A0A087XRG8_POEFO Loading...

NADH dehydrogenase [ubiquinone] 1 alpha subcomplex subunit 10, mitochondrial

Accessory subunit of the mitochondrial membrane respiratory chain NADH dehydrogenase (Complex I), that is believed not to be involved in catalysis. Complex I functions in the transfer of electrons from NADH to the respiratory chain. The immediate electron acceptor for the enzyme is believed to be ubiquinone.

AlphaFold DB , UniProt , Accession A0A087XRG8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 355 aa.

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(Predicted Aligned Error values between residue pairs)

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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	37	Very low	30.5	Very low	251 Å²	251	162.7 Å²	162.7	100%	1.236	85%	0.854	S	S	*	*				0	119.4	0	-70	-154.8	-173	0	0	107.8
2	A	31.4	Very low	30.4	Very low	97 Å²	97	157.8 Å²	157.8	80%	0.802	85%	0.854	S	S	*	*			trans	-85.4	139.6	-169.2	0	0	0	0	0	111.4
3	L	29.4	Very low	30.2	Very low	176 Å²	176	164.2 Å²	164.2	92%	0.921	86%	0.859	S	S	*	*			trans	-103.9	111.2	167.4	-94.3	155.9	0	0	0	108.2
4	T	29.4	Very low	30.2	Very low	125 Å²	125	162.3 Å²	162.3	77%	0.767	86%	0.857	S	S	*	*			trans	-82.5	121	-178	-36	0	0	0	0	109.5
5	V	32	Very low	30.1	Very low	134 Å²	134	160.5 Å²	160.5	81%	0.812	86%	0.855	S	S	*	*			trans	-116.6	111.3	167.9	177.7	0	0	0	0	107.8
6	V	32.2	Very low	30.1	Very low	111 Å²	111	156.7 Å²	156.7	67%	0.673	85%	0.854	S	S	*	*			trans	-81.8	114.3	178.5	176.6	0	0	0	0	108.8	F8	V6-F8 HydrophobicContact CG1-CD2 4.44Å; V6-F8 HydrophobicContact CG1-CE2 4.37Å
7	R	27.6	Very low	30	Very low	231 Å²	231	155.6 Å²	155.6	87%	0.872	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-91.7	117.5	171.1	-114.6	178.8	175.9	176.3	-1	108.9
8	F	28.1	Very low	29.8	Very low	187 Å²	187	159.8 Å²	159.8	82%	0.82	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-76.7	121.7	168.1	-90.2	-89.5	0	0	0	110.1	V6	V6-F8 HydrophobicContact CG1-CD2 4.44Å; V6-F8 HydrophobicContact CG1-CE2 4.37Å
9	L	28.8	Very low	29.7	Very low	165 Å²	165	156.6 Å²	156.6	86%	0.864	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-87.6	118.8	175.9	-81.5	154.3	0	0	0	110
10	F	28.3	Very low	29.5	Very low	191 Å²	191	159.8 Å²	159.8	84%	0.838	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-95.6	124.3	159.3	-72.1	-84.7	0	0	0	108.4	A12	F10-A12 PolarHBondContact O-N 3.22Å
11	P	31.3	Very low	29.4	Very low	122 Å²	122	157.4 Å²	157.4	79%	0.792	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-82.6	117.8	172.9	30.7	-29.3	0	0	0	110.5	R13	P11-R13 PolarHBondContact O-N 2.97Å
12	A	29	Very low	28.9	Very low	103 Å²	103	151.8 Å²	151.8	85%	0.851	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-65.4	125.6	166.8	0	0	0	0	0	109.9	F10	F10-A12 PolarHBondContact O-N 3.22Å
13	R	28.5	Very low	28.8	Very low	242 Å²	242	152.9 Å²	152.9	91%	0.913	82%	0.823	S	S	*	*			trans	-106	117	165.9	-97.6	-175.8	171.2	-177.9	-1.7	109.8	P11	P11-R13 PolarHBondContact O-N 2.97Å
14	T	30.7	Very low	28.9	Very low	137 Å²	137	153.1 Å²	153.1	84%	0.84	82%	0.819	S	S	*	*			trans	-54.1	128.2	172	43.8	0	0	0	0	112.6
15	T	28.8	Very low	28.8	Very low	135 Å²	135	156.5 Å²	156.5	83%	0.828	82%	0.823	S	S	*	*			trans	-82.6	110.8	170	37.8	0	0	0	0	110.2
16	A	28.9	Very low	28.6	Very low	100 Å²	100	154.6 Å²	154.6	83%	0.826	82%	0.822	S	S	*	*			trans	-88.8	107.7	165.3	0	0	0	0	0	108.8	R18	A16-R18 PolarHBondContact O-N 3.33Å
17	V	28.2	Very low	28.4	Very low	139 Å²	139	152.3 Å²	152.3	84%	0.842	82%	0.821	S	S	*	*			trans	-78.2	111	174.2	176.7	0	0	0	0	108.4
18	R	26.6	Very low	28.6	Very low	230 Å²	230	147.6 Å²	147.6	87%	0.868	82%	0.817	S	S	*	*			trans	-108.5	109.1	168.2	-150.1	176.5	-169.7	179.5	3.8	107.5	A16 R20	A16-R18 PolarHBondContact O-N 3.33Å; R18-R20 PolarHBondContact O-N 3.31Å
19	A	28.6	Very low	28.6	Very low	99 Å²	99	147.4 Å²	147.4	82%	0.818	82%	0.819	S	S	*	*			trans	-62.8	116.5	176.5	0	0	0	0	0	110
20	R	26.1	Very low	28.8	Very low	220 Å²	220	146 Å²	146	83%	0.83	82%	0.817	S	S	*	*			trans	-128.1	128.7	163.8	-96.4	-176.5	171.9	176.3	-3.4	108.1	R18 V22	R18-R20 PolarHBondContact O-N 3.31Å; R20-V22 PolarHBondContact O-N 3.41Å
21	S	26.5	Very low	28.9	Very low	111 Å²	111	141.6 Å²	141.6	78%	0.776	81%	0.81	S	S	*	*			trans	-42.4	118.3	174.3	50.5	0	0	0	0	112.2	V23	S21-V23 PolarHBondContact O-N 3.13Å; S21-V23 VanDerWaalsContact O-N 3.08Å
22	V	27	Very low	28.8	Very low	132 Å²	132	141.6 Å²	141.6	80%	0.8	81%	0.81	S	S	*	*			trans	-76	92.6	173.6	179.7	0	0	0	0	108.1	R20 Q24	R20-V22 PolarHBondContact O-N 3.41Å; V22-Q24 HydrophobicContact CG1-CG 4.41Å
23	V	29.2	Very low	29	Very low	121 Å²	121	140.7 Å²	140.7	73%	0.733	81%	0.811	S	S	*	*			trans	-78.7	112.1	155.5	175.6	0	0	0	0	105.5	S21 K25	S21-V23 PolarHBondContact O-N 3.13Å; S21-V23 VanDerWaalsContact O-N 3.08Å; V23-K25 VanDerWaalsContact C-N 3.31Å; V23-K25 PolarHBondContact O-N 3.26Å
24	Q	30.3	Very low	29.5	Very low	180 Å²	180	139 Å²	139	84%	0.841	81%	0.805	S	S	*	*			trans	-61.3	92.9	172.4	-77.7	177.5	-25.3	0	0	108.9	V22 A26	V22-Q24 HydrophobicContact CG1-CG 4.41Å; Q24-A26 PolarHBondContact O-N 3.02Å; Q24-A26 VanDerWaalsContact O-N 3.17Å
25	K	28.5	Very low	30.5	Very low	196 Å²	196	137.4 Å²	137.4	85%	0.852	80%	0.8	S	S	*	*			trans	-70	103.6	157.2	-87.1	-175.3	173.5	-177.1	0	106.4	V23 G27	V23-K25 VanDerWaalsContact C-N 3.31Å; V23-K25 PolarHBondContact O-N 3.26Å; K25-G27 PolarHBondContact O-N 3.21Å
26	A	27.9	Very low	31.9	Very low	94 Å²	94	138.5 Å²	138.5	78%	0.777	80%	0.8	S	S	*	*			trans	-54.9	105.8	164.7	0	0	0	0	0	107.7	Q24 V28	Q24-A26 PolarHBondContact O-N 3.02Å; Q24-A26 VanDerWaalsContact O-N 3.17Å; A26-V28 PolarHBondContact O-N 3.39Å
27	G	28.2	Very low	34	Very low	64 Å²	64	141 Å²	141	66%	0.66	79%	0.794	S	S	*	*			trans	-65.5	112.8	170.6	0	0	0	0	0	107.5	K25 H29	K25-G27 PolarHBondContact O-N 3.21Å; G27-H29 PolarHBondContact O-N 3.23Å; G27-H29 VanDerWaalsContact O-N 3.09Å
28	V	31.7	Very low	36.6	Very low	131 Å²	131	135.1 Å²	135.1	79%	0.794	76%	0.757	S	S	*	*			trans	-58.4	115	166.3	176.8	0	0	0	0	106.2	A26 T30	A26-V28 PolarHBondContact O-N 3.39Å; V28-T30 PolarHBondContact O-N 2.76Å
29	H	27.3	Very low	39.4	Very low	183 Å²	183	125.3 Å²	125.3	85%	0.847	73%	0.727	S	S	*	*			trans	-53.8	109.7	167.9	-88.7	-83.6	0	0	0	108	G27 S31	G27-H29 PolarHBondContact O-N 3.23Å; G27-H29 VanDerWaalsContact O-N 3.09Å; H29-S31 VanDerWaalsContact C-N 3.3Å; H29-S31 PolarHBondContact O-N 2.85Å
30	T	32.7	Very low	42	Very low	136 Å²	136	127 Å²	127	83%	0.834	71%	0.713	S	S	*	*			trans	-73.3	88.6	169.6	51.3	0	0	0	0	107.8	V28	V28-T30 PolarHBondContact O-N 2.76Å
31	S	30.1	Very low	44.8	Very low	99 Å²	99	125.8 Å²	125.8	69%	0.692	71%	0.708	S	S	*	*			trans	-63.4	147.9	158.9	45.4	0	0	0	0	109	H29 G33	H29-S31 VanDerWaalsContact C-N 3.3Å; H29-S31 PolarHBondContact O-N 2.85Å; S31-G33 PolarHBondContact O-N 3.36Å
32	P	30.2	Very low	47.7	Very low	121 Å²	121	121.7 Å²	121.7	79%	0.786	68%	0.681	S	S	*	*			trans	-59.1	133.5	174.5	26.6	-32.6	0	0	0	108.1	R34	P32-R34 PolarHBondContact O-N 2.94Å
33	G	33.1	Very low	50.5	Low	85 Å²	85	117 Å²	117	88%	0.876	65%	0.649	S	S	*	*			trans	-62.7	72.7	-177	0	0	0	0	0	113.7	S31	S31-G33 PolarHBondContact O-N 3.36Å
34	R	39.5	Very low	53.2	Low	205 Å²	205	115.9 Å²	115.9	77%	0.774	64%	0.638	S	S	*	*			trans	-82.7	112.7	145.1	-92.5	-177.7	170.6	174.4	-2.5	105.3	P32 L36	P32-R34 PolarHBondContact O-N 2.94Å; R34-L36 PolarHBondContact O-N 3.33Å
35	S	50.4	Low	55.9	Low	105 Å²	105	114.5 Å²	114.5	73%	0.734	64%	0.635	S	S	*	*			trans	-60	90	157.9	48.8	0	0	0	0	106.5	E37	S35-E37 PolarHBondContact O-N 2.85Å
36	L	59.9	Low	58.5	Low	158 Å²	158	107.5 Å²	107.5	83%	0.827	62%	0.619	S	S	*	*			trans	-65.2	105.3	173.1	-78.2	167.7	0	0	0	106.3	R34	R34-L36 PolarHBondContact O-N 3.33Å
37	E	71.8	Confident	61	Low	151 Å²	151	105.6 Å²	105.6	71%	0.706	59%	0.594	S	S	*	*			trans	-65.6	131.9	176.1	-70.7	-166.9	172.3	0	0	109.4	S35 G39	S35-E37 PolarHBondContact O-N 2.85Å; E37-G39 PolarHBondContact O-N 3.24Å
38	Y	82.6	Confident	63.6	Low	16 Å²	16	108.7 Å²	108.7	6%	0.063	59%	0.586	C	S	.	*			trans	-66.6	131.2	173.2	170.3	-96.8	0	0	0	108.6	A42 Y43 E47 H292 R295 Q299	Y38-A42 HydrophobicContact CD2-CB 3.57Å; Y38-A42 HydrophobicContact CE2-CB 3.85Å; Y38-Y43 WeakPolarHBondContact OH-CD2 3.27Å; Y38-E47 HydrophobicContact CE2-CB 4.2Å; Y38-E47 HydrophobicContact CE2-CG 4.46Å; Y38-E47 PolarHBondContact OH-O 3.3Å; Y38-H292 AromaticContact CE1-CE1 3.71Å; Y38-H292 AromaticContact CE1-ND1 3.27Å; Y38-H292 VanDerWaalsContact CE1-ND1 3.27Å; Y38-H292 WeakPolarHBondContact CE1-ND1 3.5Å; Y38-H292 AromaticContact CZ-ND1 3.39Å; Y38-H292 PolarHBondContact OH-ND1 3.48Å; Y38-R295 HydrophobicContact CD1-CB 4.26Å; Y38-R295 HydrophobicContact CD1-CG 3.71Å; Y38-R295 VanDerWaalsContact CD2-CZ 3.45Å; Y38-R295 HydrophobicContact CE1-CB 4.05Å; Y38-R295 HydrophobicContact CE1-CG 3.9Å; Y38-R295 HydrophobicContact CG-CG 4.43Å; Y38-Q299 VanDerWaalsContact CB-OE1 3.32Å; Y38-Q299 PolarHBondContact O-OE1 3.15Å
39	G	86.3	Confident	65.9	Low	24 Å²	24	102.6 Å²	102.6	25%	0.247	55%	0.549	C	S	.	.			trans	-145	-176.6	-174.8	0	0	0	0	0	111.9	E37 W41 A42 Y43	E37-G39 PolarHBondContact O-N 3.24Å; G39-W41 PolarHBondContact O-N 2.94Å; G39-A42 WeakPolarHBondContact O-CB 3.46Å; G39-A42 PolarHBondContact O-N 3.48Å; G39-A42 VanDerWaalsContact O-N 3.09Å; G39-Y43 PolarHBondContact O-N 3.32Å; G39-Y43 VanDerWaalsContact O-N 3.16Å
40	W	83.5	Confident	68.5	Low	136 Å²	136	96.6 Å²	96.6	52%	0.515	53%	0.525	S	S	.	.	H	α-helix	trans	-58	-36.4	-178.7	-171	-101.8	0	0	0	112.8	Y43 I44 H292	W40-Y43 WeakPolarHBondContact O-CB 3.45Å; W40-Y43 PolarHBondContact O-N 3.44Å; W40-I44 VanDerWaalsContact CD1-CD1 3.47Å; W40-I44 HydrophobicContact CG-CD1 4.48Å; W40-I44 PolarHBondContact O-N 3.43Å; W40-H292 AromaticContact CE3-CD2 3.99Å; W40-H292 AromaticContact CE3-NE2 3.47Å; W40-H292 AromaticContact CZ3-NE2 4Å
41	W	85.1	Confident	71	Confident	194 Å²	194	95 Å²	95	74%	0.735	52%	0.517	S	S	*	.	H	α-helix	trans	-64.6	-42.1	175.9	-69.1	116.5	0	0	0	112.7	G39 Y43 I44 L45	G39-W41 PolarHBondContact O-N 2.94Å; W41-Y43 VanDerWaalsContact C-N 3.29Å; W41-Y43 PolarHBondContact O-N 3.22Å; W41-I44 PolarHBondContact O-N 3.17Å; W41-L45 VanDerWaalsContact O-CB 3.25Å; W41-L45 WeakPolarHBondContact O-CB 3.34Å; W41-L45 WeakPolarHBondContact O-CD1 3.39Å; W41-L45 WeakPolarHBondContact O-CG 3.48Å; W41-L45 PolarHBondContact O-N 3.45Å
42	A	86.1	Confident	73.6	Confident	25 Å²	25	94.4 Å²	94.4	21%	0.207	50%	0.5	C	S	.	.	H	α-helix	trans	-62.2	-40.1	176.4	0	0	0	0	0	111.2	Y38 G39 L45 G46 E47	Y38-A42 HydrophobicContact CD2-CB 3.57Å; Y38-A42 HydrophobicContact CE2-CB 3.85Å; G39-A42 WeakPolarHBondContact O-CB 3.46Å; G39-A42 PolarHBondContact O-N 3.48Å; G39-A42 VanDerWaalsContact O-N 3.09Å; A42-L45 PolarHBondContact O-N 2.98Å; A42-G46 PolarHBondContact O-N 3.19Å; A42-E47 HydrophobicContact CB-CB 4.44Å; A42-E47 WeakPolarHBondContact O-CB 3.36Å; A42-E47 PolarHBondContact O-N 3.45Å
43	Y	85.9	Confident	76.1	Confident	33 Å²	33	91.6 Å²	91.6	13%	0.129	48%	0.475	C	S	.	.	H	α-helix	trans	-62.5	-49	174.7	-178	-108.5	0	0	0	112.7	Y38 G39 W40 W41 L45 G46 R48 D288 H292	Y38-Y43 WeakPolarHBondContact OH-CD2 3.27Å; G39-Y43 PolarHBondContact O-N 3.32Å; G39-Y43 VanDerWaalsContact O-N 3.16Å; W40-Y43 WeakPolarHBondContact O-CB 3.45Å; W40-Y43 PolarHBondContact O-N 3.44Å; W41-Y43 VanDerWaalsContact C-N 3.29Å; W41-Y43 PolarHBondContact O-N 3.22Å; Y43-L45 VanDerWaalsContact C-N 3.32Å; Y43-L45 PolarHBondContact O-N 2.81Å; Y43-G46 PolarHBondContact O-N 3.05Å; Y43-G46 VanDerWaalsContact O-N 3.1Å; Y43-R48 HydrophobicContact CE2-CG 4.43Å; Y43-D288 HydrophobicContact CE2-CB 4.29Å; Y43-H292 WeakPolarHBondContact CB-ND1 3.32Å; Y43-H292 HydrophobicContact CD2-CB 4.01Å; Y43-H292 AromaticContact CD2-ND1 3.82Å; Y43-H292 HydrophobicContact CE2-CB 4.05Å; Y43-H292 HydrophobicContact CG-CB 4.44Å; Y43-H292 AromaticContact CG-ND1 3.61Å
44	I	86.6	Confident	78.6	Confident	98 Å²	98	95.4 Å²	95.4	50%	0.503	47%	0.468	S	S	.	.	H	α-helix	trans	-62.4	-39.5	177.1	-73.7	-177.9	0	0	0	111.7	W40 W41 G46	W40-I44 VanDerWaalsContact CD1-CD1 3.47Å; W40-I44 HydrophobicContact CG-CD1 4.48Å; W40-I44 PolarHBondContact O-N 3.43Å; W41-I44 PolarHBondContact O-N 3.17Å; I44-G46 PolarHBondContact O-N 3.01Å
45	L	87.3	Confident	80.5	Confident	150 Å²	150	92.7 Å²	92.7	79%	0.785	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	0.8	178.2	-69.5	168.8	0	0	0	113.1	W41 A42 Y43	W41-L45 VanDerWaalsContact O-CB 3.25Å; W41-L45 WeakPolarHBondContact O-CB 3.34Å; W41-L45 WeakPolarHBondContact O-CD1 3.39Å; W41-L45 WeakPolarHBondContact O-CG 3.48Å; W41-L45 PolarHBondContact O-N 3.45Å; A42-L45 PolarHBondContact O-N 2.98Å; Y43-L45 VanDerWaalsContact C-N 3.32Å; Y43-L45 PolarHBondContact O-N 2.81Å
46	G	81.6	Confident	82	Confident	49 Å²	49	91.9 Å²	91.9	51%	0.505	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	106	7.4	169.3	0	0	0	0	0	114.7	A42 Y43 I44 R48	A42-G46 PolarHBondContact O-N 3.19Å; Y43-G46 PolarHBondContact O-N 3.05Å; Y43-G46 VanDerWaalsContact O-N 3.1Å; I44-G46 PolarHBondContact O-N 3.01Å; G46-R48 VanDerWaalsContact C-N 3.26Å; G46-R48 PolarHBondContact O-N 2.93Å
47	E	81.6	Confident	83.4	Confident	55 Å²	55	84.6 Å²	84.6	26%	0.257	41%	0.408	S	S	.	.			trans	-77.2	75.4	176.2	-156.6	-167	159.6	0	0	111.7	Y38 A42 R52 R295	Y38-E47 HydrophobicContact CE2-CB 4.2Å; Y38-E47 HydrophobicContact CE2-CG 4.46Å; Y38-E47 PolarHBondContact OH-O 3.3Å; A42-E47 HydrophobicContact CB-CB 4.44Å; A42-E47 WeakPolarHBondContact O-CB 3.36Å; A42-E47 PolarHBondContact O-N 3.45Å; E47-R52 IonicContact OE1-CZ 3.24Å; E47-R52 IonicContact OE1-NH1 2.92Å; E47-R52 PolarHBondContact OE1-NH1 3.24Å; E47-R52 IonicContact OE1-NH2 2.73Å; E47-R52 PolarHBondContact OE1-NH2 3.47Å; E47-R295 IonicContact OE1-CZ 3.38Å; E47-R295 IonicContact OE1-NH1 2.98Å; E47-R295 PolarHBondContact OE1-NH1 3.27Å; E47-R295 IonicContact OE1-NH2 2.82Å; E47-R295 PolarHBondContact OE1-NH2 3.04Å; E47-R295 IonicContact OE2-NH2 3.93Å
48	R	82.9	Confident	84.3	Confident	129 Å²	129	79.7 Å²	79.7	49%	0.487	38%	0.384	S	S	.	.			trans	-88.5	151.6	176.4	-59.9	-174.3	-179.1	-160.1	7	112.1	Y43 G46 P51 D288	Y43-R48 HydrophobicContact CE2-CG 4.43Å; G46-R48 VanDerWaalsContact C-N 3.26Å; G46-R48 PolarHBondContact O-N 2.93Å; R48-P51 HydrophobicContact CB-CG 4.15Å; R48-D288 WeakPolarHBondContact CD-OD2 3.36Å; R48-D288 IonicContact NH1-OD2 3.22Å; R48-D288 PolarHBondContact NH1-OD2 3.4Å
49	T	80.1	Confident	84.9	Confident	2 Å²	2	79 Å²	79	1%	0.012	38%	0.381	C	S	.	.	S	Bend	trans	-86	-40.2	-178.8	51.5	0	0	0	0	112.4	P51 R52 L151 Y291	T49-P51 VanDerWaalsContact C-CD 3.4Å; T49-R52 WeakPolarHBondContact O-CB 3.37Å; T49-R52 PolarHBondContact O-N 2.92Å; T49-L151 HydrophobicContact CG2-CB 4.29Å; T49-L151 HydrophobicContact CG2-CD2 4.41Å; T49-Y291 WeakPolarHBondContact OG1-CB 3.38Å
50	T	81.9	Confident	85.3	Confident	58 Å²	58	77.9 Å²	77.9	36%	0.356	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-55.8	-38.5	-176.2	51.4	0	0	0	0	115	R52 F53 D288 Y291	T50-R52 PolarHBondContact O-N 3.32Å; T50-R52 VanDerWaalsContact O-N 3.15Å; T50-F53 PolarHBondContact O-N 3.17Å; T50-D288 VanDerWaalsContact CB-OD1 3.27Å; T50-D288 WeakPolarHBondContact CB-OD1 3.5Å; T50-D288 WeakPolarHBondContact CG2-OD1 3.29Å; T50-D288 PolarHBondContact OG1-OD1 2.92Å; T50-D288 PolarHBondContact OG1-OD2 3.06Å; T50-Y291 HydrophobicContact CG2-CD2 4.24Å; T50-Y291 HydrophobicContact CG2-CE2 4.29Å
51	P	84.3	Confident	85.8	Confident	103 Å²	103	71.4 Å²	71.4	67%	0.669	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-68.9	-15.4	179.8	-18	33.9	0	0	0	113.5	R48 T49	R48-P51 HydrophobicContact CB-CG 4.15Å; T49-P51 VanDerWaalsContact C-CD 3.4Å
52	R	84.2	Confident	86.2	Confident	86 Å²	86	62.2 Å²	62.2	33%	0.325	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-86.7	-16.3	179.3	-59.7	-176.4	177.7	170.2	3.1	112.3	E47 T49 T50 K54 T152	E47-R52 IonicContact OE1-CZ 3.24Å; E47-R52 IonicContact OE1-NH1 2.92Å; E47-R52 PolarHBondContact OE1-NH1 3.24Å; E47-R52 IonicContact OE1-NH2 2.73Å; E47-R52 PolarHBondContact OE1-NH2 3.47Å; T49-R52 WeakPolarHBondContact O-CB 3.37Å; T49-R52 PolarHBondContact O-N 2.92Å; T50-R52 PolarHBondContact O-N 3.32Å; T50-R52 VanDerWaalsContact O-N 3.15Å; R52-K54 PolarHBondContact O-N 3.06Å; R52-T152 WeakPolarHBondContact CD-O 3.36Å; R52-T152 PolarHBondContact NH1-O 3.26Å
53	F	84.3	Confident	86.5	Confident	61 Å²	61	61 Å²	61	27%	0.268	30%	0.3	S	S	.	.			trans	-74.5	126.9	-178.5	-70.5	-15.5	0	0	0	111.8	T50 L150 L151 Y291	T50-F53 PolarHBondContact O-N 3.17Å; F53-L150 HydrophobicContact CE1-CD2 3.68Å; F53-L150 HydrophobicContact CE1-CG 4.34Å; F53-L150 HydrophobicContact CZ-CD2 3.82Å; F53-L151 HydrophobicContact CE1-CD2 4.33Å; F53-L151 HydrophobicContact CZ-CD2 3.79Å; F53-Y291 HydrophobicContact CE2-CD2 4.46Å; F53-Y291 AromaticContact CE2-CE1 4Å; F53-Y291 HydrophobicContact CE2-CE1 4Å; F53-Y291 AromaticContact CE2-CE2 3.92Å; F53-Y291 HydrophobicContact CE2-CE2 3.92Å; F53-Y291 AromaticContact CE2-CZ 3.66Å; F53-Y291 HydrophobicContact CZ-CD1 4.46Å; F53-Y291 HydrophobicContact CZ-CE1 4.16Å
54	K	84	Confident	86.5	Confident	165 Å²	165	59.4 Å²	59.4	72%	0.717	29%	0.294	S	S	*	.			trans	-108.8	174.6	172.6	-59.7	-178.5	-176.8	177.3	0	108.9	R52 Y56 S57	R52-K54 PolarHBondContact O-N 3.06Å; K54-Y56 PolarHBondContact O-N 2.89Å; K54-S57 PolarHBondContact N-OG 3.21Å; K54-S57 WeakPolarHBondContact O-CB 3.44Å; K54-S57 PolarHBondContact O-N 3.49Å; K54-S57 PolarHBondContact O-OG 3.27Å
55	Q	79.8	Confident	86.5	Confident	148 Å²	148	55 Å²	55	69%	0.692	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-38.5	177.3	-169.9	172	-7.4	0	0	112.7
56	Y	82.6	Confident	86.1	Confident	89 Å²	89	49.8 Å²	49.8	35%	0.349	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	12.1	178.3	-59.4	-74.3	0	0	0	114.2	K54 K58 L81 M83 G156 E274	K54-Y56 PolarHBondContact O-N 2.89Å; Y56-K58 PolarHBondContact O-N 3.32Å; Y56-L81 HydrophobicContact CD1-CD2 4.08Å; Y56-L81 HydrophobicContact CE1-CD2 3.81Å; Y56-M83 HydrophobicContact CD1-CE 4.02Å; Y56-M83 HydrophobicContact CG-CE 4.39Å; Y56-M83 WeakPolarHBondContact O-CE 3.45Å; Y56-G156 WeakPolarHBondContact O-CA 3.37Å; Y56-G156 PolarHBondContact O-N 3.35Å; Y56-E274 HydrophobicContact CE1-CG 4.39Å; Y56-E274 PolarHBondContact OH-OE1 2.77Å
57	S	89.3	Confident	85.9	Confident	5 Å²	5	48.5 Å²	48.5	4%	0.035	23%	0.229	C	C	.	.			trans	-79.3	67.8	174.1	-54.1	0	0	0	0	110.3	K54 G154	K54-S57 PolarHBondContact N-OG 3.21Å; K54-S57 WeakPolarHBondContact O-CB 3.44Å; K54-S57 PolarHBondContact O-N 3.49Å; K54-S57 PolarHBondContact O-OG 3.27Å; S57-G154 WeakPolarHBondContact CB-O 3.23Å; S57-G154 PolarHBondContact OG-O 2.59Å
58	K	91.7	Very high	85.5	Confident	48 Å²	48	45.9 Å²	45.9	21%	0.209	22%	0.217	C	C	.	.			trans	-128.8	149.8	-173.3	-58.1	-65.9	170.9	-170.4	0	110.7	Y56 G156 V157 H202	Y56-K58 PolarHBondContact O-N 3.32Å; K58-G156 CarbonylContact O-C 3.47Å; K58-G156 WeakPolarHBondContact O-CA 3.4Å; K58-V157 PolarHBondContact O-N 3.1Å; K58-H202 HydrophobicContact CB-CB 4.25Å; K58-H202 HydrophobicContact CD-CB 4.11Å; K58-H202 WeakPolarHBondContact CD-CD2 3.35Å
59	I	93.9	Very high	85.2	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	113.8	170.9	-54.4	-175.5	0	0	0	107.2	T61 Y143 I147 L150 V157 L159 P201 H202 L203 W283	I59-T61 HydrophobicContact CG2-CG2 4.43Å; I59-Y143 HydrophobicContact CG2-CE2 4.04Å; I59-I147 HydrophobicContact CD1-CG1 3.73Å; I59-L150 HydrophobicContact CD1-CD1 4.43Å; I59-L150 HydrophobicContact CG1-CD1 3.65Å; I59-V157 WeakPolarHBondContact CA-O 3.46Å; I59-L159 HydrophobicContact CG2-CD1 3.9Å; I59-P201 HydrophobicContact CG2-CB 4.3Å; I59-H202 PolarHBondContact N-ND1 3.35Å; I59-H202 VanDerWaalsContact N-ND1 3.17Å; I59-H202 PolarHBondContact O-N 3.11Å; I59-L203 PolarHBondContact O-N 3.48Å; I59-W283 HydrophobicContact CD1-CH2 3.9Å; I59-W283 HydrophobicContact CD1-CZ2 4.14Å; I59-W283 HydrophobicContact CG1-CH2 4.48Å
60	I	94.6	Very high	85.3	Confident	2 Å²	2	42.2 Å²	42.2	1%	0.01	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	129.6	177.4	-54.4	179.7	0	0	0	107.7	L81 M83 V157 I158 L159 L203 L205 I273	I60-L81 HydrophobicContact CD1-CD1 4.18Å; I60-M83 HydrophobicContact CD1-CE 3.91Å; I60-M83 HydrophobicContact CD1-SD 3.84Å; I60-M83 HydrophobicContact CG1-SD 4.45Å; I60-V157 PolarHBondContact N-O 2.98Å; I60-I158 HydrophobicContact CB-CG1 4.34Å; I60-I158 CarbonylContact O-C 3.53Å; I60-I158 WeakPolarHBondContact O-CA 3.28Å; I60-L159 PolarHBondContact O-N 3.07Å; I60-L203 WeakPolarHBondContact CA-O 3.47Å; I60-L203 HydrophobicContact CD1-CD2 4.23Å; I60-L203 HydrophobicContact CG1-CB 4.2Å; I60-L203 HydrophobicContact CG1-CD2 4.31Å; I60-L203 HydrophobicContact CG2-CB 4.25Å; I60-L203 HydrophobicContact CG2-CD2 3.98Å; I60-L203 HydrophobicContact CG2-CG 4.19Å; I60-L205 HydrophobicContact CG2-CD1 3.9Å; I60-L205 HydrophobicContact CG2-CG 3.97Å; I60-I273 HydrophobicContact CD1-CD1 4.32Å; I60-I273 HydrophobicContact CD1-CG2 4.49Å
61	T	94.3	Very high	85.5	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	132	177.8	55	0	0	0	0	109.5	I59 L159 P201 L203 V204 L205	I59-T61 HydrophobicContact CG2-CG2 4.43Å; T61-L159 WeakPolarHBondContact CA-O 3.25Å; T61-L159 HydrophobicContact CG2-CB 4.02Å; T61-L159 HydrophobicContact CG2-CD1 4.16Å; T61-P201 HydrophobicContact CG2-CB 3.66Å; T61-P201 HydrophobicContact CG2-CG 4.08Å; T61-L203 PolarHBondContact N-O 3.49Å; T61-L203 PolarHBondContact OG1-O 3.28Å; T61-V204 WeakPolarHBondContact O-CA 3.48Å; T61-V204 WeakPolarHBondContact OG1-CG2 3.33Å; T61-L205 PolarHBondContact O-N 3.4Å
62	I	93.4	Very high	85.6	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	113.2	177.2	-64.7	159.4	0	0	0	108.3	K70 L73 A74 L77 I158 L159 R161 L205 I207	I62-K70 HydrophobicContact CG2-CB 3.89Å; I62-K70 HydrophobicContact CG2-CD 4.31Å; I62-K70 HydrophobicContact CG2-CG 3.84Å; I62-L73 HydrophobicContact CG2-CD2 4.4Å; I62-A74 HydrophobicContact CD1-CB 3.41Å; I62-A74 VanDerWaalsContact CD1-CB 3.41Å; I62-L77 HydrophobicContact CD1-CD1 4.01Å; I62-I158 HydrophobicContact CD1-CG2 3.62Å; I62-I158 HydrophobicContact CG1-CG2 4.36Å; I62-L159 PolarHBondContact N-O 2.75Å; I62-R161 PolarHBondContact O-N 3.26Å; I62-L205 CarbonylContact C-O 3.58Å; I62-L205 WeakPolarHBondContact CA-O 3.43Å; I62-L205 HydrophobicContact CD1-CD1 4.46Å; I62-L205 HydrophobicContact CG1-CB 3.98Å; I62-L205 HydrophobicContact CG1-CD1 3.91Å; I62-L205 HydrophobicContact CG1-CG 4.38Å; I62-I207 HydrophobicContact CG2-CD1 4.07Å; I62-I207 HydrophobicContact CG2-CG1 4.47Å
63	D	91.8	Very high	85.8	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	156.6	-178.1	-85.1	-44.3	0	0	0	111.9	R161 S165 V204 L205 Y206 I207 Y241 F245	D63-R161 WeakPolarHBondContact OD1-CA 3.07Å; D63-S165 WeakPolarHBondContact OD1-CB 3.15Å; D63-S165 PolarHBondContact OD1-OG 3.47Å; D63-V204 HydrophobicContact CB-CG1 4.19Å; D63-V204 WeakPolarHBondContact OD2-CG1 3.4Å; D63-L205 PolarHBondContact N-O 2.63Å; D63-Y206 HydrophobicContact CB-CD2 4.29Å; D63-I207 PolarHBondContact O-N 3.06Å; D63-Y241 HydrophobicContact CB-CE1 4.18Å; D63-F245 HydrophobicContact CB-CE1 4.34Å; D63-F245 WeakPolarHBondContact OD2-CE1 3.48Å; D63-F245 WeakPolarHBondContact OD2-CZ 3.49Å
64	G	87.3	Confident	86.1	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	154.6	179.4	-179.1	0	0	0	0	0	112.3	K70 R161	G64-K70 PolarHBondContact O-NZ 3.46Å; G64-R161 PolarHBondContact O-NH2 3.11Å
65	N	85.5	Confident	86.5	Confident	4 Å²	4	28.5 Å²	28.5	2%	0.021	16%	0.162	C	C	.	.			trans	-68.6	168.5	-175.9	-147.6	-22.9	0	0	0	112.2	A67 S68 K70 V214	N65-A67 VanDerWaalsContact C-N 3.31Å; N65-A67 PolarHBondContact O-N 3.38Å; N65-S68 PolarHBondContact N-OG 3.03Å; N65-S68 PolarHBondContact O-N 3.32Å; N65-S68 PolarHBondContact O-OG 3.4Å; N65-K70 WeakPolarHBondContact O-CE 3.35Å; N65-K70 PolarHBondContact O-NZ 3.26Å; N65-K70 VanDerWaalsContact O-NZ 3.15Å; N65-V214 HydrophobicContact CB-CG1 4.44Å; N65-V214 HydrophobicContact CB-CG2 3.83Å
66	L	79.7	Confident	87.1	Confident	42 Å²	42	27.2 Å²	27.2	22%	0.22	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-35.5	-169.9	-74.6	93.6	0	0	0	114.4	Y118 F169 L234	L66-Y118 VanDerWaalsContact CD2-OH 3.25Å; L66-Y118 WeakPolarHBondContact CD2-OH 3.17Å; L66-F169 HydrophobicContact CD1-CE1 3.97Å; L66-L234 HydrophobicContact CD1-CD2 3.94Å
67	A	77.5	Confident	87.4	Confident	21 Å²	21	23 Å²	23	17%	0.174	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.4	33.5	-174.5	0	0	0	0	0	113.9	N65 G69 Q209 V214 K217 L218	N65-A67 VanDerWaalsContact C-N 3.31Å; N65-A67 PolarHBondContact O-N 3.38Å; A67-G69 VanDerWaalsContact C-N 3.33Å; A67-G69 PolarHBondContact O-N 3.3Å; A67-Q209 PolarHBondContact O-OE1 3.08Å; A67-V214 HydrophobicContact CB-CG1 3.99Å; A67-K217 HydrophobicContact CB-CB 4Å; A67-K217 WeakPolarHBondContact O-CD 3.33Å; A67-L218 HydrophobicContact CB-CD2 3.89Å; A67-L218 HydrophobicContact CB-CG 3.98Å
68	S	73.1	Confident	87.5	Confident	1 Å²	1	22.8 Å²	22.8	1%	0.007	14%	0.136	C	C	.	.	S	Bend	trans	-86.3	4.6	-176.5	-51.2	0	0	0	0	115.2	N65 K70 Q209	N65-S68 PolarHBondContact N-OG 3.03Å; N65-S68 PolarHBondContact O-N 3.32Å; N65-S68 PolarHBondContact O-OG 3.4Å; S68-K70 VanDerWaalsContact C-N 3.28Å; S68-K70 PolarHBondContact O-N 3.25Å; S68-Q209 PolarHBondContact OG-OE1 3.31Å
69	G	75.4	Confident	87.6	Confident	47 Å²	47	26.4 Å²	26.4	49%	0.485	16%	0.158	S	C	.	.			trans	71.5	22.6	177.4	0	0	0	0	0	114.1	A67 G71 A72 L73	A67-G69 VanDerWaalsContact C-N 3.33Å; A67-G69 PolarHBondContact O-N 3.3Å; G69-G71 PolarHBondContact O-N 3.22Å; G69-A72 PolarHBondContact O-N 2.99Å; G69-L73 PolarHBondContact O-N 3.39Å
70	K	83.3	Confident	87.4	Confident	6 Å²	6	31.1 Å²	31.1	3%	0.026	18%	0.178	C	C	.	.	H	α-helix	trans	-56.9	-46.1	-173.2	-67.9	173.3	-73	173.6	0	113.3	I62 G64 N65 S68 A72 L73 A74 I207	I62-K70 HydrophobicContact CG2-CB 3.89Å; I62-K70 HydrophobicContact CG2-CD 4.31Å; I62-K70 HydrophobicContact CG2-CG 3.84Å; G64-K70 PolarHBondContact O-NZ 3.46Å; N65-K70 WeakPolarHBondContact O-CE 3.35Å; N65-K70 PolarHBondContact O-NZ 3.26Å; N65-K70 VanDerWaalsContact O-NZ 3.15Å; S68-K70 VanDerWaalsContact C-N 3.28Å; S68-K70 PolarHBondContact O-N 3.25Å; K70-A72 VanDerWaalsContact C-N 3.32Å; K70-A72 PolarHBondContact O-N 3.22Å; K70-L73 WeakPolarHBondContact O-CB 3.29Å; K70-L73 PolarHBondContact O-N 2.96Å; K70-L73 VanDerWaalsContact O-N 3.08Å; K70-A74 WeakPolarHBondContact O-CB 3.31Å; K70-A74 PolarHBondContact O-N 2.92Å; K70-I207 HydrophobicContact CG-CD1 3.81Å
71	G	84.8	Confident	87.1	Confident	15 Å²	15	32 Å²	32	16%	0.155	18%	0.183	C	C	.	.	H	α-helix	trans	-60.1	-38	179.6	0	0	0	0	0	114.8	G69 L73 A74 Q75 E160	G69-G71 PolarHBondContact O-N 3.22Å; G71-L73 VanDerWaalsContact C-N 3.33Å; G71-L73 PolarHBondContact O-N 3.41Å; G71-A74 PolarHBondContact O-N 3.4Å; G71-Q75 WeakPolarHBondContact O-CB 3.37Å; G71-Q75 PolarHBondContact O-N 2.88Å; G71-E160 WeakPolarHBondContact CA-OE1 3.29Å; G71-E160 VanDerWaalsContact CA-OE2 3.29Å; G71-E160 WeakPolarHBondContact CA-OE2 2.99Å; G71-E160 PolarHBondContact N-OE2 3.39Å
72	A	87.7	Confident	87	Confident	60 Å²	60	34.3 Å²	34.3	50%	0.496	21%	0.207	S	C	.	.	H	α-helix	trans	-67.1	-35.7	176.1	0	0	0	0	0	112.1	G69 K70 K76	G69-A72 PolarHBondContact O-N 2.99Å; K70-A72 VanDerWaalsContact C-N 3.32Å; K70-A72 PolarHBondContact O-N 3.22Å; A72-K76 VanDerWaalsContact O-CG 3.29Å; A72-K76 WeakPolarHBondContact O-CG 3.49Å; A72-K76 PolarHBondContact O-N 3.22Å
73	L	88.5	Confident	87	Confident	9 Å²	9	35 Å²	35	5%	0.047	21%	0.21	C	C	.	.	H	α-helix	trans	-68.9	-47	173.7	-174.7	73.3	0	0	0	111	I62 G69 K70 G71 Q75 K76 L77 I207 V263 I269	I62-L73 HydrophobicContact CG2-CD2 4.4Å; G69-L73 PolarHBondContact O-N 3.39Å; K70-L73 WeakPolarHBondContact O-CB 3.29Å; K70-L73 PolarHBondContact O-N 2.96Å; K70-L73 VanDerWaalsContact O-N 3.08Å; G71-L73 VanDerWaalsContact C-N 3.33Å; G71-L73 PolarHBondContact O-N 3.41Å; L73-Q75 VanDerWaalsContact C-N 3.33Å; L73-Q75 PolarHBondContact O-N 3.45Å; L73-K76 PolarHBondContact O-N 3.35Å; L73-L77 HydrophobicContact CD1-CD1 4.45Å; L73-L77 HydrophobicContact CD2-CD1 4.2Å; L73-L77 HydrophobicContact CG-CD1 3.88Å; L73-L77 HydrophobicContact CG-CG 4.33Å; L73-L77 WeakPolarHBondContact O-CB 3.45Å; L73-L77 WeakPolarHBondContact O-CG 3.39Å; L73-L77 PolarHBondContact O-N 2.95Å; L73-I207 HydrophobicContact CD2-CD1 3.72Å; L73-I207 HydrophobicContact CD2-CG1 4.41Å; L73-V263 HydrophobicContact CD1-CG1 3.81Å; L73-V263 WeakPolarHBondContact CD1-O 3.23Å; L73-V263 HydrophobicContact CD2-CG1 4.04Å; L73-V263 HydrophobicContact CG-CG1 4.33Å; L73-I269 HydrophobicContact CD1-CD1 3.91Å; L73-I269 HydrophobicContact CD2-CD1 4.33Å
74	A	90.4	Very high	87	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-58.5	-45.2	-178.4	0	0	0	0	0	111.8	I62 K70 G71 L77 A78 Y85 I158 E160	I62-A74 HydrophobicContact CD1-CB 3.41Å; I62-A74 VanDerWaalsContact CD1-CB 3.41Å; K70-A74 WeakPolarHBondContact O-CB 3.31Å; K70-A74 PolarHBondContact O-N 2.92Å; G71-A74 PolarHBondContact O-N 3.4Å; A74-L77 PolarHBondContact O-N 3.36Å; A74-A78 VanDerWaalsContact O-CB 3.32Å; A74-A78 WeakPolarHBondContact O-CB 3.32Å; A74-A78 PolarHBondContact O-N 2.8Å; A74-Y85 HydrophobicContact CB-CD2 3.7Å; A74-Y85 HydrophobicContact CB-CE2 3.37Å; A74-I158 HydrophobicContact CB-CG2 4.04Å; A74-E160 HydrophobicContact CB-CG 4.05Å
75	Q	91.8	Very high	87.4	Confident	102 Å²	102	40.4 Å²	40.4	48%	0.477	24%	0.235	S	C	.	.	H	α-helix	trans	-62.9	-47.6	176.5	-170.8	173.7	13.5	0	0	111.5	G71 L73 L77 A78 D79 Y85	G71-Q75 WeakPolarHBondContact O-CB 3.37Å; G71-Q75 PolarHBondContact O-N 2.88Å; L73-Q75 VanDerWaalsContact C-N 3.33Å; L73-Q75 PolarHBondContact O-N 3.45Å; Q75-L77 VanDerWaalsContact C-N 3.33Å; Q75-L77 PolarHBondContact O-N 3.08Å; Q75-A78 PolarHBondContact O-N 3.34Å; Q75-D79 VanDerWaalsContact O-CG 3.27Å; Q75-D79 PolarHBondContact O-N 3.23Å; Q75-Y85 HydrophobicContact CB-CD1 4.12Å; Q75-Y85 HydrophobicContact CB-CE1 4.08Å; Q75-Y85 HydrophobicContact CG-CD1 4.22Å; Q75-Y85 HydrophobicContact CG-CE1 4.43Å
76	K	91.7	Very high	87.7	Confident	120 Å²	120	41.3 Å²	41.3	52%	0.522	24%	0.239	S	C	.	.	H	α-helix	trans	-60.4	-41.1	177.3	-74.8	177.2	179.9	-175.3	0	112.6	A72 L73 K80	A72-K76 VanDerWaalsContact O-CG 3.29Å; A72-K76 WeakPolarHBondContact O-CG 3.49Å; A72-K76 PolarHBondContact O-N 3.22Å; L73-K76 PolarHBondContact O-N 3.35Å; K76-K80 WeakPolarHBondContact O-CG 3.39Å; K76-K80 PolarHBondContact O-N 3.04Å; K76-K80 VanDerWaalsContact O-N 3.16Å
77	L	90.3	Very high	88.2	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-67.7	-39.9	177.9	-72.5	174.6	0	0	0	111.2	I62 L73 A74 Q75 K80 L81 I158 L205 A266 I269 V270	I62-L77 HydrophobicContact CD1-CD1 4.01Å; L73-L77 HydrophobicContact CD1-CD1 4.45Å; L73-L77 HydrophobicContact CD2-CD1 4.2Å; L73-L77 HydrophobicContact CG-CD1 3.88Å; L73-L77 HydrophobicContact CG-CG 4.33Å; L73-L77 WeakPolarHBondContact O-CB 3.45Å; L73-L77 WeakPolarHBondContact O-CG 3.39Å; L73-L77 PolarHBondContact O-N 2.95Å; A74-L77 PolarHBondContact O-N 3.36Å; Q75-L77 VanDerWaalsContact C-N 3.33Å; Q75-L77 PolarHBondContact O-N 3.08Å; L77-K80 PolarHBondContact O-N 3.5Å; L77-L81 WeakPolarHBondContact O-CB 3.42Å; L77-L81 WeakPolarHBondContact O-CG 3.34Å; L77-L81 PolarHBondContact O-N 3.35Å; L77-I158 HydrophobicContact CB-CD1 3.71Å; L77-L205 HydrophobicContact CD1-CD1 3.71Å; L77-A266 HydrophobicContact CD2-CB 4.47Å; L77-I269 HydrophobicContact CD1-CG2 4.15Å; L77-I269 HydrophobicContact CD2-CB 4.15Å; L77-I269 HydrophobicContact CD2-CG2 3.91Å; L77-V270 HydrophobicContact CD2-CG2 3.8Å
78	A	91.8	Very high	88.8	Confident	2 Å²	2	43.8 Å²	43.8	2%	0.017	25%	0.252	C	S	.	.	H	α-helix	trans	-65.4	-43.2	178.5	0	0	0	0	0	111.7	A74 Q75 K80 L81 G82 M83 I158	A74-A78 VanDerWaalsContact O-CB 3.32Å; A74-A78 WeakPolarHBondContact O-CB 3.32Å; A74-A78 PolarHBondContact O-N 2.8Å; Q75-A78 PolarHBondContact O-N 3.34Å; A78-K80 VanDerWaalsContact C-N 3.32Å; A78-K80 PolarHBondContact O-N 2.91Å; A78-L81 PolarHBondContact O-N 3.16Å; A78-G82 CarbonylContact O-C 3.6Å; A78-G82 WeakPolarHBondContact O-CA 3.1Å; A78-G82 PolarHBondContact O-N 3.15Å; A78-M83 PolarHBondContact O-N 3.44Å; A78-I158 HydrophobicContact CB-CD1 3.94Å; A78-I158 HydrophobicContact CB-CG1 4.39Å
79	D	92	Very high	89.4	Confident	123 Å²	123	43.8 Å²	43.8	66%	0.658	25%	0.252	S	S	*	.	H	α-helix	trans	-62.2	-39	176.7	-68.5	-26	0	0	0	111.7	Q75	Q75-D79 VanDerWaalsContact O-CG 3.27Å; Q75-D79 PolarHBondContact O-N 3.23Å
80	K	90.9	Very high	89.8	Confident	100 Å²	100	44.5 Å²	44.5	44%	0.435	25%	0.245	S	C	.	.	H	α-helix	trans	-73.6	-43.2	179.1	-75.2	-173.1	175.1	-160.9	0	113.3	K76 L77 A78 G82 E267 V270	K76-K80 WeakPolarHBondContact O-CG 3.39Å; K76-K80 PolarHBondContact O-N 3.04Å; K76-K80 VanDerWaalsContact O-N 3.16Å; L77-K80 PolarHBondContact O-N 3.5Å; A78-K80 VanDerWaalsContact C-N 3.32Å; A78-K80 PolarHBondContact O-N 2.91Å; K80-G82 VanDerWaalsContact C-N 3.31Å; K80-E267 IonicContact NZ-OE1 3.27Å; K80-E267 PolarHBondContact NZ-OE1 3.43Å; K80-V270 HydrophobicContact CB-CG2 4.21Å; K80-V270 HydrophobicContact CD-CG2 4.29Å
81	L	88.7	Confident	89.9	Confident	19 Å²	19	44.9 Å²	44.9	10%	0.099	25%	0.248	C	C	.	.	H	α-helix	trans	-84.2	-6.7	-178.3	-66.4	170.3	0	0	0	112.9	Y56 I60 L77 A78 M83 I158 V270 I273	Y56-L81 HydrophobicContact CD1-CD2 4.08Å; Y56-L81 HydrophobicContact CE1-CD2 3.81Å; I60-L81 HydrophobicContact CD1-CD1 4.18Å; L77-L81 WeakPolarHBondContact O-CB 3.42Å; L77-L81 WeakPolarHBondContact O-CG 3.34Å; L77-L81 PolarHBondContact O-N 3.35Å; A78-L81 PolarHBondContact O-N 3.16Å; L81-M83 HydrophobicContact CB-CE 4.01Å; L81-M83 HydrophobicContact CB-CG 3.85Å; L81-M83 HydrophobicContact CB-SD 4.07Å; L81-M83 HydrophobicContact CD1-CE 3.96Å; L81-M83 HydrophobicContact CD1-SD 4.06Å; L81-M83 HydrophobicContact CG-CE 4.45Å; L81-M83 PolarHBondContact O-N 2.99Å; L81-I158 HydrophobicContact CD1-CD1 4.33Å; L81-V270 HydrophobicContact CD2-CG1 3.88Å; L81-V270 HydrophobicContact CD2-CG2 4.25Å; L81-V270 HydrophobicContact CG-CG2 4.24Å; L81-I273 HydrophobicContact CD1-CD1 4.18Å
82	G	90.5	Very high	89.9	Confident	50 Å²	50	46.7 Å²	46.7	52%	0.515	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.2	28.6	-174.5	0	0	0	0	0	113.1	A78 K80 Q155	A78-G82 CarbonylContact O-C 3.6Å; A78-G82 WeakPolarHBondContact O-CA 3.1Å; A78-G82 PolarHBondContact O-N 3.15Å; K80-G82 VanDerWaalsContact C-N 3.31Å; G82-Q155 PolarHBondContact O-NE2 3.05Å
83	M	93.4	Very high	89.9	Confident	13 Å²	13	45.1 Å²	45.1	6%	0.064	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-94	160.7	-179.6	-67.5	-176.9	-174.3	0	0	111.2	Y56 I60 A78 L81 Y85 G156 I158	Y56-M83 HydrophobicContact CD1-CE 4.02Å; Y56-M83 HydrophobicContact CG-CE 4.39Å; Y56-M83 WeakPolarHBondContact O-CE 3.45Å; I60-M83 HydrophobicContact CD1-CE 3.91Å; I60-M83 HydrophobicContact CD1-SD 3.84Å; I60-M83 HydrophobicContact CG1-SD 4.45Å; A78-M83 PolarHBondContact O-N 3.44Å; L81-M83 HydrophobicContact CB-CE 4.01Å; L81-M83 HydrophobicContact CB-CG 3.85Å; L81-M83 HydrophobicContact CB-SD 4.07Å; L81-M83 HydrophobicContact CD1-CE 3.96Å; L81-M83 HydrophobicContact CD1-SD 4.06Å; L81-M83 HydrophobicContact CG-CE 4.45Å; L81-M83 PolarHBondContact O-N 2.99Å; M83-Y85 PolarHBondContact O-N 2.9Å; M83-G156 WeakPolarHBondContact CA-O 3.41Å; M83-G156 WeakPolarHBondContact CB-O 3.34Å; M83-I158 HydrophobicContact CB-CD1 4.32Å; M83-I158 HydrophobicContact CB-CG1 3.98Å; M83-I158 HydrophobicContact SD-CD1 4.12Å; M83-I158 HydrophobicContact SD-CG1 3.83Å
84	L	93.6	Very high	89.7	Confident	55 Å²	55	47.3 Å²	47.3	29%	0.288	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	121.4	172.6	178.7	65.2	0	0	0	109.6	M86 H149 G156 V157 I158	L84-M86 HydrophobicContact CD2-CE 3.57Å; L84-M86 HydrophobicContact CD2-CG 4.34Å; L84-M86 HydrophobicContact CG-CG 4.37Å; L84-H149 HydrophobicContact CD2-CB 4.34Å; L84-H149 VanDerWaalsContact CD2-CD2 3.5Å; L84-H149 WeakPolarHBondContact CD2-CD2 3.44Å; L84-G156 PolarHBondContact N-O 2.85Å; L84-V157 HydrophobicContact CB-CG2 4.43Å; L84-V157 CarbonylContact O-C 3.54Å; L84-V157 WeakPolarHBondContact O-CA 3.25Å; L84-I158 PolarHBondContact O-N 3.4Å
85	Y	94.8	Very high	89.5	Confident	59 Å²	59	47.6 Å²	47.6	23%	0.231	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	126	169.5	170.3	-124.9	0	0	0	110.5	A74 Q75 M83 P87 E160	A74-Y85 HydrophobicContact CB-CD2 3.7Å; A74-Y85 HydrophobicContact CB-CE2 3.37Å; Q75-Y85 HydrophobicContact CB-CD1 4.12Å; Q75-Y85 HydrophobicContact CB-CE1 4.08Å; Q75-Y85 HydrophobicContact CG-CD1 4.22Å; Q75-Y85 HydrophobicContact CG-CE1 4.43Å; M83-Y85 PolarHBondContact O-N 2.9Å; Y85-P87 HydrophobicContact CE1-CB 4.3Å; Y85-E160 HydrophobicContact CE2-CG 4.19Å; Y85-E160 WeakPolarHBondContact CE2-OE1 3.18Å; Y85-E160 PolarHBondContact OH-OE1 3.05Å
86	M	92.5	Very high	89.2	Confident	23 Å²	23	49.3 Å²	49.3	11%	0.113	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	116.4	171.4	-71.9	-169.9	177.8	0	0	109.1	L84 Q142 D145 A146 H149 V157 I158 L159	L84-M86 HydrophobicContact CD2-CE 3.57Å; L84-M86 HydrophobicContact CD2-CG 4.34Å; L84-M86 HydrophobicContact CG-CG 4.37Å; M86-Q142 HydrophobicContact SD-CG 4.42Å; M86-D145 HydrophobicContact CE-CB 4.23Å; M86-A146 HydrophobicContact CE-CB 4.31Å; M86-A146 HydrophobicContact SD-CB 3.87Å; M86-H149 HydrophobicContact CE-CB 4.35Å; M86-V157 HydrophobicContact CB-CG1 4.45Å; M86-V157 HydrophobicContact CE-CG1 4.16Å; M86-V157 HydrophobicContact CG-CG1 3.88Å; M86-V157 HydrophobicContact SD-CG1 3.81Å; M86-I158 PolarHBondContact N-O 3.08Å; M86-L159 HydrophobicContact CB-CD2 3.64Å; M86-L159 HydrophobicContact CG-CD2 4.32Å; M86-L159 HydrophobicContact SD-CD2 3.89Å
87	P	90.4	Very high	88.8	Confident	63 Å²	63	46.4 Å²	46.4	41%	0.409	24%	0.237	S	C	.	.			trans	-69.3	160.2	-177.2	30.4	-36.1	0	0	0	111.7	Y85 A89 Q142	Y85-P87 HydrophobicContact CE1-CB 4.3Å; P87-A89 PolarHBondContact O-N 3Å; P87-Q142 PolarHBondContact O-NE2 2.92Å
88	E	88.3	Confident	88.3	Confident	52 Å²	52	48.8 Å²	48.8	24%	0.243	25%	0.251	C	S	.	.			trans	-49.6	134.2	179.8	-174.9	170.8	-168.8	0	0	112.6	D90 R139 E160 R161	E88-D90 PolarHBondContact O-N 2.79Å; E88-D90 VanDerWaalsContact O-N 3.09Å; E88-R139 IonicContact OE1-NH2 2.69Å; E88-E160 HydrophobicContact CB-CB 3.95Å; E88-R161 WeakPolarHBondContact OE1-CD 3.4Å; E88-R161 IonicContact OE1-CZ 2.71Å; E88-R161 IonicContact OE1-NE 3.43Å; E88-R161 IonicContact OE1-NH1 2.63Å; E88-R161 PolarHBondContact OE1-NH1 2.93Å; E88-R161 IonicContact OE2-NH1 2.79Å
89	A	86.3	Confident	87.7	Confident	2 Å²	2	51 Å²	51	2%	0.017	27%	0.274	C	S	.	.			trans	-63.6	111.1	176	0	0	0	0	0	111.1	P87 Y93 M138 R139 Q142	P87-A89 PolarHBondContact O-N 3Å; A89-Y93 HydrophobicContact CB-CD2 4.38Å; A89-Y93 HydrophobicContact CB-CG 4.39Å; A89-M138 HydrophobicContact CB-CB 4.17Å; A89-R139 HydrophobicContact CB-CG 3.97Å; A89-Q142 HydrophobicContact CB-CB 4.4Å; A89-Q142 VanDerWaalsContact CB-OE1 3.3Å
90	D	84.9	Confident	87.1	Confident	62 Å²	62	48.2 Å²	48.2	33%	0.332	26%	0.257	S	S	.	.			trans	-78.7	167.5	168.4	-67.6	-41.1	0	0	0	110.8	E88 F92 Y93 R96	E88-D90 PolarHBondContact O-N 2.79Å; E88-D90 VanDerWaalsContact O-N 3.09Å; D90-F92 PolarHBondContact O-N 2.95Å; D90-F92 VanDerWaalsContact O-N 3.11Å; D90-Y93 VanDerWaalsContact O-CB 3.31Å; D90-Y93 WeakPolarHBondContact O-CB 3.42Å; D90-Y93 PolarHBondContact O-N 3.45Å; D90-R96 IonicContact OD2-CZ 3.42Å; D90-R96 VanDerWaalsContact OD2-CZ 3.24Å; D90-R96 IonicContact OD2-NH1 3.08Å; D90-R96 PolarHBondContact OD2-NH1 3.45Å; D90-R96 IonicContact OD2-NH2 2.8Å; D90-R96 PolarHBondContact OD2-NH2 3.46Å
91	T	84.3	Confident	86.4	Confident	14 Å²	14	53.2 Å²	53.2	9%	0.086	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-33.8	170.5	54.2	0	0	0	0	111.7	Y93 N109 L131 W134 M135	T91-Y93 VanDerWaalsContact C-N 3.3Å; T91-Y93 PolarHBondContact O-N 2.64Å; T91-N109 PolarHBondContact O-ND2 3.42Å; T91-N109 PolarHBondContact O-OD1 3.22Å; T91-L131 HydrophobicContact CG2-CD1 4.02Å; T91-W134 PolarHBondContact O-NE1 3.18Å; T91-M135 HydrophobicContact CG2-CE 3.43Å; T91-M135 VanDerWaalsContact CG2-CE 3.43Å; T91-M135 HydrophobicContact CG2-SD 4.12Å
92	F	85.9	Confident	86.1	Confident	52 Å²	52	59.9 Å²	59.9	23%	0.228	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	17.3	-178.3	-53.1	-83.5	0	0	0	113.8	D90 L94 D95 R96 P103 L104 N109	D90-F92 PolarHBondContact O-N 2.95Å; D90-F92 VanDerWaalsContact O-N 3.11Å; F92-L94 VanDerWaalsContact C-N 3.31Å; F92-L94 PolarHBondContact O-N 2.99Å; F92-D95 PolarHBondContact O-N 2.74Å; F92-R96 PolarHBondContact O-N 3.21Å; F92-P103 HydrophobicContact CB-CB 4.24Å; F92-P103 HydrophobicContact CD1-CB 3.51Å; F92-P103 HydrophobicContact CE1-CB 4.02Å; F92-P103 HydrophobicContact CG-CB 3.88Å; F92-L104 WeakPolarHBondContact CE1-O 3.41Å; F92-N109 VanDerWaalsContact CA-ND2 3.33Å; F92-N109 WeakPolarHBondContact CA-ND2 3.14Å; F92-N109 HydrophobicContact CD1-CB 4.48Å; F92-N109 WeakPolarHBondContact CD1-ND2 3.5Å; F92-N109 HydrophobicContact CE1-CB 4.39Å; F92-N109 VanDerWaalsContact CE1-ND2 3.32Å; F92-N109 WeakPolarHBondContact CE1-ND2 3.41Å; F92-N109 WeakPolarHBondContact CG-ND2 3.26Å; F92-N109 PolarHBondContact N-ND2 3.47Å
93	Y	86.6	Confident	85.7	Confident	28 Å²	28	61.6 Å²	61.6	11%	0.11	31%	0.312	C	S	.	.	H	α-helix	trans	-58.2	-43.4	-179.9	-177.2	-95.6	0	0	0	112.2	A89 D90 T91 D95 R96 M97 L141 Q142 D145	A89-Y93 HydrophobicContact CB-CD2 4.38Å; A89-Y93 HydrophobicContact CB-CG 4.39Å; D90-Y93 VanDerWaalsContact O-CB 3.31Å; D90-Y93 WeakPolarHBondContact O-CB 3.42Å; D90-Y93 PolarHBondContact O-N 3.45Å; T91-Y93 VanDerWaalsContact C-N 3.3Å; T91-Y93 PolarHBondContact O-N 2.64Å; Y93-D95 VanDerWaalsContact C-N 3.28Å; Y93-D95 PolarHBondContact O-N 3.04Å; Y93-R96 PolarHBondContact O-N 3.2Å; Y93-M97 HydrophobicContact CE1-CB 4.41Å; Y93-M97 WeakPolarHBondContact O-CB 3.36Å; Y93-M97 PolarHBondContact O-N 2.8Å; Y93-L141 HydrophobicContact CD1-CB 4.46Å; Y93-L141 HydrophobicContact CE1-CB 4.32Å; Y93-Q142 HydrophobicContact CD1-CB 4.42Å; Y93-Q142 HydrophobicContact CE1-CB 3.87Å; Y93-Q142 HydrophobicContact CE2-CB 4.02Å; Y93-Q142 HydrophobicContact CE2-CG 3.99Å; Y93-D145 PolarHBondContact OH-OD2 3.3Å
94	L	85.4	Confident	85.3	Confident	54 Å²	54	61.9 Å²	61.9	28%	0.283	31%	0.314	S	S	.	.	H	α-helix	trans	-55.8	-40.8	177	-168.2	85.7	0	0	0	112.6	F92 M97 T98 M138 L141	F92-L94 VanDerWaalsContact C-N 3.31Å; F92-L94 PolarHBondContact O-N 2.99Å; L94-M97 WeakPolarHBondContact O-CB 3.07Å; L94-M97 PolarHBondContact O-N 2.93Å; L94-T98 WeakPolarHBondContact O-CB 3.25Å; L94-T98 WeakPolarHBondContact O-CG2 3.1Å; L94-T98 PolarHBondContact O-N 3.08Å; L94-T98 PolarHBondContact O-OG1 3.47Å; L94-M138 HydrophobicContact CB-CE 4.21Å; L94-M138 HydrophobicContact CB-SD 3.82Å; L94-M138 HydrophobicContact CD1-CE 4.49Å; L94-L141 HydrophobicContact CD1-CD1 3.59Å
95	D	85.6	Confident	84.9	Confident	7 Å²	7	62.8 Å²	62.8	4%	0.037	32%	0.322	C	S	.	.	H	α-helix	trans	-67.3	-42.5	-179.8	-61.1	-16.2	0	0	0	110.9	F92 Y93 M97 T98 G99 E100 L104	F92-D95 PolarHBondContact O-N 2.74Å; Y93-D95 VanDerWaalsContact C-N 3.28Å; Y93-D95 PolarHBondContact O-N 3.04Å; D95-M97 VanDerWaalsContact C-N 3.32Å; D95-M97 PolarHBondContact O-N 2.98Å; D95-T98 WeakPolarHBondContact CA-OG1 3.46Å; D95-T98 PolarHBondContact O-N 2.99Å; D95-T98 PolarHBondContact O-OG1 3.3Å; D95-T98 VanDerWaalsContact O-OG1 3.07Å; D95-G99 PolarHBondContact O-N 3.49Å; D95-E100 HydrophobicContact CB-CB 4.24Å; D95-E100 HydrophobicContact CB-CG 4.41Å; D95-E100 WeakPolarHBondContact O-CB 3.46Å; D95-E100 PolarHBondContact O-N 2.98Å; D95-L104 PolarHBondContact OD2-N 2.85Å
96	R	85.9	Confident	84.4	Confident	138 Å²	138	65.4 Å²	65.4	52%	0.521	33%	0.332	S	S	.	.	H	α-helix	trans	-62.7	-42.3	175.1	-65.8	-177.8	-174.5	153.6	8.8	111.3	D90 F92 Y93 G99	D90-R96 IonicContact OD2-CZ 3.42Å; D90-R96 VanDerWaalsContact OD2-CZ 3.24Å; D90-R96 IonicContact OD2-NH1 3.08Å; D90-R96 PolarHBondContact OD2-NH1 3.45Å; D90-R96 IonicContact OD2-NH2 2.8Å; D90-R96 PolarHBondContact OD2-NH2 3.46Å; F92-R96 PolarHBondContact O-N 3.21Å; Y93-R96 PolarHBondContact O-N 3.2Å; R96-G99 PolarHBondContact O-N 3.04Å
97	M	82.8	Confident	83.9	Confident	59 Å²	59	68.9 Å²	68.9	29%	0.291	35%	0.351	S	S	.	.	H	α-helix	trans	-64	-42.9	179.1	-172.7	-165.3	-171.3	0	0	112.1	Y93 L94 D95 G99 D145 K301	Y93-M97 HydrophobicContact CE1-CB 4.41Å; Y93-M97 WeakPolarHBondContact O-CB 3.36Å; Y93-M97 PolarHBondContact O-N 2.8Å; L94-M97 WeakPolarHBondContact O-CB 3.07Å; L94-M97 PolarHBondContact O-N 2.93Å; D95-M97 VanDerWaalsContact C-N 3.32Å; D95-M97 PolarHBondContact O-N 2.98Å; M97-G99 PolarHBondContact O-N 3.33Å; M97-D145 WeakPolarHBondContact CE-OD1 3.36Å; M97-D145 WeakPolarHBondContact CE-OD2 3.13Å; M97-K301 HydrophobicContact CE-CB 4.38Å; M97-K301 HydrophobicContact CE-CD 3.48Å; M97-K301 VanDerWaalsContact CE-CD 3.48Å; M97-K301 HydrophobicContact CE-CG 3.48Å; M97-K301 VanDerWaalsContact CE-CG 3.48Å
98	T	79.4	Confident	83.5	Confident	49 Å²	49	68.3 Å²	68.3	30%	0.301	34%	0.342	S	S	.	.	H	α-helix	trans	-72.7	-10.4	178.5	51.7	0	0	0	0	113	L94 D95	L94-T98 WeakPolarHBondContact O-CB 3.25Å; L94-T98 WeakPolarHBondContact O-CG2 3.1Å; L94-T98 PolarHBondContact O-N 3.08Å; L94-T98 PolarHBondContact O-OG1 3.47Å; D95-T98 WeakPolarHBondContact CA-OG1 3.46Å; D95-T98 PolarHBondContact O-N 2.99Å; D95-T98 PolarHBondContact O-OG1 3.3Å; D95-T98 VanDerWaalsContact O-OG1 3.07Å
99	G	79.7	Confident	83.2	Confident	48 Å²	48	66 Å²	66	50%	0.495	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	85	25.3	176	0	0	0	0	0	113.3	D95 R96 M97	D95-G99 PolarHBondContact O-N 3.49Å; R96-G99 PolarHBondContact O-N 3.04Å; M97-G99 PolarHBondContact O-N 3.33Å
100	E	79.7	Confident	82.5	Confident	65 Å²	65	66.8 Å²	66.8	30%	0.304	34%	0.34	S	S	.	.			trans	-66.5	137.2	173	-65.3	-54.7	143.1	0	0	110.8	D95 K337	D95-E100 HydrophobicContact CB-CB 4.24Å; D95-E100 HydrophobicContact CB-CG 4.41Å; D95-E100 WeakPolarHBondContact O-CB 3.46Å; D95-E100 PolarHBondContact O-N 2.98Å; E100-K337 WeakPolarHBondContact OE1-CE 3.47Å; E100-K337 IonicContact OE1-NZ 3Å; E100-K337 PolarHBondContact OE1-NZ 3.46Å
101	K	76.1	Confident	82.4	Confident	206 Å²	206	65.8 Å²	65.8	90%	0.896	33%	0.334	S	S	*	.	S	Bend	trans	-73.7	-33.1	179.1	-68.6	178.4	-177.5	173.6	0	111.9
102	E	81.6	Confident	82.3	Confident	158 Å²	158	65.5 Å²	65.5	74%	0.738	33%	0.332	S	S	*	.	S	Bend	trans	-127.6	141.2	-179.9	-66.7	-176.9	176.9	0	0	109.1	L104	E102-L104 PolarHBondContact O-N 3.11Å
103	P	83.4	Confident	82.2	Confident	86 Å²	86	63.8 Å²	63.8	56%	0.558	33%	0.326	S	S	*	.	P	Polyproline II helix	trans	-59.6	137	175.9	-19.7	31	0	0	0	110.9	F92	F92-P103 HydrophobicContact CB-CB 4.24Å; F92-P103 HydrophobicContact CD1-CB 3.51Å; F92-P103 HydrophobicContact CE1-CB 4.02Å; F92-P103 HydrophobicContact CG-CB 3.88Å
104	L	84.4	Confident	82.1	Confident	20 Å²	20	65.3 Å²	65.3	11%	0.105	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-69.6	157.3	179.8	-68	179.4	0	0	0	111.1	F92 D95 E102 F108 Y331 L334	F92-L104 WeakPolarHBondContact CE1-O 3.41Å; D95-L104 PolarHBondContact OD2-N 2.85Å; E102-L104 PolarHBondContact O-N 3.11Å; L104-F108 HydrophobicContact CB-CB 4.49Å; L104-Y331 HydrophobicContact CD1-CD2 4.45Å; L104-Y331 HydrophobicContact CD1-CE2 3.74Å; L104-L334 HydrophobicContact CD2-CD1 3.94Å
105	P	85.4	Confident	82.1	Confident	73 Å²	73	66.4 Å²	66.4	47%	0.474	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-50.9	144.8	171.2	-28	33.8	0	0	0	112.5	D107 F108	P105-D107 PolarHBondContact O-N 2.91Å; P105-F108 HydrophobicContact CB-CD2 3.93Å; P105-F108 HydrophobicContact CB-CE2 4.09Å; P105-F108 HydrophobicContact CG-CD2 4.05Å; P105-F108 HydrophobicContact CG-CE2 3.98Å; P105-F108 PolarHBondContact O-N 2.48Å
106	R	83.2	Confident	82	Confident	114 Å²	114	70.3 Å²	70.3	43%	0.43	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-26.6	-177.7	-63.5	-180	-177.2	-173.1	-3.9	113.2	F108 N109 M111 S113 E115	R106-F108 PolarHBondContact O-N 2.7Å; R106-N109 CarbonylContact O-C 3.59Å; R106-N109 PolarHBondContact O-N 3.07Å; R106-N109 VanDerWaalsContact O-N 3.09Å; R106-M111 VanDerWaalsContact O-CA 3.31Å; R106-M111 WeakPolarHBondContact O-CA 3.46Å; R106-M111 PolarHBondContact O-N 3.49Å; R106-M111 VanDerWaalsContact O-N 3.1Å; R106-S113 PolarHBondContact NH1-OG 3.48Å; R106-E115 IonicContact CZ-OE2 3Å; R106-E115 IonicContact NH1-OE2 2.61Å; R106-E115 PolarHBondContact NH1-OE2 3.49Å; R106-E115 VanDerWaalsContact NH1-OE2 3.08Å; R106-E115 IonicContact NH2-OE1 3.12Å; R106-E115 PolarHBondContact NH2-OE1 3.29Å; R106-E115 IonicContact NH2-OE2 2.59Å; R106-E115 PolarHBondContact NH2-OE2 3.31Å
107	D	82.8	Confident	82.1	Confident	97 Å²	97	64.2 Å²	64.2	52%	0.519	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-30.7	178.7	-67.3	-18.3	0	0	0	113.2	P105 M111	P105-D107 PolarHBondContact O-N 2.91Å; D107-M111 WeakPolarHBondContact O-CG 3.44Å
108	F	82.4	Confident	82.2	Confident	51 Å²	51	62.9 Å²	62.9	22%	0.224	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-15.2	175.7	-53.3	-60.9	0	0	0	112.4	L104 P105 R106 A330 Y331 L334	L104-F108 HydrophobicContact CB-CB 4.49Å; P105-F108 HydrophobicContact CB-CD2 3.93Å; P105-F108 HydrophobicContact CB-CE2 4.09Å; P105-F108 HydrophobicContact CG-CD2 4.05Å; P105-F108 HydrophobicContact CG-CE2 3.98Å; P105-F108 PolarHBondContact O-N 2.48Å; R106-F108 PolarHBondContact O-N 2.7Å; F108-A330 HydrophobicContact CE1-CB 4.07Å; F108-A330 HydrophobicContact CZ-CB 4.03Å; F108-Y331 HydrophobicContact CB-CD2 4.2Å; F108-Y331 AromaticContact CD1-CD2 3.9Å; F108-Y331 HydrophobicContact CD1-CD2 3.9Å; F108-Y331 HydrophobicContact CD1-CG 4.29Å; F108-Y331 HydrophobicContact CE1-CD2 4.48Å; F108-Y331 HydrophobicContact CG-CD2 4Å; F108-L334 HydrophobicContact CD2-CD1 4.15Å; F108-L334 HydrophobicContact CE2-CD1 3.89Å; F108-L334 HydrophobicContact CZ-CD1 4.31Å
109	N	81.3	Confident	82.4	Confident	3 Å²	3	63.6 Å²	63.6	2%	0.016	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.7	63	-174.1	-162.9	9.6	0	0	0	111.9	T91 F92 R106 M111 W134	T91-N109 PolarHBondContact O-ND2 3.42Å; T91-N109 PolarHBondContact O-OD1 3.22Å; F92-N109 VanDerWaalsContact CA-ND2 3.33Å; F92-N109 WeakPolarHBondContact CA-ND2 3.14Å; F92-N109 HydrophobicContact CD1-CB 4.48Å; F92-N109 WeakPolarHBondContact CD1-ND2 3.5Å; F92-N109 HydrophobicContact CE1-CB 4.39Å; F92-N109 VanDerWaalsContact CE1-ND2 3.32Å; F92-N109 WeakPolarHBondContact CE1-ND2 3.41Å; F92-N109 WeakPolarHBondContact CG-ND2 3.26Å; F92-N109 PolarHBondContact N-ND2 3.47Å; R106-N109 CarbonylContact O-C 3.59Å; R106-N109 PolarHBondContact O-N 3.07Å; R106-N109 VanDerWaalsContact O-N 3.09Å; N109-M111 PolarHBondContact O-N 3.17Å; N109-W134 WeakPolarHBondContact OD1-CZ2 3.3Å; N109-W134 PolarHBondContact OD1-NE1 3.17Å
110	G	72.6	Confident	82.6	Confident	18 Å²	18	65.3 Å²	65.3	19%	0.186	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.8	4	177.6	0	0	0	0	0	115.8	C112 R130	G110-C112 PolarHBondContact O-N 3.31Å; G110-C112 VanDerWaalsContact O-N 3.07Å; G110-R130 WeakPolarHBondContact O-CD 3.44Å; G110-R130 WeakPolarHBondContact O-CG 3.38Å; G110-R130 PolarHBondContact O-NE 3.23Å
111	M	81.6	Confident	82.7	Confident	42 Å²	42	63.4 Å²	63.4	21%	0.207	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.8	32	-176.2	-57.7	173	-153	0	0	113	R106 D107 N109 R130 I319 K327	R106-M111 VanDerWaalsContact O-CA 3.31Å; R106-M111 WeakPolarHBondContact O-CA 3.46Å; R106-M111 PolarHBondContact O-N 3.49Å; R106-M111 VanDerWaalsContact O-N 3.1Å; D107-M111 WeakPolarHBondContact O-CG 3.44Å; N109-M111 PolarHBondContact O-N 3.17Å; M111-R130 VanDerWaalsContact O-CZ 3.29Å; M111-R130 PolarHBondContact O-NE 3.07Å; M111-R130 PolarHBondContact O-NH2 2.89Å; M111-I319 HydrophobicContact CE-CD1 3.86Å; M111-K327 HydrophobicContact CE-CD 3.22Å; M111-K327 VanDerWaalsContact CE-CE 3.49Å; M111-K327 HydrophobicContact SD-CD 4.39Å; M111-K327 PolarHBondContact SD-NZ 3.38Å
112	C	82.3	Confident	83	Confident	7 Å²	7	60.2 Å²	60.2	5%	0.047	31%	0.314	C	S	.	.			trans	-112.6	151	-172.4	68.6	0	0	0	0	110.8	G110 N127 L131 W134	G110-C112 PolarHBondContact O-N 3.31Å; G110-C112 VanDerWaalsContact O-N 3.07Å; C112-N127 WeakPolarHBondContact CA-OD1 3.37Å; C112-L131 HydrophobicContact CB-CB 3.95Å; C112-L131 HydrophobicContact CB-CD1 3.81Å; C112-W134 VanDerWaalsContact SG-CD1 3.51Å
113	S	83.9	Confident	83	Confident	16 Å²	16	53.6 Å²	53.6	11%	0.112	29%	0.286	C	S	.	.			trans	-142	121.7	175.9	176.4	0	0	0	0	110.9	R106 E115 K116 F117 N127	R106-S113 PolarHBondContact NH1-OG 3.48Å; S113-E115 VanDerWaalsContact C-N 3.29Å; S113-E115 PolarHBondContact OG-N 2.97Å; S113-K116 PolarHBondContact O-N 3.05Å; S113-K116 PolarHBondContact OG-N 2.85Å; S113-F117 PolarHBondContact O-N 3.16Å; S113-N127 PolarHBondContact N-OD1 2.97Å; S113-N127 VanDerWaalsContact N-OD1 3.08Å; S113-N127 PolarHBondContact O-ND2 2.88Å
114	L	84.6	Confident	82.8	Confident	61 Å²	61	54.5 Å²	54.5	32%	0.319	30%	0.301	S	S	.	.	H	α-helix	trans	-60.4	-40.6	169.8	-77.7	163.8	0	0	0	111.4	K116 F117 Y118 L131 M135	L114-K116 VanDerWaalsContact C-N 3.31Å; L114-K116 PolarHBondContact O-N 3.47Å; L114-F117 WeakPolarHBondContact O-CB 3.33Å; L114-F117 PolarHBondContact O-N 2.92Å; L114-Y118 HydrophobicContact CB-CE2 4.34Å; L114-Y118 HydrophobicContact CD2-CE2 4.18Å; L114-Y118 WeakPolarHBondContact O-CD2 3.43Å; L114-Y118 PolarHBondContact O-N 2.9Å; L114-L131 HydrophobicContact CD2-CD1 4.25Å; L114-L131 HydrophobicContact CD2-CD2 3.73Å; L114-L131 HydrophobicContact CD2-CG 4.42Å; L114-L131 HydrophobicContact CG-CD1 4.07Å; L114-L131 HydrophobicContact CG-CD2 4.17Å; L114-M135 HydrophobicContact CD1-CE 3.57Å; L114-M135 HydrophobicContact CD2-CE 3.89Å; L114-M135 HydrophobicContact CG-CE 3.88Å
115	E	84.8	Confident	82.5	Confident	76 Å²	76	58 Å²	58	36%	0.355	32%	0.32	S	S	.	.	H	α-helix	trans	-61	-44	-179.8	-60.8	167.2	168.7	0	0	110.8	R106 S113 Y118 A119 H225	R106-E115 IonicContact CZ-OE2 3Å; R106-E115 IonicContact NH1-OE2 2.61Å; R106-E115 PolarHBondContact NH1-OE2 3.49Å; R106-E115 VanDerWaalsContact NH1-OE2 3.08Å; R106-E115 IonicContact NH2-OE1 3.12Å; R106-E115 PolarHBondContact NH2-OE1 3.29Å; R106-E115 IonicContact NH2-OE2 2.59Å; R106-E115 PolarHBondContact NH2-OE2 3.31Å; S113-E115 VanDerWaalsContact C-N 3.29Å; S113-E115 PolarHBondContact OG-N 2.97Å; E115-Y118 PolarHBondContact O-N 2.76Å; E115-A119 WeakPolarHBondContact O-CB 3.45Å; E115-A119 PolarHBondContact O-N 2.93Å; E115-H225 HydrophobicContact CB-CB 4.47Å; E115-H225 HydrophobicContact CG-CB 4.47Å
116	K	85.1	Confident	82.4	Confident	90 Å²	90	55 Å²	55	39%	0.391	30%	0.302	S	S	.	.	H	α-helix	trans	-68	-38.8	176.7	-173.7	171.1	-178.6	171.2	0	111.8	S113 L114 A119 D120 D125	S113-K116 PolarHBondContact O-N 3.05Å; S113-K116 PolarHBondContact OG-N 2.85Å; L114-K116 VanDerWaalsContact C-N 3.31Å; L114-K116 PolarHBondContact O-N 3.47Å; K116-A119 PolarHBondContact O-N 2.86Å; K116-D120 PolarHBondContact O-N 3.41Å; K116-D125 WeakPolarHBondContact CE-OD2 3.47Å; K116-D125 IonicContact NZ-OD2 3.98Å; K116-D125 PolarHBondContact NZ-OD2 3.4Å
117	F	86.6	Confident	82.7	Confident	10 Å²	10	49.7 Å²	49.7	4%	0.044	28%	0.282	C	S	.	.	H	α-helix	trans	-60.6	-44.4	175.8	172.7	-107.2	0	0	0	112.1	S113 L114 D120 P121 N127 S128 L131 M173 Y178	S113-F117 PolarHBondContact O-N 3.16Å; L114-F117 WeakPolarHBondContact O-CB 3.33Å; L114-F117 PolarHBondContact O-N 2.92Å; F117-D120 CarbonylContact O-C 3.59Å; F117-P121 HydrophobicContact CD2-CB 4.35Å; F117-P121 HydrophobicContact CE2-CB 4.13Å; F117-P121 VanDerWaalsContact O-CA 3.31Å; F117-P121 WeakPolarHBondContact O-CA 3.48Å; F117-P121 VanDerWaalsContact O-CD 3.28Å; F117-P121 WeakPolarHBondContact O-CD 3.49Å; F117-P121 WeakPolarHBondContact O-CG 3.4Å; F117-P121 VanDerWaalsContact O-N 3.13Å; F117-N127 PolarHBondContact N-ND2 3.49Å; F117-S128 WeakPolarHBondContact CD2-OG 3.44Å; F117-L131 HydrophobicContact CB-CD2 3.62Å; F117-L131 HydrophobicContact CD1-CD2 4.23Å; F117-L131 HydrophobicContact CG-CD2 3.89Å; F117-M173 HydrophobicContact CE2-CG 4.37Å; F117-M173 HydrophobicContact CE2-SD 3.66Å; F117-M173 HydrophobicContact CZ-CG 4.01Å; F117-M173 HydrophobicContact CZ-SD 3.59Å; F117-M173 VanDerWaalsContact CZ-SD 3.59Å; F117-Y178 HydrophobicContact CE2-CD2 4.21Å; F117-Y178 HydrophobicContact CZ-CD2 4.22Å
118	Y	84.2	Confident	83	Confident	30 Å²	30	45.2 Å²	45.2	12%	0.118	26%	0.259	C	S	.	.	H	α-helix	trans	-76.5	-23.7	178.4	-63.5	-54.6	0	0	0	114	L66 L114 E115 H225 L226 N228 V229	L66-Y118 VanDerWaalsContact CD2-OH 3.25Å; L66-Y118 WeakPolarHBondContact CD2-OH 3.17Å; L114-Y118 HydrophobicContact CB-CE2 4.34Å; L114-Y118 HydrophobicContact CD2-CE2 4.18Å; L114-Y118 WeakPolarHBondContact O-CD2 3.43Å; L114-Y118 PolarHBondContact O-N 2.9Å; E115-Y118 PolarHBondContact O-N 2.76Å; Y118-H225 WeakPolarHBondContact CB-O 3.24Å; Y118-L226 HydrophobicContact CD2-CD2 3.97Å; Y118-L226 HydrophobicContact CE2-CD2 3.58Å; Y118-N228 VanDerWaalsContact O-CB 3.31Å; Y118-N228 WeakPolarHBondContact O-CB 3.47Å; Y118-V229 HydrophobicContact CD1-CG2 3.58Å; Y118-V229 HydrophobicContact CE1-CG2 3.73Å; Y118-V229 HydrophobicContact CG-CG2 4.21Å
119	A	85.1	Confident	83.5	Confident	64 Å²	64	43 Å²	43	53%	0.529	25%	0.248	S	C	.	.	H	α-helix	trans	-76	-48	174.9	0	0	0	0	0	112.1	E115 K116	E115-A119 WeakPolarHBondContact O-CB 3.45Å; E115-A119 PolarHBondContact O-N 2.93Å; K116-A119 PolarHBondContact O-N 2.86Å
120	D	84.1	Confident	83.9	Confident	84 Å²	84	45.8 Å²	45.8	45%	0.449	26%	0.259	S	S	.	.			trans	-142.7	89.4	177.5	-174.6	7.4	0	0	0	111	K116 F117 K122 A123	K116-D120 PolarHBondContact O-N 3.41Å; F117-D120 CarbonylContact O-C 3.59Å; D120-K122 PolarHBondContact O-N 2.79Å; D120-K122 PolarHBondContact OD1-N 3.32Å; D120-K122 VanDerWaalsContact OD1-N 3.14Å; D120-A123 HydrophobicContact CB-CB 4.43Å; D120-A123 PolarHBondContact O-N 2.82Å; D120-A123 PolarHBondContact OD1-N 3.03Å
121	P	81.4	Confident	84.9	Confident	26 Å²	26	45.2 Å²	45.2	17%	0.169	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-15.8	178.7	-14.8	24.2	0	0	0	114	F117 S128 Y178	F117-P121 HydrophobicContact CD2-CB 4.35Å; F117-P121 HydrophobicContact CE2-CB 4.13Å; F117-P121 VanDerWaalsContact O-CA 3.31Å; F117-P121 WeakPolarHBondContact O-CA 3.48Å; F117-P121 VanDerWaalsContact O-CD 3.28Å; F117-P121 WeakPolarHBondContact O-CD 3.49Å; F117-P121 WeakPolarHBondContact O-CG 3.4Å; F117-P121 VanDerWaalsContact O-N 3.13Å; P121-S128 PolarHBondContact O-OG 3.43Å; P121-Y178 HydrophobicContact CB-CD1 3.8Å; P121-Y178 HydrophobicContact CB-CD2 3.72Å; P121-Y178 HydrophobicContact CB-CE1 3.85Å; P121-Y178 HydrophobicContact CB-CE2 3.79Å; P121-Y178 HydrophobicContact CB-CG 3.75Å; P121-Y178 HydrophobicContact CG-CE1 4.28Å; P121-Y178 HydrophobicContact CG-CE2 4.19Å
122	K	82.9	Confident	85.3	Confident	139 Å²	139	43.9 Å²	43.9	60%	0.604	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.3	13.6	-176.6	-67.7	-174.6	176.7	-177.6	0	112.6	D120 A124 Y178	D120-K122 PolarHBondContact O-N 2.79Å; D120-K122 PolarHBondContact OD1-N 3.32Å; D120-K122 VanDerWaalsContact OD1-N 3.14Å; K122-A124 PolarHBondContact O-N 3.33Å; K122-Y178 HydrophobicContact CG-CD1 3.92Å; K122-Y178 HydrophobicContact CG-CE1 4.41Å
123	A	81.1	Confident	85.8	Confident	18 Å²	18	44.6 Å²	44.6	15%	0.149	25%	0.248	C	C	.	.			trans	-54.9	134.5	176.9	0	0	0	0	0	111.3	D120 D125	D120-A123 HydrophobicContact CB-CB 4.43Å; D120-A123 PolarHBondContact O-N 2.82Å; D120-A123 PolarHBondContact OD1-N 3.03Å; A123-D125 PolarHBondContact O-N 3.49Å; A123-D125 VanDerWaalsContact O-N 3.11Å
124	A	78.3	Confident	86.3	Confident	106 Å²	106	45.9 Å²	45.9	88%	0.876	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-13.5	-178.9	0	0	0	0	0	113.9	K122 G126	K122-A124 PolarHBondContact O-N 3.33Å; A124-G126 PolarHBondContact O-N 2.97Å; A124-G126 VanDerWaalsContact O-N 3.13Å
125	D	79.5	Confident	86.6	Confident	93 Å²	93	43.6 Å²	43.6	50%	0.497	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-4.2	-177.2	-58.6	-20.2	0	0	0	114.3	K116 A123 N127	K116-D125 WeakPolarHBondContact CE-OD2 3.47Å; K116-D125 IonicContact NZ-OD2 3.98Å; K116-D125 PolarHBondContact NZ-OD2 3.4Å; A123-D125 PolarHBondContact O-N 3.49Å; A123-D125 VanDerWaalsContact O-N 3.11Å; D125-N127 PolarHBondContact O-N 2.85Å
126	G	83.4	Confident	87.1	Confident	9 Å²	9	40 Å²	40	9%	0.093	22%	0.222	C	C	.	.			trans	72.2	11	-179.6	0	0	0	0	0	114.9	A124 S128 Y129 R130 E316	A124-G126 PolarHBondContact O-N 2.97Å; A124-G126 VanDerWaalsContact O-N 3.13Å; G126-S128 PolarHBondContact O-N 3.27Å; G126-Y129 PolarHBondContact O-N 3.44Å; G126-R130 PolarHBondContact O-N 3.43Å; G126-R130 VanDerWaalsContact O-N 3.1Å; G126-E316 VanDerWaalsContact CA-CG 3.5Å
127	N	88.4	Confident	87.4	Confident	3 Å²	3	36 Å²	36	2%	0.016	21%	0.205	C	C	.	.	H	α-helix	trans	-56.2	-36.7	-176.5	179.9	56.3	0	0	0	112.7	C112 S113 F117 D125 Y129 R130 L131	C112-N127 WeakPolarHBondContact CA-OD1 3.37Å; S113-N127 PolarHBondContact N-OD1 2.97Å; S113-N127 VanDerWaalsContact N-OD1 3.08Å; S113-N127 PolarHBondContact O-ND2 2.88Å; F117-N127 PolarHBondContact N-ND2 3.49Å; D125-N127 PolarHBondContact O-N 2.85Å; N127-Y129 PolarHBondContact O-N 3.34Å; N127-R130 PolarHBondContact O-N 3.37Å; N127-L131 WeakPolarHBondContact O-CB 3.46Å; N127-L131 PolarHBondContact O-N 2.91Å
128	S	89.6	Confident	87.7	Confident	4 Å²	4	35.6 Å²	35.6	3%	0.028	20%	0.203	C	C	.	.	H	α-helix	trans	-58.7	-50.7	-178.4	-53.9	0	0	0	0	112	F117 P121 G126 Q132	F117-S128 WeakPolarHBondContact CD2-OG 3.44Å; P121-S128 PolarHBondContact O-OG 3.43Å; G126-S128 PolarHBondContact O-N 3.27Å; S128-Q132 PolarHBondContact O-N 2.73Å
129	Y	91.9	Very high	88.2	Confident	3 Å²	3	34.9 Å²	34.9	1%	0.012	20%	0.2	C	C	.	.	H	α-helix	trans	-74.4	-39.8	179.8	-173.8	-115.7	0	0	0	112.4	G126 N127 L131 Q132 L133 L170 C183 H186 Y187 L314 E316 I317	G126-Y129 PolarHBondContact O-N 3.44Å; N127-Y129 PolarHBondContact O-N 3.34Å; Y129-L131 VanDerWaalsContact C-N 3.31Å; Y129-L131 PolarHBondContact O-N 3.39Å; Y129-Q132 PolarHBondContact O-N 3.21Å; Y129-L133 PolarHBondContact O-N 2.92Å; Y129-L170 HydrophobicContact CD2-CD1 4.3Å; Y129-L170 HydrophobicContact CE2-CD1 4.03Å; Y129-C183 HydrophobicContact CD1-CB 3.89Å; Y129-C183 HydrophobicContact CD2-CB 3.56Å; Y129-C183 HydrophobicContact CE1-CB 3.99Å; Y129-C183 HydrophobicContact CE2-CB 3.65Å; Y129-C183 VanDerWaalsContact CE2-O 3.23Å; Y129-C183 WeakPolarHBondContact CE2-O 3.37Å; Y129-C183 HydrophobicContact CG-CB 3.68Å; Y129-C183 PolarHBondContact OH-O 3.27Å; Y129-H186 AromaticContact CE1-ND1 3.78Å; Y129-H186 AromaticContact CZ-ND1 3.67Å; Y129-H186 PolarHBondContact OH-ND1 3.43Å; Y129-Y187 PolarHBondContact OH-N 2.98Å; Y129-L314 HydrophobicContact CE1-CD1 4.01Å; Y129-E316 HydrophobicContact CD1-CB 4.27Å; Y129-I317 HydrophobicContact CD1-CG2 3.58Å; Y129-I317 HydrophobicContact CE1-CG2 3.67Å
130	R	91.5	Very high	88.6	Confident	62 Å²	62	31.9 Å²	31.9	23%	0.234	18%	0.175	C	C	.	.	H	α-helix	trans	-59.7	-41.7	176.6	-175.3	166.6	67.5	-133.4	4	112.1	G110 M111 G126 N127 W134	G110-R130 WeakPolarHBondContact O-CD 3.44Å; G110-R130 WeakPolarHBondContact O-CG 3.38Å; G110-R130 PolarHBondContact O-NE 3.23Å; M111-R130 VanDerWaalsContact O-CZ 3.29Å; M111-R130 PolarHBondContact O-NE 3.07Å; M111-R130 PolarHBondContact O-NH2 2.89Å; G126-R130 PolarHBondContact O-N 3.43Å; G126-R130 VanDerWaalsContact O-N 3.1Å; N127-R130 PolarHBondContact O-N 3.37Å; R130-W134 WeakPolarHBondContact O-CB 3.16Å; R130-W134 PolarHBondContact O-N 3.39Å
131	L	91.8	Very high	89	Confident	7 Å²	7	28.2 Å²	28.2	4%	0.037	16%	0.156	C	C	.	.	H	α-helix	trans	-62.6	-45.4	174.7	177.3	67.2	0	0	0	111.6	T91 C112 L114 F117 N127 Y129 W134 M135	T91-L131 HydrophobicContact CG2-CD1 4.02Å; C112-L131 HydrophobicContact CB-CB 3.95Å; C112-L131 HydrophobicContact CB-CD1 3.81Å; L114-L131 HydrophobicContact CD2-CD1 4.25Å; L114-L131 HydrophobicContact CD2-CD2 3.73Å; L114-L131 HydrophobicContact CD2-CG 4.42Å; L114-L131 HydrophobicContact CG-CD1 4.07Å; L114-L131 HydrophobicContact CG-CD2 4.17Å; F117-L131 HydrophobicContact CB-CD2 3.62Å; F117-L131 HydrophobicContact CD1-CD2 4.23Å; F117-L131 HydrophobicContact CG-CD2 3.89Å; N127-L131 WeakPolarHBondContact O-CB 3.46Å; N127-L131 PolarHBondContact O-N 2.91Å; Y129-L131 VanDerWaalsContact C-N 3.31Å; Y129-L131 PolarHBondContact O-N 3.39Å; L131-W134 PolarHBondContact O-N 3.14Å; L131-M135 HydrophobicContact CD1-CE 4.24Å; L131-M135 HydrophobicContact CD1-CG 4.27Å; L131-M135 HydrophobicContact CG-CG 4.48Å; L131-M135 WeakPolarHBondContact O-CB 3.31Å; L131-M135 VanDerWaalsContact O-CG 3.3Å; L131-M135 WeakPolarHBondContact O-CG 3.26Å; L131-M135 PolarHBondContact O-N 2.66Å
132	Q	92.1	Very high	89.6	Confident	13 Å²	13	27.1 Å²	27.1	6%	0.061	15%	0.148	C	C	.	.	H	α-helix	trans	-62.7	-45.7	179.7	-173.6	59.7	15.3	0	0	111.7	S128 Y129 W134 M135 Y136 D166 L170 M173	S128-Q132 PolarHBondContact O-N 2.73Å; Y129-Q132 PolarHBondContact O-N 3.21Å; Q132-W134 VanDerWaalsContact C-N 3.34Å; Q132-W134 PolarHBondContact O-N 3.04Å; Q132-M135 PolarHBondContact O-N 3.37Å; Q132-Y136 WeakPolarHBondContact O-CB 3.47Å; Q132-Y136 PolarHBondContact O-N 3.39Å; Q132-D166 PolarHBondContact NE2-O 2.96Å; Q132-D166 PolarHBondContact NE2-OD1 3.42Å; Q132-D166 PolarHBondContact NE2-OD2 3.4Å; Q132-L170 HydrophobicContact CG-CD1 3.99Å; Q132-M173 HydrophobicContact CB-CE 3.77Å; Q132-M173 HydrophobicContact CG-CE 3.55Å
133	L	92.4	Very high	90.2	Very high	23 Å²	23	20.6 Å²	20.6	12%	0.12	12%	0.12	C	C	.	.	H	α-helix	trans	-61.9	-43.4	176.3	-179.5	61.6	0	0	0	111.3	Y129 Y136 T137 I190 I317	Y129-L133 PolarHBondContact O-N 2.92Å; L133-Y136 WeakPolarHBondContact O-CB 3.28Å; L133-Y136 PolarHBondContact O-N 3.09Å; L133-T137 PolarHBondContact O-N 2.94Å; L133-T137 PolarHBondContact O-OG1 2.91Å; L133-I190 HydrophobicContact CD1-CD1 3.63Å; L133-I317 HydrophobicContact CD2-CB 4.47Å; L133-I317 HydrophobicContact CD2-CD1 4.49Å; L133-I317 HydrophobicContact CD2-CG2 3.93Å
134	W	92.9	Very high	90.8	Very high	42 Å²	42	19.7 Å²	19.7	16%	0.159	11%	0.113	C	C	.	.	H	α-helix	trans	-62.1	-45	176.9	-171.1	-107.1	0	0	0	112.3	T91 N109 C112 R130 L131 Q132 Y136 T137 M138	T91-W134 PolarHBondContact O-NE1 3.18Å; N109-W134 WeakPolarHBondContact OD1-CZ2 3.3Å; N109-W134 PolarHBondContact OD1-NE1 3.17Å; C112-W134 VanDerWaalsContact SG-CD1 3.51Å; R130-W134 WeakPolarHBondContact O-CB 3.16Å; R130-W134 PolarHBondContact O-N 3.39Å; L131-W134 PolarHBondContact O-N 3.14Å; Q132-W134 VanDerWaalsContact C-N 3.34Å; Q132-W134 PolarHBondContact O-N 3.04Å; W134-Y136 VanDerWaalsContact C-N 3.3Å; W134-Y136 PolarHBondContact O-N 3.26Å; W134-T137 PolarHBondContact O-N 2.94Å; W134-M138 HydrophobicContact CD2-CE 4.23Å; W134-M138 HydrophobicContact CE3-CE 4.48Å; W134-M138 HydrophobicContact CH2-CE 3.82Å; W134-M138 HydrophobicContact CZ2-CE 3.47Å; W134-M138 VanDerWaalsContact CZ2-CE 3.47Å; W134-M138 HydrophobicContact CZ2-SD 4.04Å; W134-M138 HydrophobicContact CZ3-CE 4.31Å; W134-M138 WeakPolarHBondContact O-CG 3.3Å; W134-M138 PolarHBondContact O-N 3.46Å
135	M	92.3	Very high	91.5	Very high	14 Å²	14	15.8 Å²	15.8	7%	0.069	8%	0.077	C	C	.	.	H	α-helix	trans	-61.6	-39.2	175.5	-74.8	-62.9	-165.6	0	0	112.2	T91 L114 L131 Q132 M138 R139	T91-M135 HydrophobicContact CG2-CE 3.43Å; T91-M135 VanDerWaalsContact CG2-CE 3.43Å; T91-M135 HydrophobicContact CG2-SD 4.12Å; L114-M135 HydrophobicContact CD1-CE 3.57Å; L114-M135 HydrophobicContact CD2-CE 3.89Å; L114-M135 HydrophobicContact CG-CE 3.88Å; L131-M135 HydrophobicContact CD1-CE 4.24Å; L131-M135 HydrophobicContact CD1-CG 4.27Å; L131-M135 HydrophobicContact CG-CG 4.48Å; L131-M135 WeakPolarHBondContact O-CB 3.31Å; L131-M135 VanDerWaalsContact O-CG 3.3Å; L131-M135 WeakPolarHBondContact O-CG 3.26Å; L131-M135 PolarHBondContact O-N 2.66Å; Q132-M135 PolarHBondContact O-N 3.37Å; M135-M138 PolarHBondContact O-N 3.5Å; M135-R139 WeakPolarHBondContact O-CB 3.5Å; M135-R139 VanDerWaalsContact O-CG 3.32Å; M135-R139 WeakPolarHBondContact O-CG 3.01Å; M135-R139 PolarHBondContact O-N 3.28Å
136	Y	93.8	Very high	92.2	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-59.6	-49.4	174.2	-177.2	-102.3	0	0	0	111.5	Q132 L133 W134 M138 R139 L140 P163 D166 Y187 I190 S194 I195 T308	Q132-Y136 WeakPolarHBondContact O-CB 3.47Å; Q132-Y136 PolarHBondContact O-N 3.39Å; L133-Y136 WeakPolarHBondContact O-CB 3.28Å; L133-Y136 PolarHBondContact O-N 3.09Å; W134-Y136 VanDerWaalsContact C-N 3.3Å; W134-Y136 PolarHBondContact O-N 3.26Å; Y136-M138 PolarHBondContact O-N 3.18Å; Y136-R139 PolarHBondContact O-N 3.48Å; Y136-L140 WeakPolarHBondContact O-CB 3.18Å; Y136-L140 PolarHBondContact O-N 2.85Å; Y136-P163 HydrophobicContact CE2-CB 4.13Å; Y136-D166 HydrophobicContact CD2-CB 4.02Å; Y136-D166 WeakPolarHBondContact CD2-OD2 2.9Å; Y136-Y187 AromaticContact CD2-CE2 3.84Å; Y136-Y187 HydrophobicContact CD2-CE2 3.84Å; Y136-Y187 AromaticContact CD2-CZ 3.85Å; Y136-Y187 VanDerWaalsContact CD2-OH 3.26Å; Y136-Y187 WeakPolarHBondContact CD2-OH 3.29Å; Y136-Y187 HydrophobicContact CE2-CE2 4.48Å; Y136-Y187 AromaticContact CG-CE2 3.91Å; Y136-Y187 HydrophobicContact CG-CE2 3.91Å; Y136-I190 HydrophobicContact CD1-CG2 4.1Å; Y136-I190 HydrophobicContact CE1-CG2 3.71Å; Y136-S194 PolarHBondContact OH-OG 2.6Å; Y136-I195 WeakPolarHBondContact OH-CG1 3.28Å; Y136-T308 HydrophobicContact CD1-CG2 4.18Å; Y136-T308 HydrophobicContact CE1-CG2 4.13Å
137	T	93.1	Very high	92.7	Very high	7 Å²	7	10.9 Å²	10.9	4%	0.043	5%	0.049	C	C	.	.	H	α-helix	trans	-60.5	-42.9	176.9	-56.6	0	0	0	0	111.7	L133 W134 R139 L140 L141 T308	L133-T137 PolarHBondContact O-N 2.94Å; L133-T137 PolarHBondContact O-OG1 2.91Å; W134-T137 PolarHBondContact O-N 2.94Å; T137-R139 PolarHBondContact O-N 3.01Å; T137-L140 PolarHBondContact O-N 2.88Å; T137-L141 HydrophobicContact CG2-CD1 4.37Å; T137-L141 WeakPolarHBondContact O-CG 3.43Å; T137-L141 PolarHBondContact O-N 2.68Å; T137-T308 HydrophobicContact CG2-CG2 4.33Å; T137-T308 WeakPolarHBondContact OG1-CB 3.46Å; T137-T308 PolarHBondContact OG1-OG1 3.13Å; T137-T308 VanDerWaalsContact OG1-OG1 3.1Å
138	M	93	Very high	92.9	Very high	1 Å²	1	13.3 Å²	13.3	1%	0.005	6%	0.06	C	C	.	.	H	α-helix	trans	-62.9	-42.4	177.4	-66.9	-54.6	97.6	0	0	112.1	A89 L94 W134 M135 Y136 L140 L141 Q142	A89-M138 HydrophobicContact CB-CB 4.17Å; L94-M138 HydrophobicContact CB-CE 4.21Å; L94-M138 HydrophobicContact CB-SD 3.82Å; L94-M138 HydrophobicContact CD1-CE 4.49Å; W134-M138 HydrophobicContact CD2-CE 4.23Å; W134-M138 HydrophobicContact CE3-CE 4.48Å; W134-M138 HydrophobicContact CH2-CE 3.82Å; W134-M138 HydrophobicContact CZ2-CE 3.47Å; W134-M138 VanDerWaalsContact CZ2-CE 3.47Å; W134-M138 HydrophobicContact CZ2-SD 4.04Å; W134-M138 HydrophobicContact CZ3-CE 4.31Å; W134-M138 WeakPolarHBondContact O-CG 3.3Å; W134-M138 PolarHBondContact O-N 3.46Å; M135-M138 PolarHBondContact O-N 3.5Å; Y136-M138 PolarHBondContact O-N 3.18Å; M138-L140 VanDerWaalsContact C-N 3.34Å; M138-L141 HydrophobicContact CE-CD1 3.81Å; M138-L141 PolarHBondContact O-N 3.43Å; M138-Q142 WeakPolarHBondContact O-CB 3.34Å; M138-Q142 PolarHBondContact O-N 3.06Å
139	R	93.6	Very high	93	Very high	14 Å²	14	15.1 Å²	15.1	5%	0.053	7%	0.068	C	C	.	.	H	α-helix	trans	-66.5	-36.4	175.9	-71.4	177.2	-171	165.1	14.5	112.1	E88 A89 M135 Y136 T137 Q142 Y143 P163 D166	E88-R139 IonicContact OE1-NH2 2.69Å; A89-R139 HydrophobicContact CB-CG 3.97Å; M135-R139 WeakPolarHBondContact O-CB 3.5Å; M135-R139 VanDerWaalsContact O-CG 3.32Å; M135-R139 WeakPolarHBondContact O-CG 3.01Å; M135-R139 PolarHBondContact O-N 3.28Å; Y136-R139 PolarHBondContact O-N 3.48Å; T137-R139 PolarHBondContact O-N 3.01Å; R139-Q142 PolarHBondContact O-N 3.09Å; R139-Y143 WeakPolarHBondContact O-CB 3.37Å; R139-Y143 PolarHBondContact O-N 3.33Å; R139-P163 HydrophobicContact CB-CG 4.23Å; R139-P163 WeakPolarHBondContact O-CG 3.34Å; R139-D166 IonicContact CZ-OD1 3.47Å; R139-D166 IonicContact NH1-OD1 3.99Å; R139-D166 PolarHBondContact NH1-OD1 2.92Å; R139-D166 IonicContact NH2-OD1 3.66Å
140	L	93.6	Very high	93	Very high	2 Å²	2	15 Å²	15	1%	0.01	7%	0.068	C	C	.	.	H	α-helix	trans	-65.1	-44.5	176	-166.7	72.8	0	0	0	111.1	Y136 T137 M138 Y143 S144 P163 F198 V304 T308	Y136-L140 WeakPolarHBondContact O-CB 3.18Å; Y136-L140 PolarHBondContact O-N 2.85Å; T137-L140 PolarHBondContact O-N 2.88Å; M138-L140 VanDerWaalsContact C-N 3.34Å; L140-Y143 PolarHBondContact O-N 3.22Å; L140-S144 PolarHBondContact O-N 3.25Å; L140-P163 HydrophobicContact CD1-CB 4.31Å; L140-P163 HydrophobicContact CD1-CG 4.27Å; L140-F198 HydrophobicContact CD1-CD2 3.8Å; L140-F198 HydrophobicContact CD1-CE2 3.53Å; L140-F198 HydrophobicContact CD1-CZ 4.43Å; L140-F198 HydrophobicContact CD2-CE2 4.29Å; L140-F198 HydrophobicContact CG-CE2 3.97Å; L140-V304 HydrophobicContact CD2-CG1 4.11Å; L140-V304 HydrophobicContact CG-CG1 4.12Å; L140-T308 HydrophobicContact CD2-CG2 3.48Å; L140-T308 VanDerWaalsContact CD2-CG2 3.48Å
141	L	93.2	Very high	92.9	Very high	6 Å²	6	12.1 Å²	12.1	3%	0.031	6%	0.056	C	C	.	.	H	α-helix	trans	-61.6	-45.5	174.8	-71.2	174	0	0	0	111.3	Y93 L94 T137 M138 Y143 S144 D145 K301 V304	Y93-L141 HydrophobicContact CD1-CB 4.46Å; Y93-L141 HydrophobicContact CE1-CB 4.32Å; L94-L141 HydrophobicContact CD1-CD1 3.59Å; T137-L141 HydrophobicContact CG2-CD1 4.37Å; T137-L141 WeakPolarHBondContact O-CG 3.43Å; T137-L141 PolarHBondContact O-N 2.68Å; M138-L141 HydrophobicContact CE-CD1 3.81Å; M138-L141 PolarHBondContact O-N 3.43Å; L141-Y143 VanDerWaalsContact C-N 3.31Å; L141-Y143 PolarHBondContact O-N 3.24Å; L141-S144 WeakPolarHBondContact O-CB 3.41Å; L141-S144 PolarHBondContact O-N 3.21Å; L141-S144 VanDerWaalsContact O-N 3.12Å; L141-S144 PolarHBondContact O-OG 3.37Å; L141-D145 PolarHBondContact O-N 3.36Å; L141-K301 HydrophobicContact CD2-CB 4.45Å; L141-V304 HydrophobicContact CD2-CB 4.41Å; L141-V304 HydrophobicContact CD2-CG1 4.11Å
142	Q	94	Very high	92.8	Very high	3 Å²	3	13.5 Å²	13.5	1%	0.014	7%	0.065	C	C	.	.	H	α-helix	trans	-59.4	-41.8	174.7	-178.6	176.8	38.6	0	0	112.4	M86 P87 A89 Y93 M138 R139 S144 D145 A146 L159	M86-Q142 HydrophobicContact SD-CG 4.42Å; P87-Q142 PolarHBondContact O-NE2 2.92Å; A89-Q142 HydrophobicContact CB-CB 4.4Å; A89-Q142 VanDerWaalsContact CB-OE1 3.3Å; Y93-Q142 HydrophobicContact CD1-CB 4.42Å; Y93-Q142 HydrophobicContact CE1-CB 3.87Å; Y93-Q142 HydrophobicContact CE2-CB 4.02Å; Y93-Q142 HydrophobicContact CE2-CG 3.99Å; M138-Q142 WeakPolarHBondContact O-CB 3.34Å; M138-Q142 PolarHBondContact O-N 3.06Å; R139-Q142 PolarHBondContact O-N 3.09Å; Q142-S144 VanDerWaalsContact C-N 3.29Å; Q142-S144 PolarHBondContact O-N 3.2Å; Q142-D145 WeakPolarHBondContact O-CB 3.19Å; Q142-D145 PolarHBondContact O-N 3.34Å; Q142-A146 PolarHBondContact O-N 2.95Å; Q142-L159 HydrophobicContact CG-CD2 3.82Å
143	Y	94.7	Very high	92.6	Very high	2 Å²	2	16.2 Å²	16.2	1%	0.008	8%	0.083	C	C	.	.	H	α-helix	trans	-64.4	-36.7	176.7	-162.6	-109.6	0	0	0	111.7	I59 R139 L140 L141 D145 A146 I147 L159 P163 F164 F198 L199 P200	I59-Y143 HydrophobicContact CG2-CE2 4.04Å; R139-Y143 WeakPolarHBondContact O-CB 3.37Å; R139-Y143 PolarHBondContact O-N 3.33Å; L140-Y143 PolarHBondContact O-N 3.22Å; L141-Y143 VanDerWaalsContact C-N 3.31Å; L141-Y143 PolarHBondContact O-N 3.24Å; Y143-D145 VanDerWaalsContact C-N 3.33Å; Y143-D145 PolarHBondContact O-N 2.94Å; Y143-A146 WeakPolarHBondContact O-CB 3.46Å; Y143-A146 PolarHBondContact O-N 3.04Å; Y143-I147 HydrophobicContact CD1-CD1 3.64Å; Y143-I147 HydrophobicContact CD1-CG1 4.38Å; Y143-I147 HydrophobicContact CE1-CD1 3.43Å; Y143-I147 VanDerWaalsContact CE1-CD1 3.43Å; Y143-I147 HydrophobicContact CE1-CG1 4.18Å; Y143-I147 WeakPolarHBondContact O-CG1 3.2Å; Y143-I147 PolarHBondContact O-N 2.85Å; Y143-L159 HydrophobicContact CD2-CD1 3.66Å; Y143-L159 HydrophobicContact CE2-CD1 3.97Å; Y143-P163 HydrophobicContact CG-CG 4.1Å; Y143-F164 HydrophobicContact CE1-CE2 4.03Å; Y143-F164 AromaticContact CZ-CE2 3.95Å; Y143-F198 HydrophobicContact CD1-CB 4.21Å; Y143-F198 HydrophobicContact CD1-CD1 4.39Å; Y143-F198 HydrophobicContact CD1-CG 4.27Å; Y143-F198 HydrophobicContact CE1-CB 3.98Å; Y143-F198 HydrophobicContact CE1-CG 4.5Å; Y143-L199 WeakPolarHBondContact CE1-O 3.49Å; Y143-L199 PolarHBondContact OH-O 2.9Å; Y143-P200 VanDerWaalsContact OH-C 3.26Å
144	S	93.8	Very high	92.4	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-62.7	-39.3	173	86.8	0	0	0	0	112.1	L140 L141 Q142 I147 E148 K301	L140-S144 PolarHBondContact O-N 3.25Å; L141-S144 WeakPolarHBondContact O-CB 3.41Å; L141-S144 PolarHBondContact O-N 3.21Å; L141-S144 VanDerWaalsContact O-N 3.12Å; L141-S144 PolarHBondContact O-OG 3.37Å; Q142-S144 VanDerWaalsContact C-N 3.29Å; Q142-S144 PolarHBondContact O-N 3.2Å; S144-I147 PolarHBondContact O-N 2.52Å; S144-E148 WeakPolarHBondContact O-CB 3.45Å; S144-E148 PolarHBondContact O-N 3.21Å; S144-K301 PolarHBondContact OG-NZ 3.42Å; S144-K301 VanDerWaalsContact OG-NZ 3.12Å
145	D	93.2	Very high	92.4	Very high	23 Å²	23	16.9 Å²	16.9	12%	0.123	9%	0.089	C	C	.	.	H	α-helix	trans	-67.2	-39	175.9	-66.1	-17.1	0	0	0	111.5	M86 Y93 M97 L141 Q142 Y143 E148 H149 K301	M86-D145 HydrophobicContact CE-CB 4.23Å; Y93-D145 PolarHBondContact OH-OD2 3.3Å; M97-D145 WeakPolarHBondContact CE-OD1 3.36Å; M97-D145 WeakPolarHBondContact CE-OD2 3.13Å; L141-D145 PolarHBondContact O-N 3.36Å; Q142-D145 WeakPolarHBondContact O-CB 3.19Å; Q142-D145 PolarHBondContact O-N 3.34Å; Y143-D145 VanDerWaalsContact C-N 3.33Å; Y143-D145 PolarHBondContact O-N 2.94Å; D145-E148 PolarHBondContact O-N 3.27Å; D145-H149 WeakPolarHBondContact O-CB 3.46Å; D145-H149 PolarHBondContact O-N 3.35Å; D145-K301 WeakPolarHBondContact OD1-CE 3.42Å; D145-K301 IonicContact OD1-NZ 3.78Å; D145-K301 PolarHBondContact OD1-NZ 2.65Å
146	A	94	Very high	92.5	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-62.6	-45.1	175.6	0	0	0	0	0	111.7	M86 Q142 Y143 H149 L150 V157 L159	M86-A146 HydrophobicContact CE-CB 4.31Å; M86-A146 HydrophobicContact SD-CB 3.87Å; Q142-A146 PolarHBondContact O-N 2.95Å; Y143-A146 WeakPolarHBondContact O-CB 3.46Å; Y143-A146 PolarHBondContact O-N 3.04Å; A146-H149 PolarHBondContact O-N 2.92Å; A146-L150 WeakPolarHBondContact O-CB 3.4Å; A146-L150 PolarHBondContact O-N 3.07Å; A146-V157 HydrophobicContact CB-CB 4.27Å; A146-V157 HydrophobicContact CB-CG1 3.81Å; A146-V157 HydrophobicContact CB-CG2 4.46Å; A146-L159 HydrophobicContact CB-CD1 3.76Å; A146-L159 HydrophobicContact CB-CD2 4.11Å; A146-L159 HydrophobicContact CB-CG 4.22Å
147	I	93.1	Very high	92.6	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-66	-44.3	175.9	-68.1	169.2	0	0	0	110.4	I59 Y143 S144 H149 L150 L151 F198 M294 V298	I59-I147 HydrophobicContact CD1-CG1 3.73Å; Y143-I147 HydrophobicContact CD1-CD1 3.64Å; Y143-I147 HydrophobicContact CD1-CG1 4.38Å; Y143-I147 HydrophobicContact CE1-CD1 3.43Å; Y143-I147 VanDerWaalsContact CE1-CD1 3.43Å; Y143-I147 HydrophobicContact CE1-CG1 4.18Å; Y143-I147 WeakPolarHBondContact O-CG1 3.2Å; Y143-I147 PolarHBondContact O-N 2.85Å; S144-I147 PolarHBondContact O-N 2.52Å; I147-H149 VanDerWaalsContact C-N 3.34Å; I147-H149 PolarHBondContact O-N 2.86Å; I147-L150 PolarHBondContact O-N 3.25Å; I147-L151 HydrophobicContact CG2-CD1 3.57Å; I147-L151 HydrophobicContact CG2-CG 3.96Å; I147-L151 WeakPolarHBondContact O-CB 3.43Å; I147-L151 VanDerWaalsContact O-CG 3.26Å; I147-L151 WeakPolarHBondContact O-CG 3.31Å; I147-L151 PolarHBondContact O-N 2.97Å; I147-F198 HydrophobicContact CD1-CB 4.4Å; I147-F198 HydrophobicContact CD1-CD1 3.65Å; I147-F198 HydrophobicContact CD1-CE1 4.45Å; I147-F198 HydrophobicContact CD1-CG 4.42Å; I147-M294 HydrophobicContact CG2-CE 3.88Å; I147-M294 HydrophobicContact CG2-CG 4Å; I147-M294 HydrophobicContact CG2-SD 3.97Å; I147-V298 HydrophobicContact CB-CG1 4Å; I147-V298 HydrophobicContact CG2-CG1 3.79Å; I147-V298 HydrophobicContact CG2-CG2 4.36Å
148	E	92.6	Very high	92.6	Very high	54 Å²	54	16 Å²	16	25%	0.252	8%	0.084	S	C	.	.	H	α-helix	trans	-57.9	-47.3	177.3	-174.1	179.7	178.2	0	0	111.1	S144 D145 L150 L151 T152 V298 K301	S144-E148 WeakPolarHBondContact O-CB 3.45Å; S144-E148 PolarHBondContact O-N 3.21Å; D145-E148 PolarHBondContact O-N 3.27Å; E148-L150 PolarHBondContact O-N 2.78Å; E148-L151 PolarHBondContact O-N 3.04Å; E148-T152 HydrophobicContact CG-CG2 4.15Å; E148-T152 VanDerWaalsContact O-CB 3.27Å; E148-T152 WeakPolarHBondContact O-CB 3.27Å; E148-T152 WeakPolarHBondContact O-CG2 3.42Å; E148-T152 PolarHBondContact O-N 2.9Å; E148-T152 PolarHBondContact O-OG1 3.15Å; E148-V298 HydrophobicContact CB-CB 4.34Å; E148-V298 HydrophobicContact CB-CG2 3.76Å; E148-V298 HydrophobicContact CG-CG2 4.29Å; E148-K301 WeakPolarHBondContact OE2-CE 3.5Å; E148-K301 IonicContact OE2-NZ 3.44Å; E148-K301 PolarHBondContact OE2-NZ 3.17Å
149	H	92.1	Very high	92.7	Very high	42 Å²	42	16 Å²	16	19%	0.194	9%	0.085	C	C	.	.	H	α-helix	trans	-60.2	-45	176.8	-174.3	74.3	0	0	0	111.8	L84 M86 D145 A146 I147 T152 T153 Q155 V157	L84-H149 HydrophobicContact CD2-CB 4.34Å; L84-H149 VanDerWaalsContact CD2-CD2 3.5Å; L84-H149 WeakPolarHBondContact CD2-CD2 3.44Å; M86-H149 HydrophobicContact CE-CB 4.35Å; D145-H149 WeakPolarHBondContact O-CB 3.46Å; D145-H149 PolarHBondContact O-N 3.35Å; A146-H149 PolarHBondContact O-N 2.92Å; I147-H149 VanDerWaalsContact C-N 3.34Å; I147-H149 PolarHBondContact O-N 2.86Å; H149-T152 WeakPolarHBondContact CA-OG1 3.17Å; H149-T152 PolarHBondContact O-N 2.84Å; H149-T152 PolarHBondContact O-OG1 3.4Å; H149-T153 PolarHBondContact NE2-OG1 3.27Å; H149-T153 WeakPolarHBondContact O-CB 3.27Å; H149-T153 PolarHBondContact O-N 3.02Å; H149-T153 PolarHBondContact O-OG1 2.7Å; H149-Q155 PolarHBondContact NE2-OE1 3.09Å; H149-V157 HydrophobicContact CB-CG2 4.32Å
150	L	92.6	Very high	92.6	Very high	1 Å²	1	16.1 Å²	16.1	1%	0.005	9%	0.086	C	C	.	.	H	α-helix	trans	-64.3	-44.1	179.2	-178.5	134.6	0	0	0	112.2	F53 I59 A146 I147 E148 G154	F53-L150 HydrophobicContact CE1-CD2 3.68Å; F53-L150 HydrophobicContact CE1-CG 4.34Å; F53-L150 HydrophobicContact CZ-CD2 3.82Å; I59-L150 HydrophobicContact CD1-CD1 4.43Å; I59-L150 HydrophobicContact CG1-CD1 3.65Å; A146-L150 WeakPolarHBondContact O-CB 3.4Å; A146-L150 PolarHBondContact O-N 3.07Å; I147-L150 PolarHBondContact O-N 3.25Å; E148-L150 PolarHBondContact O-N 2.78Å; L150-G154 WeakPolarHBondContact O-CA 3.37Å; L150-G154 PolarHBondContact O-N 3Å
151	L	90.1	Very high	92.3	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-72.5	-31.5	-180	-64.9	178.3	0	0	0	113	T49 F53 I147 E148 Y291 M294 R295	T49-L151 HydrophobicContact CG2-CB 4.29Å; T49-L151 HydrophobicContact CG2-CD2 4.41Å; F53-L151 HydrophobicContact CE1-CD2 4.33Å; F53-L151 HydrophobicContact CZ-CD2 3.79Å; I147-L151 HydrophobicContact CG2-CD1 3.57Å; I147-L151 HydrophobicContact CG2-CG 3.96Å; I147-L151 WeakPolarHBondContact O-CB 3.43Å; I147-L151 VanDerWaalsContact O-CG 3.26Å; I147-L151 WeakPolarHBondContact O-CG 3.31Å; I147-L151 PolarHBondContact O-N 2.97Å; E148-L151 PolarHBondContact O-N 3.04Å; L151-Y291 HydrophobicContact CD2-CD1 3.54Å; L151-Y291 HydrophobicContact CD2-CE1 4.18Å; L151-Y291 HydrophobicContact CD2-CG 4.23Å; L151-M294 HydrophobicContact CD1-CB 4.38Å; L151-M294 HydrophobicContact CD1-CE 3.71Å; L151-M294 HydrophobicContact CD1-CG 4.22Å; L151-M294 HydrophobicContact CD2-CE 3.93Å; L151-M294 HydrophobicContact CG-CE 4.24Å; L151-R295 HydrophobicContact CB-CG 4.48Å; L151-R295 HydrophobicContact CD1-CB 3.82Å; L151-R295 HydrophobicContact CD1-CG 4.47Å
152	T	88.8	Confident	92.2	Very high	36 Å²	36	16.2 Å²	16.2	22%	0.221	9%	0.085	C	C	.	.	H	α-helix	trans	-81.9	-48.7	-179.4	53.9	0	0	0	0	111.7	R52 E148 H149	R52-T152 WeakPolarHBondContact CD-O 3.36Å; R52-T152 PolarHBondContact NH1-O 3.26Å; E148-T152 HydrophobicContact CG-CG2 4.15Å; E148-T152 VanDerWaalsContact O-CB 3.27Å; E148-T152 WeakPolarHBondContact O-CB 3.27Å; E148-T152 WeakPolarHBondContact O-CG2 3.42Å; E148-T152 PolarHBondContact O-N 2.9Å; E148-T152 PolarHBondContact O-OG1 3.15Å; H149-T152 WeakPolarHBondContact CA-OG1 3.17Å; H149-T152 PolarHBondContact O-N 2.84Å; H149-T152 PolarHBondContact O-OG1 3.4Å
153	T	88.4	Confident	92	Very high	71 Å²	71	16.2 Å²	16.2	44%	0.436	9%	0.086	S	C	.	.	H	α-helix	trans	-96.8	-23.3	-172.7	69.1	0	0	0	0	113.5	H149 Q155	H149-T153 PolarHBondContact NE2-OG1 3.27Å; H149-T153 WeakPolarHBondContact O-CB 3.27Å; H149-T153 PolarHBondContact O-N 3.02Å; H149-T153 PolarHBondContact O-OG1 2.7Å; T153-Q155 PolarHBondContact O-N 3.47Å; T153-Q155 WeakPolarHBondContact OG1-CB 3.49Å; T153-Q155 PolarHBondContact OG1-N 2.88Å
154	G	88.7	Confident	91.8	Very high	5 Å²	5	17.4 Å²	17.4	5%	0.052	9%	0.091	C	C	.	.			trans	71.4	8.9	-167.9	0	0	0	0	0	113.3	S57 L150	S57-G154 WeakPolarHBondContact CB-O 3.23Å; S57-G154 PolarHBondContact OG-O 2.59Å; L150-G154 WeakPolarHBondContact O-CA 3.37Å; L150-G154 PolarHBondContact O-N 3Å
155	Q	92.4	Very high	91.7	Very high	74 Å²	74	17.4 Å²	17.4	35%	0.346	9%	0.091	S	C	.	.			trans	-84.3	138.2	175.1	-167.8	-178.1	11	0	0	110.3	G82 H149 T153	G82-Q155 PolarHBondContact O-NE2 3.05Å; H149-Q155 PolarHBondContact NE2-OE1 3.09Å; T153-Q155 PolarHBondContact O-N 3.47Å; T153-Q155 WeakPolarHBondContact OG1-CB 3.49Å; T153-Q155 PolarHBondContact OG1-N 2.88Å
156	G	93.4	Very high	91.6	Very high	2 Å²	2	16.3 Å²	16.3	2%	0.021	9%	0.085	C	C	.	.			trans	-63.9	156	172.2	0	0	0	0	0	112.4	Y56 K58 M83 L84	Y56-G156 WeakPolarHBondContact O-CA 3.37Å; Y56-G156 PolarHBondContact O-N 3.35Å; K58-G156 CarbonylContact O-C 3.47Å; K58-G156 WeakPolarHBondContact O-CA 3.4Å; M83-G156 WeakPolarHBondContact CA-O 3.41Å; M83-G156 WeakPolarHBondContact CB-O 3.34Å; L84-G156 PolarHBondContact N-O 2.85Å
157	V	95.3	Very high	91.4	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	132.4	-178.9	-173.6	0	0	0	0	109.7	K58 I59 I60 L84 M86 A146 H149 L159	K58-V157 PolarHBondContact O-N 3.1Å; I59-V157 WeakPolarHBondContact CA-O 3.46Å; I60-V157 PolarHBondContact N-O 2.98Å; L84-V157 HydrophobicContact CB-CG2 4.43Å; L84-V157 CarbonylContact O-C 3.54Å; L84-V157 WeakPolarHBondContact O-CA 3.25Å; M86-V157 HydrophobicContact CB-CG1 4.45Å; M86-V157 HydrophobicContact CE-CG1 4.16Å; M86-V157 HydrophobicContact CG-CG1 3.88Å; M86-V157 HydrophobicContact SD-CG1 3.81Å; A146-V157 HydrophobicContact CB-CB 4.27Å; A146-V157 HydrophobicContact CB-CG1 3.81Å; A146-V157 HydrophobicContact CB-CG2 4.46Å; H149-V157 HydrophobicContact CB-CG2 4.32Å; V157-L159 HydrophobicContact CG1-CD2 4.45Å; V157-L159 HydrophobicContact CG1-CG 4.17Å
158	I	95.1	Very high	91.4	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	122.4	171.7	-54.3	-169.4	0	0	0	108.7	I60 I62 A74 L77 A78 L81 M83 L84 M86	I60-I158 HydrophobicContact CB-CG1 4.34Å; I60-I158 CarbonylContact O-C 3.53Å; I60-I158 WeakPolarHBondContact O-CA 3.28Å; I62-I158 HydrophobicContact CD1-CG2 3.62Å; I62-I158 HydrophobicContact CG1-CG2 4.36Å; A74-I158 HydrophobicContact CB-CG2 4.04Å; L77-I158 HydrophobicContact CB-CD1 3.71Å; A78-I158 HydrophobicContact CB-CD1 3.94Å; A78-I158 HydrophobicContact CB-CG1 4.39Å; L81-I158 HydrophobicContact CD1-CD1 4.33Å; M83-I158 HydrophobicContact CB-CD1 4.32Å; M83-I158 HydrophobicContact CB-CG1 3.98Å; M83-I158 HydrophobicContact SD-CD1 4.12Å; M83-I158 HydrophobicContact SD-CG1 3.83Å; L84-I158 PolarHBondContact O-N 3.4Å; M86-I158 PolarHBondContact N-O 3.08Å
159	L	93.8	Very high	91.3	Very high	2 Å²	2	15.1 Å²	15.1	1%	0.01	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	144	-178.7	-72	163.3	0	0	0	111	I59 I60 T61 I62 M86 Q142 Y143 A146 V157	I59-L159 HydrophobicContact CG2-CD1 3.9Å; I60-L159 PolarHBondContact O-N 3.07Å; T61-L159 WeakPolarHBondContact CA-O 3.25Å; T61-L159 HydrophobicContact CG2-CB 4.02Å; T61-L159 HydrophobicContact CG2-CD1 4.16Å; I62-L159 PolarHBondContact N-O 2.75Å; M86-L159 HydrophobicContact CB-CD2 3.64Å; M86-L159 HydrophobicContact CG-CD2 4.32Å; M86-L159 HydrophobicContact SD-CD2 3.89Å; Q142-L159 HydrophobicContact CG-CD2 3.82Å; Y143-L159 HydrophobicContact CD2-CD1 3.66Å; Y143-L159 HydrophobicContact CE2-CD1 3.97Å; A146-L159 HydrophobicContact CB-CD1 3.76Å; A146-L159 HydrophobicContact CB-CD2 4.11Å; A146-L159 HydrophobicContact CB-CG 4.22Å; V157-L159 HydrophobicContact CG1-CD2 4.45Å; V157-L159 HydrophobicContact CG1-CG 4.17Å
160	E	90.9	Very high	91.4	Very high	16 Å²	16	13.1 Å²	13.1	8%	0.075	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	112.2	164.8	-76.7	-175.3	-111.4	0	0	110.6	G71 A74 Y85 E88	G71-E160 WeakPolarHBondContact CA-OE1 3.29Å; G71-E160 VanDerWaalsContact CA-OE2 3.29Å; G71-E160 WeakPolarHBondContact CA-OE2 2.99Å; G71-E160 PolarHBondContact N-OE2 3.39Å; A74-E160 HydrophobicContact CB-CG 4.05Å; Y85-E160 HydrophobicContact CE2-CG 4.19Å; Y85-E160 WeakPolarHBondContact CE2-OE1 3.18Å; Y85-E160 PolarHBondContact OH-OE1 3.05Å; E88-E160 HydrophobicContact CB-CB 3.95Å
161	R	89.1	Confident	91.3	Very high	9 Å²	9	15.1 Å²	15.1	3%	0.034	8%	0.081	C	C	.	.	S	Bend	trans	59.2	151.3	-171.9	-61.7	174.1	164.8	150.4	0.1	113.5	I62 D63 G64 E88 F169	I62-R161 PolarHBondContact O-N 3.26Å; D63-R161 WeakPolarHBondContact OD1-CA 3.07Å; G64-R161 PolarHBondContact O-NH2 3.11Å; E88-R161 WeakPolarHBondContact OE1-CD 3.4Å; E88-R161 IonicContact OE1-CZ 2.71Å; E88-R161 IonicContact OE1-NE 3.43Å; E88-R161 IonicContact OE1-NH1 2.63Å; E88-R161 PolarHBondContact OE1-NH1 2.93Å; E88-R161 IonicContact OE2-NH1 2.79Å; R161-F169 VanDerWaalsContact CZ-CZ 3.41Å
162	S	89.4	Confident	91.4	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.081	C	C	.	.			trans	-122	164	178.6	67.5	0	0	0	0	111.3	F164 S165 D166	S162-F164 PolarHBondContact O-N 2.99Å; S162-F164 VanDerWaalsContact O-N 3.16Å; S162-F164 PolarHBondContact OG-N 3.18Å; S162-S165 PolarHBondContact N-OG 3.41Å; S162-S165 PolarHBondContact O-N 3.26Å; S162-S165 PolarHBondContact O-OG 3.22Å; S162-S165 PolarHBondContact OG-N 3.18Å; S162-D166 PolarHBondContact O-N 3.22Å
163	P	91.4	Very high	91.5	Very high	4 Å²	4	13.5 Å²	13.5	3%	0.026	7%	0.071	C	C	.	.	G	3₁₀ helix	trans	-54.7	-29.7	169.9	-24.8	34.1	0	0	0	112.8	Y136 R139 L140 Y143 S165 D166	Y136-P163 HydrophobicContact CE2-CB 4.13Å; R139-P163 HydrophobicContact CB-CG 4.23Å; R139-P163 WeakPolarHBondContact O-CG 3.34Å; L140-P163 HydrophobicContact CD1-CB 4.31Å; L140-P163 HydrophobicContact CD1-CG 4.27Å; Y143-P163 HydrophobicContact CG-CG 4.1Å; P163-S165 VanDerWaalsContact C-N 3.32Å; P163-S165 PolarHBondContact O-N 3.25Å; P163-D166 WeakPolarHBondContact O-CB 3.46Å; P163-D166 PolarHBondContact O-N 3.3Å
164	F	89.9	Confident	91.7	Very high	27 Å²	27	14.1 Å²	14.1	12%	0.118	7%	0.068	C	C	.	.	G	3₁₀ helix	trans	-65	-36.5	177	-58.6	-89	0	0	0	112.4	Y143 S162 D166 I195 P200 F245	Y143-F164 HydrophobicContact CE1-CE2 4.03Å; Y143-F164 AromaticContact CZ-CE2 3.95Å; S162-F164 PolarHBondContact O-N 2.99Å; S162-F164 VanDerWaalsContact O-N 3.16Å; S162-F164 PolarHBondContact OG-N 3.18Å; F164-D166 VanDerWaalsContact C-N 3.3Å; F164-D166 PolarHBondContact O-N 3.04Å; F164-I195 HydrophobicContact CD1-CD1 4.16Å; F164-I195 HydrophobicContact CD1-CG2 3.97Å; F164-I195 HydrophobicContact CE1-CD1 4.43Å; F164-I195 HydrophobicContact CE1-CG2 3.31Å; F164-I195 HydrophobicContact CZ-CG2 3.98Å; F164-P200 HydrophobicContact CE1-CB 4.23Å; F164-P200 HydrophobicContact CZ-CB 4.13Å; F164-F245 HydrophobicContact CB-CE2 4.02Å
165	S	90.8	Very high	91.8	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.091	C	C	.	.	G	3₁₀ helix	trans	-74.9	-17.3	179	74.7	0	0	0	0	113.2	D63 S162 P163 M167 V168 F245	D63-S165 WeakPolarHBondContact OD1-CB 3.15Å; D63-S165 PolarHBondContact OD1-OG 3.47Å; S162-S165 PolarHBondContact N-OG 3.41Å; S162-S165 PolarHBondContact O-N 3.26Å; S162-S165 PolarHBondContact O-OG 3.22Å; S162-S165 PolarHBondContact OG-N 3.18Å; P163-S165 VanDerWaalsContact C-N 3.32Å; P163-S165 PolarHBondContact O-N 3.25Å; S165-M167 VanDerWaalsContact C-N 3.26Å; S165-M167 PolarHBondContact O-N 3.07Å; S165-V168 WeakPolarHBondContact O-CG2 3.4Å; S165-V168 PolarHBondContact O-N 3.4Å; S165-F245 VanDerWaalsContact CA-CE2 3.5Å
166	D	91	Very high	91.6	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.082	C	C	.	.	G	3₁₀ helix	trans	-66.3	-26.5	-170.4	-169.9	55.5	0	0	0	113.8	Q132 Y136 R139 S162 P163 F164 V168 F169 L170 Y187	Q132-D166 PolarHBondContact NE2-O 2.96Å; Q132-D166 PolarHBondContact NE2-OD1 3.42Å; Q132-D166 PolarHBondContact NE2-OD2 3.4Å; Y136-D166 HydrophobicContact CD2-CB 4.02Å; Y136-D166 WeakPolarHBondContact CD2-OD2 2.9Å; R139-D166 IonicContact CZ-OD1 3.47Å; R139-D166 IonicContact NH1-OD1 3.99Å; R139-D166 PolarHBondContact NH1-OD1 2.92Å; R139-D166 IonicContact NH2-OD1 3.66Å; S162-D166 PolarHBondContact O-N 3.22Å; P163-D166 WeakPolarHBondContact O-CB 3.46Å; P163-D166 PolarHBondContact O-N 3.3Å; F164-D166 VanDerWaalsContact C-N 3.3Å; F164-D166 PolarHBondContact O-N 3.04Å; D166-V168 PolarHBondContact O-N 3.03Å; D166-V168 VanDerWaalsContact O-N 3.08Å; D166-F169 PolarHBondContact O-N 2.83Å; D166-L170 PolarHBondContact O-N 3.47Å; D166-Y187 WeakPolarHBondContact CB-OH 3.46Å; D166-Y187 WeakPolarHBondContact OD2-CE2 3.31Å; D166-Y187 PolarHBondContact OD2-OH 3.11Å
167	M	90.6	Very high	91.4	Very high	20 Å²	20	19 Å²	19	10%	0.099	10%	0.104	C	C	.	.	H	α-helix	trans	-57.3	-28.1	177.8	67.2	173.2	174.7	0	0	113.4	S165 F169 L170 D171 Y187 K191 F245	S165-M167 VanDerWaalsContact C-N 3.26Å; S165-M167 PolarHBondContact O-N 3.07Å; M167-F169 VanDerWaalsContact C-N 3.27Å; M167-F169 PolarHBondContact O-N 2.85Å; M167-L170 PolarHBondContact O-N 3.5Å; M167-D171 PolarHBondContact O-N 3.35Å; M167-Y187 HydrophobicContact CB-CE1 4.48Å; M167-K191 PolarHBondContact SD-NZ 2.81Å; M167-F245 HydrophobicContact CE-CB 3.84Å; M167-F245 HydrophobicContact CE-CD2 3.85Å; M167-F245 HydrophobicContact CE-CG 4.35Å
168	V	92.5	Very high	91.1	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-66.1	-32.1	-179.5	-54.1	0	0	0	0	112	S165 D166 A172 V237 Y241 F245	S165-V168 WeakPolarHBondContact O-CG2 3.4Å; S165-V168 PolarHBondContact O-N 3.4Å; D166-V168 PolarHBondContact O-N 3.03Å; D166-V168 VanDerWaalsContact O-N 3.08Å; V168-A172 VanDerWaalsContact O-CB 3.28Å; V168-A172 WeakPolarHBondContact O-CB 3.45Å; V168-A172 PolarHBondContact O-N 2.76Å; V168-A172 VanDerWaalsContact O-N 3.09Å; V168-V237 HydrophobicContact CG2-CG1 4.44Å; V168-Y241 HydrophobicContact CB-CD2 4.22Å; V168-Y241 HydrophobicContact CB-CE2 4.27Å; V168-Y241 HydrophobicContact CB-CG 4.37Å; V168-Y241 HydrophobicContact CG1-CD1 3.88Å; V168-Y241 HydrophobicContact CG1-CD2 4.36Å; V168-Y241 HydrophobicContact CG1-CE1 4.1Å; V168-Y241 HydrophobicContact CG1-CG 4.02Å; V168-Y241 HydrophobicContact CG2-CD1 4.41Å; V168-Y241 HydrophobicContact CG2-CD2 3.91Å; V168-Y241 HydrophobicContact CG2-CE1 4.01Å; V168-Y241 HydrophobicContact CG2-CE2 3.46Å; V168-Y241 VanDerWaalsContact CG2-CE2 3.46Å; V168-Y241 HydrophobicContact CG2-CG 4.37Å; V168-F245 HydrophobicContact CG1-CB 3.72Å; V168-F245 HydrophobicContact CG1-CG 4.32Å
169	F	91.7	Very high	91	Very high	8 Å²	8	21.7 Å²	21.7	4%	0.035	12%	0.116	C	C	.	.	H	α-helix	trans	-75.3	-40.4	177.7	-64.9	-71.2	0	0	0	110.7	L66 R161 D166 M167 A172 M173 V237	L66-F169 HydrophobicContact CD1-CE1 3.97Å; R161-F169 VanDerWaalsContact CZ-CZ 3.41Å; D166-F169 PolarHBondContact O-N 2.83Å; M167-F169 VanDerWaalsContact C-N 3.27Å; M167-F169 PolarHBondContact O-N 2.85Å; F169-A172 PolarHBondContact O-N 3.39Å; F169-M173 HydrophobicContact CB-CE 4.17Å; F169-M173 WeakPolarHBondContact O-CB 3.32Å; F169-M173 VanDerWaalsContact O-CE 3.3Å; F169-M173 WeakPolarHBondContact O-CE 3.46Å; F169-M173 VanDerWaalsContact O-CG 3.26Å; F169-M173 WeakPolarHBondContact O-CG 3.12Å; F169-M173 PolarHBondContact O-N 2.91Å; F169-V237 HydrophobicContact CD1-CG2 4.15Å; F169-V237 HydrophobicContact CE1-CG1 4.07Å; F169-V237 HydrophobicContact CE1-CG2 4.36Å
170	L	92.6	Very high	90.9	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-60.6	-49.6	174.5	-170.7	86.5	0	0	0	111.6	Y129 Q132 D166 M167 A172 M173 F174 I179 V184 Y187	Y129-L170 HydrophobicContact CD2-CD1 4.3Å; Y129-L170 HydrophobicContact CE2-CD1 4.03Å; Q132-L170 HydrophobicContact CG-CD1 3.99Å; D166-L170 PolarHBondContact O-N 3.47Å; M167-L170 PolarHBondContact O-N 3.5Å; L170-A172 VanDerWaalsContact C-N 3.31Å; L170-A172 PolarHBondContact O-N 2.67Å; L170-M173 WeakPolarHBondContact O-CB 2.91Å; L170-M173 PolarHBondContact O-N 3.36Å; L170-M173 VanDerWaalsContact O-N 3.13Å; L170-F174 PolarHBondContact O-N 3.49Å; L170-I179 HydrophobicContact CD1-CD1 3.53Å; L170-I179 HydrophobicContact CG-CD1 3.83Å; L170-V184 HydrophobicContact CD2-CB 4.47Å; L170-V184 HydrophobicContact CD2-CG1 4.07Å; L170-V184 HydrophobicContact CD2-CG2 4.41Å; L170-Y187 HydrophobicContact CD1-CD2 4.13Å; L170-Y187 HydrophobicContact CD1-CG 4.05Å; L170-Y187 HydrophobicContact CD2-CD1 3.33Å; L170-Y187 HydrophobicContact CD2-CD2 4.31Å; L170-Y187 HydrophobicContact CD2-CE1 3.93Å; L170-Y187 HydrophobicContact CD2-CG 3.54Å; L170-Y187 HydrophobicContact CG-CD1 4.42Å; L170-Y187 HydrophobicContact CG-CG 4.35Å
171	D	91.8	Very high	91.1	Very high	42 Å²	42	32.4 Å²	32.4	23%	0.225	16%	0.16	C	C	.	.	H	α-helix	trans	-61.1	-42.4	178.8	-73.2	-14	0	0	0	111.1	M167 M173 F174 N175 S240	M167-D171 PolarHBondContact O-N 3.35Å; D171-M173 VanDerWaalsContact C-N 3.34Å; D171-M173 PolarHBondContact O-N 2.87Å; D171-F174 PolarHBondContact O-N 2.9Å; D171-N175 WeakPolarHBondContact O-CB 3.42Å; D171-N175 PolarHBondContact O-N 3.32Å; D171-N175 PolarHBondContact O-ND2 3.2Å; D171-S240 WeakPolarHBondContact CB-OG 3.49Å
172	A	91.8	Very high	91.2	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-62.6	-40	175.3	0	0	0	0	0	112.2	V168 F169 L170 N175 Q176 Y233 V237	V168-A172 VanDerWaalsContact O-CB 3.28Å; V168-A172 WeakPolarHBondContact O-CB 3.45Å; V168-A172 PolarHBondContact O-N 2.76Å; V168-A172 VanDerWaalsContact O-N 3.09Å; F169-A172 PolarHBondContact O-N 3.39Å; L170-A172 VanDerWaalsContact C-N 3.31Å; L170-A172 PolarHBondContact O-N 2.67Å; A172-N175 PolarHBondContact O-N 3.19Å; A172-Q176 VanDerWaalsContact O-CG 3.29Å; A172-Q176 WeakPolarHBondContact O-CG 3.33Å; A172-Q176 PolarHBondContact O-N 2.97Å; A172-Y233 HydrophobicContact CB-CD2 3.96Å; A172-Y233 HydrophobicContact CB-CE2 3.67Å; A172-V237 HydrophobicContact CB-CB 4.3Å; A172-V237 HydrophobicContact CB-CG2 3.39Å
173	M	90.9	Very high	91.4	Very high	3 Å²	3	37 Å²	37	2%	0.015	18%	0.181	C	C	.	.	H	α-helix	trans	-66.8	-37.3	175.5	-75	-172.2	-89.1	0	0	112.5	F117 Q132 F169 L170 D171 Q176 G177 Y178 I179 Y233	F117-M173 HydrophobicContact CE2-CG 4.37Å; F117-M173 HydrophobicContact CE2-SD 3.66Å; F117-M173 HydrophobicContact CZ-CG 4.01Å; F117-M173 HydrophobicContact CZ-SD 3.59Å; F117-M173 VanDerWaalsContact CZ-SD 3.59Å; Q132-M173 HydrophobicContact CB-CE 3.77Å; Q132-M173 HydrophobicContact CG-CE 3.55Å; F169-M173 HydrophobicContact CB-CE 4.17Å; F169-M173 WeakPolarHBondContact O-CB 3.32Å; F169-M173 VanDerWaalsContact O-CE 3.3Å; F169-M173 WeakPolarHBondContact O-CE 3.46Å; F169-M173 VanDerWaalsContact O-CG 3.26Å; F169-M173 WeakPolarHBondContact O-CG 3.12Å; F169-M173 PolarHBondContact O-N 2.91Å; L170-M173 WeakPolarHBondContact O-CB 2.91Å; L170-M173 PolarHBondContact O-N 3.36Å; L170-M173 VanDerWaalsContact O-N 3.13Å; D171-M173 VanDerWaalsContact C-N 3.34Å; D171-M173 PolarHBondContact O-N 2.87Å; M173-Q176 PolarHBondContact O-N 3.17Å; M173-G177 PolarHBondContact O-N 2.56Å; M173-Y178 HydrophobicContact CB-CD2 4.34Å; M173-Y178 HydrophobicContact CG-CD2 4.08Å; M173-Y178 PolarHBondContact O-N 2.93Å; M173-I179 HydrophobicContact CB-CD1 4.04Å; M173-I179 HydrophobicContact CB-CG1 4.14Å; M173-I179 HydrophobicContact CB-CG2 4.36Å; M173-Y233 HydrophobicContact CG-CE2 3.75Å
174	F	92.4	Very high	91.5	Very high	84 Å²	84	37.5 Å²	37.5	37%	0.368	18%	0.184	S	C	.	.	H	α-helix	trans	-66.4	-45	176	-177.9	-110	0	0	0	111.5	L170 D171 Q176 G177 I179 K181 V184	L170-F174 PolarHBondContact O-N 3.49Å; D171-F174 PolarHBondContact O-N 2.9Å; F174-Q176 PolarHBondContact O-N 2.92Å; F174-G177 WeakPolarHBondContact O-CA 3.31Å; F174-G177 PolarHBondContact O-N 3.46Å; F174-I179 HydrophobicContact CB-CD1 4.11Å; F174-I179 HydrophobicContact CB-CG1 4.02Å; F174-I179 HydrophobicContact CD2-CG1 4.37Å; F174-K181 HydrophobicContact CE2-CB 4.04Å; F174-K181 HydrophobicContact CE2-CG 4.49Å; F174-K181 HydrophobicContact CZ-CB 4.48Å; F174-V184 HydrophobicContact CB-CG2 4.03Å; F174-V184 HydrophobicContact CD2-CG2 3.62Å; F174-V184 HydrophobicContact CE2-CG2 4.31Å; F174-V184 HydrophobicContact CG-CG2 3.92Å
175	N	91.4	Very high	91.7	Very high	101 Å²	101	40 Å²	40	54%	0.54	20%	0.199	S	C	.	.	H	α-helix	trans	-61.4	-32.5	178	-71	-25.7	0	0	0	112.9	D171 A172 G177	D171-N175 WeakPolarHBondContact O-CB 3.42Å; D171-N175 PolarHBondContact O-N 3.32Å; D171-N175 PolarHBondContact O-ND2 3.2Å; A172-N175 PolarHBondContact O-N 3.19Å; N175-G177 VanDerWaalsContact C-N 3.3Å
176	Q	88.6	Confident	91.9	Very high	34 Å²	34	40.3 Å²	40.3	16%	0.159	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-3.8	175.4	-62.2	-58.9	-34.9	0	0	113.6	A172 M173 F174 Y178 Q232 Y233 S236	A172-Q176 VanDerWaalsContact O-CG 3.29Å; A172-Q176 WeakPolarHBondContact O-CG 3.33Å; A172-Q176 PolarHBondContact O-N 2.97Å; M173-Q176 PolarHBondContact O-N 3.17Å; F174-Q176 PolarHBondContact O-N 2.92Å; Q176-Y178 HydrophobicContact CB-CD1 3.94Å; Q176-Y178 HydrophobicContact CB-CD2 4.07Å; Q176-Y178 HydrophobicContact CB-CE1 3.63Å; Q176-Y178 HydrophobicContact CB-CE2 3.77Å; Q176-Y178 HydrophobicContact CB-CG 4.14Å; Q176-Y178 HydrophobicContact CG-CE2 4.26Å; Q176-Q232 PolarHBondContact NE2-O 2.71Å; Q176-Y233 HydrophobicContact CG-CD2 4.13Å; Q176-S236 PolarHBondContact NE2-OG 3.09Å
177	G	89.1	Confident	92	Very high	47 Å²	47	40.3 Å²	40.3	49%	0.485	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.1	32.9	-178.4	0	0	0	0	0	113.6	M173 F174 N175	M173-G177 PolarHBondContact O-N 2.56Å; F174-G177 WeakPolarHBondContact O-CA 3.31Å; F174-G177 PolarHBondContact O-N 3.46Å; N175-G177 VanDerWaalsContact C-N 3.3Å
178	Y	89.4	Confident	92.2	Very high	43 Å²	43	42.5 Å²	42.5	17%	0.169	21%	0.212	C	C	.	.			trans	-84.4	-24.2	175.3	-58.8	-18.4	0	0	0	112.5	F117 P121 K122 M173 Q176 S230 Y233	F117-Y178 HydrophobicContact CE2-CD2 4.21Å; F117-Y178 HydrophobicContact CZ-CD2 4.22Å; P121-Y178 HydrophobicContact CB-CD1 3.8Å; P121-Y178 HydrophobicContact CB-CD2 3.72Å; P121-Y178 HydrophobicContact CB-CE1 3.85Å; P121-Y178 HydrophobicContact CB-CE2 3.79Å; P121-Y178 HydrophobicContact CB-CG 3.75Å; P121-Y178 HydrophobicContact CG-CE1 4.28Å; P121-Y178 HydrophobicContact CG-CE2 4.19Å; K122-Y178 HydrophobicContact CG-CD1 3.92Å; K122-Y178 HydrophobicContact CG-CE1 4.41Å; M173-Y178 HydrophobicContact CB-CD2 4.34Å; M173-Y178 HydrophobicContact CG-CD2 4.08Å; M173-Y178 PolarHBondContact O-N 2.93Å; Q176-Y178 HydrophobicContact CB-CD1 3.94Å; Q176-Y178 HydrophobicContact CB-CD2 4.07Å; Q176-Y178 HydrophobicContact CB-CE1 3.63Å; Q176-Y178 HydrophobicContact CB-CE2 3.77Å; Q176-Y178 HydrophobicContact CB-CG 4.14Å; Q176-Y178 HydrophobicContact CG-CE2 4.26Å; Y178-S230 PolarHBondContact OH-OG 3.43Å; Y178-Y233 HydrophobicContact CE2-CD2 4.03Å
179	I	92	Very high	92.2	Very high	15 Å²	15	47.2 Å²	47.2	8%	0.077	24%	0.235	C	C	.	.	S	Bend	trans	-128.1	152.6	-177.5	60.5	174.7	0	0	0	110.9	L170 M173 F174 V184	L170-I179 HydrophobicContact CD1-CD1 3.53Å; L170-I179 HydrophobicContact CG-CD1 3.83Å; M173-I179 HydrophobicContact CB-CD1 4.04Å; M173-I179 HydrophobicContact CB-CG1 4.14Å; M173-I179 HydrophobicContact CB-CG2 4.36Å; F174-I179 HydrophobicContact CB-CD1 4.11Å; F174-I179 HydrophobicContact CB-CG1 4.02Å; F174-I179 HydrophobicContact CD2-CG1 4.37Å; I179-V184 HydrophobicContact CD1-CG2 3.7Å; I179-V184 HydrophobicContact CG1-CG2 4.25Å
180	R	92.3	Very high	92.3	Very high	99 Å²	99	46.9 Å²	46.9	37%	0.374	23%	0.233	S	C	.	.			trans	-81.8	156.7	178.2	-59.5	-172.8	-67.7	131.6	11.3	110.7	E182 C183 V184 P315 E316	R180-E182 VanDerWaalsContact C-N 3.25Å; R180-E182 IonicContact CZ-OE2 3.43Å; R180-E182 IonicContact NH1-OE2 2.6Å; R180-E182 PolarHBondContact NH1-OE2 3.41Å; R180-E182 IonicContact NH2-OE2 3.94Å; R180-E182 PolarHBondContact O-N 2.88Å; R180-C183 VanDerWaalsContact O-CB 3.32Å; R180-C183 WeakPolarHBondContact O-CB 3.35Å; R180-C183 PolarHBondContact O-N 2.95Å; R180-C183 VanDerWaalsContact O-N 3.13Å; R180-V184 PolarHBondContact O-N 2.77Å; R180-P315 VanDerWaalsContact NH2-CD 3.29Å; R180-E316 IonicContact CZ-OE1 2.97Å; R180-E316 IonicContact CZ-OE2 3.6Å; R180-E316 IonicContact NE-OE1 2.77Å; R180-E316 PolarHBondContact NE-OE1 3.34Å; R180-E316 IonicContact NH2-OE1 3.83Å; R180-E316 PolarHBondContact NH2-OE1 2.96Å; R180-E316 IonicContact NH2-OE2 2.78Å; R180-E316 PolarHBondContact NH2-OE2 3.07Å
181	K	93.5	Very high	92.2	Very high	144 Å²	144	49 Å²	49	63%	0.626	24%	0.243	S	C	*	.	H	α-helix	trans	-60.5	-35.4	178	-172.9	176.8	179.2	-179.4	0	112.6	F174 C183 V184 N185	F174-K181 HydrophobicContact CE2-CB 4.04Å; F174-K181 HydrophobicContact CE2-CG 4.49Å; F174-K181 HydrophobicContact CZ-CB 4.48Å; K181-C183 VanDerWaalsContact C-N 3.29Å; K181-C183 PolarHBondContact O-N 3.48Å; K181-V184 WeakPolarHBondContact O-CB 3.3Å; K181-V184 PolarHBondContact O-N 2.79Å; K181-V184 VanDerWaalsContact O-N 3.13Å; K181-N185 PolarHBondContact O-N 3.27Å
182	E	92.4	Very high	92.2	Very high	104 Å²	104	51.5 Å²	51.5	49%	0.486	26%	0.259	S	S	.	.	H	α-helix	trans	-58.2	-40.9	175.5	-66.1	166	-178.1	0	0	111.8	R180 V184 N185 H186 L314	R180-E182 VanDerWaalsContact C-N 3.25Å; R180-E182 IonicContact CZ-OE2 3.43Å; R180-E182 IonicContact NH1-OE2 2.6Å; R180-E182 PolarHBondContact NH1-OE2 3.41Å; R180-E182 IonicContact NH2-OE2 3.94Å; R180-E182 PolarHBondContact O-N 2.88Å; E182-V184 VanDerWaalsContact C-N 3.32Å; E182-V184 PolarHBondContact O-N 3.3Å; E182-N185 PolarHBondContact O-N 3.41Å; E182-H186 PolarHBondContact O-N 2.91Å; E182-L314 HydrophobicContact CB-CD2 4.01Å
183	C	92.4	Very high	92.2	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-65	-36.5	176.5	-53.2	0	0	0	0	112.1	Y129 R180 K181 Y187	Y129-C183 HydrophobicContact CD1-CB 3.89Å; Y129-C183 HydrophobicContact CD2-CB 3.56Å; Y129-C183 HydrophobicContact CE1-CB 3.99Å; Y129-C183 HydrophobicContact CE2-CB 3.65Å; Y129-C183 VanDerWaalsContact CE2-O 3.23Å; Y129-C183 WeakPolarHBondContact CE2-O 3.37Å; Y129-C183 HydrophobicContact CG-CB 3.68Å; Y129-C183 PolarHBondContact OH-O 3.27Å; R180-C183 VanDerWaalsContact O-CB 3.32Å; R180-C183 WeakPolarHBondContact O-CB 3.35Å; R180-C183 PolarHBondContact O-N 2.95Å; R180-C183 VanDerWaalsContact O-N 3.13Å; K181-C183 VanDerWaalsContact C-N 3.29Å; K181-C183 PolarHBondContact O-N 3.48Å; C183-Y187 WeakPolarHBondContact O-CB 3.5Å; C183-Y187 PolarHBondContact O-N 2.91Å
184	V	93.9	Very high	92.2	Very high	15 Å²	15	55.1 Å²	55.1	9%	0.091	28%	0.278	C	S	.	.	H	α-helix	trans	-66.9	-43	176.2	178.2	0	0	0	0	110.8	L170 F174 I179 R180 K181 E182 Y187 N188	L170-V184 HydrophobicContact CD2-CB 4.47Å; L170-V184 HydrophobicContact CD2-CG1 4.07Å; L170-V184 HydrophobicContact CD2-CG2 4.41Å; F174-V184 HydrophobicContact CB-CG2 4.03Å; F174-V184 HydrophobicContact CD2-CG2 3.62Å; F174-V184 HydrophobicContact CE2-CG2 4.31Å; F174-V184 HydrophobicContact CG-CG2 3.92Å; I179-V184 HydrophobicContact CD1-CG2 3.7Å; I179-V184 HydrophobicContact CG1-CG2 4.25Å; R180-V184 PolarHBondContact O-N 2.77Å; K181-V184 WeakPolarHBondContact O-CB 3.3Å; K181-V184 PolarHBondContact O-N 2.79Å; K181-V184 VanDerWaalsContact O-N 3.13Å; E182-V184 VanDerWaalsContact C-N 3.32Å; E182-V184 PolarHBondContact O-N 3.3Å; V184-Y187 PolarHBondContact O-N 3.5Å; V184-N188 PolarHBondContact O-N 3.32Å; V184-N188 PolarHBondContact O-ND2 2.87Å
185	N	94.3	Very high	92	Very high	81 Å²	81	52.4 Å²	52.4	43%	0.433	27%	0.267	S	S	.	.	H	α-helix	trans	-60.7	-47.7	176.3	-67.6	-9.5	0	0	0	111.4	K181 E182 Y187 N188 E189	K181-N185 PolarHBondContact O-N 3.27Å; E182-N185 PolarHBondContact O-N 3.41Å; N185-Y187 VanDerWaalsContact C-N 3.32Å; N185-Y187 PolarHBondContact O-N 3.3Å; N185-N188 PolarHBondContact O-N 2.95Å; N185-N188 VanDerWaalsContact O-N 3.13Å; N185-E189 PolarHBondContact O-N 3.49Å
186	H	94.5	Very high	91.8	Very high	6 Å²	6	52.6 Å²	52.6	3%	0.028	28%	0.275	C	S	.	.	H	α-helix	trans	-57.7	-43	176.2	176.6	-98.1	0	0	0	112.5	Y129 E182 N188 E189 I190 I310 L314 I317	Y129-H186 AromaticContact CE1-ND1 3.78Å; Y129-H186 AromaticContact CZ-ND1 3.67Å; Y129-H186 PolarHBondContact OH-ND1 3.43Å; E182-H186 PolarHBondContact O-N 2.91Å; H186-N188 PolarHBondContact O-N 3.43Å; H186-E189 PolarHBondContact O-N 3.5Å; H186-I190 WeakPolarHBondContact CE1-CD1 3.42Å; H186-I190 WeakPolarHBondContact O-CG1 3.36Å; H186-I190 PolarHBondContact O-N 2.86Å; H186-I190 VanDerWaalsContact O-N 3.1Å; H186-I310 WeakPolarHBondContact NE2-CG1 3.45Å; H186-L314 HydrophobicContact CB-CD1 3.55Å; H186-I317 WeakPolarHBondContact CE1-CD1 3.49Å; H186-I317 WeakPolarHBondContact NE2-CD1 3.5Å
187	Y	94.6	Very high	91.9	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-63.7	-42.3	176	179.9	-83.6	0	0	0	111.8	Y129 Y136 D166 M167 L170 C183 V184 N185 E189 I190 K191	Y129-Y187 PolarHBondContact OH-N 2.98Å; Y136-Y187 AromaticContact CD2-CE2 3.84Å; Y136-Y187 HydrophobicContact CD2-CE2 3.84Å; Y136-Y187 AromaticContact CD2-CZ 3.85Å; Y136-Y187 VanDerWaalsContact CD2-OH 3.26Å; Y136-Y187 WeakPolarHBondContact CD2-OH 3.29Å; Y136-Y187 HydrophobicContact CE2-CE2 4.48Å; Y136-Y187 AromaticContact CG-CE2 3.91Å; Y136-Y187 HydrophobicContact CG-CE2 3.91Å; D166-Y187 WeakPolarHBondContact CB-OH 3.46Å; D166-Y187 WeakPolarHBondContact OD2-CE2 3.31Å; D166-Y187 PolarHBondContact OD2-OH 3.11Å; M167-Y187 HydrophobicContact CB-CE1 4.48Å; L170-Y187 HydrophobicContact CD1-CD2 4.13Å; L170-Y187 HydrophobicContact CD1-CG 4.05Å; L170-Y187 HydrophobicContact CD2-CD1 3.33Å; L170-Y187 HydrophobicContact CD2-CD2 4.31Å; L170-Y187 HydrophobicContact CD2-CE1 3.93Å; L170-Y187 HydrophobicContact CD2-CG 3.54Å; L170-Y187 HydrophobicContact CG-CD1 4.42Å; L170-Y187 HydrophobicContact CG-CG 4.35Å; C183-Y187 WeakPolarHBondContact O-CB 3.5Å; C183-Y187 PolarHBondContact O-N 2.91Å; V184-Y187 PolarHBondContact O-N 3.5Å; N185-Y187 VanDerWaalsContact C-N 3.32Å; N185-Y187 PolarHBondContact O-N 3.3Å; Y187-E189 VanDerWaalsContact C-N 3.32Å; Y187-E189 PolarHBondContact O-N 3.45Å; Y187-I190 PolarHBondContact O-N 3.19Å; Y187-K191 HydrophobicContact CD1-CB 4.37Å; Y187-K191 HydrophobicContact CE1-CB 4.19Å; Y187-K191 HydrophobicContact CE1-CD 4.11Å; Y187-K191 HydrophobicContact CE1-CG 4.5Å; Y187-K191 VanDerWaalsContact O-CB 3.23Å; Y187-K191 WeakPolarHBondContact O-CB 3.48Å; Y187-K191 PolarHBondContact O-N 3.5Å
188	N	93.4	Very high	91.9	Very high	65 Å²	65	54 Å²	54	35%	0.348	27%	0.268	S	S	.	.	H	α-helix	trans	-64.6	-36.1	179.2	-73.3	-27.9	0	0	0	112.3	V184 N185 H186 T192	V184-N188 PolarHBondContact O-N 3.32Å; V184-N188 PolarHBondContact O-ND2 2.87Å; N185-N188 PolarHBondContact O-N 2.95Å; N185-N188 VanDerWaalsContact O-N 3.13Å; H186-N188 PolarHBondContact O-N 3.43Å; N188-T192 WeakPolarHBondContact O-CB 3.49Å; N188-T192 PolarHBondContact O-N 3.16Å; N188-T192 PolarHBondContact O-OG1 3.39Å
189	E	93.6	Very high	92	Very high	100 Å²	100	52.9 Å²	52.9	47%	0.467	27%	0.265	S	S	.	.	H	α-helix	trans	-62.6	-51.4	172.6	-72.5	176.2	-164.3	0	0	111.3	N185 H186 Y187 K191 T192 I193 I310	N185-E189 PolarHBondContact O-N 3.49Å; H186-E189 PolarHBondContact O-N 3.5Å; Y187-E189 VanDerWaalsContact C-N 3.32Å; Y187-E189 PolarHBondContact O-N 3.45Å; E189-K191 VanDerWaalsContact C-N 3.32Å; E189-K191 PolarHBondContact O-N 3.03Å; E189-T192 PolarHBondContact O-N 3.29Å; E189-T192 VanDerWaalsContact O-N 3.16Å; E189-I193 WeakPolarHBondContact O-CG1 3.44Å; E189-I193 PolarHBondContact O-N 3.47Å; E189-I310 HydrophobicContact CB-CD1 3.94Å
190	I	92.9	Very high	92	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-56.9	-47.6	176.4	-72	172	0	0	0	111	L133 Y136 H186 Y187 T192 I193 S194 T308 I310	L133-I190 HydrophobicContact CD1-CD1 3.63Å; Y136-I190 HydrophobicContact CD1-CG2 4.1Å; Y136-I190 HydrophobicContact CE1-CG2 3.71Å; H186-I190 WeakPolarHBondContact CE1-CD1 3.42Å; H186-I190 WeakPolarHBondContact O-CG1 3.36Å; H186-I190 PolarHBondContact O-N 2.86Å; H186-I190 VanDerWaalsContact O-N 3.1Å; Y187-I190 PolarHBondContact O-N 3.19Å; I190-T192 VanDerWaalsContact C-N 3.29Å; I190-T192 PolarHBondContact O-N 3.48Å; I190-I193 PolarHBondContact O-N 3.41Å; I190-S194 WeakPolarHBondContact O-CB 3.46Å; I190-S194 PolarHBondContact O-N 3.08Å; I190-S194 PolarHBondContact O-OG 3.43Å; I190-T308 VanDerWaalsContact CD1-O 3.29Å; I190-T308 WeakPolarHBondContact CD1-O 3.34Å; I190-T308 HydrophobicContact CG2-CG2 4.35Å; I190-I310 HydrophobicContact CD1-CD1 4.39Å; I190-I310 HydrophobicContact CD1-CG1 4.17Å; I190-I310 HydrophobicContact CG1-CD1 3.76Å; I190-I310 HydrophobicContact CG1-CG1 3.84Å; I190-I310 HydrophobicContact CG1-CG2 4.32Å
191	K	91.8	Very high	92.1	Very high	47 Å²	47	48 Å²	48	20%	0.204	25%	0.248	C	C	.	.	H	α-helix	trans	-57.9	-44.2	178.8	-176.9	-170.6	173.4	-170.8	0	111	M167 Y187 E189 I193 I195	M167-K191 PolarHBondContact SD-NZ 2.81Å; Y187-K191 HydrophobicContact CD1-CB 4.37Å; Y187-K191 HydrophobicContact CE1-CB 4.19Å; Y187-K191 HydrophobicContact CE1-CD 4.11Å; Y187-K191 HydrophobicContact CE1-CG 4.5Å; Y187-K191 VanDerWaalsContact O-CB 3.23Å; Y187-K191 WeakPolarHBondContact O-CB 3.48Å; Y187-K191 PolarHBondContact O-N 3.5Å; E189-K191 VanDerWaalsContact C-N 3.32Å; E189-K191 PolarHBondContact O-N 3.03Å; K191-I193 VanDerWaalsContact C-N 3.34Å; K191-I193 PolarHBondContact O-N 3.45Å; K191-I195 HydrophobicContact CD-CD1 4.08Å; K191-I195 HydrophobicContact CG-CD1 3.36Å; K191-I195 HydrophobicContact CG-CG1 3.94Å; K191-I195 WeakPolarHBondContact O-CB 3.32Å; K191-I195 WeakPolarHBondContact O-CG1 3.49Å; K191-I195 PolarHBondContact O-N 2.92Å
192	T	91.7	Very high	92	Very high	93 Å²	93	41.8 Å²	41.8	57%	0.571	22%	0.221	S	C	*	.	H	α-helix	trans	-65	-39.8	-179.4	-56.6	0	0	0	0	111.1	N188 E189 I190 C196	N188-T192 WeakPolarHBondContact O-CB 3.49Å; N188-T192 PolarHBondContact O-N 3.16Å; N188-T192 PolarHBondContact O-OG1 3.39Å; E189-T192 PolarHBondContact O-N 3.29Å; E189-T192 VanDerWaalsContact O-N 3.16Å; I190-T192 VanDerWaalsContact C-N 3.29Å; I190-T192 PolarHBondContact O-N 3.48Å; T192-C196 PolarHBondContact O-SG 2.68Å
193	I	91.9	Very high	92	Very high	79 Å²	79	36.9 Å²	36.9	41%	0.405	20%	0.198	S	C	.	.	H	α-helix	trans	-71	-49	179	-65.2	163.2	0	0	0	111	E189 I190 K191 L307 I310	E189-I193 WeakPolarHBondContact O-CG1 3.44Å; E189-I193 PolarHBondContact O-N 3.47Å; I190-I193 PolarHBondContact O-N 3.41Å; K191-I193 VanDerWaalsContact C-N 3.34Å; K191-I193 PolarHBondContact O-N 3.45Å; I193-L307 HydrophobicContact CG2-CD2 4.34Å; I193-I310 HydrophobicContact CD1-CG2 3.79Å
194	S	90.4	Very high	92.1	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-77.4	-41.8	-171.7	53.8	0	0	0	0	113.5	Y136 I190 C196 E197 F198	Y136-S194 PolarHBondContact OH-OG 2.6Å; I190-S194 WeakPolarHBondContact O-CB 3.46Å; I190-S194 PolarHBondContact O-N 3.08Å; I190-S194 PolarHBondContact O-OG 3.43Å; S194-C196 VanDerWaalsContact C-N 3.34Å; S194-C196 PolarHBondContact O-N 2.94Å; S194-E197 PolarHBondContact O-N 3.04Å; S194-F198 WeakPolarHBondContact O-CD2 3.45Å
195	I	88	Confident	92.1	Very high	28 Å²	28	36.2 Å²	36.2	14%	0.144	19%	0.194	C	C	.	.	H	α-helix	trans	-67.9	-32.9	-177	-67.3	-169.4	0	0	0	112.1	Y136 F164 K191 E197 F198	Y136-I195 WeakPolarHBondContact OH-CG1 3.28Å; F164-I195 HydrophobicContact CD1-CD1 4.16Å; F164-I195 HydrophobicContact CD1-CG2 3.97Å; F164-I195 HydrophobicContact CE1-CD1 4.43Å; F164-I195 HydrophobicContact CE1-CG2 3.31Å; F164-I195 HydrophobicContact CZ-CG2 3.98Å; K191-I195 HydrophobicContact CD-CD1 4.08Å; K191-I195 HydrophobicContact CG-CD1 3.36Å; K191-I195 HydrophobicContact CG-CG1 3.94Å; K191-I195 WeakPolarHBondContact O-CB 3.32Å; K191-I195 WeakPolarHBondContact O-CG1 3.49Å; K191-I195 PolarHBondContact O-N 2.92Å; I195-E197 PolarHBondContact O-N 2.89Å; I195-E197 VanDerWaalsContact O-N 3.17Å; I195-F198 PolarHBondContact O-N 3.24Å; I195-F198 VanDerWaalsContact O-N 3.07Å; I195-F198 VanDerWaalsContact O-O 3.06Å
196	C	87.9	Confident	92	Very high	104 Å²	104	32.5 Å²	32.5	70%	0.703	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-22.1	-179.2	-70.6	0	0	0	0	113.6	T192 S194 F198	T192-C196 PolarHBondContact O-SG 2.68Å; S194-C196 VanDerWaalsContact C-N 3.34Å; S194-C196 PolarHBondContact O-N 2.94Å; C196-F198 VanDerWaalsContact C-N 3.31Å
197	E	88.9	Confident	91.8	Very high	98 Å²	98	32.2 Å²	32.2	46%	0.458	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-11.8	178.3	-65.1	-69.3	156	0	0	113	S194 I195 L297 L307	S194-E197 PolarHBondContact O-N 3.04Å; I195-E197 PolarHBondContact O-N 2.89Å; I195-E197 VanDerWaalsContact O-N 3.17Å; E197-L297 HydrophobicContact CB-CD2 3.81Å; E197-L297 HydrophobicContact CG-CD2 4.44Å; E197-L307 HydrophobicContact CB-CD1 4.26Å; E197-L307 HydrophobicContact CG-CD1 4.05Å; E197-L307 HydrophobicContact CG-CD2 4.43Å
198	F	90.4	Very high	91.5	Very high	12 Å²	12	34.1 Å²	34.1	5%	0.053	18%	0.182	C	C	.	.	S	Bend	trans	-120	144.8	-175.7	-60.4	-72.3	0	0	0	112.6	L140 Y143 I147 S194 I195 C196 L297 V298 V304 L307	L140-F198 HydrophobicContact CD1-CD2 3.8Å; L140-F198 HydrophobicContact CD1-CE2 3.53Å; L140-F198 HydrophobicContact CD1-CZ 4.43Å; L140-F198 HydrophobicContact CD2-CE2 4.29Å; L140-F198 HydrophobicContact CG-CE2 3.97Å; Y143-F198 HydrophobicContact CD1-CB 4.21Å; Y143-F198 HydrophobicContact CD1-CD1 4.39Å; Y143-F198 HydrophobicContact CD1-CG 4.27Å; Y143-F198 HydrophobicContact CE1-CB 3.98Å; Y143-F198 HydrophobicContact CE1-CG 4.5Å; I147-F198 HydrophobicContact CD1-CB 4.4Å; I147-F198 HydrophobicContact CD1-CD1 3.65Å; I147-F198 HydrophobicContact CD1-CE1 4.45Å; I147-F198 HydrophobicContact CD1-CG 4.42Å; S194-F198 WeakPolarHBondContact O-CD2 3.45Å; I195-F198 PolarHBondContact O-N 3.24Å; I195-F198 VanDerWaalsContact O-N 3.07Å; I195-F198 VanDerWaalsContact O-O 3.06Å; C196-F198 VanDerWaalsContact C-N 3.31Å; F198-L297 HydrophobicContact CE1-CD2 4.42Å; F198-V298 HydrophobicContact CD1-CG1 4.49Å; F198-V298 HydrophobicContact CE1-CG1 3.93Å; F198-V304 HydrophobicContact CZ-CG1 3.86Å; F198-V304 HydrophobicContact CZ-CG2 4.12Å; F198-L307 HydrophobicContact CE2-CD1 4.27Å
199	L	91.1	Very high	91.1	Very high	20 Å²	20	31 Å²	31	11%	0.105	17%	0.166	C	C	.	.	P	Polyproline II helix	trans	-75.4	142.7	171.2	-58.6	174.1	0	0	0	110.1	Y143 P282 W283 Q286 M294	Y143-L199 WeakPolarHBondContact CE1-O 3.49Å; Y143-L199 PolarHBondContact OH-O 2.9Å; L199-P282 HydrophobicContact CD2-CB 4.1Å; L199-P282 HydrophobicContact CD2-CG 3.84Å; L199-W283 HydrophobicContact CB-CD2 4.32Å; L199-W283 HydrophobicContact CB-CH2 3.96Å; L199-W283 HydrophobicContact CB-CZ2 3.57Å; L199-W283 HydrophobicContact CB-CZ3 4.48Å; L199-W283 HydrophobicContact CD1-CD2 3.98Å; L199-W283 HydrophobicContact CD1-CE3 3.66Å; L199-W283 HydrophobicContact CD1-CH2 3.94Å; L199-W283 HydrophobicContact CD1-CZ2 4.23Å; L199-W283 HydrophobicContact CD1-CZ3 3.65Å; L199-Q286 HydrophobicContact CD1-CG 3.78Å; L199-Q286 HydrophobicContact CD2-CG 4.43Å; L199-M294 HydrophobicContact CD1-CE 3.84Å; L199-M294 HydrophobicContact CD1-SD 3.91Å; L199-M294 HydrophobicContact CG-SD 3.99Å
200	P	92.7	Very high	90.9	Very high	13 Å²	13	29 Å²	29	8%	0.084	16%	0.161	C	C	.	.	P	Polyproline II helix	trans	-63.4	160.4	175	28.9	-35.3	0	0	0	111.3	Y143 F164 P282 W283	Y143-P200 VanDerWaalsContact OH-C 3.26Å; F164-P200 HydrophobicContact CE1-CB 4.23Å; F164-P200 HydrophobicContact CZ-CB 4.13Å; P200-P282 HydrophobicContact CG-CG 3.95Å; P200-W283 WeakPolarHBondContact O-CZ2 3.35Å; P200-W283 PolarHBondContact O-NE1 2.74Å
201	P	93.3	Very high	90.6	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.162	C	C	.	.	P	Polyproline II helix	trans	-59.7	156.3	172.9	26.7	-35.1	0	0	0	111	I59 T61 V204 I249 S253	I59-P201 HydrophobicContact CG2-CB 4.3Å; T61-P201 HydrophobicContact CG2-CB 3.66Å; T61-P201 HydrophobicContact CG2-CG 4.08Å; P201-V204 HydrophobicContact CB-CG2 4.46Å; P201-V204 HydrophobicContact CG-CG2 3.68Å; P201-I249 HydrophobicContact CG-CD1 4.4Å; P201-S253 WeakPolarHBondContact O-CB 3.36Å
202	H	92.3	Very high	90.3	Very high	13 Å²	13	31.5 Å²	31.5	6%	0.06	17%	0.174	C	C	.	.	S	Bend	trans	-75.2	-37.6	177.8	-67.4	80.6	0	0	0	111.5	K58 I59 E254 F278 W283	K58-H202 HydrophobicContact CB-CB 4.25Å; K58-H202 HydrophobicContact CD-CB 4.11Å; K58-H202 WeakPolarHBondContact CD-CD2 3.35Å; I59-H202 PolarHBondContact N-ND1 3.35Å; I59-H202 VanDerWaalsContact N-ND1 3.17Å; I59-H202 PolarHBondContact O-N 3.11Å; H202-E254 PolarHBondContact O-N 2.99Å; H202-E254 VanDerWaalsContact O-N 3.15Å; H202-F278 HydrophobicContact CB-CD1 4.25Å; H202-F278 HydrophobicContact CB-CE1 4.3Å; H202-W283 AromaticContact CD2-CD1 3.8Å; H202-W283 AromaticContact CD2-CD2 3.9Å; H202-W283 AromaticContact CD2-CG 3.72Å; H202-W283 AromaticContact CE1-CD2 3.23Å; H202-W283 AromaticContact CE1-CE2 3.24Å; H202-W283 AromaticContact CE1-CE3 3.37Å; H202-W283 AromaticContact CE1-CG 3.91Å; H202-W283 AromaticContact CE1-CH2 3.56Å; H202-W283 AromaticContact CE1-CZ2 3.42Å; H202-W283 VanDerWaalsContact CE1-CZ2 3.42Å; H202-W283 WeakPolarHBondContact CE1-CZ2 3.47Å; H202-W283 AromaticContact CE1-CZ3 3.53Å; H202-W283 AromaticContact CE1-NE1 3.86Å; H202-W283 AromaticContact CG-NE1 3.91Å; H202-W283 AromaticContact ND1-CD2 3.93Å; H202-W283 AromaticContact ND1-CE2 3.49Å; H202-W283 AromaticContact ND1-CZ2 3.62Å; H202-W283 AromaticContact ND1-NE1 3.78Å; H202-W283 AromaticContact NE2-CD1 3.95Å; H202-W283 AromaticContact NE2-CD2 3.24Å; H202-W283 AromaticContact NE2-CE2 3.67Å; H202-W283 AromaticContact NE2-CE3 3.49Å; H202-W283 AromaticContact NE2-CG 3.47Å
203	L	92.9	Very high	90	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	134.6	-178.4	179	62.3	0	0	0	110.1	I59 I60 T61 L205 E254 L256 I273 L276 F278	I59-L203 PolarHBondContact O-N 3.48Å; I60-L203 WeakPolarHBondContact CA-O 3.47Å; I60-L203 HydrophobicContact CD1-CD2 4.23Å; I60-L203 HydrophobicContact CG1-CB 4.2Å; I60-L203 HydrophobicContact CG1-CD2 4.31Å; I60-L203 HydrophobicContact CG2-CB 4.25Å; I60-L203 HydrophobicContact CG2-CD2 3.98Å; I60-L203 HydrophobicContact CG2-CG 4.19Å; T61-L203 PolarHBondContact N-O 3.49Å; T61-L203 PolarHBondContact OG1-O 3.28Å; L203-L205 HydrophobicContact CD1-CD2 4.23Å; L203-L205 HydrophobicContact CD2-CD2 3.78Å; L203-L205 HydrophobicContact CD2-CG 4.21Å; L203-L205 HydrophobicContact CG-CD2 3.95Å; L203-L205 HydrophobicContact CG-CG 4.28Å; L203-E254 WeakPolarHBondContact CA-O 3.49Å; L203-E254 HydrophobicContact CD1-CB 3.93Å; L203-E254 WeakPolarHBondContact CD1-O 3.42Å; L203-L256 HydrophobicContact CD1-CD1 4.04Å; L203-L256 HydrophobicContact CD1-CG 3.96Å; L203-L256 HydrophobicContact CD2-CD1 4.33Å; L203-I273 HydrophobicContact CD2-CD1 4.08Å; L203-I273 HydrophobicContact CD2-CG1 3.65Å; L203-I273 HydrophobicContact CD2-CG2 4.49Å; L203-L276 HydrophobicContact CD1-CD1 3.85Å; L203-L276 HydrophobicContact CD2-CD1 4.48Å; L203-F278 HydrophobicContact CB-CE1 4.11Å
204	V	93.9	Very high	89.7	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	121.8	168.1	-174.3	0	0	0	0	109.2	T61 D63 P201 F245 I249 E254 L255 L256	T61-V204 WeakPolarHBondContact O-CA 3.48Å; T61-V204 WeakPolarHBondContact OG1-CG2 3.33Å; D63-V204 HydrophobicContact CB-CG1 4.19Å; D63-V204 WeakPolarHBondContact OD2-CG1 3.4Å; P201-V204 HydrophobicContact CB-CG2 4.46Å; P201-V204 HydrophobicContact CG-CG2 3.68Å; V204-F245 HydrophobicContact CG1-CE1 3.97Å; V204-F245 HydrophobicContact CG1-CZ 4.1Å; V204-I249 HydrophobicContact CB-CG1 4.21Å; V204-I249 HydrophobicContact CG2-CD1 3.99Å; V204-I249 HydrophobicContact CG2-CG1 3.43Å; V204-I249 VanDerWaalsContact CG2-CG1 3.43Å; V204-E254 PolarHBondContact N-O 3.11Å; V204-L255 HydrophobicContact CB-CD1 4.12Å; V204-L255 HydrophobicContact CG1-CD1 4.21Å; V204-L255 WeakPolarHBondContact O-CA 3.5Å; V204-L256 PolarHBondContact O-N 3.34Å
205	L	92.9	Very high	89.4	Confident	1 Å²	1	29.3 Å²	29.3	1%	0.005	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	105.3	173.3	-62.5	-175.6	0	0	0	108	I60 T61 I62 D63 L77 L203 L256 Y258 I269 I273	I60-L205 HydrophobicContact CG2-CD1 3.9Å; I60-L205 HydrophobicContact CG2-CG 3.97Å; T61-L205 PolarHBondContact O-N 3.4Å; I62-L205 CarbonylContact C-O 3.58Å; I62-L205 WeakPolarHBondContact CA-O 3.43Å; I62-L205 HydrophobicContact CD1-CD1 4.46Å; I62-L205 HydrophobicContact CG1-CB 3.98Å; I62-L205 HydrophobicContact CG1-CD1 3.91Å; I62-L205 HydrophobicContact CG1-CG 4.38Å; D63-L205 PolarHBondContact N-O 2.63Å; L77-L205 HydrophobicContact CD1-CD1 3.71Å; L203-L205 HydrophobicContact CD1-CD2 4.23Å; L203-L205 HydrophobicContact CD2-CD2 3.78Å; L203-L205 HydrophobicContact CD2-CG 4.21Å; L203-L205 HydrophobicContact CG-CD2 3.95Å; L203-L205 HydrophobicContact CG-CG 4.28Å; L205-L256 HydrophobicContact CD2-CB 3.67Å; L205-L256 HydrophobicContact CD2-CD1 3.72Å; L205-L256 HydrophobicContact CD2-CG 4.19Å; L205-Y258 HydrophobicContact CD2-CE2 3.98Å; L205-I269 HydrophobicContact CD1-CG2 4.13Å; L205-I273 HydrophobicContact CD1-CD1 4.45Å
206	Y	92.8	Very high	89.4	Confident	3 Å²	3	34.3 Å²	34.3	1%	0.012	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	121.4	177.2	-179.9	-101.9	0	0	0	110.7	D63 D208 Y241 L246 L256 V257 Y258	D63-Y206 HydrophobicContact CB-CD2 4.29Å; Y206-D208 HydrophobicContact CD1-CB 4.42Å; Y206-D208 HydrophobicContact CE1-CB 3.89Å; Y206-Y241 HydrophobicContact CD2-CD1 4.08Å; Y206-Y241 HydrophobicContact CD2-CE1 4.45Å; Y206-Y241 AromaticContact CE2-CD1 3.64Å; Y206-Y241 HydrophobicContact CE2-CD1 3.64Å; Y206-Y241 HydrophobicContact CE2-CD2 4.19Å; Y206-Y241 HydrophobicContact CE2-CE1 4.21Å; Y206-Y241 AromaticContact CE2-CG 3.64Å; Y206-Y241 HydrophobicContact CE2-CG 3.64Å; Y206-L246 HydrophobicContact CD1-CD1 4.1Å; Y206-L246 HydrophobicContact CD1-CD2 4.22Å; Y206-L246 HydrophobicContact CD2-CD2 4.09Å; Y206-L246 HydrophobicContact CE1-CD1 4.23Å; Y206-L246 HydrophobicContact CG-CD1 4.5Å; Y206-L246 HydrophobicContact CG-CD2 3.8Å; Y206-L256 PolarHBondContact N-O 2.99Å; Y206-V257 HydrophobicContact CD1-CG1 4.11Å; Y206-V257 HydrophobicContact CD1-CG2 4.45Å; Y206-V257 WeakPolarHBondContact O-CA 3.14Å; Y206-Y258 PolarHBondContact O-N 3.33Å
207	I	90.4	Very high	89.2	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.005	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	109.7	174	-56	179.5	0	0	0	108.6	I62 D63 K70 L73 Q209 Y258 M260 V263	I62-I207 HydrophobicContact CG2-CD1 4.07Å; I62-I207 HydrophobicContact CG2-CG1 4.47Å; D63-I207 PolarHBondContact O-N 3.06Å; K70-I207 HydrophobicContact CG-CD1 3.81Å; L73-I207 HydrophobicContact CD2-CD1 3.72Å; L73-I207 HydrophobicContact CD2-CG1 4.41Å; I207-Q209 PolarHBondContact O-N 3.19Å; I207-Y258 WeakPolarHBondContact CA-O 3.27Å; I207-M260 HydrophobicContact CG2-SD 3.83Å; I207-V263 HydrophobicContact CD1-CG1 4.29Å; I207-V263 HydrophobicContact CD1-CG2 4.25Å; I207-V263 HydrophobicContact CG1-CG2 4.12Å; I207-V263 HydrophobicContact CG2-CG2 3.93Å
208	D	88.4	Confident	88.9	Confident	39 Å²	39	28.4 Å²	28.4	21%	0.209	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	119.8	173.9	-156.4	13.2	0	0	0	109.3	Y206 K242 Y258	Y206-D208 HydrophobicContact CD1-CB 4.42Å; Y206-D208 HydrophobicContact CE1-CB 3.89Å; D208-K242 VanDerWaalsContact OD1-CE 3.25Å; D208-K242 WeakPolarHBondContact OD1-CE 3.17Å; D208-K242 IonicContact OD1-NZ 2.7Å; D208-K242 PolarHBondContact OD1-NZ 3.47Å; D208-K242 WeakPolarHBondContact OD2-CE 3.13Å; D208-K242 IonicContact OD2-NZ 2.79Å; D208-K242 PolarHBondContact OD2-NZ 2.79Å; D208-Y258 PolarHBondContact N-O 3.46Å
209	Q	85.4	Confident	88.5	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.005	16%	0.158	C	C	.	.			trans	-140.6	124.5	175.6	-167.3	-171.6	2.2	0	0	109.3	A67 S68 I207 A211 E213 V214 K217 M260	A67-Q209 PolarHBondContact O-OE1 3.08Å; S68-Q209 PolarHBondContact OG-OE1 3.31Å; I207-Q209 PolarHBondContact O-N 3.19Å; Q209-A211 PolarHBondContact O-N 2.68Å; Q209-E213 HydrophobicContact CG-CB 4.48Å; Q209-V214 HydrophobicContact CB-CG2 4.17Å; Q209-V214 VanDerWaalsContact CD-CG2 3.44Å; Q209-V214 HydrophobicContact CG-CG2 3.83Å; Q209-K217 VanDerWaalsContact NE2-CE 3.33Å; Q209-M260 HydrophobicContact CB-CG 4.16Å; Q209-M260 HydrophobicContact CB-SD 4.24Å; Q209-M260 HydrophobicContact CG-CG 3.85Å; Q209-M260 HydrophobicContact CG-SD 4.08Å
210	P	87.9	Confident	88.1	Confident	56 Å²	56	39.7 Å²	39.7	36%	0.364	19%	0.188	S	C	.	.			trans	-64	136.8	-177.8	25.6	-33.9	0	0	0	110.8	E212 E213 V214	P210-E212 PolarHBondContact O-N 3.33Å; P210-E213 HydrophobicContact CG-CB 4.08Å; P210-E213 HydrophobicContact CG-CG 3.75Å; P210-E213 PolarHBondContact O-N 3.48Å; P210-V214 PolarHBondContact O-N 2.88Å
211	A	86.8	Confident	87.1	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.008	20%	0.199	C	C	.	.	H	α-helix	trans	-51.4	-30.6	-179.3	0	0	0	0	0	114.3	Q209 V214 Q215 L234 K235 E238	Q209-A211 PolarHBondContact O-N 2.68Å; A211-V214 PolarHBondContact O-N 2.82Å; A211-Q215 PolarHBondContact O-N 3.26Å; A211-L234 HydrophobicContact CB-CB 3.81Å; A211-K235 HydrophobicContact CB-CB 4.48Å; A211-K235 HydrophobicContact CB-CG 3.65Å; A211-E238 PolarHBondContact N-OE2 3.15Å
212	E	87.1	Confident	85.7	Confident	100 Å²	100	44.8 Å²	44.8	47%	0.467	24%	0.236	S	C	.	.	H	α-helix	trans	-70.1	-39.2	-179.2	-53.7	-168.2	170	0	0	112.4	P210 Q215 K216 L231 K235	P210-E212 PolarHBondContact O-N 3.33Å; E212-Q215 PolarHBondContact O-N 3.42Å; E212-K216 WeakPolarHBondContact O-CG 3.36Å; E212-K216 PolarHBondContact O-N 3.4Å; E212-K216 VanDerWaalsContact O-N 3.17Å; E212-L231 HydrophobicContact CG-CD1 4.24Å; E212-K235 IonicContact OE1-NZ 2.93Å; E212-K235 PolarHBondContact OE1-NZ 2.92Å
213	E	85.1	Confident	84.9	Confident	89 Å²	89	50.5 Å²	50.5	42%	0.416	26%	0.26	S	S	.	.	H	α-helix	trans	-71.4	-37.7	174.3	-69.9	-176.6	-179.9	0	0	111.6	Q209 P210 Q215 K216 K217	Q209-E213 HydrophobicContact CG-CB 4.48Å; P210-E213 HydrophobicContact CG-CB 4.08Å; P210-E213 HydrophobicContact CG-CG 3.75Å; P210-E213 PolarHBondContact O-N 3.48Å; E213-Q215 VanDerWaalsContact C-N 3.29Å; E213-Q215 PolarHBondContact O-N 3.33Å; E213-K216 PolarHBondContact O-N 2.76Å; E213-K217 WeakPolarHBondContact O-CG 3.42Å; E213-K217 PolarHBondContact O-N 2.61Å
214	V	84.9	Confident	83.9	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-58.2	-45.8	174	175.9	0	0	0	0	109.7	N65 A67 Q209 P210 A211 K216 K217 L218 L234	N65-V214 HydrophobicContact CB-CG1 4.44Å; N65-V214 HydrophobicContact CB-CG2 3.83Å; A67-V214 HydrophobicContact CB-CG1 3.99Å; Q209-V214 HydrophobicContact CB-CG2 4.17Å; Q209-V214 VanDerWaalsContact CD-CG2 3.44Å; Q209-V214 HydrophobicContact CG-CG2 3.83Å; P210-V214 PolarHBondContact O-N 2.88Å; A211-V214 PolarHBondContact O-N 2.82Å; V214-K216 VanDerWaalsContact C-N 3.35Å; V214-K216 PolarHBondContact O-N 3.32Å; V214-K217 PolarHBondContact O-N 3.41Å; V214-L218 HydrophobicContact CG1-CD1 3.93Å; V214-L218 HydrophobicContact CG1-CG 4.3Å; V214-L218 WeakPolarHBondContact O-CB 3.42Å; V214-L218 VanDerWaalsContact O-CG 3.29Å; V214-L218 WeakPolarHBondContact O-CG 3.19Å; V214-L218 PolarHBondContact O-N 3.29Å; V214-L234 HydrophobicContact CB-CD1 4.41Å; V214-L234 HydrophobicContact CG1-CD1 4.01Å; V214-L234 HydrophobicContact CG1-CD2 4.13Å
215	Q	85.2	Confident	82.8	Confident	36 Å²	36	57.9 Å²	57.9	17%	0.168	30%	0.302	C	S	.	.	H	α-helix	trans	-62.5	-40.8	177.6	-162.9	-171.6	43.2	0	0	112.3	A211 E212 E213 L218 K219 L234	A211-Q215 PolarHBondContact O-N 3.26Å; E212-Q215 PolarHBondContact O-N 3.42Å; E213-Q215 VanDerWaalsContact C-N 3.29Å; E213-Q215 PolarHBondContact O-N 3.33Å; Q215-L218 PolarHBondContact O-N 3.13Å; Q215-K219 WeakPolarHBondContact O-CG 3.18Å; Q215-K219 PolarHBondContact O-N 3.26Å; Q215-L234 HydrophobicContact CB-CD1 4.04Å; Q215-L234 HydrophobicContact CG-CD1 4.5Å
216	K	86.3	Confident	81.8	Confident	133 Å²	133	59.5 Å²	59.5	58%	0.578	31%	0.31	S	S	*	.	H	α-helix	trans	-60.5	-45.8	175.1	-71.7	174.6	-175.8	174.3	0	111.3	E212 E213 V214 K219 Q220	E212-K216 WeakPolarHBondContact O-CG 3.36Å; E212-K216 PolarHBondContact O-N 3.4Å; E212-K216 VanDerWaalsContact O-N 3.17Å; E213-K216 PolarHBondContact O-N 2.76Å; V214-K216 VanDerWaalsContact C-N 3.35Å; V214-K216 PolarHBondContact O-N 3.32Å; K216-K219 PolarHBondContact O-N 2.99Å; K216-Q220 WeakPolarHBondContact O-CB 3.06Å; K216-Q220 VanDerWaalsContact O-CG 3.27Å; K216-Q220 WeakPolarHBondContact O-CG 3.05Å; K216-Q220 PolarHBondContact O-N 2.89Å
217	K	84.3	Confident	80.8	Confident	69 Å²	69	63.6 Å²	63.6	30%	0.3	33%	0.329	S	S	.	.	H	α-helix	trans	-63.7	-39.4	176.2	-72	-177.1	-177.1	170.8	0	112.5	A67 Q209 E213 V214 Q220 S221	A67-K217 HydrophobicContact CB-CB 4Å; A67-K217 WeakPolarHBondContact O-CD 3.33Å; Q209-K217 VanDerWaalsContact NE2-CE 3.33Å; E213-K217 WeakPolarHBondContact O-CG 3.42Å; E213-K217 PolarHBondContact O-N 2.61Å; V214-K217 PolarHBondContact O-N 3.41Å; K217-Q220 PolarHBondContact O-N 2.9Å; K217-S221 WeakPolarHBondContact O-CB 3.26Å; K217-S221 PolarHBondContact O-N 2.94Å
218	L	83.3	Confident	80.2	Confident	10 Å²	10	68.6 Å²	68.6	5%	0.052	36%	0.356	C	S	.	.	H	α-helix	trans	-66.1	-37.5	176.6	-71.8	173.1	0	0	0	112.1	A67 V214 Q215 S221 L226 V229 L234	A67-L218 HydrophobicContact CB-CD2 3.89Å; A67-L218 HydrophobicContact CB-CG 3.98Å; V214-L218 HydrophobicContact CG1-CD1 3.93Å; V214-L218 HydrophobicContact CG1-CG 4.3Å; V214-L218 WeakPolarHBondContact O-CB 3.42Å; V214-L218 VanDerWaalsContact O-CG 3.29Å; V214-L218 WeakPolarHBondContact O-CG 3.19Å; V214-L218 PolarHBondContact O-N 3.29Å; Q215-L218 PolarHBondContact O-N 3.13Å; L218-S221 WeakPolarHBondContact O-CB 3.22Å; L218-S221 PolarHBondContact O-N 3.1Å; L218-L226 HydrophobicContact CD2-CB 4.31Å; L218-L226 HydrophobicContact CD2-CD1 4.29Å; L218-V229 HydrophobicContact CD1-CB 4.37Å; L218-V229 HydrophobicContact CD1-CG1 4.49Å; L218-V229 HydrophobicContact CD1-CG2 4.49Å; L218-L234 HydrophobicContact CD1-CD1 4.04Å; L218-L234 HydrophobicContact CD1-CD2 4.41Å
219	K	82.2	Confident	79.8	Confident	112 Å²	112	67.1 Å²	67.1	49%	0.487	35%	0.349	S	S	.	.	H	α-helix	trans	-68.6	-36.5	173.7	-73.7	177	176.8	177	0	112.7	Q215 K216 S221	Q215-K219 WeakPolarHBondContact O-CG 3.18Å; Q215-K219 PolarHBondContact O-N 3.26Å; K216-K219 PolarHBondContact O-N 2.99Å; K219-S221 VanDerWaalsContact C-N 3.31Å
220	Q	82.4	Confident	79.8	Confident	157 Å²	157	68.8 Å²	68.8	73%	0.734	36%	0.361	S	S	*	.	H	α-helix	trans	-71.9	-27.1	174.5	-72.1	170.9	-5.7	0	0	112.4	K216 K217 G222	K216-Q220 WeakPolarHBondContact O-CB 3.06Å; K216-Q220 VanDerWaalsContact O-CG 3.27Å; K216-Q220 WeakPolarHBondContact O-CG 3.05Å; K216-Q220 PolarHBondContact O-N 2.89Å; K217-Q220 PolarHBondContact O-N 2.9Å; Q220-G222 PolarHBondContact O-N 3.35Å
221	S	71.6	Confident	79.7	Confident	45 Å²	45	68.6 Å²	68.6	32%	0.315	36%	0.356	S	S	.	.	S	Bend	trans	-64.9	116.6	170.7	-169.3	0	0	0	0	108.3	K217 L218 K219 K223	K217-S221 WeakPolarHBondContact O-CB 3.26Å; K217-S221 PolarHBondContact O-N 2.94Å; L218-S221 WeakPolarHBondContact O-CB 3.22Å; L218-S221 PolarHBondContact O-N 3.1Å; K219-S221 VanDerWaalsContact C-N 3.31Å; S221-K223 PolarHBondContact O-N 3.31Å
222	G	63.8	Low	79.9	Confident	74 Å²	74	74.8 Å²	74.8	76%	0.763	39%	0.385	S	S	*	.	S	Bend	trans	-65.8	18.2	-175.4	0	0	0	0	0	115.7	Q220	Q220-G222 PolarHBondContact O-N 3.35Å
223	K	74.6	Confident	80	Confident	133 Å²	133	70.5 Å²	70.5	58%	0.578	36%	0.364	S	S	*	.			trans	-92.2	110.9	178.1	-68.2	-178.9	178.1	-179.5	0	109.3	S221 H225 L226	S221-K223 PolarHBondContact O-N 3.31Å; K223-H225 VanDerWaalsContact C-N 3.27Å; K223-H225 PolarHBondContact O-N 3Å; K223-L226 HydrophobicContact CB-CB 4.36Å; K223-L226 HydrophobicContact CB-CD1 3.99Å; K223-L226 HydrophobicContact CB-CG 4.17Å; K223-L226 HydrophobicContact CD-CD1 3.74Å; K223-L226 HydrophobicContact CG-CD1 4.46Å; K223-L226 PolarHBondContact O-N 2.79Å; K223-L226 VanDerWaalsContact O-N 3.11Å
224	P	72.3	Confident	80.2	Confident	82 Å²	82	66.2 Å²	66.2	53%	0.532	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-60.5	-35.8	-171.7	22.8	-32.9	0	0	0	112.8	L226 Q227	P224-L226 VanDerWaalsContact C-N 3.31Å; P224-L226 PolarHBondContact O-N 2.69Å; P224-Q227 WeakPolarHBondContact O-CB 3.4Å; P224-Q227 PolarHBondContact O-N 3.34Å
225	H	70.6	Confident	80.5	Confident	73 Å²	73	70.1 Å²	70.1	34%	0.338	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-66.2	-29.3	-179.9	-55	-69.6	0	0	0	113.7	E115 Y118 K223 Q227	E115-H225 HydrophobicContact CB-CB 4.47Å; E115-H225 HydrophobicContact CG-CB 4.47Å; Y118-H225 WeakPolarHBondContact CB-O 3.24Å; K223-H225 VanDerWaalsContact C-N 3.27Å; K223-H225 PolarHBondContact O-N 3Å; H225-Q227 VanDerWaalsContact C-N 3.3Å; H225-Q227 PolarHBondContact O-N 2.93Å
226	L	72.8	Confident	80.8	Confident	35 Å²	35	69.2 Å²	69.2	18%	0.183	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-81	-11.5	-179.5	-67.2	179.3	0	0	0	113	Y118 L218 K223 P224 N228 V229	Y118-L226 HydrophobicContact CD2-CD2 3.97Å; Y118-L226 HydrophobicContact CE2-CD2 3.58Å; L218-L226 HydrophobicContact CD2-CB 4.31Å; L218-L226 HydrophobicContact CD2-CD1 4.29Å; K223-L226 HydrophobicContact CB-CB 4.36Å; K223-L226 HydrophobicContact CB-CD1 3.99Å; K223-L226 HydrophobicContact CB-CG 4.17Å; K223-L226 HydrophobicContact CD-CD1 3.74Å; K223-L226 HydrophobicContact CG-CD1 4.46Å; K223-L226 PolarHBondContact O-N 2.79Å; K223-L226 VanDerWaalsContact O-N 3.11Å; P224-L226 VanDerWaalsContact C-N 3.31Å; P224-L226 PolarHBondContact O-N 2.69Å; L226-N228 VanDerWaalsContact C-N 3.31Å; L226-V229 WeakPolarHBondContact O-CG2 2.9Å
227	Q	70.8	Confident	81	Confident	89 Å²	89	62.9 Å²	62.9	42%	0.416	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-75.6	-23.5	179.2	-59.1	-175.3	-4.5	0	0	112.4	P224 H225 V229	P224-Q227 WeakPolarHBondContact O-CB 3.4Å; P224-Q227 PolarHBondContact O-N 3.34Å; H225-Q227 VanDerWaalsContact C-N 3.3Å; H225-Q227 PolarHBondContact O-N 2.93Å; Q227-V229 VanDerWaalsContact C-N 3.26Å; Q227-V229 PolarHBondContact O-N 3.38Å
228	N	78.2	Confident	81.3	Confident	106 Å²	106	61 Å²	61	57%	0.567	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-82.2	-0.5	-177.7	-67.9	-11.9	0	0	0	113.7	Y118 L226 S230	Y118-N228 VanDerWaalsContact O-CB 3.31Å; Y118-N228 WeakPolarHBondContact O-CB 3.47Å; L226-N228 VanDerWaalsContact C-N 3.31Å; N228-S230 PolarHBondContact O-N 3.44Å
229	V	81	Confident	81.7	Confident	9 Å²	9	64.2 Å²	64.2	6%	0.055	34%	0.341	C	S	.	.			trans	-66.3	123.8	-179.3	-177.1	0	0	0	0	110.4	Y118 L218 L226 Q227 Y233 L234	Y118-V229 HydrophobicContact CD1-CG2 3.58Å; Y118-V229 HydrophobicContact CE1-CG2 3.73Å; Y118-V229 HydrophobicContact CG-CG2 4.21Å; L218-V229 HydrophobicContact CD1-CB 4.37Å; L218-V229 HydrophobicContact CD1-CG1 4.49Å; L218-V229 HydrophobicContact CD1-CG2 4.49Å; L226-V229 WeakPolarHBondContact O-CG2 2.9Å; Q227-V229 VanDerWaalsContact C-N 3.26Å; Q227-V229 PolarHBondContact O-N 3.38Å; V229-Y233 HydrophobicContact CG1-CD1 4.02Å; V229-L234 HydrophobicContact CG1-CD1 4.16Å; V229-L234 HydrophobicContact CG1-CD2 3.93Å; V229-L234 HydrophobicContact CG1-CG 3.85Å
230	S	83.9	Confident	82.2	Confident	36 Å²	36	59.2 Å²	59.2	25%	0.252	32%	0.32	S	S	.	.			trans	-70.5	138.9	-179.3	76.9	0	0	0	0	111.1	Y178 N228 Q232 Y233 L234	Y178-S230 PolarHBondContact OH-OG 3.43Å; N228-S230 PolarHBondContact O-N 3.44Å; S230-Q232 PolarHBondContact O-N 3.1Å; S230-Y233 PolarHBondContact O-N 3.21Å; S230-Y233 WeakPolarHBondContact OG-CB 3.47Å; S230-Y233 PolarHBondContact OG-N 3.26Å; S230-Y233 VanDerWaalsContact OG-N 3.11Å; S230-L234 PolarHBondContact O-N 3.25Å
231	L	87.4	Confident	82.6	Confident	51 Å²	51	51.7 Å²	51.7	27%	0.267	29%	0.285	S	S	.	.	H	α-helix	trans	-64.3	-32.1	175.8	177.5	145	0	0	0	111.4	E212 L234 K235	E212-L231 HydrophobicContact CG-CD1 4.24Å; L231-L234 PolarHBondContact O-N 3.01Å; L231-K235 HydrophobicContact CD2-CD 3.69Å; L231-K235 HydrophobicContact CD2-CG 4.26Å; L231-K235 WeakPolarHBondContact O-CG 3.35Å; L231-K235 PolarHBondContact O-N 2.93Å
232	Q	89.5	Confident	83.5	Confident	131 Å²	131	53.3 Å²	53.3	61%	0.612	29%	0.286	S	S	*	.	H	α-helix	trans	-63.1	-43.1	175.4	-67.6	-179.8	-20.7	0	0	111.3	Q176 S230 L234 K235 S236	Q176-Q232 PolarHBondContact NE2-O 2.71Å; S230-Q232 PolarHBondContact O-N 3.1Å; Q232-L234 PolarHBondContact O-N 3.01Å; Q232-K235 PolarHBondContact O-N 2.63Å; Q232-S236 PolarHBondContact O-N 3.12Å; Q232-S236 PolarHBondContact O-OG 2.72Å; Q232-S236 VanDerWaalsContact O-OG 3.07Å
233	Y	89.2	Confident	84.8	Confident	10 Å²	10	56.7 Å²	56.7	4%	0.039	28%	0.28	C	S	.	.	H	α-helix	trans	-60.5	-45.8	175.5	175.7	-107.8	0	0	0	111.9	A172 M173 Q176 Y178 V229 S230 K235 S236 V237	A172-Y233 HydrophobicContact CB-CD2 3.96Å; A172-Y233 HydrophobicContact CB-CE2 3.67Å; M173-Y233 HydrophobicContact CG-CE2 3.75Å; Q176-Y233 HydrophobicContact CG-CD2 4.13Å; Y178-Y233 HydrophobicContact CE2-CD2 4.03Å; V229-Y233 HydrophobicContact CG1-CD1 4.02Å; S230-Y233 PolarHBondContact O-N 3.21Å; S230-Y233 WeakPolarHBondContact OG-CB 3.47Å; S230-Y233 PolarHBondContact OG-N 3.26Å; S230-Y233 VanDerWaalsContact OG-N 3.11Å; Y233-K235 VanDerWaalsContact C-N 3.34Å; Y233-K235 PolarHBondContact O-N 2.65Å; Y233-S236 WeakPolarHBondContact O-CB 3.48Å; Y233-S236 PolarHBondContact O-N 3.12Å; Y233-V237 HydrophobicContact CD1-CG2 4.45Å; Y233-V237 HydrophobicContact CE1-CG2 4.07Å; Y233-V237 HydrophobicContact CE2-CG2 4.19Å; Y233-V237 WeakPolarHBondContact O-CG2 3.16Å; Y233-V237 PolarHBondContact O-N 3.39Å
234	L	89.3	Confident	85.3	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-63.5	-38	178.2	-65.3	174.4	0	0	0	112.7	L66 A211 V214 Q215 L218 V229 S230 L231 Q232 V237 E238	L66-L234 HydrophobicContact CD1-CD2 3.94Å; A211-L234 HydrophobicContact CB-CB 3.81Å; V214-L234 HydrophobicContact CB-CD1 4.41Å; V214-L234 HydrophobicContact CG1-CD1 4.01Å; V214-L234 HydrophobicContact CG1-CD2 4.13Å; Q215-L234 HydrophobicContact CB-CD1 4.04Å; Q215-L234 HydrophobicContact CG-CD1 4.5Å; L218-L234 HydrophobicContact CD1-CD1 4.04Å; L218-L234 HydrophobicContact CD1-CD2 4.41Å; V229-L234 HydrophobicContact CG1-CD1 4.16Å; V229-L234 HydrophobicContact CG1-CD2 3.93Å; V229-L234 HydrophobicContact CG1-CG 3.85Å; S230-L234 PolarHBondContact O-N 3.25Å; L231-L234 PolarHBondContact O-N 3.01Å; Q232-L234 PolarHBondContact O-N 3.01Å; L234-V237 PolarHBondContact O-N 3.32Å; L234-E238 PolarHBondContact O-N 3.37Å
235	K	91.6	Very high	86.1	Confident	81 Å²	81	48.9 Å²	48.9	35%	0.352	24%	0.244	S	C	.	.	H	α-helix	trans	-65.7	-40.9	173.2	-74.8	-173.3	175.4	-178.4	0	111.4	A211 E212 L231 Q232 Y233 V237 E238 D239	A211-K235 HydrophobicContact CB-CB 4.48Å; A211-K235 HydrophobicContact CB-CG 3.65Å; E212-K235 IonicContact OE1-NZ 2.93Å; E212-K235 PolarHBondContact OE1-NZ 2.92Å; L231-K235 HydrophobicContact CD2-CD 3.69Å; L231-K235 HydrophobicContact CD2-CG 4.26Å; L231-K235 WeakPolarHBondContact O-CG 3.35Å; L231-K235 PolarHBondContact O-N 2.93Å; Q232-K235 PolarHBondContact O-N 2.63Å; Y233-K235 VanDerWaalsContact C-N 3.34Å; Y233-K235 PolarHBondContact O-N 2.65Å; K235-V237 VanDerWaalsContact C-N 3.34Å; K235-V237 PolarHBondContact O-N 3.3Å; K235-E238 PolarHBondContact O-N 3Å; K235-D239 WeakPolarHBondContact O-CB 3.49Å; K235-D239 PolarHBondContact O-N 2.95Å
236	S	91.4	Very high	87.1	Confident	17 Å²	17	46.6 Å²	46.6	12%	0.119	23%	0.234	C	C	.	.	H	α-helix	trans	-62.5	-38.9	174.2	-60.6	0	0	0	0	112.4	Q176 Q232 Y233 D239 S240	Q176-S236 PolarHBondContact NE2-OG 3.09Å; Q232-S236 PolarHBondContact O-N 3.12Å; Q232-S236 PolarHBondContact O-OG 2.72Å; Q232-S236 VanDerWaalsContact O-OG 3.07Å; Y233-S236 WeakPolarHBondContact O-CB 3.48Å; Y233-S236 PolarHBondContact O-N 3.12Å; S236-D239 PolarHBondContact O-N 3.25Å; S236-S240 WeakPolarHBondContact O-CB 3.33Å; S236-S240 PolarHBondContact O-N 3.26Å; S236-S240 PolarHBondContact O-OG 2.89Å
237	V	91.2	Very high	88	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-63.1	-47.1	174.7	171.1	0	0	0	0	110.8	V168 F169 A172 Y233 L234 K235 D239 S240 Y241	V168-V237 HydrophobicContact CG2-CG1 4.44Å; F169-V237 HydrophobicContact CD1-CG2 4.15Å; F169-V237 HydrophobicContact CE1-CG1 4.07Å; F169-V237 HydrophobicContact CE1-CG2 4.36Å; A172-V237 HydrophobicContact CB-CB 4.3Å; A172-V237 HydrophobicContact CB-CG2 3.39Å; Y233-V237 HydrophobicContact CD1-CG2 4.45Å; Y233-V237 HydrophobicContact CE1-CG2 4.07Å; Y233-V237 HydrophobicContact CE2-CG2 4.19Å; Y233-V237 WeakPolarHBondContact O-CG2 3.16Å; Y233-V237 PolarHBondContact O-N 3.39Å; L234-V237 PolarHBondContact O-N 3.32Å; K235-V237 VanDerWaalsContact C-N 3.34Å; K235-V237 PolarHBondContact O-N 3.3Å; V237-D239 PolarHBondContact O-N 2.95Å; V237-S240 PolarHBondContact O-N 3.46Å; V237-Y241 HydrophobicContact CG1-CD2 3.7Å; V237-Y241 HydrophobicContact CG1-CE2 3.64Å; V237-Y241 VanDerWaalsContact O-CD2 3.3Å; V237-Y241 WeakPolarHBondContact O-CD2 3.23Å; V237-Y241 PolarHBondContact O-N 3.13Å
238	E	90.6	Very high	88.8	Confident	31 Å²	31	46.2 Å²	46.2	15%	0.145	24%	0.243	C	C	.	.	H	α-helix	trans	-59.7	-45.5	177.4	-170.5	-175.8	157.7	0	0	111.7	A211 L234 K235 S240 Y241 K242	A211-E238 PolarHBondContact N-OE2 3.15Å; L234-E238 PolarHBondContact O-N 3.37Å; K235-E238 PolarHBondContact O-N 3Å; E238-S240 PolarHBondContact O-N 2.87Å; E238-Y241 PolarHBondContact O-N 3.33Å; E238-K242 HydrophobicContact CG-CD 4.29Å; E238-K242 WeakPolarHBondContact O-CG 3.32Å; E238-K242 PolarHBondContact O-N 3.46Å; E238-K242 IonicContact OE1-NZ 3Å; E238-K242 PolarHBondContact OE1-NZ 3Å
239	D	92.1	Very high	89.2	Confident	76 Å²	76	41.3 Å²	41.3	41%	0.406	22%	0.217	S	C	.	.	H	α-helix	trans	-61.2	-44.1	176.1	-81	-12	0	0	0	111.9	K235 S236 V237 K242 K243	K235-D239 WeakPolarHBondContact O-CB 3.49Å; K235-D239 PolarHBondContact O-N 2.95Å; S236-D239 PolarHBondContact O-N 3.25Å; V237-D239 PolarHBondContact O-N 2.95Å; D239-K242 PolarHBondContact O-N 2.86Å; D239-K243 VanDerWaalsContact O-CB 3.27Å; D239-K243 WeakPolarHBondContact O-CB 3.33Å; D239-K243 VanDerWaalsContact O-CG 3.31Å; D239-K243 WeakPolarHBondContact O-CG 2.99Å; D239-K243 PolarHBondContact O-N 2.67Å; D239-K243 IonicContact OD2-NZ 2.95Å
240	S	91.3	Very high	89.6	Confident	7 Å²	7	49.3 Å²	49.3	5%	0.049	25%	0.246	C	C	.	.	H	α-helix	trans	-65.7	-37.6	178.2	-72.7	0	0	0	0	112.2	D171 S236 V237 E238 S244 F245	D171-S240 WeakPolarHBondContact CB-OG 3.49Å; S236-S240 WeakPolarHBondContact O-CB 3.33Å; S236-S240 PolarHBondContact O-N 3.26Å; S236-S240 PolarHBondContact O-OG 2.89Å; V237-S240 PolarHBondContact O-N 3.46Å; E238-S240 PolarHBondContact O-N 2.87Å; S240-S244 WeakPolarHBondContact O-CB 3.44Å; S240-S244 PolarHBondContact O-N 2.9Å; S240-F245 PolarHBondContact O-N 2.74Å
241	Y	91.3	Very high	89.8	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.27	C	S	.	.	I	π-helix	trans	-58.6	-53.1	171.2	-90.6	-69.1	0	0	0	110.5	D63 V168 Y206 V237 E238 F245 L246	D63-Y241 HydrophobicContact CB-CE1 4.18Å; V168-Y241 HydrophobicContact CB-CD2 4.22Å; V168-Y241 HydrophobicContact CB-CE2 4.27Å; V168-Y241 HydrophobicContact CB-CG 4.37Å; V168-Y241 HydrophobicContact CG1-CD1 3.88Å; V168-Y241 HydrophobicContact CG1-CD2 4.36Å; V168-Y241 HydrophobicContact CG1-CE1 4.1Å; V168-Y241 HydrophobicContact CG1-CG 4.02Å; V168-Y241 HydrophobicContact CG2-CD1 4.41Å; V168-Y241 HydrophobicContact CG2-CD2 3.91Å; V168-Y241 HydrophobicContact CG2-CE1 4.01Å; V168-Y241 HydrophobicContact CG2-CE2 3.46Å; V168-Y241 VanDerWaalsContact CG2-CE2 3.46Å; V168-Y241 HydrophobicContact CG2-CG 4.37Å; Y206-Y241 HydrophobicContact CD2-CD1 4.08Å; Y206-Y241 HydrophobicContact CD2-CE1 4.45Å; Y206-Y241 AromaticContact CE2-CD1 3.64Å; Y206-Y241 HydrophobicContact CE2-CD1 3.64Å; Y206-Y241 HydrophobicContact CE2-CD2 4.19Å; Y206-Y241 HydrophobicContact CE2-CE1 4.21Å; Y206-Y241 AromaticContact CE2-CG 3.64Å; Y206-Y241 HydrophobicContact CE2-CG 3.64Å; V237-Y241 HydrophobicContact CG1-CD2 3.7Å; V237-Y241 HydrophobicContact CG1-CE2 3.64Å; V237-Y241 VanDerWaalsContact O-CD2 3.3Å; V237-Y241 WeakPolarHBondContact O-CD2 3.23Å; V237-Y241 PolarHBondContact O-N 3.13Å; E238-Y241 PolarHBondContact O-N 3.33Å; Y241-F245 HydrophobicContact CD1-CB 4.19Å; Y241-F245 AromaticContact CD1-CD1 3.63Å; Y241-F245 HydrophobicContact CD1-CD1 3.63Å; Y241-F245 HydrophobicContact CD1-CE1 4.29Å; Y241-F245 HydrophobicContact CD1-CG 4.11Å; Y241-F245 AromaticContact CE1-CD1 3.96Å; Y241-F245 HydrophobicContact CE1-CD1 3.96Å; Y241-F245 HydrophobicContact CE1-CE1 4.23Å; Y241-F245 HydrophobicContact CE1-CG 4.43Å; Y241-F245 PolarHBondContact O-N 2.97Å; Y241-L246 WeakPolarHBondContact O-CG 3.39Å; Y241-L246 PolarHBondContact O-N 3.39Å
242	K	90.2	Very high	89.7	Confident	78 Å²	78	55.5 Å²	55.5	34%	0.339	27%	0.273	S	S	.	.	I	π-helix	trans	-68.7	-37.3	-174.6	-70	176.4	177.6	175.5	0	113.6	D208 E238 D239 L246	D208-K242 VanDerWaalsContact OD1-CE 3.25Å; D208-K242 WeakPolarHBondContact OD1-CE 3.17Å; D208-K242 IonicContact OD1-NZ 2.7Å; D208-K242 PolarHBondContact OD1-NZ 3.47Å; D208-K242 WeakPolarHBondContact OD2-CE 3.13Å; D208-K242 IonicContact OD2-NZ 2.79Å; D208-K242 PolarHBondContact OD2-NZ 2.79Å; E238-K242 HydrophobicContact CG-CD 4.29Å; E238-K242 WeakPolarHBondContact O-CG 3.32Å; E238-K242 PolarHBondContact O-N 3.46Å; E238-K242 IonicContact OE1-NZ 3Å; E238-K242 PolarHBondContact OE1-NZ 3Å; D239-K242 PolarHBondContact O-N 2.86Å; K242-L246 HydrophobicContact CG-CD1 4.37Å
243	K	91	Very high	89.6	Confident	146 Å²	146	49.3 Å²	49.3	64%	0.635	24%	0.244	S	C	*	.	I	π-helix	trans	-87.5	-38.8	-175.1	-68	173.5	-175.8	165.5	0	114	D239 P247	D239-K243 VanDerWaalsContact O-CB 3.27Å; D239-K243 WeakPolarHBondContact O-CB 3.33Å; D239-K243 VanDerWaalsContact O-CG 3.31Å; D239-K243 WeakPolarHBondContact O-CG 2.99Å; D239-K243 PolarHBondContact O-N 2.67Å; D239-K243 IonicContact OD2-NZ 2.95Å; K243-P247 WeakPolarHBondContact O-CG 3.24Å
244	S	86.5	Confident	89.7	Confident	49 Å²	49	49.8 Å²	49.8	34%	0.343	25%	0.247	S	C	.	.	I	π-helix	trans	-110.5	-46.5	-169.9	-55.8	0	0	0	0	112.6	S240 S248	S240-S244 WeakPolarHBondContact O-CB 3.44Å; S240-S244 PolarHBondContact O-N 2.9Å; S244-S248 PolarHBondContact O-OG 2.6Å
245	F	89.4	Confident	89.9	Confident	1 Å²	1	51.7 Å²	51.7	0%	0.004	26%	0.257	C	S	.	.	I	π-helix	trans	-79.5	-52.3	-172	178.8	-102.8	0	0	0	113.1	D63 F164 S165 M167 V168 V204 S240 Y241 S248 I249	D63-F245 HydrophobicContact CB-CE1 4.34Å; D63-F245 WeakPolarHBondContact OD2-CE1 3.48Å; D63-F245 WeakPolarHBondContact OD2-CZ 3.49Å; F164-F245 HydrophobicContact CB-CE2 4.02Å; S165-F245 VanDerWaalsContact CA-CE2 3.5Å; M167-F245 HydrophobicContact CE-CB 3.84Å; M167-F245 HydrophobicContact CE-CD2 3.85Å; M167-F245 HydrophobicContact CE-CG 4.35Å; V168-F245 HydrophobicContact CG1-CB 3.72Å; V168-F245 HydrophobicContact CG1-CG 4.32Å; V204-F245 HydrophobicContact CG1-CE1 3.97Å; V204-F245 HydrophobicContact CG1-CZ 4.1Å; S240-F245 PolarHBondContact O-N 2.74Å; Y241-F245 HydrophobicContact CD1-CB 4.19Å; Y241-F245 AromaticContact CD1-CD1 3.63Å; Y241-F245 HydrophobicContact CD1-CD1 3.63Å; Y241-F245 HydrophobicContact CD1-CE1 4.29Å; Y241-F245 HydrophobicContact CD1-CG 4.11Å; Y241-F245 AromaticContact CE1-CD1 3.96Å; Y241-F245 HydrophobicContact CE1-CD1 3.96Å; Y241-F245 HydrophobicContact CE1-CE1 4.23Å; Y241-F245 HydrophobicContact CE1-CG 4.43Å; Y241-F245 PolarHBondContact O-N 2.97Å; F245-S248 PolarHBondContact O-N 2.86Å; F245-S248 PolarHBondContact O-OG 3.02Å; F245-S248 VanDerWaalsContact O-OG 3.07Å; F245-I249 HydrophobicContact CD1-CG2 4.5Å; F245-I249 HydrophobicContact CE1-CG2 4.29Å; F245-I249 HydrophobicContact CE2-CB 4.44Å; F245-I249 HydrophobicContact CE2-CG1 4.32Å; F245-I249 HydrophobicContact CZ-CB 4.35Å; F245-I249 HydrophobicContact CZ-CG1 4.04Å; F245-I249 WeakPolarHBondContact O-CB 3.37Å; F245-I249 WeakPolarHBondContact O-CG2 3.38Å; F245-I249 PolarHBondContact O-N 3.15Å
246	L	90.3	Very high	89.9	Confident	25 Å²	25	49.3 Å²	49.3	13%	0.131	25%	0.248	C	C	.	.	H	α-helix	trans	-60.4	-38.4	-177.4	-61.8	-178.8	0	0	0	113.4	Y206 Y241 K242 I249 R250 L255	Y206-L246 HydrophobicContact CD1-CD1 4.1Å; Y206-L246 HydrophobicContact CD1-CD2 4.22Å; Y206-L246 HydrophobicContact CD2-CD2 4.09Å; Y206-L246 HydrophobicContact CE1-CD1 4.23Å; Y206-L246 HydrophobicContact CG-CD1 4.5Å; Y206-L246 HydrophobicContact CG-CD2 3.8Å; Y241-L246 WeakPolarHBondContact O-CG 3.39Å; Y241-L246 PolarHBondContact O-N 3.39Å; K242-L246 HydrophobicContact CG-CD1 4.37Å; L246-I249 WeakPolarHBondContact O-CG2 3.46Å; L246-R250 VanDerWaalsContact O-CB 3.28Å; L246-R250 WeakPolarHBondContact O-CB 3.02Å; L246-R250 PolarHBondContact O-N 3.49Å; L246-L255 HydrophobicContact CB-CD2 4.16Å; L246-L255 HydrophobicContact CD2-CD1 3.79Å; L246-L255 HydrophobicContact CD2-CD2 3.92Å; L246-L255 HydrophobicContact CD2-CG 4.5Å
247	P	91.3	Very high	89.9	Confident	65 Å²	65	52 Å²	52	42%	0.422	26%	0.264	S	S	.	.	H	α-helix	trans	-66.9	-45.3	174.9	-25.5	38.3	0	0	0	113.2	K243 I249 R250	K243-P247 WeakPolarHBondContact O-CG 3.24Å; P247-I249 PolarHBondContact O-N 3.39Å; P247-R250 PolarHBondContact O-N 3.38Å
248	S	87.5	Confident	89.8	Confident	51 Å²	51	52.6 Å²	52.6	36%	0.357	27%	0.266	S	S	.	.	H	α-helix	trans	-69.1	-35.2	-177	58.3	0	0	0	0	112.8	S244 F245 T252	S244-S248 PolarHBondContact O-OG 2.6Å; F245-S248 PolarHBondContact O-N 2.86Å; F245-S248 PolarHBondContact O-OG 3.02Å; F245-S248 VanDerWaalsContact O-OG 3.07Å; S248-T252 PolarHBondContact O-OG1 2.9Å
249	I	88.4	Confident	89.5	Confident	4 Å²	4	54.8 Å²	54.8	2%	0.021	28%	0.278	C	S	.	.	H	α-helix	trans	-75.8	-27.3	179.9	-153.1	45.4	0	0	0	112.3	P201 V204 F245 L246 P247 E251 T252 S253 L255	P201-I249 HydrophobicContact CG-CD1 4.4Å; V204-I249 HydrophobicContact CB-CG1 4.21Å; V204-I249 HydrophobicContact CG2-CD1 3.99Å; V204-I249 HydrophobicContact CG2-CG1 3.43Å; V204-I249 VanDerWaalsContact CG2-CG1 3.43Å; F245-I249 HydrophobicContact CD1-CG2 4.5Å; F245-I249 HydrophobicContact CE1-CG2 4.29Å; F245-I249 HydrophobicContact CE2-CB 4.44Å; F245-I249 HydrophobicContact CE2-CG1 4.32Å; F245-I249 HydrophobicContact CZ-CB 4.35Å; F245-I249 HydrophobicContact CZ-CG1 4.04Å; F245-I249 WeakPolarHBondContact O-CB 3.37Å; F245-I249 WeakPolarHBondContact O-CG2 3.38Å; F245-I249 PolarHBondContact O-N 3.15Å; L246-I249 WeakPolarHBondContact O-CG2 3.46Å; P247-I249 PolarHBondContact O-N 3.39Å; I249-E251 VanDerWaalsContact C-N 3.28Å; I249-E251 PolarHBondContact O-N 3.37Å; I249-T252 PolarHBondContact O-N 3.32Å; I249-T252 PolarHBondContact O-OG1 3.35Å; I249-S253 VanDerWaalsContact CD1-OG 3.27Å; I249-S253 WeakPolarHBondContact CD1-OG 3.48Å; I249-S253 VanDerWaalsContact CG1-OG 3.23Å; I249-S253 WeakPolarHBondContact CG1-OG 3.26Å; I249-S253 PolarHBondContact O-N 3.41Å; I249-S253 VanDerWaalsContact O-O 3.1Å; I249-S253 PolarHBondContact O-OG 3.47Å; I249-L255 HydrophobicContact CG2-CD1 4.19Å; I249-L255 HydrophobicContact CG2-CD2 4.37Å
250	R	88.1	Confident	88.8	Confident	177 Å²	177	53.4 Å²	53.4	67%	0.668	27%	0.27	S	S	*	.	H	α-helix	trans	-68.6	-25.7	177.2	-175	177.1	-176.7	178.9	2.6	113	L246 P247	L246-R250 VanDerWaalsContact O-CB 3.28Å; L246-R250 WeakPolarHBondContact O-CB 3.02Å; L246-R250 PolarHBondContact O-N 3.49Å; P247-R250 PolarHBondContact O-N 3.38Å
251	E	87.3	Confident	88	Confident	162 Å²	162	58.1 Å²	58.1	76%	0.757	30%	0.299	S	S	*	.	H	α-helix	trans	-74.2	-33.8	174.7	-66.2	178.6	176.5	0	0	111.7	I249	I249-E251 VanDerWaalsContact C-N 3.28Å; I249-E251 PolarHBondContact O-N 3.37Å
252	T	85.9	Confident	87	Confident	54 Å²	54	60.9 Å²	60.9	33%	0.331	31%	0.312	S	S	.	.	H	α-helix	trans	-104.6	-24.6	-169.5	49.7	0	0	0	0	114.3	S248 I249 G281	S248-T252 PolarHBondContact O-OG1 2.9Å; I249-T252 PolarHBondContact O-N 3.32Å; I249-T252 PolarHBondContact O-OG1 3.35Å; T252-G281 WeakPolarHBondContact O-CA 3.44Å
253	S	88.1	Confident	86	Confident	2 Å²	2	58 Å²	58	1%	0.014	30%	0.3	C	S	.	.	S	Bend	trans	-145.6	166.2	-174.2	66.3	0	0	0	0	112	P201 I249	P201-S253 WeakPolarHBondContact O-CB 3.36Å; I249-S253 VanDerWaalsContact CD1-OG 3.27Å; I249-S253 WeakPolarHBondContact CD1-OG 3.48Å; I249-S253 VanDerWaalsContact CG1-OG 3.23Å; I249-S253 WeakPolarHBondContact CG1-OG 3.26Å; I249-S253 PolarHBondContact O-N 3.41Å; I249-S253 VanDerWaalsContact O-O 3.1Å; I249-S253 PolarHBondContact O-OG 3.47Å
254	E	91.7	Very high	85	Confident	20 Å²	20	58.4 Å²	58.4	9%	0.093	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	140.7	171.6	-64.6	-58.4	155.9	0	0	110.6	H202 L203 V204 F278 K280	H202-E254 PolarHBondContact O-N 2.99Å; H202-E254 VanDerWaalsContact O-N 3.15Å; L203-E254 WeakPolarHBondContact CA-O 3.49Å; L203-E254 HydrophobicContact CD1-CB 3.93Å; L203-E254 WeakPolarHBondContact CD1-O 3.42Å; V204-E254 PolarHBondContact N-O 3.11Å; E254-F278 HydrophobicContact CB-CE1 4.43Å; E254-F278 HydrophobicContact CG-CD1 4.08Å; E254-F278 HydrophobicContact CG-CE1 4.33Å; E254-K280 WeakPolarHBondContact OE1-CD 3.32Å; E254-K280 WeakPolarHBondContact OE1-CE 3.41Å; E254-K280 WeakPolarHBondContact OE1-CG 3.47Å; E254-K280 IonicContact OE1-NZ 2.7Å; E254-K280 PolarHBondContact OE1-NZ 2.66Å; E254-K280 IonicContact OE2-NZ 3.69Å; E254-K280 PolarHBondContact OE2-NZ 2.78Å
255	L	92.3	Very high	84.6	Confident	40 Å²	40	60.7 Å²	60.7	21%	0.209	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	123.7	-177	175.7	68	0	0	0	109.7	V204 L246 I249 V257	V204-L255 HydrophobicContact CB-CD1 4.12Å; V204-L255 HydrophobicContact CG1-CD1 4.21Å; V204-L255 WeakPolarHBondContact O-CA 3.5Å; L246-L255 HydrophobicContact CB-CD2 4.16Å; L246-L255 HydrophobicContact CD2-CD1 3.79Å; L246-L255 HydrophobicContact CD2-CD2 3.92Å; L246-L255 HydrophobicContact CD2-CG 4.5Å; I249-L255 HydrophobicContact CG2-CD1 4.19Å; I249-L255 HydrophobicContact CG2-CD2 4.37Å; L255-V257 HydrophobicContact CD1-CG2 4.42Å; L255-V257 HydrophobicContact CD2-CG2 4.24Å; L255-V257 HydrophobicContact CG-CG2 4.13Å
256	L	91.4	Very high	84.2	Confident	31 Å²	31	61 Å²	61	16%	0.162	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	129.8	168.8	-64.1	173.7	0	0	0	109.4	L203 V204 L205 Y206 Y258 D272 I273 L276	L203-L256 HydrophobicContact CD1-CD1 4.04Å; L203-L256 HydrophobicContact CD1-CG 3.96Å; L203-L256 HydrophobicContact CD2-CD1 4.33Å; V204-L256 PolarHBondContact O-N 3.34Å; L205-L256 HydrophobicContact CD2-CB 3.67Å; L205-L256 HydrophobicContact CD2-CD1 3.72Å; L205-L256 HydrophobicContact CD2-CG 4.19Å; Y206-L256 PolarHBondContact N-O 2.99Å; L256-Y258 HydrophobicContact CB-CD2 4.33Å; L256-Y258 HydrophobicContact CB-CE2 3.65Å; L256-Y258 HydrophobicContact CD1-CE2 4.17Å; L256-D272 HydrophobicContact CD1-CB 4.28Å; L256-I273 HydrophobicContact CD1-CG1 4.33Å; L256-L276 HydrophobicContact CD1-CD1 3.57Å; L256-L276 HydrophobicContact CD2-CD1 4.07Å; L256-L276 HydrophobicContact CG-CD1 3.87Å
257	V	91.1	Very high	84	Confident	74 Å²	74	66 Å²	66	45%	0.448	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	125	-179.7	177.5	0	0	0	0	108.4	Y206 L255	Y206-V257 HydrophobicContact CD1-CG1 4.11Å; Y206-V257 HydrophobicContact CD1-CG2 4.45Å; Y206-V257 WeakPolarHBondContact O-CA 3.14Å; L255-V257 HydrophobicContact CD1-CG2 4.42Å; L255-V257 HydrophobicContact CD2-CG2 4.24Å; L255-V257 HydrophobicContact CG-CG2 4.13Å
258	Y	89.1	Confident	83.8	Confident	11 Å²	11	68.8 Å²	68.8	4%	0.043	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	141.2	-179.1	-68.2	-74.1	0	0	0	111.9	L205 Y206 I207 D208 L256 Q262 I269 D272	L205-Y258 HydrophobicContact CD2-CE2 3.98Å; Y206-Y258 PolarHBondContact O-N 3.33Å; I207-Y258 WeakPolarHBondContact CA-O 3.27Å; D208-Y258 PolarHBondContact N-O 3.46Å; L256-Y258 HydrophobicContact CB-CD2 4.33Å; L256-Y258 HydrophobicContact CB-CE2 3.65Å; L256-Y258 HydrophobicContact CD1-CE2 4.17Å; Y258-Q262 HydrophobicContact CD1-CB 4.19Å; Y258-I269 HydrophobicContact CD1-CG1 4.39Å; Y258-I269 HydrophobicContact CD2-CD1 4.46Å; Y258-I269 HydrophobicContact CD2-CG1 4.44Å; Y258-I269 HydrophobicContact CE1-CG1 3.97Å; Y258-I269 HydrophobicContact CE2-CB 4.5Å; Y258-I269 HydrophobicContact CE2-CD1 4.43Å; Y258-I269 HydrophobicContact CE2-CG1 4Å; Y258-I269 HydrophobicContact CE2-CG2 3.99Å; Y258-D272 WeakPolarHBondContact CE1-OD2 3.33Å; Y258-D272 VanDerWaalsContact OH-CB 3.26Å; Y258-D272 WeakPolarHBondContact OH-CB 3.18Å; Y258-D272 PolarHBondContact OH-OD2 2.93Å
259	D	85.9	Confident	83.8	Confident	77 Å²	77	66.4 Å²	66.4	41%	0.412	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	155	167.8	-67.8	-32	0	0	0	111.2	T261 Q262 V263	D259-T261 PolarHBondContact O-N 2.95Å; D259-Q262 PolarHBondContact O-N 3.14Å; D259-V263 WeakPolarHBondContact O-CG2 3.38Å; D259-V263 PolarHBondContact O-N 3.21Å
260	M	76.3	Confident	83.8	Confident	48 Å²	48	67.2 Å²	67.2	24%	0.236	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-29.3	179.4	-73.5	-65	-44.6	0	0	115.3	I207 Q209	I207-M260 HydrophobicContact CG2-SD 3.83Å; Q209-M260 HydrophobicContact CB-CG 4.16Å; Q209-M260 HydrophobicContact CB-SD 4.24Å; Q209-M260 HydrophobicContact CG-CG 3.85Å; Q209-M260 HydrophobicContact CG-SD 4.08Å
261	T	74.2	Confident	83.9	Confident	106 Å²	106	63.7 Å²	63.7	65%	0.65	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-39.2	176.8	48.7	0	0	0	0	111.6	D259	D259-T261 PolarHBondContact O-N 2.95Å
262	Q	71	Confident	84	Confident	57 Å²	57	58.5 Å²	58.5	27%	0.266	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-77.3	-27.3	179.8	-57.9	177.4	10	0	0	111.8	Y258 D259 Q264 D265	Y258-Q262 HydrophobicContact CD1-CB 4.19Å; D259-Q262 PolarHBondContact O-N 3.14Å; Q262-Q264 PolarHBondContact O-N 3.42Å; Q262-D265 PolarHBondContact O-N 3.36Å; Q262-D265 VanDerWaalsContact O-N 3.13Å
263	V	68.8	Low	84.1	Confident	17 Å²	17	56.4 Å²	56.4	10%	0.103	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-62.3	-22.3	177.2	170.9	0	0	0	0	113.2	L73 I207 D259 D265	L73-V263 HydrophobicContact CD1-CG1 3.81Å; L73-V263 WeakPolarHBondContact CD1-O 3.23Å; L73-V263 HydrophobicContact CD2-CG1 4.04Å; L73-V263 HydrophobicContact CG-CG1 4.33Å; I207-V263 HydrophobicContact CD1-CG1 4.29Å; I207-V263 HydrophobicContact CD1-CG2 4.25Å; I207-V263 HydrophobicContact CG1-CG2 4.12Å; I207-V263 HydrophobicContact CG2-CG2 3.93Å; D259-V263 WeakPolarHBondContact O-CG2 3.38Å; D259-V263 PolarHBondContact O-N 3.21Å; V263-D265 PolarHBondContact O-N 3.44Å
264	Q	69.8	Low	84.1	Confident	156 Å²	156	60.8 Å²	60.8	73%	0.729	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-68	-27.8	177	-62	-170.7	12	0	0	112.1	Q262 A266	Q262-Q264 PolarHBondContact O-N 3.42Å; Q264-A266 PolarHBondContact O-N 3.11Å
265	D	78.6	Confident	83.9	Confident	96 Å²	96	69 Å²	69	51%	0.513	34%	0.336	S	S	.	.			trans	-93.9	75	-177.6	-63.8	-31.6	0	0	0	111	Q262 V263 E267 R268 I269	Q262-D265 PolarHBondContact O-N 3.36Å; Q262-D265 VanDerWaalsContact O-N 3.13Å; V263-D265 PolarHBondContact O-N 3.44Å; D265-E267 PolarHBondContact O-N 2.83Å; D265-R268 HydrophobicContact CB-CB 4.22Å; D265-R268 PolarHBondContact O-N 3.12Å; D265-R268 VanDerWaalsContact O-N 3.17Å; D265-I269 PolarHBondContact O-N 2.89Å
266	A	82	Confident	83.7	Confident	7 Å²	7	69.1 Å²	69.1	6%	0.058	34%	0.336	C	S	.	.	H	α-helix	trans	-59.4	-19.3	178	0	0	0	0	0	113.8	L77 Q264 V270	L77-A266 HydrophobicContact CD2-CB 4.47Å; Q264-A266 PolarHBondContact O-N 3.11Å; A266-V270 WeakPolarHBondContact O-CG2 3.37Å; A266-V270 PolarHBondContact O-N 3.01Å
267	E	85	Confident	83.3	Confident	132 Å²	132	75.2 Å²	75.2	62%	0.617	36%	0.361	S	S	*	.	H	α-helix	trans	-69.2	-46.8	176.1	-66.5	-180	179.9	0	0	111.5	K80 D265 I269 V270 E271	K80-E267 IonicContact NZ-OE1 3.27Å; K80-E267 PolarHBondContact NZ-OE1 3.43Å; D265-E267 PolarHBondContact O-N 2.83Å; E267-I269 VanDerWaalsContact C-N 3.26Å; E267-I269 PolarHBondContact O-N 3.36Å; E267-V270 WeakPolarHBondContact O-CB 3.26Å; E267-V270 PolarHBondContact O-N 3.37Å; E267-E271 WeakPolarHBondContact O-CG 3.43Å; E267-E271 PolarHBondContact O-N 3.24Å
268	R	87.3	Confident	82.9	Confident	123 Å²	123	74 Å²	74	46%	0.464	35%	0.35	S	S	.	.	H	α-helix	trans	-59	-40.7	176.9	-177.4	178.5	175.1	166.3	-0.2	111.8	D265 V270 E271 D272	D265-R268 HydrophobicContact CB-CB 4.22Å; D265-R268 PolarHBondContact O-N 3.12Å; D265-R268 VanDerWaalsContact O-N 3.17Å; R268-V270 VanDerWaalsContact C-N 3.32Å; R268-V270 PolarHBondContact O-N 3.11Å; R268-E271 PolarHBondContact O-N 3.09Å; R268-D272 WeakPolarHBondContact O-CB 3.34Å; R268-D272 VanDerWaalsContact O-CG 3.22Å; R268-D272 PolarHBondContact O-N 3.34Å
269	I	88.1	Confident	82.3	Confident	1 Å²	1	79.6 Å²	79.6	1%	0.005	38%	0.381	C	S	.	.	H	α-helix	trans	-64.1	-40.2	177.4	-58.7	174.1	0	0	0	110.7	L73 L77 L205 Y258 D265 E267 D272 I273	L73-I269 HydrophobicContact CD1-CD1 3.91Å; L73-I269 HydrophobicContact CD2-CD1 4.33Å; L77-I269 HydrophobicContact CD1-CG2 4.15Å; L77-I269 HydrophobicContact CD2-CB 4.15Å; L77-I269 HydrophobicContact CD2-CG2 3.91Å; L205-I269 HydrophobicContact CD1-CG2 4.13Å; Y258-I269 HydrophobicContact CD1-CG1 4.39Å; Y258-I269 HydrophobicContact CD2-CD1 4.46Å; Y258-I269 HydrophobicContact CD2-CG1 4.44Å; Y258-I269 HydrophobicContact CE1-CG1 3.97Å; Y258-I269 HydrophobicContact CE2-CB 4.5Å; Y258-I269 HydrophobicContact CE2-CD1 4.43Å; Y258-I269 HydrophobicContact CE2-CG1 4Å; Y258-I269 HydrophobicContact CE2-CG2 3.99Å; D265-I269 PolarHBondContact O-N 2.89Å; E267-I269 VanDerWaalsContact C-N 3.26Å; E267-I269 PolarHBondContact O-N 3.36Å; I269-D272 PolarHBondContact O-N 2.84Å; I269-I273 HydrophobicContact CG2-CD1 3.9Å; I269-I273 HydrophobicContact CG2-CG1 4.48Å; I269-I273 WeakPolarHBondContact O-CD1 3.11Å; I269-I273 WeakPolarHBondContact O-CG1 3.27Å; I269-I273 PolarHBondContact O-N 2.85Å
270	V	88.6	Confident	82	Confident	20 Å²	20	80.5 Å²	80.5	12%	0.121	38%	0.381	C	S	.	.	H	α-helix	trans	-64.8	-44.1	176.2	169.2	0	0	0	0	110.9	L77 K80 L81 A266 E267 R268 I273 E274	L77-V270 HydrophobicContact CD2-CG2 3.8Å; K80-V270 HydrophobicContact CB-CG2 4.21Å; K80-V270 HydrophobicContact CD-CG2 4.29Å; L81-V270 HydrophobicContact CD2-CG1 3.88Å; L81-V270 HydrophobicContact CD2-CG2 4.25Å; L81-V270 HydrophobicContact CG-CG2 4.24Å; A266-V270 WeakPolarHBondContact O-CG2 3.37Å; A266-V270 PolarHBondContact O-N 3.01Å; E267-V270 WeakPolarHBondContact O-CB 3.26Å; E267-V270 PolarHBondContact O-N 3.37Å; R268-V270 VanDerWaalsContact C-N 3.32Å; R268-V270 PolarHBondContact O-N 3.11Å; V270-I273 WeakPolarHBondContact O-CB 2.97Å; V270-I273 PolarHBondContact O-N 3.18Å; V270-E274 WeakPolarHBondContact O-CG 3.36Å; V270-E274 PolarHBondContact O-N 2.84Å
271	E	88.9	Confident	82.1	Confident	104 Å²	104	79.4 Å²	79.4	49%	0.486	38%	0.382	S	S	.	.	H	α-helix	trans	-58.9	-48.3	175.1	-69.5	174.7	-176.3	0	0	111.2	E267 R268 I273 E274 Y275	E267-E271 WeakPolarHBondContact O-CG 3.43Å; E267-E271 PolarHBondContact O-N 3.24Å; R268-E271 PolarHBondContact O-N 3.09Å; E271-I273 VanDerWaalsContact C-N 3.26Å; E271-I273 PolarHBondContact O-N 3.08Å; E271-E274 PolarHBondContact O-N 3.22Å; E271-Y275 HydrophobicContact CB-CE2 4.37Å; E271-Y275 WeakPolarHBondContact O-CD2 3.45Å; E271-Y275 PolarHBondContact O-N 3.3Å
272	D	89.7	Confident	82.7	Confident	52 Å²	52	76.1 Å²	76.1	28%	0.278	36%	0.363	S	S	.	.	H	α-helix	trans	-58	-39.4	177.1	-69.9	-24.6	0	0	0	111.5	L256 Y258 R268 I269 Y275 L276	L256-D272 HydrophobicContact CD1-CB 4.28Å; Y258-D272 WeakPolarHBondContact CE1-OD2 3.33Å; Y258-D272 VanDerWaalsContact OH-CB 3.26Å; Y258-D272 WeakPolarHBondContact OH-CB 3.18Å; Y258-D272 PolarHBondContact OH-OD2 2.93Å; R268-D272 WeakPolarHBondContact O-CB 3.34Å; R268-D272 VanDerWaalsContact O-CG 3.22Å; R268-D272 PolarHBondContact O-N 3.34Å; I269-D272 PolarHBondContact O-N 2.84Å; D272-Y275 PolarHBondContact O-N 3.34Å; D272-L276 WeakPolarHBondContact O-CG 3.34Å; D272-L276 PolarHBondContact O-N 2.94Å
273	I	88.5	Confident	83.4	Confident	10 Å²	10	74.1 Å²	74.1	5%	0.051	35%	0.353	C	S	.	.	H	α-helix	trans	-64.9	-38.3	175.5	-68.8	165.9	0	0	0	111.7	I60 L81 L203 L205 L256 I269 V270 E271 L276	I60-I273 HydrophobicContact CD1-CD1 4.32Å; I60-I273 HydrophobicContact CD1-CG2 4.49Å; L81-I273 HydrophobicContact CD1-CD1 4.18Å; L203-I273 HydrophobicContact CD2-CD1 4.08Å; L203-I273 HydrophobicContact CD2-CG1 3.65Å; L203-I273 HydrophobicContact CD2-CG2 4.49Å; L205-I273 HydrophobicContact CD1-CD1 4.45Å; L256-I273 HydrophobicContact CD1-CG1 4.33Å; I269-I273 HydrophobicContact CG2-CD1 3.9Å; I269-I273 HydrophobicContact CG2-CG1 4.48Å; I269-I273 WeakPolarHBondContact O-CD1 3.11Å; I269-I273 WeakPolarHBondContact O-CG1 3.27Å; I269-I273 PolarHBondContact O-N 2.85Å; V270-I273 WeakPolarHBondContact O-CB 2.97Å; V270-I273 PolarHBondContact O-N 3.18Å; E271-I273 VanDerWaalsContact C-N 3.26Å; E271-I273 PolarHBondContact O-N 3.08Å; I273-L276 PolarHBondContact O-N 2.97Å
274	E	87	Confident	84.2	Confident	94 Å²	94	77.3 Å²	77.3	44%	0.439	37%	0.374	S	S	.	.	H	α-helix	trans	-72.3	-31.8	179.4	-72	-177.5	169.8	0	0	112.8	Y56 V270 E271 L276	Y56-E274 HydrophobicContact CE1-CG 4.39Å; Y56-E274 PolarHBondContact OH-OE1 2.77Å; V270-E274 WeakPolarHBondContact O-CG 3.36Å; V270-E274 PolarHBondContact O-N 2.84Å; E271-E274 PolarHBondContact O-N 3.22Å; E274-L276 VanDerWaalsContact C-N 3.34Å
275	Y	88.3	Confident	85	Confident	192 Å²	192	77.2 Å²	77.2	75%	0.753	37%	0.373	S	S	*	.	H	α-helix	trans	-76.1	-20.4	175.1	-75.1	-64.4	0	0	0	113.7	E271 D272	E271-Y275 HydrophobicContact CB-CE2 4.37Å; E271-Y275 WeakPolarHBondContact O-CD2 3.45Å; E271-Y275 PolarHBondContact O-N 3.3Å; D272-Y275 PolarHBondContact O-N 3.34Å
276	L	87.5	Confident	85.4	Confident	43 Å²	43	74.8 Å²	74.8	23%	0.225	36%	0.359	C	S	.	.			trans	-67.7	132.6	179.6	-83.7	171.1	0	0	0	112	L203 L256 D272 I273 E274 F278	L203-L276 HydrophobicContact CD1-CD1 3.85Å; L203-L276 HydrophobicContact CD2-CD1 4.48Å; L256-L276 HydrophobicContact CD1-CD1 3.57Å; L256-L276 HydrophobicContact CD2-CD1 4.07Å; L256-L276 HydrophobicContact CG-CD1 3.87Å; D272-L276 WeakPolarHBondContact O-CG 3.34Å; D272-L276 PolarHBondContact O-N 2.94Å; I273-L276 PolarHBondContact O-N 2.97Å; E274-L276 VanDerWaalsContact C-N 3.34Å; L276-F278 HydrophobicContact CB-CE2 4.43Å; L276-F278 HydrophobicContact CB-CZ 4.31Å
277	K	83.7	Confident	85.7	Confident	159 Å²	159	79.7 Å²	79.7	69%	0.691	38%	0.384	S	S	*	.			trans	-97.8	118	169.8	-65.1	-175.9	179.8	-178.6	0	109.2	D279	K277-D279 VanDerWaalsContact C-N 3.25Å; K277-D279 PolarHBondContact O-N 3.19Å
278	F	82.6	Confident	85.8	Confident	49 Å²	49	74.6 Å²	74.6	22%	0.215	36%	0.361	C	S	.	.			trans	-84.2	67.4	-178.3	-66.3	-77.5	0	0	0	111.4	H202 L203 E254 L276	H202-F278 HydrophobicContact CB-CD1 4.25Å; H202-F278 HydrophobicContact CB-CE1 4.3Å; L203-F278 HydrophobicContact CB-CE1 4.11Å; E254-F278 HydrophobicContact CB-CE1 4.43Å; E254-F278 HydrophobicContact CG-CD1 4.08Å; E254-F278 HydrophobicContact CG-CE1 4.33Å; L276-F278 HydrophobicContact CB-CE2 4.43Å; L276-F278 HydrophobicContact CB-CZ 4.31Å
279	D	77.1	Confident	85.9	Confident	128 Å²	128	73 Å²	73	68%	0.684	36%	0.361	S	S	*	.			trans	-95.8	-10.6	-179.7	-58.8	-26.8	0	0	0	112.1	K277	K277-D279 VanDerWaalsContact C-N 3.25Å; K277-D279 PolarHBondContact O-N 3.19Å
280	K	79.6	Confident	86	Confident	97 Å²	97	75.1 Å²	75.1	42%	0.422	38%	0.376	S	S	.	.			trans	-93.5	152.1	-178.6	-64.8	-175.7	-159.1	133.8	0	113.2	E254	E254-K280 WeakPolarHBondContact OE1-CD 3.32Å; E254-K280 WeakPolarHBondContact OE1-CE 3.41Å; E254-K280 WeakPolarHBondContact OE1-CG 3.47Å; E254-K280 IonicContact OE1-NZ 2.7Å; E254-K280 PolarHBondContact OE1-NZ 2.66Å; E254-K280 IonicContact OE2-NZ 3.69Å; E254-K280 PolarHBondContact OE2-NZ 2.78Å
281	G	78.8	Confident	86.1	Confident	25 Å²	25	74.8 Å²	74.8	26%	0.258	37%	0.373	S	S	.	.	S	Bend	trans	92.9	177.4	172.1	0	0	0	0	0	113.9	T252 W283 P284	T252-G281 WeakPolarHBondContact O-CA 3.44Å; G281-W283 PolarHBondContact O-N 3.33Å; G281-P284 WeakPolarHBondContact O-CD 3.26Å
282	P	86.4	Confident	86.2	Confident	37 Å²	37	70 Å²	70	24%	0.24	35%	0.351	C	S	.	.	S	Bend	trans	-77.6	-4.4	-176.3	31	-36.1	0	0	0	113.8	L199 P200 E285 Q286	L199-P282 HydrophobicContact CD2-CB 4.1Å; L199-P282 HydrophobicContact CD2-CG 3.84Å; P200-P282 HydrophobicContact CG-CG 3.95Å; P282-E285 PolarHBondContact O-N 2.68Å; P282-Q286 WeakPolarHBondContact O-CG 3.25Å; P282-Q286 PolarHBondContact O-NE2 2.81Å
283	W	86.1	Confident	86.2	Confident	14 Å²	14	72.6 Å²	72.6	5%	0.053	36%	0.361	C	S	.	.	S	Bend	trans	-62.1	-42.5	-176.9	-69.3	98	0	0	0	115	I59 L199 P200 H202 G281 E285 Q286 Y291	I59-W283 HydrophobicContact CD1-CH2 3.9Å; I59-W283 HydrophobicContact CD1-CZ2 4.14Å; I59-W283 HydrophobicContact CG1-CH2 4.48Å; L199-W283 HydrophobicContact CB-CD2 4.32Å; L199-W283 HydrophobicContact CB-CH2 3.96Å; L199-W283 HydrophobicContact CB-CZ2 3.57Å; L199-W283 HydrophobicContact CB-CZ3 4.48Å; L199-W283 HydrophobicContact CD1-CD2 3.98Å; L199-W283 HydrophobicContact CD1-CE3 3.66Å; L199-W283 HydrophobicContact CD1-CH2 3.94Å; L199-W283 HydrophobicContact CD1-CZ2 4.23Å; L199-W283 HydrophobicContact CD1-CZ3 3.65Å; P200-W283 WeakPolarHBondContact O-CZ2 3.35Å; P200-W283 PolarHBondContact O-NE1 2.74Å; H202-W283 AromaticContact CD2-CD1 3.8Å; H202-W283 AromaticContact CD2-CD2 3.9Å; H202-W283 AromaticContact CD2-CG 3.72Å; H202-W283 AromaticContact CE1-CD2 3.23Å; H202-W283 AromaticContact CE1-CE2 3.24Å; H202-W283 AromaticContact CE1-CE3 3.37Å; H202-W283 AromaticContact CE1-CG 3.91Å; H202-W283 AromaticContact CE1-CH2 3.56Å; H202-W283 AromaticContact CE1-CZ2 3.42Å; H202-W283 VanDerWaalsContact CE1-CZ2 3.42Å; H202-W283 WeakPolarHBondContact CE1-CZ2 3.47Å; H202-W283 AromaticContact CE1-CZ3 3.53Å; H202-W283 AromaticContact CE1-NE1 3.86Å; H202-W283 AromaticContact CG-NE1 3.91Å; H202-W283 AromaticContact ND1-CD2 3.93Å; H202-W283 AromaticContact ND1-CE2 3.49Å; H202-W283 AromaticContact ND1-CZ2 3.62Å; H202-W283 AromaticContact ND1-NE1 3.78Å; H202-W283 AromaticContact NE2-CD1 3.95Å; H202-W283 AromaticContact NE2-CD2 3.24Å; H202-W283 AromaticContact NE2-CE2 3.67Å; H202-W283 AromaticContact NE2-CE3 3.49Å; H202-W283 AromaticContact NE2-CG 3.47Å; G281-W283 PolarHBondContact O-N 3.33Å; W283-E285 PolarHBondContact O-N 3.41Å; W283-Q286 PolarHBondContact O-N 3.21Å; W283-Y291 HydrophobicContact CE3-CE1 4.35Å; W283-Y291 HydrophobicContact CZ3-CE1 4.24Å; W283-Y291 PolarHBondContact O-OH 3.15Å
284	P	85.6	Confident	86.4	Confident	85 Å²	85	73 Å²	73	55%	0.552	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-23.3	178.6	-19.2	34.4	0	0	0	113.3	G281 Q286	G281-P284 WeakPolarHBondContact O-CD 3.26Å; P284-Q286 VanDerWaalsContact C-N 3.29Å
285	E	85.8	Confident	86.5	Confident	153 Å²	153	69.2 Å²	69.2	72%	0.715	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-4	-178.6	-58.8	179.7	170.7	0	0	113.1	P282 W283	P282-E285 PolarHBondContact O-N 2.68Å; W283-E285 PolarHBondContact O-N 3.41Å
286	Q	87.2	Confident	86.7	Confident	46 Å²	46	65.6 Å²	65.6	22%	0.215	33%	0.332	C	S	.	.			trans	-83.6	130.6	-175.3	-59.5	-53.1	-51.8	0	0	113	L199 P282 W283 P284 Y291	L199-Q286 HydrophobicContact CD1-CG 3.78Å; L199-Q286 HydrophobicContact CD2-CG 4.43Å; P282-Q286 WeakPolarHBondContact O-CG 3.25Å; P282-Q286 PolarHBondContact O-NE2 2.81Å; W283-Q286 PolarHBondContact O-N 3.21Å; P284-Q286 VanDerWaalsContact C-N 3.29Å; Q286-Y291 HydrophobicContact CB-CD2 4.26Å; Q286-Y291 HydrophobicContact CB-CE1 3.95Å; Q286-Y291 HydrophobicContact CB-CE2 3.55Å; Q286-Y291 WeakPolarHBondContact CB-OH 3.37Å; Q286-Y291 HydrophobicContact CG-CE1 4.27Å
287	D	88.3	Confident	86.8	Confident	109 Å²	109	64.1 Å²	64.1	58%	0.583	32%	0.324	S	S	*	.			trans	-94.1	166.2	173.3	-66.9	-35.6	0	0	0	112.7	I289 S290 Y291	D287-I289 PolarHBondContact O-N 2.73Å; D287-I289 VanDerWaalsContact O-N 3.11Å; D287-S290 PolarHBondContact O-N 2.95Å; D287-Y291 WeakPolarHBondContact O-CD2 3.25Å; D287-Y291 PolarHBondContact O-N 3.29Å
288	D	87.2	Confident	87.1	Confident	26 Å²	26	56.5 Å²	56.5	14%	0.139	29%	0.291	C	S	.	.	H	α-helix	trans	-51.4	-34.1	173	-83.8	-31.5	0	0	0	112.9	Y43 R48 T50 H292	Y43-D288 HydrophobicContact CE2-CB 4.29Å; R48-D288 WeakPolarHBondContact CD-OD2 3.36Å; R48-D288 IonicContact NH1-OD2 3.22Å; R48-D288 PolarHBondContact NH1-OD2 3.4Å; T50-D288 VanDerWaalsContact CB-OD1 3.27Å; T50-D288 WeakPolarHBondContact CB-OD1 3.5Å; T50-D288 WeakPolarHBondContact CG2-OD1 3.29Å; T50-D288 PolarHBondContact OG1-OD1 2.92Å; T50-D288 PolarHBondContact OG1-OD2 3.06Å; D288-H292 WeakPolarHBondContact O-CB 3.48Å; D288-H292 PolarHBondContact O-N 2.91Å
289	I	89.6	Confident	87.5	Confident	89 Å²	89	56.4 Å²	56.4	46%	0.456	29%	0.291	S	S	.	.	H	α-helix	trans	-71.4	-45	179.6	-60.2	172.2	0	0	0	110.5	D287 Y291 H292 H293	D287-I289 PolarHBondContact O-N 2.73Å; D287-I289 VanDerWaalsContact O-N 3.11Å; I289-Y291 VanDerWaalsContact C-N 3.32Å; I289-Y291 PolarHBondContact O-N 3.26Å; I289-H292 WeakPolarHBondContact O-CB 3.43Å; I289-H292 PolarHBondContact O-N 3.48Å; I289-H292 VanDerWaalsContact O-N 3.13Å; I289-H293 PolarHBondContact O-CD2 3.13Å; I289-H293 PolarHBondContact O-N 3.42Å
290	S	90.1	Very high	88.1	Confident	46 Å²	46	53.7 Å²	53.7	32%	0.322	28%	0.277	S	S	.	.	H	α-helix	trans	-60.9	-44.1	176.4	-53.3	0	0	0	0	110.6	D287 H292 H293 M294	D287-S290 PolarHBondContact O-N 2.95Å; S290-H292 VanDerWaalsContact C-N 3.33Å; S290-H292 PolarHBondContact O-N 3.29Å; S290-H293 PolarHBondContact O-N 3.46Å; S290-M294 PolarHBondContact O-N 2.99Å
291	Y	90.2	Very high	88.6	Confident	13 Å²	13	51 Å²	51	5%	0.051	27%	0.266	C	S	.	.	H	α-helix	trans	-63	-36.1	173.6	-71.4	-55.5	0	0	0	113.2	T49 T50 F53 L151 W283 Q286 D287 I289 M294 R295	T49-Y291 WeakPolarHBondContact OG1-CB 3.38Å; T50-Y291 HydrophobicContact CG2-CD2 4.24Å; T50-Y291 HydrophobicContact CG2-CE2 4.29Å; F53-Y291 HydrophobicContact CE2-CD2 4.46Å; F53-Y291 AromaticContact CE2-CE1 4Å; F53-Y291 HydrophobicContact CE2-CE1 4Å; F53-Y291 AromaticContact CE2-CE2 3.92Å; F53-Y291 HydrophobicContact CE2-CE2 3.92Å; F53-Y291 AromaticContact CE2-CZ 3.66Å; F53-Y291 HydrophobicContact CZ-CD1 4.46Å; F53-Y291 HydrophobicContact CZ-CE1 4.16Å; L151-Y291 HydrophobicContact CD2-CD1 3.54Å; L151-Y291 HydrophobicContact CD2-CE1 4.18Å; L151-Y291 HydrophobicContact CD2-CG 4.23Å; W283-Y291 HydrophobicContact CE3-CE1 4.35Å; W283-Y291 HydrophobicContact CZ3-CE1 4.24Å; W283-Y291 PolarHBondContact O-OH 3.15Å; Q286-Y291 HydrophobicContact CB-CD2 4.26Å; Q286-Y291 HydrophobicContact CB-CE1 3.95Å; Q286-Y291 HydrophobicContact CB-CE2 3.55Å; Q286-Y291 WeakPolarHBondContact CB-OH 3.37Å; Q286-Y291 HydrophobicContact CG-CE1 4.27Å; D287-Y291 WeakPolarHBondContact O-CD2 3.25Å; D287-Y291 PolarHBondContact O-N 3.29Å; I289-Y291 VanDerWaalsContact C-N 3.32Å; I289-Y291 PolarHBondContact O-N 3.26Å; Y291-M294 HydrophobicContact CD1-CE 3.68Å; Y291-M294 HydrophobicContact CE1-CE 4Å; Y291-R295 VanDerWaalsContact O-CB 3.26Å; Y291-R295 WeakPolarHBondContact O-CB 3.47Å; Y291-R295 PolarHBondContact O-N 3.04Å
292	H	90.6	Very high	89	Confident	4 Å²	4	58 Å²	58	2%	0.019	29%	0.291	C	S	.	.	H	α-helix	trans	-61.7	-47.7	173.9	171.4	82.6	0	0	0	111.8	Y38 W40 Y43 D288 I289 S290 R295 K296	Y38-H292 AromaticContact CE1-CE1 3.71Å; Y38-H292 AromaticContact CE1-ND1 3.27Å; Y38-H292 VanDerWaalsContact CE1-ND1 3.27Å; Y38-H292 WeakPolarHBondContact CE1-ND1 3.5Å; Y38-H292 AromaticContact CZ-ND1 3.39Å; Y38-H292 PolarHBondContact OH-ND1 3.48Å; W40-H292 AromaticContact CE3-CD2 3.99Å; W40-H292 AromaticContact CE3-NE2 3.47Å; W40-H292 AromaticContact CZ3-NE2 4Å; Y43-H292 WeakPolarHBondContact CB-ND1 3.32Å; Y43-H292 HydrophobicContact CD2-CB 4.01Å; Y43-H292 AromaticContact CD2-ND1 3.82Å; Y43-H292 HydrophobicContact CE2-CB 4.05Å; Y43-H292 HydrophobicContact CG-CB 4.44Å; Y43-H292 AromaticContact CG-ND1 3.61Å; D288-H292 WeakPolarHBondContact O-CB 3.48Å; D288-H292 PolarHBondContact O-N 2.91Å; I289-H292 WeakPolarHBondContact O-CB 3.43Å; I289-H292 PolarHBondContact O-N 3.48Å; I289-H292 VanDerWaalsContact O-N 3.13Å; S290-H292 VanDerWaalsContact C-N 3.33Å; S290-H292 PolarHBondContact O-N 3.29Å; H292-R295 PolarHBondContact O-N 3.17Å; H292-K296 PolarHBondContact O-N 3.38Å
293	H	91	Very high	89.2	Confident	106 Å²	106	62.4 Å²	62.4	49%	0.491	30%	0.303	S	S	.	.	H	α-helix	trans	-63.7	-44	178.5	-73.4	-64.1	0	0	0	112	I289 S290 R295 K296 L297	I289-H293 PolarHBondContact O-CD2 3.13Å; I289-H293 PolarHBondContact O-N 3.42Å; S290-H293 PolarHBondContact O-N 3.46Å; H293-R295 PolarHBondContact O-N 3.19Å; H293-K296 PolarHBondContact O-N 3.1Å; H293-L297 PolarHBondContact O-N 3.5Å
294	M	91.4	Very high	89.4	Confident	17 Å²	17	61.7 Å²	61.7	8%	0.084	30%	0.301	C	S	.	.	H	α-helix	trans	-61.9	-43.7	175.6	-173.9	169	65.8	0	0	111.3	I147 L151 L199 S290 Y291 K296 L297 V298	I147-M294 HydrophobicContact CG2-CE 3.88Å; I147-M294 HydrophobicContact CG2-CG 4Å; I147-M294 HydrophobicContact CG2-SD 3.97Å; L151-M294 HydrophobicContact CD1-CB 4.38Å; L151-M294 HydrophobicContact CD1-CE 3.71Å; L151-M294 HydrophobicContact CD1-CG 4.22Å; L151-M294 HydrophobicContact CD2-CE 3.93Å; L151-M294 HydrophobicContact CG-CE 4.24Å; L199-M294 HydrophobicContact CD1-CE 3.84Å; L199-M294 HydrophobicContact CD1-SD 3.91Å; L199-M294 HydrophobicContact CG-SD 3.99Å; S290-M294 PolarHBondContact O-N 2.99Å; Y291-M294 HydrophobicContact CD1-CE 3.68Å; Y291-M294 HydrophobicContact CE1-CE 4Å; M294-K296 VanDerWaalsContact C-N 3.31Å; M294-K296 PolarHBondContact O-N 3.39Å; M294-L297 WeakPolarHBondContact O-CB 3.45Å; M294-L297 PolarHBondContact O-N 3.02Å; M294-L297 VanDerWaalsContact O-N 3.16Å; M294-V298 HydrophobicContact CG-CG1 4.43Å; M294-V298 WeakPolarHBondContact O-CG1 3.17Å; M294-V298 WeakPolarHBondContact O-CG2 3.49Å; M294-V298 PolarHBondContact O-N 3.31Å
295	R	90.3	Very high	89.6	Confident	16 Å²	16	58.2 Å²	58.2	6%	0.06	28%	0.28	C	S	.	.	H	α-helix	trans	-59.2	-41.5	175.8	-171.9	169.1	171.4	-169.7	-5	111.8	Y38 E47 L151 Y291 H292 H293 V298 Q299	Y38-R295 HydrophobicContact CD1-CB 4.26Å; Y38-R295 HydrophobicContact CD1-CG 3.71Å; Y38-R295 VanDerWaalsContact CD2-CZ 3.45Å; Y38-R295 HydrophobicContact CE1-CB 4.05Å; Y38-R295 HydrophobicContact CE1-CG 3.9Å; Y38-R295 HydrophobicContact CG-CG 4.43Å; E47-R295 IonicContact OE1-CZ 3.38Å; E47-R295 IonicContact OE1-NH1 2.98Å; E47-R295 PolarHBondContact OE1-NH1 3.27Å; E47-R295 IonicContact OE1-NH2 2.82Å; E47-R295 PolarHBondContact OE1-NH2 3.04Å; E47-R295 IonicContact OE2-NH2 3.93Å; L151-R295 HydrophobicContact CB-CG 4.48Å; L151-R295 HydrophobicContact CD1-CB 3.82Å; L151-R295 HydrophobicContact CD1-CG 4.47Å; Y291-R295 VanDerWaalsContact O-CB 3.26Å; Y291-R295 WeakPolarHBondContact O-CB 3.47Å; Y291-R295 PolarHBondContact O-N 3.04Å; H292-R295 PolarHBondContact O-N 3.17Å; H293-R295 PolarHBondContact O-N 3.19Å; R295-V298 WeakPolarHBondContact O-CG2 3.05Å; R295-Q299 WeakPolarHBondContact O-CB 3.29Å; R295-Q299 PolarHBondContact O-N 3.19Å; R295-Q299 VanDerWaalsContact O-N 3.15Å
296	K	90.9	Very high	89.8	Confident	116 Å²	116	54 Å²	54	50%	0.504	27%	0.267	S	S	.	.	H	α-helix	trans	-65.9	-39.1	176.8	-171.2	-178.8	179.8	-177	0	111.9	H292 H293 M294	H292-K296 PolarHBondContact O-N 3.38Å; H293-K296 PolarHBondContact O-N 3.1Å; M294-K296 VanDerWaalsContact C-N 3.31Å; M294-K296 PolarHBondContact O-N 3.39Å
297	L	91	Very high	89.9	Confident	11 Å²	11	53 Å²	53	6%	0.058	26%	0.263	C	S	.	.	H	α-helix	trans	-65.5	-51.8	176.3	177.9	67.2	0	0	0	111.2	E197 F198 H293 M294 Q299 D300 R303 V304	E197-L297 HydrophobicContact CB-CD2 3.81Å; E197-L297 HydrophobicContact CG-CD2 4.44Å; F198-L297 HydrophobicContact CE1-CD2 4.42Å; H293-L297 PolarHBondContact O-N 3.5Å; M294-L297 WeakPolarHBondContact O-CB 3.45Å; M294-L297 PolarHBondContact O-N 3.02Å; M294-L297 VanDerWaalsContact O-N 3.16Å; L297-Q299 VanDerWaalsContact C-N 3.26Å; L297-Q299 PolarHBondContact O-N 3.05Å; L297-D300 PolarHBondContact O-N 3.32Å; L297-D300 VanDerWaalsContact O-N 3.15Å; L297-R303 HydrophobicContact CD1-CG 3.89Å; L297-V304 HydrophobicContact CG-CG2 4.4Å
298	V	90.4	Very high	89.9	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-67.6	-27.2	-174.6	-63.4	0	0	0	0	113.1	I147 E148 F198 M294 R295 D300 K301	I147-V298 HydrophobicContact CB-CG1 4Å; I147-V298 HydrophobicContact CG2-CG1 3.79Å; I147-V298 HydrophobicContact CG2-CG2 4.36Å; E148-V298 HydrophobicContact CB-CB 4.34Å; E148-V298 HydrophobicContact CB-CG2 3.76Å; E148-V298 HydrophobicContact CG-CG2 4.29Å; F198-V298 HydrophobicContact CD1-CG1 4.49Å; F198-V298 HydrophobicContact CE1-CG1 3.93Å; M294-V298 HydrophobicContact CG-CG1 4.43Å; M294-V298 WeakPolarHBondContact O-CG1 3.17Å; M294-V298 WeakPolarHBondContact O-CG2 3.49Å; M294-V298 PolarHBondContact O-N 3.31Å; R295-V298 WeakPolarHBondContact O-CG2 3.05Å; V298-D300 VanDerWaalsContact C-N 3.3Å; V298-K301 VanDerWaalsContact O-CD 3.24Å; V298-K301 WeakPolarHBondContact O-CD 3.49Å; V298-K301 WeakPolarHBondContact O-CE 3.29Å; V298-K301 PolarHBondContact O-NZ 2.87Å
299	Q	89.3	Confident	89.9	Confident	46 Å²	46	52.8 Å²	52.8	22%	0.215	26%	0.258	C	S	.	.	H	α-helix	trans	-69	-31.5	176.5	-166.6	-168	-46.2	0	0	111.8	Y38 R295 L297 K301	Y38-Q299 VanDerWaalsContact CB-OE1 3.32Å; Y38-Q299 PolarHBondContact O-OE1 3.15Å; R295-Q299 WeakPolarHBondContact O-CB 3.29Å; R295-Q299 PolarHBondContact O-N 3.19Å; R295-Q299 VanDerWaalsContact O-N 3.15Å; L297-Q299 VanDerWaalsContact C-N 3.26Å; L297-Q299 PolarHBondContact O-N 3.05Å; Q299-K301 PolarHBondContact O-N 3.31Å
300	D	90.1	Very high	89.9	Confident	72 Å²	72	50.1 Å²	50.1	39%	0.385	24%	0.244	S	C	.	.			trans	-88.4	88.9	177.2	-174.7	-10.7	0	0	0	110.7	L297 V298 E302 R303 V304	L297-D300 PolarHBondContact O-N 3.32Å; L297-D300 VanDerWaalsContact O-N 3.15Å; V298-D300 VanDerWaalsContact C-N 3.3Å; D300-E302 VanDerWaalsContact C-N 3.29Å; D300-E302 PolarHBondContact O-N 3.49Å; D300-E302 PolarHBondContact OD1-N 3.24Å; D300-R303 HydrophobicContact CB-CB 3.99Å; D300-R303 PolarHBondContact O-N 2.9Å; D300-R303 PolarHBondContact OD1-N 3.37Å; D300-R303 WeakPolarHBondContact OD2-CB 3.17Å; D300-V304 WeakPolarHBondContact O-CG2 3.35Å; D300-V304 PolarHBondContact O-N 2.93Å
301	K	89.7	Confident	89.9	Confident	41 Å²	41	53.5 Å²	53.5	18%	0.178	27%	0.265	C	S	.	.	H	α-helix	trans	-68.1	-28.9	-176.4	-52.2	-58	178.7	179.1	0	113.2	M97 L141 S144 D145 E148 V298 Q299 V304 G305	M97-K301 HydrophobicContact CE-CB 4.38Å; M97-K301 HydrophobicContact CE-CD 3.48Å; M97-K301 VanDerWaalsContact CE-CD 3.48Å; M97-K301 HydrophobicContact CE-CG 3.48Å; M97-K301 VanDerWaalsContact CE-CG 3.48Å; L141-K301 HydrophobicContact CD2-CB 4.45Å; S144-K301 PolarHBondContact OG-NZ 3.42Å; S144-K301 VanDerWaalsContact OG-NZ 3.12Å; D145-K301 WeakPolarHBondContact OD1-CE 3.42Å; D145-K301 IonicContact OD1-NZ 3.78Å; D145-K301 PolarHBondContact OD1-NZ 2.65Å; E148-K301 WeakPolarHBondContact OE2-CE 3.5Å; E148-K301 IonicContact OE2-NZ 3.44Å; E148-K301 PolarHBondContact OE2-NZ 3.17Å; V298-K301 VanDerWaalsContact O-CD 3.24Å; V298-K301 WeakPolarHBondContact O-CD 3.49Å; V298-K301 WeakPolarHBondContact O-CE 3.29Å; V298-K301 PolarHBondContact O-NZ 2.87Å; Q299-K301 PolarHBondContact O-N 3.31Å; K301-V304 PolarHBondContact O-N 3.38Å; K301-G305 PolarHBondContact O-N 3.44Å
302	E	88.5	Confident	89.9	Confident	171 Å²	171	55.5 Å²	55.5	80%	0.799	28%	0.279	S	S	*	.	H	α-helix	trans	-66.7	-43.9	175	-65.7	-172.2	174	0	0	110.1	D300 G305 S306	D300-E302 VanDerWaalsContact C-N 3.29Å; D300-E302 PolarHBondContact O-N 3.49Å; D300-E302 PolarHBondContact OD1-N 3.24Å; E302-G305 PolarHBondContact O-N 3.03Å; E302-S306 WeakPolarHBondContact O-CB 3.5Å; E302-S306 PolarHBondContact O-N 3.39Å
303	R	89.9	Confident	89.9	Confident	129 Å²	129	63.4 Å²	63.4	49%	0.487	31%	0.313	S	S	.	.	H	α-helix	trans	-62.8	-43.2	174.4	-175.6	173.2	176.8	176.4	-1.9	112.2	L297 D300 G305 S306 L307	L297-R303 HydrophobicContact CD1-CG 3.89Å; D300-R303 HydrophobicContact CB-CB 3.99Å; D300-R303 PolarHBondContact O-N 2.9Å; D300-R303 PolarHBondContact OD1-N 3.37Å; D300-R303 WeakPolarHBondContact OD2-CB 3.17Å; R303-G305 VanDerWaalsContact C-N 3.34Å; R303-G305 PolarHBondContact O-N 2.99Å; R303-S306 PolarHBondContact O-N 3.16Å; R303-S306 PolarHBondContact O-OG 2.82Å; R303-L307 PolarHBondContact O-N 2.93Å
304	V	90.7	Very high	90	Very high	0 Å²	0	59 Å²	59	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-60.2	-45.3	174.8	173.5	0	0	0	0	111.2	L140 L141 F198 L297 D300 K301 S306 L307	L140-V304 HydrophobicContact CD2-CG1 4.11Å; L140-V304 HydrophobicContact CG-CG1 4.12Å; L141-V304 HydrophobicContact CD2-CB 4.41Å; L141-V304 HydrophobicContact CD2-CG1 4.11Å; F198-V304 HydrophobicContact CZ-CG1 3.86Å; F198-V304 HydrophobicContact CZ-CG2 4.12Å; L297-V304 HydrophobicContact CG-CG2 4.4Å; D300-V304 WeakPolarHBondContact O-CG2 3.35Å; D300-V304 PolarHBondContact O-N 2.93Å; K301-V304 PolarHBondContact O-N 3.38Å; V304-S306 VanDerWaalsContact C-N 3.31Å; V304-S306 PolarHBondContact O-N 2.82Å; V304-L307 WeakPolarHBondContact O-CB 3.35Å; V304-L307 PolarHBondContact O-N 3.33Å
305	G	88.5	Confident	89.9	Confident	12 Å²	12	63 Å²	63	12%	0.124	32%	0.32	C	S	.	.	H	α-helix	trans	-60.1	-40.2	175.9	0	0	0	0	0	112.8	K301 E302 R303 L307 T308 H309	K301-G305 PolarHBondContact O-N 3.44Å; E302-G305 PolarHBondContact O-N 3.03Å; R303-G305 VanDerWaalsContact C-N 3.34Å; R303-G305 PolarHBondContact O-N 2.99Å; G305-L307 PolarHBondContact O-N 2.7Å; G305-T308 PolarHBondContact O-N 2.98Å; G305-T308 PolarHBondContact O-OG1 2.98Å; G305-H309 PolarHBondContact O-CD2 2.97Å
306	S	90.4	Very high	89.8	Confident	63 Å²	63	63.4 Å²	63.4	44%	0.441	32%	0.323	S	S	.	.	H	α-helix	trans	-59.9	-27.6	179.8	79	0	0	0	0	113.8	E302 R303 V304 T308 H309	E302-S306 WeakPolarHBondContact O-CB 3.5Å; E302-S306 PolarHBondContact O-N 3.39Å; R303-S306 PolarHBondContact O-N 3.16Å; R303-S306 PolarHBondContact O-OG 2.82Å; V304-S306 VanDerWaalsContact C-N 3.31Å; V304-S306 PolarHBondContact O-N 2.82Å; S306-T308 PolarHBondContact O-N 3.42Å; S306-T308 VanDerWaalsContact O-N 3.17Å; S306-H309 PolarHBondContact O-N 3.13Å
307	L	89.6	Confident	89.8	Confident	25 Å²	25	59.6 Å²	59.6	13%	0.131	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-22.6	175.5	-60.1	172.9	0	0	0	112.7	I193 E197 F198 R303 V304 G305	I193-L307 HydrophobicContact CG2-CD2 4.34Å; E197-L307 HydrophobicContact CB-CD1 4.26Å; E197-L307 HydrophobicContact CG-CD1 4.05Å; E197-L307 HydrophobicContact CG-CD2 4.43Å; F198-L307 HydrophobicContact CE2-CD1 4.27Å; R303-L307 PolarHBondContact O-N 2.93Å; V304-L307 WeakPolarHBondContact O-CB 3.35Å; V304-L307 PolarHBondContact O-N 3.33Å; G305-L307 PolarHBondContact O-N 2.7Å
308	T	88.3	Confident	89.7	Confident	2 Å²	2	62 Å²	62	1%	0.012	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-5.8	178.3	68.1	0	0	0	0	113.6	Y136 T137 L140 I190 G305 S306	Y136-T308 HydrophobicContact CD1-CG2 4.18Å; Y136-T308 HydrophobicContact CE1-CG2 4.13Å; T137-T308 HydrophobicContact CG2-CG2 4.33Å; T137-T308 WeakPolarHBondContact OG1-CB 3.46Å; T137-T308 PolarHBondContact OG1-OG1 3.13Å; T137-T308 VanDerWaalsContact OG1-OG1 3.1Å; L140-T308 HydrophobicContact CD2-CG2 3.48Å; L140-T308 VanDerWaalsContact CD2-CG2 3.48Å; I190-T308 VanDerWaalsContact CD1-O 3.29Å; I190-T308 WeakPolarHBondContact CD1-O 3.34Å; I190-T308 HydrophobicContact CG2-CG2 4.35Å; G305-T308 PolarHBondContact O-N 2.98Å; G305-T308 PolarHBondContact O-OG1 2.98Å; S306-T308 PolarHBondContact O-N 3.42Å; S306-T308 VanDerWaalsContact O-N 3.17Å
309	H	87.2	Confident	89.7	Confident	130 Å²	130	65.6 Å²	65.6	60%	0.602	34%	0.341	S	S	*	.			trans	-109.4	95	-177	-64	-58.1	0	0	0	110.5	G305 S306	G305-H309 PolarHBondContact O-CD2 2.97Å; S306-H309 PolarHBondContact O-N 3.13Å
310	I	89.5	Confident	89.8	Confident	33 Å²	33	65.3 Å²	65.3	17%	0.169	35%	0.351	C	S	.	.			trans	-100.3	145.6	172.3	60.7	174.4	0	0	0	110.8	H186 E189 I190 I193 V312	H186-I310 WeakPolarHBondContact NE2-CG1 3.45Å; E189-I310 HydrophobicContact CB-CD1 3.94Å; I190-I310 HydrophobicContact CD1-CD1 4.39Å; I190-I310 HydrophobicContact CD1-CG1 4.17Å; I190-I310 HydrophobicContact CG1-CD1 3.76Å; I190-I310 HydrophobicContact CG1-CG1 3.84Å; I190-I310 HydrophobicContact CG1-CG2 4.32Å; I193-I310 HydrophobicContact CD1-CG2 3.79Å; I310-V312 HydrophobicContact CD1-CB 4.29Å; I310-V312 HydrophobicContact CD1-CG2 3.76Å; I310-V312 HydrophobicContact CG1-CB 4.24Å; I310-V312 HydrophobicContact CG1-CG2 4Å; I310-V312 PolarHBondContact O-N 3.25Å
311	P	90.1	Very high	90	Very high	117 Å²	117	65.6 Å²	65.6	76%	0.76	36%	0.363	S	S	*	.	S	Bend	trans	-78.8	56.5	-178.2	34.1	-36.9	0	0	0	111.7
312	V	90.9	Very high	90.2	Very high	55 Å²	55	71.7 Å²	71.7	33%	0.333	39%	0.392	S	S	.	.			trans	-112.5	120.5	176.2	176	0	0	0	0	108.6	I310 L314	I310-V312 HydrophobicContact CD1-CB 4.29Å; I310-V312 HydrophobicContact CD1-CG2 3.76Å; I310-V312 HydrophobicContact CG1-CB 4.24Å; I310-V312 HydrophobicContact CG1-CG2 4Å; I310-V312 PolarHBondContact O-N 3.25Å; V312-L314 HydrophobicContact CG1-CG 4.47Å; V312-L314 PolarHBondContact O-N 3.39Å
313	F	91.3	Very high	90.3	Very high	170 Å²	170	67.5 Å²	67.5	75%	0.746	38%	0.375	S	S	*	.			trans	-89.4	102.9	-173.6	-58.3	-72.7	0	0	0	111	T318	F313-T318 WeakPolarHBondContact CA-OG1 3.39Å; F313-T318 HydrophobicContact CD1-CG2 3.88Å
314	L	91.3	Very high	90.4	Very high	13 Å²	13	68 Å²	68	7%	0.068	38%	0.378	C	S	.	.			trans	-109.5	141.1	167.7	-61.6	176	0	0	0	110.5	Y129 E182 H186 V312 E316 I317 T318	Y129-L314 HydrophobicContact CE1-CD1 4.01Å; E182-L314 HydrophobicContact CB-CD2 4.01Å; H186-L314 HydrophobicContact CB-CD1 3.55Å; V312-L314 HydrophobicContact CG1-CG 4.47Å; V312-L314 PolarHBondContact O-N 3.39Å; L314-E316 PolarHBondContact O-N 3.5Å; L314-I317 HydrophobicContact CB-CD1 4.06Å; L314-I317 HydrophobicContact CB-CG1 3.98Å; L314-I317 HydrophobicContact CD1-CD1 4.24Å; L314-I317 HydrophobicContact CG-CD1 4.36Å; L314-I317 PolarHBondContact O-N 3.17Å; L314-T318 PolarHBondContact N-OG1 2.89Å; L314-T318 VanDerWaalsContact N-OG1 3.15Å; L314-T318 WeakPolarHBondContact O-CB 3.38Å; L314-T318 PolarHBondContact O-N 3.08Å; L314-T318 PolarHBondContact O-OG1 2.86Å
315	P	90.6	Very high	90.6	Very high	101 Å²	101	71.7 Å²	71.7	66%	0.656	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-24.4	-177.6	25.8	-34.5	0	0	0	113.7	R180	R180-P315 VanDerWaalsContact NH2-CD 3.29Å
316	E	88.6	Confident	90.8	Very high	25 Å²	25	77.9 Å²	77.9	12%	0.117	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-28.9	179	-63.6	87.5	167.1	0	0	113.8	G126 Y129 R180 L314	G126-E316 VanDerWaalsContact CA-CG 3.5Å; Y129-E316 HydrophobicContact CD1-CB 4.27Å; R180-E316 IonicContact CZ-OE1 2.97Å; R180-E316 IonicContact CZ-OE2 3.6Å; R180-E316 IonicContact NE-OE1 2.77Å; R180-E316 PolarHBondContact NE-OE1 3.34Å; R180-E316 IonicContact NH2-OE1 3.83Å; R180-E316 PolarHBondContact NH2-OE1 2.96Å; R180-E316 IonicContact NH2-OE2 2.78Å; R180-E316 PolarHBondContact NH2-OE2 3.07Å; L314-E316 PolarHBondContact O-N 3.5Å
317	I	89.3	Confident	90.9	Very high	36 Å²	36	77.5 Å²	77.5	19%	0.185	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.4	-25.5	-173.1	71.6	-173	0	0	0	112.7	Y129 L133 H186 L314 I319	Y129-I317 HydrophobicContact CD1-CG2 3.58Å; Y129-I317 HydrophobicContact CE1-CG2 3.67Å; L133-I317 HydrophobicContact CD2-CB 4.47Å; L133-I317 HydrophobicContact CD2-CD1 4.49Å; L133-I317 HydrophobicContact CD2-CG2 3.93Å; H186-I317 WeakPolarHBondContact CE1-CD1 3.49Å; H186-I317 WeakPolarHBondContact NE2-CD1 3.5Å; L314-I317 HydrophobicContact CB-CD1 4.06Å; L314-I317 HydrophobicContact CB-CG1 3.98Å; L314-I317 HydrophobicContact CD1-CD1 4.24Å; L314-I317 HydrophobicContact CG-CD1 4.36Å; L314-I317 PolarHBondContact O-N 3.17Å; I317-I319 PolarHBondContact O-N 2.94Å
318	T	90.7	Very high	91	Very high	61 Å²	61	80.3 Å²	80.3	37%	0.374	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-73	119.8	-175.3	-55.9	0	0	0	0	109.1	F313 L314	F313-T318 WeakPolarHBondContact CA-OG1 3.39Å; F313-T318 HydrophobicContact CD1-CG2 3.88Å; L314-T318 PolarHBondContact N-OG1 2.89Å; L314-T318 VanDerWaalsContact N-OG1 3.15Å; L314-T318 WeakPolarHBondContact O-CB 3.38Å; L314-T318 PolarHBondContact O-N 3.08Å; L314-T318 PolarHBondContact O-OG1 2.86Å
319	I	88.8	Confident	91.3	Very high	75 Å²	75	86.9 Å²	86.9	39%	0.385	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-95.9	133.9	176	-57.9	168.4	0	0	0	107.8	M111 I317 D323	M111-I319 HydrophobicContact CE-CD1 3.86Å; I317-I319 PolarHBondContact O-N 2.94Å; I319-D323 HydrophobicContact CG2-CB 3.93Å
320	G	92.2	Very high	91.6	Very high	41 Å²	41	82.8 Å²	82.8	42%	0.423	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-62.1	146.4	175	0	0	0	0	0	111.7	H322 D323 Y324	G320-H322 VanDerWaalsContact C-N 3.29Å; G320-H322 PolarHBondContact O-N 3.13Å; G320-D323 PolarHBondContact O-N 3.42Å; G320-Y324 PolarHBondContact O-N 3.46Å
321	A	93.4	Very high	91.6	Very high	78 Å²	78	84.7 Å²	84.7	65%	0.645	44%	0.443	S	S	*	.	H	α-helix	trans	-57.7	-39.8	-176.4	0	0	0	0	0	113	Y324 D325	A321-Y324 PolarHBondContact O-N 3.01Å; A321-D325 WeakPolarHBondContact O-CB 3.34Å; A321-D325 PolarHBondContact O-N 3.11Å
322	H	94.9	Very high	91.6	Very high	168 Å²	168	83.8 Å²	83.8	78%	0.778	43%	0.425	S	S	*	.	H	α-helix	trans	-65	-44.8	177.9	-62.8	-61.5	0	0	0	112.6	G320 Y324 D325 Q326	G320-H322 VanDerWaalsContact C-N 3.29Å; G320-H322 PolarHBondContact O-N 3.13Å; H322-Y324 VanDerWaalsContact C-N 3.32Å; H322-Y324 PolarHBondContact O-N 3.22Å; H322-D325 PolarHBondContact O-N 3.03Å; H322-Q326 WeakPolarHBondContact O-CB 3.21Å; H322-Q326 PolarHBondContact O-N 3.08Å
323	D	91.2	Very high	91.6	Very high	84 Å²	84	85.3 Å²	85.3	45%	0.449	44%	0.443	S	S	.	.	H	α-helix	trans	-65.3	-39	178.1	-69.8	-4.5	0	0	0	111.2	I319 G320 K327	I319-D323 HydrophobicContact CG2-CB 3.93Å; G320-D323 PolarHBondContact O-N 3.42Å; D323-K327 WeakPolarHBondContact O-CB 3.4Å; D323-K327 WeakPolarHBondContact O-CD 3.19Å; D323-K327 VanDerWaalsContact O-CG 3.25Å; D323-K327 WeakPolarHBondContact O-CG 3.37Å; D323-K327 PolarHBondContact O-N 2.8Å; D323-K327 VanDerWaalsContact O-N 3.12Å
324	Y	91.4	Very high	91.5	Very high	138 Å²	138	79.3 Å²	79.3	54%	0.541	42%	0.418	S	S	.	.	H	α-helix	trans	-63.4	-48.9	175.9	-179.5	-94.2	0	0	0	111.2	G320 A321 H322 Q326 K327 Y328	G320-Y324 PolarHBondContact O-N 3.46Å; A321-Y324 PolarHBondContact O-N 3.01Å; H322-Y324 VanDerWaalsContact C-N 3.32Å; H322-Y324 PolarHBondContact O-N 3.22Å; Y324-Q326 PolarHBondContact O-N 3.31Å; Y324-K327 PolarHBondContact O-N 3.48Å; Y324-Y328 VanDerWaalsContact O-CB 3.25Å; Y324-Y328 WeakPolarHBondContact O-CB 3.34Å; Y324-Y328 PolarHBondContact O-N 2.95Å
325	D	94.5	Very high	91.4	Very high	79 Å²	79	82.9 Å²	82.9	42%	0.422	44%	0.443	S	S	.	.	H	α-helix	trans	-61.5	-45.7	-179	-165.6	49.9	0	0	0	111.6	A321 H322 K327 Y328 Y329	A321-D325 WeakPolarHBondContact O-CB 3.34Å; A321-D325 PolarHBondContact O-N 3.11Å; H322-D325 PolarHBondContact O-N 3.03Å; D325-K327 VanDerWaalsContact C-N 3.33Å; D325-K327 PolarHBondContact O-N 3.02Å; D325-Y328 PolarHBondContact O-N 3.48Å; D325-Y329 WeakPolarHBondContact O-CD2 3.27Å; D325-Y329 PolarHBondContact O-N 3.44Å; D325-Y329 VanDerWaalsContact O-N 3.08Å; D325-Y329 WeakPolarHBondContact OD1-CE2 3.26Å
326	Q	93.9	Very high	91.1	Very high	141 Å²	141	79 Å²	79	66%	0.659	42%	0.42	S	S	*	.	H	α-helix	trans	-58.1	-45.3	175.9	-174.1	179.9	7.5	0	0	111.7	H322 Y324 A330	H322-Q326 WeakPolarHBondContact O-CB 3.21Å; H322-Q326 PolarHBondContact O-N 3.08Å; Y324-Q326 PolarHBondContact O-N 3.31Å; Q326-A330 WeakPolarHBondContact O-CB 3.21Å; Q326-A330 PolarHBondContact O-N 3.28Å
327	K	91.9	Very high	90.9	Very high	55 Å²	55	79.2 Å²	79.2	24%	0.239	42%	0.421	C	S	.	.	H	α-helix	trans	-72.6	-34.7	-178.9	-73.6	171.7	176.1	157.3	0	112.6	M111 D323 Y324 D325 A330 Y331	M111-K327 HydrophobicContact CE-CD 3.22Å; M111-K327 VanDerWaalsContact CE-CE 3.49Å; M111-K327 HydrophobicContact SD-CD 4.39Å; M111-K327 PolarHBondContact SD-NZ 3.38Å; D323-K327 WeakPolarHBondContact O-CB 3.4Å; D323-K327 WeakPolarHBondContact O-CD 3.19Å; D323-K327 VanDerWaalsContact O-CG 3.25Å; D323-K327 WeakPolarHBondContact O-CG 3.37Å; D323-K327 PolarHBondContact O-N 2.8Å; D323-K327 VanDerWaalsContact O-N 3.12Å; Y324-K327 PolarHBondContact O-N 3.48Å; D325-K327 VanDerWaalsContact C-N 3.33Å; D325-K327 PolarHBondContact O-N 3.02Å; K327-A330 PolarHBondContact O-N 2.97Å; K327-Y331 WeakPolarHBondContact O-CB 3.2Å; K327-Y331 PolarHBondContact O-N 3.21Å
328	Y	91.9	Very high	90.9	Very high	84 Å²	84	80.6 Å²	80.6	33%	0.329	43%	0.429	S	S	.	.	H	α-helix	trans	-61.6	-47.6	175.4	175.9	-101.1	0	0	0	111.6	Y324 D325 Y331 R332	Y324-Y328 VanDerWaalsContact O-CB 3.25Å; Y324-Y328 WeakPolarHBondContact O-CB 3.34Å; Y324-Y328 PolarHBondContact O-N 2.95Å; D325-Y328 PolarHBondContact O-N 3.48Å; Y328-Y331 PolarHBondContact O-N 3.33Å; Y328-R332 PolarHBondContact O-N 2.79Å; Y328-R332 PolarHBondContact OH-NE 3.29Å; Y328-R332 PolarHBondContact OH-NH2 3Å
329	Y	93.3	Very high	90.7	Very high	140 Å²	140	85 Å²	85	55%	0.549	44%	0.44	S	S	.	.	H	α-helix	trans	-69.1	-35.8	175.1	-70.2	-62.5	0	0	0	112.6	D325 Y331 R332 A333	D325-Y329 WeakPolarHBondContact O-CD2 3.27Å; D325-Y329 PolarHBondContact O-N 3.44Å; D325-Y329 VanDerWaalsContact O-N 3.08Å; D325-Y329 WeakPolarHBondContact OD1-CE2 3.26Å; Y329-Y331 VanDerWaalsContact C-N 3.31Å; Y329-Y331 PolarHBondContact O-N 2.95Å; Y329-R332 PolarHBondContact O-N 3.18Å; Y329-A333 WeakPolarHBondContact O-CB 3.44Å; Y329-A333 PolarHBondContact O-N 3.26Å
330	A	93.1	Very high	90.5	Very high	44 Å²	44	84.7 Å²	84.7	36%	0.364	45%	0.448	S	S	.	.	H	α-helix	trans	-61.9	-39.4	173.6	0	0	0	0	0	112	F108 Q326 K327 A333	F108-A330 HydrophobicContact CE1-CB 4.07Å; F108-A330 HydrophobicContact CZ-CB 4.03Å; Q326-A330 WeakPolarHBondContact O-CB 3.21Å; Q326-A330 PolarHBondContact O-N 3.28Å; K327-A330 PolarHBondContact O-N 2.97Å; A330-A333 PolarHBondContact O-N 3.15Å
331	Y	90.7	Very high	90.1	Very high	74 Å²	74	92.2 Å²	92.2	29%	0.29	46%	0.464	S	S	.	.	H	α-helix	trans	-66.3	-44.7	175	179	-100.5	0	0	0	111.6	L104 F108 K327 Y328 Y329 A333 L334 K337	L104-Y331 HydrophobicContact CD1-CD2 4.45Å; L104-Y331 HydrophobicContact CD1-CE2 3.74Å; F108-Y331 HydrophobicContact CB-CD2 4.2Å; F108-Y331 AromaticContact CD1-CD2 3.9Å; F108-Y331 HydrophobicContact CD1-CD2 3.9Å; F108-Y331 HydrophobicContact CD1-CG 4.29Å; F108-Y331 HydrophobicContact CE1-CD2 4.48Å; F108-Y331 HydrophobicContact CG-CD2 4Å; K327-Y331 WeakPolarHBondContact O-CB 3.2Å; K327-Y331 PolarHBondContact O-N 3.21Å; Y328-Y331 PolarHBondContact O-N 3.33Å; Y329-Y331 VanDerWaalsContact C-N 3.31Å; Y329-Y331 PolarHBondContact O-N 2.95Å; Y331-A333 VanDerWaalsContact C-N 3.26Å; Y331-A333 PolarHBondContact O-N 3.35Å; Y331-L334 HydrophobicContact CD2-CD1 4.02Å; Y331-L334 VanDerWaalsContact O-CB 3.24Å; Y331-L334 WeakPolarHBondContact O-CB 3.45Å; Y331-L334 WeakPolarHBondContact O-CG 3.17Å; Y331-L334 PolarHBondContact O-N 3.29Å; Y331-L334 VanDerWaalsContact O-N 3.11Å; Y331-K337 HydrophobicContact CE1-CB 4.25Å; Y331-K337 HydrophobicContact CE1-CD 4.27Å; Y331-K337 HydrophobicContact CE1-CG 4.45Å; Y331-K337 HydrophobicContact CE2-CD 4.39Å; Y331-K337 HydrophobicContact CE2-CG 4.46Å; Y331-K337 WeakPolarHBondContact O-CB 3.25Å; Y331-K337 WeakPolarHBondContact OH-CD 3.38Å; Y331-K337 PolarHBondContact OH-NZ 3.44Å
332	R	90.4	Very high	89.7	Confident	98 Å²	98	89.2 Å²	89.2	37%	0.37	44%	0.441	S	S	.	.	H	α-helix	trans	-65.6	-27.4	176.9	-77.5	-170.8	166.9	-140.5	-1.9	113.9	Y328 Y329 L334	Y328-R332 PolarHBondContact O-N 2.79Å; Y328-R332 PolarHBondContact OH-NE 3.29Å; Y328-R332 PolarHBondContact OH-NH2 3Å; Y329-R332 PolarHBondContact O-N 3.18Å; R332-L334 PolarHBondContact O-N 2.88Å
333	A	90.9	Very high	89.4	Confident	86 Å²	86	85.5 Å²	85.5	71%	0.711	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-12.1	175.5	0	0	0	0	0	113.1	Y329 A330 Y331	Y329-A333 WeakPolarHBondContact O-CB 3.44Å; Y329-A333 PolarHBondContact O-N 3.26Å; A330-A333 PolarHBondContact O-N 3.15Å; Y331-A333 VanDerWaalsContact C-N 3.26Å; Y331-A333 PolarHBondContact O-N 3.35Å
334	L	89.4	Confident	89.2	Confident	44 Å²	44	81.7 Å²	81.7	23%	0.23	40%	0.4	C	S	.	.	S	Bend	trans	-67.9	146.1	173.5	-62.3	174.8	0	0	0	110.9	L104 F108 Y331 R332 G336 K337	L104-L334 HydrophobicContact CD2-CD1 3.94Å; F108-L334 HydrophobicContact CD2-CD1 4.15Å; F108-L334 HydrophobicContact CE2-CD1 3.89Å; F108-L334 HydrophobicContact CZ-CD1 4.31Å; Y331-L334 HydrophobicContact CD2-CD1 4.02Å; Y331-L334 VanDerWaalsContact O-CB 3.24Å; Y331-L334 WeakPolarHBondContact O-CB 3.45Å; Y331-L334 WeakPolarHBondContact O-CG 3.17Å; Y331-L334 PolarHBondContact O-N 3.29Å; Y331-L334 VanDerWaalsContact O-N 3.11Å; R332-L334 PolarHBondContact O-N 2.88Å; L334-G336 PolarHBondContact O-N 2.83Å; L334-K337 HydrophobicContact CB-CB 4.2Å; L334-K337 HydrophobicContact CB-CG 3.93Å; L334-K337 PolarHBondContact O-N 2.64Å
335	P	87.6	Confident	89	Confident	89 Å²	89	78.7 Å²	78.7	58%	0.578	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	130.1	-179.1	26.4	-34.1	0	0	0	110.6	K337 D346 V347	P335-K337 VanDerWaalsContact C-N 3.34Å; P335-D346 VanDerWaalsContact CA-OD2 3.22Å; P335-D346 WeakPolarHBondContact CA-OD2 3.48Å; P335-V347 HydrophobicContact CB-CG1 4.36Å
336	G	84.6	Confident	88.7	Confident	18 Å²	18	79.4 Å²	79.4	19%	0.186	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.1	8.8	178.8	0	0	0	0	0	115.4	L334 N344 D346 V347	L334-G336 PolarHBondContact O-N 2.83Å; G336-N344 PolarHBondContact O-ND2 3.16Å; G336-D346 PolarHBondContact N-OD2 3.01Å; G336-V347 VanDerWaalsContact CA-CG1 3.5Å
337	K	85.8	Confident	88.3	Confident	30 Å²	30	76.5 Å²	76.5	13%	0.13	40%	0.399	C	S	.	.			trans	-115	-3.1	-177.3	-62	-59	-170.6	176.2	0	115	E100 Y331 L334 P335	E100-K337 WeakPolarHBondContact OE1-CE 3.47Å; E100-K337 IonicContact OE1-NZ 3Å; E100-K337 PolarHBondContact OE1-NZ 3.46Å; Y331-K337 HydrophobicContact CE1-CB 4.25Å; Y331-K337 HydrophobicContact CE1-CD 4.27Å; Y331-K337 HydrophobicContact CE1-CG 4.45Å; Y331-K337 HydrophobicContact CE2-CD 4.39Å; Y331-K337 HydrophobicContact CE2-CG 4.46Å; Y331-K337 WeakPolarHBondContact O-CB 3.25Å; Y331-K337 WeakPolarHBondContact OH-CD 3.38Å; Y331-K337 PolarHBondContact OH-NZ 3.44Å; L334-K337 HydrophobicContact CB-CB 4.2Å; L334-K337 HydrophobicContact CB-CG 3.93Å; L334-K337 PolarHBondContact O-N 2.64Å; P335-K337 VanDerWaalsContact C-N 3.34Å
338	N	87.6	Confident	88.1	Confident	66 Å²	66	76.2 Å²	76.2	35%	0.353	41%	0.412	S	S	.	.	S	Bend	trans	-74.6	-37	-177.8	-162.5	14.9	0	0	0	112.2
339	Y	87.7	Confident	87.9	Confident	153 Å²	153	74.5 Å²	74.5	60%	0.6	41%	0.409	S	S	*	.	S	Bend	trans	-125.2	173.4	178.7	-54.6	-74.3	0	0	0	112.2	N344	Y339-N344 WeakPolarHBondContact CA-OD1 3.36Å; Y339-N344 WeakPolarHBondContact CB-OD1 3.42Å; Y339-N344 PolarHBondContact N-OD1 3.43Å; Y339-N344 PolarHBondContact O-ND2 3.39Å
340	A	84.7	Confident	87.6	Confident	68 Å²	68	75.2 Å²	75.2	56%	0.562	42%	0.415	S	S	*	.	S	Bend	trans	-55.1	148.6	174	0	0	0	0	0	111.5	G342 Y343 N344	A340-G342 PolarHBondContact O-N 3.04Å; A340-Y343 HydrophobicContact CB-CD2 4.07Å; A340-Y343 WeakPolarHBondContact O-CB 3.36Å; A340-Y343 PolarHBondContact O-N 3.37Å; A340-Y343 VanDerWaalsContact O-N 3.08Å; A340-N344 PolarHBondContact O-ND2 3.24Å
341	R	83.6	Confident	87.3	Confident	199 Å²	199	80.9 Å²	80.9	75%	0.751	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	129.9	-179.6	-171.5	177.9	-178.2	174.4	4	110.5
342	G	84.5	Confident	87.1	Confident	16 Å²	16	79.9 Å²	79.9	17%	0.165	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	94.2	-2.4	-178.1	0	0	0	0	0	114.8	A340 D349 K355	A340-G342 PolarHBondContact O-N 3.04Å; G342-D349 VanDerWaalsContact C-CG 3.43Å; G342-D349 VanDerWaalsContact CA-CG 3.48Å; G342-D349 WeakPolarHBondContact CA-OD2 3.37Å; G342-D349 PolarHBondContact N-OD2 3.33Å; G342-K355 WeakPolarHBondContact O-CD 3.48Å; G342-K355 PolarHBondContact O-NZ 2.94Å
343	Y	88	Confident	86.9	Confident	90 Å²	90	85.2 Å²	85.2	35%	0.353	45%	0.447	S	S	.	.			trans	-118.7	14.8	178.2	-63.2	-92.5	0	0	0	113.5	A340 D349 I352 K355	A340-Y343 HydrophobicContact CB-CD2 4.07Å; A340-Y343 WeakPolarHBondContact O-CB 3.36Å; A340-Y343 PolarHBondContact O-N 3.37Å; A340-Y343 VanDerWaalsContact O-N 3.08Å; Y343-D349 PolarHBondContact N-OD2 3.24Å; Y343-D349 VanDerWaalsContact N-OD2 3.11Å; Y343-I352 HydrophobicContact CD1-CG2 4.04Å; Y343-K355 HydrophobicContact CD1-CB 4.44Å; Y343-K355 HydrophobicContact CE1-CB 3.53Å; Y343-K355 WeakPolarHBondContact CE1-OXT 3.42Å; Y343-K355 VanDerWaalsContact OH-C 3.25Å; Y343-K355 WeakPolarHBondContact OH-CB 3.47Å; Y343-K355 PolarHBondContact OH-O 2.95Å
344	N	87.4	Confident	86.5	Confident	3 Å²	3	86.3 Å²	86.3	2%	0.016	44%	0.44	C	S	.	.			trans	-102.5	104.6	-174	-73.8	-54.4	0	0	0	111	G336 Y339 A340 D346 V347 D349	G336-N344 PolarHBondContact O-ND2 3.16Å; Y339-N344 WeakPolarHBondContact CA-OD1 3.36Å; Y339-N344 WeakPolarHBondContact CB-OD1 3.42Å; Y339-N344 PolarHBondContact N-OD1 3.43Å; Y339-N344 PolarHBondContact O-ND2 3.39Å; A340-N344 PolarHBondContact O-ND2 3.24Å; N344-D346 VanDerWaalsContact C-N 3.3Å; N344-D346 VanDerWaalsContact C-OD1 3.29Å; N344-D346 VanDerWaalsContact CB-OD1 3.26Å; N344-D346 WeakPolarHBondContact CB-OD1 3.11Å; N344-D346 PolarHBondContact O-N 2.87Å; N344-V347 HydrophobicContact CB-CG2 3.55Å; N344-V347 VanDerWaalsContact O-CG2 3.26Å; N344-V347 WeakPolarHBondContact O-CG2 3.25Å; N344-V347 PolarHBondContact O-N 3.34Å; N344-D349 PolarHBondContact N-OD2 3.01Å; N344-D349 VanDerWaalsContact O-CB 3.25Å; N344-D349 WeakPolarHBondContact O-CB 3.48Å; N344-D349 PolarHBondContact O-N 3.16Å; N344-D349 VanDerWaalsContact O-N 3.14Å
345	A	87.7	Confident	86	Confident	76 Å²	76	90 Å²	90	63%	0.628	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-66.9	-30.8	-176	0	0	0	0	0	113.4	V347 G348 I352	A345-V347 VanDerWaalsContact C-N 3.33Å; A345-V347 PolarHBondContact O-N 2.96Å; A345-G348 PolarHBondContact O-N 3.09Å; A345-G348 VanDerWaalsContact O-N 3.11Å; A345-I352 HydrophobicContact CB-CD1 3.73Å
346	D	87.8	Confident	85.9	Confident	94 Å²	94	90.1 Å²	90.1	50%	0.503	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-64.2	-30.7	178	57.1	-34.3	0	0	0	113.5	P335 G336 N344	P335-D346 VanDerWaalsContact CA-OD2 3.22Å; P335-D346 WeakPolarHBondContact CA-OD2 3.48Å; G336-D346 PolarHBondContact N-OD2 3.01Å; N344-D346 VanDerWaalsContact C-N 3.3Å; N344-D346 VanDerWaalsContact C-OD1 3.29Å; N344-D346 VanDerWaalsContact CB-OD1 3.26Å; N344-D346 WeakPolarHBondContact CB-OD1 3.11Å; N344-D346 PolarHBondContact O-N 2.87Å
347	V	86.4	Confident	86	Confident	79 Å²	79	93.8 Å²	93.8	48%	0.479	46%	0.462	S	S	.	.	G	3₁₀ helix	trans	-94.1	6.2	173.4	-61.9	0	0	0	0	113.3	P335 G336 N344 A345	P335-V347 HydrophobicContact CB-CG1 4.36Å; G336-V347 VanDerWaalsContact CA-CG1 3.5Å; N344-V347 HydrophobicContact CB-CG2 3.55Å; N344-V347 VanDerWaalsContact O-CG2 3.26Å; N344-V347 WeakPolarHBondContact O-CG2 3.25Å; N344-V347 PolarHBondContact O-N 3.34Å; A345-V347 VanDerWaalsContact C-N 3.33Å; A345-V347 PolarHBondContact O-N 2.96Å
348	G	86.3	Confident	86	Confident	49 Å²	49	97.4 Å²	97.4	51%	0.505	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	83	24.4	175.8	0	0	0	0	0	114.5	A345 K350	A345-G348 PolarHBondContact O-N 3.09Å; A345-G348 VanDerWaalsContact O-N 3.11Å; G348-K350 PolarHBondContact O-N 3.42Å
349	D	87.5	Confident	85.9	Confident	48 Å²	48	99.2 Å²	99.2	26%	0.257	49%	0.488	S	S	.	.			trans	-61.6	127.9	173.6	-75.8	-35.5	0	0	0	110.9	G342 Y343 N344 I352	G342-D349 VanDerWaalsContact C-CG 3.43Å; G342-D349 VanDerWaalsContact CA-CG 3.48Å; G342-D349 WeakPolarHBondContact CA-OD2 3.37Å; G342-D349 PolarHBondContact N-OD2 3.33Å; Y343-D349 PolarHBondContact N-OD2 3.24Å; Y343-D349 VanDerWaalsContact N-OD2 3.11Å; N344-D349 PolarHBondContact N-OD2 3.01Å; N344-D349 VanDerWaalsContact O-CB 3.25Å; N344-D349 WeakPolarHBondContact O-CB 3.48Å; N344-D349 PolarHBondContact O-N 3.16Å; N344-D349 VanDerWaalsContact O-N 3.14Å; D349-I352 HydrophobicContact CB-CD1 4.21Å; D349-I352 HydrophobicContact CB-CG1 4.14Å; D349-I352 WeakPolarHBondContact O-CD1 3.47Å; D349-I352 WeakPolarHBondContact O-CG1 3.5Å
350	K	88.3	Confident	85.8	Confident	156 Å²	156	95.9 Å²	95.9	68%	0.678	48%	0.481	S	S	*	.			trans	-95.7	155.7	-179.3	-62.2	-177.9	-178.3	177.7	0	111.2	G348 I352 K355	G348-K350 PolarHBondContact O-N 3.42Å; K350-I352 VanDerWaalsContact C-N 3.27Å; K350-I352 PolarHBondContact O-N 3.28Å; K350-K355 WeakPolarHBondContact O-CE 3.08Å; K350-K355 PolarHBondContact O-NZ 3.07Å
351	Y	86.1	Confident	85.8	Confident	162 Å²	162	97.7 Å²	97.7	64%	0.635	48%	0.476	S	S	*	.			trans	58.7	33.4	175.2	-56.7	-78.6	0	0	0	114.2	W353 L354 K355	Y351-W353 PolarHBondContact O-N 3.1Å; Y351-L354 HydrophobicContact CD1-CD1 4.11Å; Y351-L354 PolarHBondContact O-N 3.43Å; Y351-K355 PolarHBondContact O-N 3.07Å
352	I	87.8	Confident	86	Confident	54 Å²	54	90.5 Å²	90.5	28%	0.277	46%	0.456	S	S	.	.	G	3₁₀ helix	trans	-55	-39.8	-177.2	-60.6	174.4	0	0	0	111.7	Y343 A345 D349 K350 L354	Y343-I352 HydrophobicContact CD1-CG2 4.04Å; A345-I352 HydrophobicContact CB-CD1 3.73Å; D349-I352 HydrophobicContact CB-CD1 4.21Å; D349-I352 HydrophobicContact CB-CG1 4.14Å; D349-I352 WeakPolarHBondContact O-CD1 3.47Å; D349-I352 WeakPolarHBondContact O-CG1 3.5Å; K350-I352 VanDerWaalsContact C-N 3.27Å; K350-I352 PolarHBondContact O-N 3.28Å; I352-L354 VanDerWaalsContact C-N 3.26Å; I352-L354 PolarHBondContact O-N 3.17Å
353	W	85.4	Confident	86.1	Confident	210 Å²	210	96.2 Å²	96.2	80%	0.795	48%	0.479	S	S	*	.	G	3₁₀ helix	trans	-73.1	-11.2	179.5	66.9	-77.6	0	0	0	115	Y351	Y351-W353 PolarHBondContact O-N 3.1Å
354	L	83.2	Confident	86	Confident	108 Å²	108	96.8 Å²	96.8	57%	0.565	49%	0.489	S	S	*	.	G	3₁₀ helix	trans	-112.9	1.6	-178.7	-71.4	178.8	0	0	0	113.5	Y351 I352	Y351-L354 HydrophobicContact CD1-CD1 4.11Å; Y351-L354 PolarHBondContact O-N 3.43Å; I352-L354 VanDerWaalsContact C-N 3.26Å; I352-L354 PolarHBondContact O-N 3.17Å
355	K	77.8	Confident	85.8	Confident	122 Å²	122	105.3 Å²	105.3	53%	0.53	53%	0.532	S	S	.	.			trans	-99.8	0	173.8	-71.3	169.7	172.9	165.1	0	108.7	G342 Y343 K350 Y351	G342-K355 WeakPolarHBondContact O-CD 3.48Å; G342-K355 PolarHBondContact O-NZ 2.94Å; Y343-K355 HydrophobicContact CD1-CB 4.44Å; Y343-K355 HydrophobicContact CE1-CB 3.53Å; Y343-K355 WeakPolarHBondContact CE1-OXT 3.42Å; Y343-K355 VanDerWaalsContact OH-C 3.25Å; Y343-K355 WeakPolarHBondContact OH-CB 3.47Å; Y343-K355 PolarHBondContact OH-O 2.95Å; K350-K355 WeakPolarHBondContact O-CE 3.08Å; K350-K355 PolarHBondContact O-NZ 3.07Å; Y351-K355 PolarHBondContact O-N 3.07Å

Retrieved 355 of 355 residues in 533.2 ms (Link to these results)

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