.7	-2.7	-147.4	-24.9	0	0	0	109
981	F	23.2	Very low	28.4	Very low	190 Å²	190	135.6 Å²	135.6	83%	0.833	78%	0.777	S	S	*	*			trans	-147.1	116.6	165	-125.1	-75.7	0	0	0	114
982	S	26.2	Very low	29.2	Very low	97 Å²	97	134.2 Å²	134.2	68%	0.678	77%	0.771	S	S	*	*			trans	81.5	130.1	156.8	82	0	0	0	0	120.7
983	S	24.1	Very low	30.2	Very low	100 Å²	100	133.6 Å²	133.6	70%	0.699	77%	0.765	S	S	*	*				106.7	155	121	82.3	0	0	0	0	120.6
984	C	23.7	Very low	30.2	Very low	113 Å²	113	135.9 Å²	135.9	76%	0.764	77%	0.769	S	S	*	*			trans	84.6	141.6	151.4	-63.5	0	0	0	0	121
985	S	23.2	Very low	30.2	Very low	99 Å²	99	132.4 Å²	132.4	69%	0.692	76%	0.759	S	S	*	*			trans	59.9	128.8	166.3	-67.3	0	0	0	0	118
986	E	27.7	Very low	30.2	Very low	178 Å²	178	132.8 Å²	132.8	83%	0.832	76%	0.762	S	S	*	*				62.8	134.1	57.8	-62.5	-172.9	135.5	0	0	111.7
987	S	29	Very low	30.3	Very low	97 Å²	97	135.2 Å²	135.2	68%	0.678	76%	0.761	S	S	*	*			cis	-167.5	159.3	26.2	30.3	0	0	0	0	111.8
988	L	28.8	Very low	30.3	Very low	172 Å²	172	133 Å²	133	90%	0.901	75%	0.75	S	S	*	*			trans	56.8	150.7	147.5	-59.5	162.6	0	0	0	118
989	A	27	Very low	30.3	Very low	89 Å²	89	131.6 Å²	131.6	74%	0.736	75%	0.747	S	S	*	*			cis	-164.8	-173.3	28.2	0	0	0	0	0	112.5
990	A	28.1	Very low	30.3	Very low	101 Å²	101	129.6 Å²	129.6	84%	0.835	74%	0.74	S	S	*	*			trans	80.2	98.7	151.7	0	0	0	0	0	121.1
991	E	27.9	Very low	30.1	Very low	182 Å²	182	130.7 Å²	130.7	85%	0.85	74%	0.739	S	S	*	*			trans	-64.2	-166.7	146.3	-58.9	-176.1	138.5	0	0	113.1
992	P	50.5	Low	30.4	Very low	109 Å²	109	127.1 Å²	127.1	71%	0.708	73%	0.728	S	S	*	*			cis	-128.8	-132.2	-41	29.5	-5.6	0	0	0	108.9
993	P	48.7	Very low	30.6	Very low	100 Å²	100	130 Å²	130	65%	0.649	73%	0.731	S	S	*	*			cis	-136.6	-179	-24.7	36.5	-16.2	0	0	0	117.6
994	F	29.8	Very low	30.8	Very low	194 Å²	194	129.3 Å²	129.3	85%	0.851	73%	0.726	S	S	*	*			trans	70.1	146.1	147.2	-101.9	-136.4	0	0	0	118.9
995	V	30.5	Very low	31	Very low	98 Å²	98	133.9 Å²	133.9	59%	0.594	73%	0.733	S	S	*	*			cis	-153.6	-179.8	-9	-109.4	0	0	0	0	107.6
996	D	30.6	Very low	31.3	Very low	135 Å²	135	140.9 Å²	140.9	72%	0.722	75%	0.745	S	S	*	*			cis	-126.8	178.4	4.1	-72.4	-73.9	0	0	0	108.9
997	E	30.8	Very low	31.3	Very low	155 Å²	155	139.9 Å²	139.9	72%	0.724	74%	0.744	S	S	*	*			cis	91.1	142	15.4	-133.4	-173.4	-104.5	0	0	119.2
998	N	32.3	Very low	32.2	Very low	113 Å²	113	140.3 Å²	140.3	60%	0.604	74%	0.744	S	S	*	*			trans	69.8	141	164.8	-61.9	-44.4	0	0	0	120.2
999	L	32.3	Very low	32.1	Very low	139 Å²	139	140.1 Å²	140.1	73%	0.728	74%	0.737	S	S	*	*			cis	-162.7	152.8	-3.5	-108.1	164.1	0	0	0	111.5
1000	V	29.4	Very low	32.5	Very low	114 Å²	114	142.3 Å²	142.3	69%	0.691	73%	0.73	S	S	*	*			trans	68.9	142.9	143.6	153.6	0	0	0	0	120
1001	F	28.2	Very low	32.6	Very low	170 Å²	170	145.3 Å²	145.3	75%	0.746	72%	0.724	S	S	*	*			cis	-147.7	165.3	-0.3	-127.5	-28.1	0	0	0	113
1002	N	29.2	Very low	32.6	Very low	114 Å²	114	146.2 Å²	146.2	61%	0.61	73%	0.728	S	S	*	*			trans	-7	154.4	147.7	-70.1	31.8	0	0	0	119.4
1003	E	30	Very low	31.6	Very low	157 Å²	157	151 Å²	151	73%	0.734	74%	0.738	S	S	*	*			cis	-173.4	177.5	-1.2	-110	-166.8	79.4	0	0	108.3
1004	S	29.1	Very low	30.8	Very low	87 Å²	87	156.1 Å²	156.1	61%	0.608	75%	0.75	S	S	*	*			cis	-164.3	173.5	-20.4	51.6	0	0	0	0	110.1
1005	K	28.2	Very low	30.8	Very low	209 Å²	209	150.6 Å²	150.6	91%	0.909	75%	0.748	S	S	*	*			trans	-168	140.2	153.1	-111.3	157.7	-173.5	171.4	0	111.8
1006	R	29.6	Very low	30.6	Very low	246 Å²	246	151.1 Å²	151.1	93%	0.928	76%	0.756	S	S	*	*			trans	-88.4	145.3	169.7	-79.3	-173.1	175.9	-171.4	-0	111.8
1007	L	28	Very low	30.6	Very low	156 Å²	156	155.4 Å²	155.4	82%	0.817	76%	0.762	S	S	*	*			trans	-18.8	161.4	147.3	-63.1	170.8	0	0	0	116.7
1008	P	46.3	Very low	30.7	Very low	106 Å²	106	154.6 Å²	154.6	69%	0.688	76%	0.756	S	S	*	*			cis	-146	167.6	28.4	43.1	-24	0	0	0	119.5
1009	F	28.5	Very low	30.6	Very low	168 Å²	168	155.8 Å²	155.8	74%	0.737	76%	0.758	S	S	*	*			trans	57.2	143.1	139.3	-83.9	-127.1	0	0	0	121.9
1010	F	34	Very low	30.4	Very low	136 Å²	136	154.6 Å²	154.6	60%	0.596	76%	0.756	S	S	*	*			cis	-159.2	141.9	-13.9	-147.3	-127.9	0	0	0	112.8
1011	K	30.7	Very low	30.3	Very low	163 Å²	163	158.4 Å²	158.4	71%	0.709	76%	0.764	S	S	*	*			trans	14	133.6	156.5	-55.3	180	-171.7	172.3	0	121.7
1012	Q	27.7	Very low	30.4	Very low	201 Å²	201	155.7 Å²	155.7	94%	0.939	76%	0.761	S	S	*	*				-128.4	129.9	117.3	-81.7	-163.6	0.6	0	0	110.9
1013	K	29.6	Very low	30.3	Very low	209 Å²	209	157.4 Å²	157.4	91%	0.909	77%	0.769	S	S	*	*			trans	-153.5	143.6	156.2	-158.5	170.6	-175.2	178.5	0	109.7
1014	K	32.8	Very low	30.3	Very low	208 Å²	208	153 Å²	153	90%	0.904	76%	0.756	S	S	*	*			trans	-68.2	135.8	-173.9	-60.2	174	179.8	178.6	0	111.6
1015	G	28.7	Very low	30.3	Very low	79 Å²	79	152.8 Å²	152.8	81%	0.814	74%	0.742	S	S	*	*			trans	-91.5	161.8	161.2	0	0	0	0	0	111.2
1016	S	27.5	Very low	30.3	Very low	108 Å²	108	146.8 Å²	146.8	76%	0.755	73%	0.726	S	S	*	*			trans	-154.4	156.7	178.5	67.9	0	0	0	0	112.5
1017	R	30.7	Very low	30.3	Very low	225 Å²	225	140.6 Å²	140.6	85%	0.849	71%	0.706	S	S	*	*			trans	71	153.4	171.6	-70.6	179.5	169.1	177.6	-3.6	115.1
1018	K	32.9	Very low	30.4	Very low	139 Å²	139	141.8 Å²	141.8	60%	0.604	71%	0.71	S	S	*	*			cis	-156.4	158.6	9.7	-136.9	168.7	166.3	-97.4	0	112.9
1019	E	29	Very low	29.8	Very low	138 Å²	138	140.4 Å²	140.4	65%	0.645	71%	0.707	S	S	*	*			trans	60.3	156.3	160	-92	102.4	-129.6	0	0	118.9
1020	T	27.7	Very low	29.9	Very low	113 Å²	113	139.5 Å²	139.5	69%	0.693	71%	0.71	S	S	*	*			cis	-147.3	147.4	16.1	-21.9	0	0	0	0	112.8
1021	K	29	Very low	29.7	Very low	195 Å²	195	137 Å²	137	85%	0.848	71%	0.709	S	S	*	*			trans	40.8	142.9	141.3	-82.5	178.9	179.7	-177.5	0	121.8
1022	V	28.8	Very low	29.7	Very low	113 Å²	113	138.1 Å²	138.1	69%	0.685	72%	0.717	S	S	*	*			cis	-168.6	160.2	-5.2	88.5	0	0	0	0	111.1
1023	L	27.8	Very low	29.7	Very low	149 Å²	149	131.8 Å²	131.8	78%	0.78	71%	0.706	S	S	*	*			trans	25.1	145.8	157.3	-65.1	160	0	0	0	121.1
1024	S	28.9	Very low	29.9	Very low	65 Å²	65	131.2 Å²	131.2	46%	0.455	71%	0.706	S	S	.	*			cis	-165	-161.1	-2.4	56.2	0	0	0	0	107.6	F431	F431-S1024 WeakPolarHBondContact CE2-OG 3.28Å; F431-S1024 WeakPolarHBondContact CZ-OG 3.48Å
1025	R	29	Very low	29.8	Very low	82 Å²	82	126.2 Å²	126.2	31%	0.309	70%	0.704	S	S	.	*			cis	-149.7	-140.5	10.3	-153.5	-155.4	177.9	-150.1	-4.2	111.1	L430 D433 S434	L430-R1025 VanDerWaalsContact O-CD 3.27Å; L430-R1025 WeakPolarHBondContact O-CD 3.46Å; L430-R1025 PolarHBondContact O-NH1 3.36Å; D433-R1025 PolarHBondContact O-NH2 3.07Å; D433-R1025 VanDerWaalsContact O-NH2 3.1Å; D433-R1025 IonicContact OD2-CZ 3.05Å; D433-R1025 VanDerWaalsContact OD2-CZ 3.25Å; D433-R1025 IonicContact OD2-NH1 2.69Å; D433-R1025 PolarHBondContact OD2-NH1 3.2Å; D433-R1025 IonicContact OD2-NH2 2.97Å; D433-R1025 PolarHBondContact OD2-NH2 3.4Å; S434-R1025 PolarHBondContact OG-NE 3.07Å
1026	S	29.9	Very low	29.7	Very low	83 Å²	83	127.7 Å²	127.7	58%	0.58	70%	0.702	S	S	*	*			trans	-153	164.3	180	60.5	0	0	0	0	111
1027	K	28.6	Very low	30.7	Very low	116 Å²	116	127.6 Å²	127.6	50%	0.504	70%	0.698	S	S	.	*			trans	-165.5	160	130.6	-120	171.7	169.2	177.5	0	115.7	L430 D433	L430-K1027 HydrophobicContact CD2-CB 4.17Å; L430-K1027 HydrophobicContact CD2-CD 3.53Å; L430-K1027 HydrophobicContact CD2-CG 4.45Å; D433-K1027 VanDerWaalsContact CG-NZ 3.32Å; D433-K1027 IonicContact OD1-NZ 3Å; D433-K1027 VanDerWaalsContact OD2-CE 3.25Å; D433-K1027 WeakPolarHBondContact OD2-CE 3.42Å; D433-K1027 IonicContact OD2-NZ 2.71Å; D433-K1027 PolarHBondContact OD2-NZ 3.04Å
1028	M	29.3	Very low	30.7	Very low	182 Å²	182	124.1 Å²	124.1	90%	0.897	69%	0.694	S	S	*	*			trans	-101.3	-170.8	165.1	-60.7	174.3	150.6	0	0	108.5
1029	A	34	Very low	30.5	Very low	77 Å²	77	125.6 Å²	125.6	64%	0.636	70%	0.7	S	S	*	*			cis	-127.4	-126.8	-2.7	0	0	0	0	0	111.4
1030	D	31.4	Very low	30.6	Very low	149 Å²	149	124 Å²	124	80%	0.797	70%	0.704	S	S	*	*			cis	-144.8	-179.7	8.6	-72.5	-92.7	0	0	0	107.4
1031	S	29.4	Very low	30.8	Very low	82 Å²	82	130 Å²	130	57%	0.573	71%	0.714	S	S	*	*			cis	-154	172.2	12.6	-158.2	0	0	0	0	112.1
1032	E	30	Very low	31.2	Very low	187 Å²	187	128.5 Å²	128.5	87%	0.874	71%	0.714	S	S	*	*			trans	26.6	144.2	150.7	-68.2	153.3	135.4	0	0	123.1
1033	G	29.6	Very low	32.4	Very low	69 Å²	69	128.1 Å²	128.1	71%	0.711	71%	0.714	S	S	*	*			cis	164.9	-168.1	-2.1	0	0	0	0	0	115.3
1034	Q	31.9	Very low	32.7	Very low	197 Å²	197	128 Å²	128	92%	0.921	71%	0.713	S	S	*	*			trans	72.8	134.6	170.4	-62.4	-164.2	0.1	0	0	122.1
1035	A	30.9	Very low	33	Very low	103 Å²	103	135.3 Å²	135.3	85%	0.851	73%	0.731	S	S	*	*			trans	76.4	143.3	146.9	0	0	0	0	0	121.9
1036	S	27.8	Very low	33.2	Very low	110 Å²	110	136.2 Å²	136.2	77%	0.769	75%	0.749	S	S	*	*			trans	-124.1	-173.6	174.6	66.7	0	0	0	0	107.7
1037	P	48.9	Very low	33.5	Very low	105 Å²	105	140.7 Å²	140.7	68%	0.682	76%	0.761	S	S	*	*			cis	-143.5	176.1	8.6	43.6	-24.5	0	0	0	117.9
1038	M	28.9	Very low	33.8	Very low	153 Å²	153	146 Å²	146	75%	0.754	79%	0.794	S	S	*	*			trans	54.4	134.6	142.4	-82.3	-158.4	-179.8	0	0	124.5
1039	K	29.7	Very low	34	Very low	170 Å²	170	144.2 Å²	144.2	74%	0.739	79%	0.789	S	S	*	*			trans	78.3	97	137.4	-73.7	173.5	177	169.3	0	121
1040	S	30.3	Very low	34	Very low	103 Å²	103	147.7 Å²	147.7	72%	0.72	80%	0.797	S	S	*	*				101.6	152.8	108.3	82.3	0	0	0	0	120.9
1041	R	33.6	Very low	34.1	Very low	241 Å²	241	147.7 Å²	147.7	91%	0.909	80%	0.797	S	S	*	*			trans	71.8	108.8	160.5	-69.3	-175.8	175.2	-173.2	-1.7	119.6
1042	L	36.1	Very low	34.4	Very low	163 Å²	163	151.5 Å²	151.5	85%	0.853	81%	0.811	S	S	*	*			trans	-47.1	167.1	139.9	-63.5	165.7	0	0	0	112
1043	P	54.8	Low	34.7	Very low	105 Å²	105	149.3 Å²	149.3	68%	0.682	81%	0.807	S	S	*	*			cis	-141.7	-176.2	14	35.3	-12.6	0	0	0	117.4
1044	L	34.4	Very low	35	Very low	145 Å²	145	154.7 Å²	154.7	76%	0.759	81%	0.813	S	S	*	*			trans	73.9	109.1	144.9	-81.4	162.8	0	0	0	122.9
1045	R	34.6	Very low	35.2	Very low	219 Å²	219	151.6 Å²	151.6	83%	0.826	81%	0.805	S	S	*	*				63.7	123.2	124	-94	-167.8	165.4	171.8	-4.2	123.3
1046	C	33.7	Very low	35.6	Very low	101 Å²	101	155.4 Å²	155.4	68%	0.682	80%	0.802	S	S	*	*				90.5	143.5	125.9	-75.4	0	0	0	0	121.7
1047	Q	34.7	Very low	36.2	Very low	178 Å²	178	159.2 Å²	159.2	83%	0.832	80%	0.804	S	S	*	*			trans	70.4	128.3	166.5	-70.5	168.4	-15.9	0	0	116
1048	N	34.7	Very low	35.1	Very low	227 Å²	227	164.1 Å²	164.1	100%	1.214	82%	0.816	S	S	*	*			cis	-120.3	0	-1.2	-75.2	-44.8	0	0	0	111.7

Retrieved 1,048 of 1,048 residues in 453.5 ms (Link to these results)

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