A0A087XMF4_POEFO Loading...

Cytidine and dCMP deaminase domain-containing protein 1

AlphaFold DB , UniProt , Accession A0A087XMF4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 510 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	30.3	Very low	27.5	Very low	227 Å²	227	172.9 Å²	172.9	100%	1.118	86%	0.863	S	S	*	*				0	126.2	0	-74.1	160.6	166.6	0	0	106
2	D	27.4	Very low	27.4	Very low	163 Å²	163	174.4 Å²	174.4	87%	0.872	87%	0.866	S	S	*	*			trans	58.7	149.4	163.8	-42.7	-33.2	0	0	0	116
3	G	27.9	Very low	27.4	Very low	68 Å²	68	172.2 Å²	172.2	70%	0.701	87%	0.868	S	S	*	*			cis	122	141.1	29.2	0	0	0	0	0	106.6
4	T	28.8	Very low	27.3	Very low	141 Å²	141	165.1 Å²	165.1	87%	0.865	86%	0.86	S	S	*	*			cis	-157.3	170.6	18.9	-53.2	0	0	0	0	109.9
5	W	28.4	Very low	27.4	Very low	237 Å²	237	163.1 Å²	163.1	90%	0.898	86%	0.861	S	S	*	*			trans	-79	157.3	179.9	-69.5	30	0	0	0	114.8
6	N	26.7	Very low	27.2	Very low	151 Å²	151	157.5 Å²	157.5	81%	0.807	85%	0.854	S	S	*	*			trans	172.1	156.3	140.4	-94.2	-36.9	0	0	0	110.8
7	R	28.6	Very low	27	Very low	224 Å²	224	163.2 Å²	163.2	85%	0.845	86%	0.861	S	S	*	*			cis	-158.2	157.1	-22.9	-162.8	171.4	-172.2	-160.7	4.4	109.5
8	T	27.2	Very low	27	Very low	110 Å²	110	164.1 Å²	164.1	68%	0.675	86%	0.86	S	S	*	*			trans	-52.2	152.1	179.4	53.8	0	0	0	0	117.7
9	E	25.1	Very low	26.9	Very low	199 Å²	199	162.5 Å²	162.5	93%	0.93	86%	0.858	S	S	*	*			trans	-115	163.8	135.8	-72.5	-155.7	128.6	0	0	111.1
10	R	23.9	Very low	26.8	Very low	231 Å²	231	164.2 Å²	164.2	87%	0.872	86%	0.857	S	S	*	*			trans	-130.5	145	178.2	-75.6	179.5	170	-176.6	-3.9	109.7
11	V	27.8	Very low	27	Very low	151 Å²	151	164.4 Å²	164.4	92%	0.915	86%	0.859	S	S	*	*			trans	-112.3	148.6	160.3	-179.6	0	0	0	0	109
12	Q	26.8	Very low	26.8	Very low	191 Å²	191	156.6 Å²	156.6	89%	0.893	84%	0.837	S	S	*	*			trans	-90.7	159.3	-165.1	-66	173.3	-17.3	0	0	113.7
13	T	28.1	Very low	26.8	Very low	146 Å²	146	154.6 Å²	154.6	90%	0.896	84%	0.836	S	S	*	*			trans	-96.3	146.2	176.7	46	0	0	0	0	112.8
14	G	24.7	Very low	26.8	Very low	73 Å²	73	157.4 Å²	157.4	75%	0.753	84%	0.84	S	S	*	*			trans	-117.4	159.2	167.7	0	0	0	0	0	111.8
15	P	29.9	Very low	26.7	Very low	134 Å²	134	159.1 Å²	159.1	87%	0.87	84%	0.838	S	S	*	*			trans	-102.6	136	-147.7	36.1	-34.6	0	0	0	117.2
16	G	23.2	Very low	26.8	Very low	74 Å²	74	153.2 Å²	153.2	76%	0.763	83%	0.828	S	S	*	*				80.6	110.4	114.7	0	0	0	0	0	120
17	R	25	Very low	27	Very low	254 Å²	254	152.6 Å²	152.6	96%	0.958	83%	0.825	S	S	*	*			trans	-153.8	125	134.3	-113	174.9	-171.6	-171.9	1.9	110.7
18	E	26.4	Very low	27	Very low	180 Å²	180	146.1 Å²	146.1	84%	0.841	81%	0.814	S	S	*	*			trans	-80.8	147.8	174.8	-57.1	171.3	142.1	0	0	110.4
19	T	24.6	Very low	27.2	Very low	134 Å²	134	149.4 Å²	149.4	82%	0.822	82%	0.819	S	S	*	*				179.3	150.6	114.2	24.6	0	0	0	0	113.2
20	K	26.1	Very low	27.5	Very low	195 Å²	195	147.4 Å²	147.4	85%	0.848	81%	0.813	S	S	*	*			trans	69.1	107	164.3	-70.3	-174.8	175.7	-175.4	0	118.3	G22	K20-G22 PolarHBondContact O-N 3.22Å
21	D	29.8	Very low	28	Very low	169 Å²	169	146.1 Å²	146.1	90%	0.904	82%	0.817	S	S	*	*			trans	-51.4	128	154.3	-49.7	-90.1	0	0	0	111.6
22	G	25.9	Very low	29	Very low	64 Å²	64	141.6 Å²	141.6	66%	0.66	80%	0.801	S	S	*	*			trans	-116.3	115.8	161.7	0	0	0	0	0	107.8	K20 T24	K20-G22 PolarHBondContact O-N 3.22Å; G22-T24 PolarHBondContact O-N 3.23Å
23	S	27.6	Very low	30.7	Very low	121 Å²	121	135.7 Å²	135.7	85%	0.846	77%	0.773	S	S	*	*			trans	-61.9	98.6	-178.4	177.5	0	0	0	0	110.8	Q25	S23-Q25 PolarHBondContact O-N 3.31Å
24	T	27.5	Very low	33.1	Very low	126 Å²	126	131.9 Å²	131.9	77%	0.773	75%	0.747	S	S	*	*			trans	-74.9	80.1	170.4	53.5	0	0	0	0	108.9	G22 T26	G22-T24 PolarHBondContact O-N 3.23Å; T24-T26 PolarHBondContact O-N 3.24Å
25	Q	27.5	Very low	36.2	Very low	178 Å²	178	129.7 Å²	129.7	83%	0.832	72%	0.72	S	S	*	*			trans	-56.5	108.3	165	-179.1	173.6	-9.9	0	0	107.7	S23 D27	S23-Q25 PolarHBondContact O-N 3.31Å; Q25-D27 PolarHBondContact O-N 2.89Å
26	T	30.4	Very low	39.2	Very low	113 Å²	113	127.2 Å²	127.2	69%	0.693	69%	0.693	S	S	*	*			trans	-69.9	97.9	-178.8	48.6	0	0	0	0	108.9	T24 S28	T24-T26 PolarHBondContact O-N 3.24Å; T26-S28 PolarHBondContact O-N 3.39Å
27	D	30.6	Very low	42.6	Very low	137 Å²	137	123.8 Å²	123.8	73%	0.733	66%	0.657	S	S	*	*			trans	-72.2	63.3	168.2	-169.3	15.8	0	0	0	109.7	Q25 K29	Q25-D27 PolarHBondContact O-N 2.89Å; D27-K29 PolarHBondContact O-N 2.96Å
28	S	28.3	Very low	45.9	Very low	89 Å²	89	113.3 Å²	113.3	62%	0.622	62%	0.623	S	S	*	*			trans	-76.1	71.8	176.8	60	0	0	0	0	109	T26 I30	T26-S28 PolarHBondContact O-N 3.39Å; S28-I30 VanDerWaalsContact C-N 3.3Å; S28-I30 PolarHBondContact O-N 3.24Å
29	K	32.7	Very low	49.1	Very low	179 Å²	179	108.7 Å²	108.7	78%	0.778	60%	0.6	S	S	*	*			trans	-54.8	101.2	157.3	-75.2	-165.9	175.9	-169.9	0	107.5	D27 Q31	D27-K29 PolarHBondContact O-N 2.96Å; K29-Q31 PolarHBondContact O-N 2.98Å
30	I	31.4	Very low	52.5	Low	156 Å²	156	103.3 Å²	103.3	80%	0.8	57%	0.567	S	S	*	*			trans	-55.5	131.4	177	-62.7	174.2	0	0	0	107.1	S28 G32	S28-I30 VanDerWaalsContact C-N 3.3Å; S28-I30 PolarHBondContact O-N 3.24Å; I30-G32 PolarHBondContact O-N 3.15Å
31	Q	34.6	Very low	55.9	Low	205 Å²	205	94.1 Å²	94.1	96%	0.958	53%	0.527	S	S	*	.			trans	-75.5	60	-174.8	-164.7	172.8	2.7	0	0	111.5	K29	K29-Q31 PolarHBondContact O-N 2.98Å
32	G	48.2	Very low	59.2	Low	56 Å²	56	86.2 Å²	86.2	58%	0.577	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-97.8	153.4	173.4	0	0	0	0	0	111.5	I30	I30-G32 PolarHBondContact O-N 3.15Å
33	H	62.8	Low	62.6	Low	67 Å²	67	83.5 Å²	83.5	31%	0.31	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-71.5	137.7	172	-177.2	-54.2	0	0	0	110
34	D	78.8	Confident	66	Low	65 Å²	65	78 Å²	78	35%	0.348	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-52.5	137.8	177.3	-79.4	-14.4	0	0	0	111.9	F195	D34-F195 HydrophobicContact CB-CD2 4.46Å; D34-F195 HydrophobicContact CB-CE2 3.84Å; D34-F195 HydrophobicContact CB-CZ 3.96Å; D34-F195 WeakPolarHBondContact OD2-CE2 3.24Å
35	P	89.8	Confident	69.3	Low	28 Å²	28	72 Å²	72	18%	0.182	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-69.9	135.1	-177.4	29.6	-35.2	0	0	0	110.9	A189 L192 F195	P35-A189 HydrophobicContact CB-CB 4.14Å; P35-L192 HydrophobicContact CB-CB 3.96Å; P35-L192 HydrophobicContact CB-CD1 4.09Å; P35-L192 HydrophobicContact CG-CB 4.38Å; P35-L192 HydrophobicContact CG-CD1 4.4Å; P35-L192 VanDerWaalsContact O-CD1 3.29Å; P35-L192 WeakPolarHBondContact O-CD1 3.35Å; P35-F195 HydrophobicContact CG-CB 3.67Å; P35-F195 HydrophobicContact CG-CD1 4.23Å; P35-F195 HydrophobicContact CG-CG 3.93Å; P35-F195 WeakPolarHBondContact O-CD1 3.5Å
36	R	91.4	Very high	72.7	Confident	81 Å²	81	63.6 Å²	63.6	31%	0.306	34%	0.34	S	S	.	.			trans	-122.7	153.4	179.1	63	-175.8	177.2	169.3	0.6	112.1	T325 E326	R36-T325 WeakPolarHBondContact CD-O 3.29Å; R36-E326 IonicContact CZ-OE1 2.8Å; R36-E326 IonicContact NH1-OE1 3.56Å; R36-E326 PolarHBondContact NH1-OE1 3.27Å
37	L	94.5	Very high	76	Confident	2 Å²	2	58.2 Å²	58.2	1%	0.01	31%	0.307	C	S	.	.			trans	-59.9	145.1	171.4	-78.2	169.9	0	0	0	111	N41 L42 L45 L192 Y323 R324	L37-N41 HydrophobicContact CD2-CB 4.14Å; L37-L42 HydrophobicContact CB-CB 4.47Å; L37-L42 HydrophobicContact CD1-CD1 4.37Å; L37-L45 HydrophobicContact CD1-CD1 3.75Å; L37-L45 HydrophobicContact CD2-CD1 3.59Å; L37-L45 HydrophobicContact CG-CD1 4.36Å; L37-L192 HydrophobicContact CD2-CD2 3.99Å; L37-L192 HydrophobicContact CG-CD2 4.41Å; L37-Y323 PolarHBondContact N-O 3.03Å; L37-R324 WeakPolarHBondContact O-CD 3.38Å
38	S	95.1	Very high	79.2	Confident	34 Å²	34	51.7 Å²	51.7	24%	0.238	27%	0.272	C	S	.	.			trans	-75	159.3	164.2	83.3	0	0	0	0	110.4	V40 N41 L42 Q186	S38-V40 VanDerWaalsContact C-N 3.3Å; S38-V40 PolarHBondContact O-N 3.09Å; S38-N41 PolarHBondContact O-N 3.44Å; S38-N41 WeakPolarHBondContact OG-CB 3.33Å; S38-N41 PolarHBondContact OG-N 3.14Å; S38-N41 VanDerWaalsContact OG-N 3.1Å; S38-L42 WeakPolarHBondContact O-CB 3.49Å; S38-L42 PolarHBondContact O-N 3.3Å; S38-Q186 PolarHBondContact OG-OE1 3Å
39	K	94.7	Very high	82.5	Confident	83 Å²	83	48.2 Å²	48.2	36%	0.361	25%	0.246	S	C	.	.	H	α-helix	trans	-60.3	-40.4	176	-72.9	-164.3	176.1	-165.8	0	111.8	L42 F43 G77	K39-L42 PolarHBondContact O-N 3.37Å; K39-F43 HydrophobicContact CB-CD2 4.44Å; K39-F43 HydrophobicContact CB-CE2 3.88Å; K39-F43 HydrophobicContact CB-CZ 4.31Å; K39-F43 HydrophobicContact CD-CZ 4.5Å; K39-F43 WeakPolarHBondContact O-CD2 3.49Å; K39-F43 WeakPolarHBondContact O-CG 3.38Å; K39-F43 PolarHBondContact O-N 3.24Å; K39-G77 PolarHBondContact NZ-O 2.88Å; K39-G77 VanDerWaalsContact NZ-O 3.13Å
40	V	96	Very high	85.6	Confident	22 Å²	22	39.7 Å²	39.7	13%	0.133	21%	0.209	C	C	.	.	H	α-helix	trans	-58.3	-53.1	175.7	174.4	0	0	0	0	110.6	S38 L42 F43 T44 Y109 L184 Q186	S38-V40 VanDerWaalsContact C-N 3.3Å; S38-V40 PolarHBondContact O-N 3.09Å; V40-L42 VanDerWaalsContact C-N 3.35Å; V40-L42 PolarHBondContact O-N 3.42Å; V40-F43 PolarHBondContact O-N 3.09Å; V40-T44 PolarHBondContact O-N 3.39Å; V40-T44 PolarHBondContact O-OG1 3.4Å; V40-Y109 HydrophobicContact CG1-CE1 4.48Å; V40-L184 HydrophobicContact CG1-CB 3.79Å; V40-L184 WeakPolarHBondContact CG1-O 3.32Å; V40-Q186 HydrophobicContact CB-CG 4.33Å; V40-Q186 HydrophobicContact CG1-CG 4.32Å
41	N	97.1	Very high	88.6	Confident	2 Å²	2	33.5 Å²	33.5	1%	0.011	18%	0.176	C	C	.	.	H	α-helix	trans	-67.5	-35.6	-176.5	-72.5	5	0	0	0	111.9	L37 S38 L45 Q186 L273	L37-N41 HydrophobicContact CD2-CB 4.14Å; S38-N41 PolarHBondContact O-N 3.44Å; S38-N41 WeakPolarHBondContact OG-CB 3.33Å; S38-N41 PolarHBondContact OG-N 3.14Å; S38-N41 VanDerWaalsContact OG-N 3.1Å; N41-L45 WeakPolarHBondContact O-CB 3.34Å; N41-L45 WeakPolarHBondContact O-CD1 3.21Å; N41-L45 WeakPolarHBondContact O-CG 3.49Å; N41-L45 PolarHBondContact O-N 3.47Å; N41-Q186 PolarHBondContact ND2-O 3.41Å; N41-Q186 PolarHBondContact OD1-N 3.45Å; N41-Q186 VanDerWaalsContact OD1-N 3.14Å; N41-Q186 PolarHBondContact OD1-O 3.21Å; N41-L273 HydrophobicContact CB-CD2 3.83Å
42	L	97.7	Very high	91.5	Very high	2 Å²	2	25.5 Å²	25.5	1%	0.01	14%	0.141	C	C	.	.	H	α-helix	trans	-58.8	-50.3	170.6	172	65.9	0	0	0	112	L37 S38 K39 V40 T44 L45 L46 L320 L321 R324	L37-L42 HydrophobicContact CB-CB 4.47Å; L37-L42 HydrophobicContact CD1-CD1 4.37Å; S38-L42 WeakPolarHBondContact O-CB 3.49Å; S38-L42 PolarHBondContact O-N 3.3Å; K39-L42 PolarHBondContact O-N 3.37Å; V40-L42 VanDerWaalsContact C-N 3.35Å; V40-L42 PolarHBondContact O-N 3.42Å; L42-T44 VanDerWaalsContact C-N 3.34Å; L42-T44 PolarHBondContact O-N 3.27Å; L42-L45 PolarHBondContact O-N 2.87Å; L42-L46 HydrophobicContact CD1-CD1 3.89Å; L42-L46 HydrophobicContact CD1-CG 4.17Å; L42-L46 HydrophobicContact CG-CD1 3.97Å; L42-L46 WeakPolarHBondContact O-CB 3.15Å; L42-L46 WeakPolarHBondContact O-CG 3.36Å; L42-L46 PolarHBondContact O-N 3.4Å; L42-L320 HydrophobicContact CD1-CB 4.39Å; L42-L320 VanDerWaalsContact CD1-O 3.32Å; L42-L320 WeakPolarHBondContact CD1-O 3.48Å; L42-L321 HydrophobicContact CD1-CD2 4.29Å; L42-L321 HydrophobicContact CD2-CD2 4.14Å; L42-R324 HydrophobicContact CD2-CB 3.8Å; L42-R324 HydrophobicContact CD2-CG 3.96Å
43	F	98.3	Very high	93.7	Very high	8 Å²	8	23.4 Å²	23.4	4%	0.035	12%	0.116	C	C	.	.	H	α-helix	trans	-68.7	-33.3	-177.7	-57.5	-36.7	0	0	0	112.2	K39 V40 L46 S47 V72 V74 V79 Y109	K39-F43 HydrophobicContact CB-CD2 4.44Å; K39-F43 HydrophobicContact CB-CE2 3.88Å; K39-F43 HydrophobicContact CB-CZ 4.31Å; K39-F43 HydrophobicContact CD-CZ 4.5Å; K39-F43 WeakPolarHBondContact O-CD2 3.49Å; K39-F43 WeakPolarHBondContact O-CG 3.38Å; K39-F43 PolarHBondContact O-N 3.24Å; V40-F43 PolarHBondContact O-N 3.09Å; F43-L46 HydrophobicContact CD1-CD1 4.45Å; F43-L46 PolarHBondContact O-N 3.18Å; F43-S47 PolarHBondContact O-N 3.04Å; F43-V72 HydrophobicContact CD1-CG1 4.38Å; F43-V72 WeakPolarHBondContact O-CG2 3.37Å; F43-V74 HydrophobicContact CD1-CG2 4.03Å; F43-V74 HydrophobicContact CD2-CG1 4.36Å; F43-V74 HydrophobicContact CD2-CG2 3.85Å; F43-V74 HydrophobicContact CE1-CG2 4.14Å; F43-V74 HydrophobicContact CE2-CB 4.46Å; F43-V74 HydrophobicContact CE2-CG1 3.72Å; F43-V74 HydrophobicContact CE2-CG2 3.95Å; F43-V74 HydrophobicContact CG-CG2 3.9Å; F43-V74 HydrophobicContact CZ-CG1 3.89Å; F43-V74 HydrophobicContact CZ-CG2 4.1Å; F43-V79 HydrophobicContact CD1-CG2 4.17Å; F43-V79 HydrophobicContact CE1-CG2 3.75Å; F43-Y109 HydrophobicContact CB-CD1 3.74Å; F43-Y109 HydrophobicContact CB-CD2 3.75Å; F43-Y109 HydrophobicContact CB-CE1 4.04Å; F43-Y109 HydrophobicContact CB-CE2 4.03Å; F43-Y109 HydrophobicContact CB-CG 3.61Å; F43-Y109 HydrophobicContact CD2-CD2 4.17Å; F43-Y109 HydrophobicContact CD2-CE1 4.29Å; F43-Y109 AromaticContact CD2-CE2 3.62Å; F43-Y109 HydrophobicContact CD2-CE2 3.62Å; F43-Y109 AromaticContact CD2-CZ 3.71Å; F43-Y109 HydrophobicContact CE2-CE2 4.48Å; F43-Y109 HydrophobicContact CG-CD2 4.27Å; F43-Y109 HydrophobicContact CG-CE2 4.18Å
44	T	98	Very high	95	Very high	6 Å²	6	21.4 Å²	21.4	4%	0.037	11%	0.109	C	C	.	.	H	α-helix	trans	-66.8	-42.6	170.3	-62	0	0	0	0	112.3	V40 L42 L46 S47 L48 W133 L185	V40-T44 PolarHBondContact O-N 3.39Å; V40-T44 PolarHBondContact O-OG1 3.4Å; L42-T44 VanDerWaalsContact C-N 3.34Å; L42-T44 PolarHBondContact O-N 3.27Å; T44-L46 VanDerWaalsContact C-N 3.32Å; T44-L46 PolarHBondContact O-N 2.86Å; T44-S47 PolarHBondContact O-N 3.41Å; T44-S47 PolarHBondContact O-OG 2.92Å; T44-L48 HydrophobicContact CG2-CD1 4.28Å; T44-L48 VanDerWaalsContact O-CG 3.31Å; T44-L48 WeakPolarHBondContact O-CG 3.46Å; T44-L48 PolarHBondContact O-N 3.41Å; T44-W133 HydrophobicContact CG2-CE3 3.6Å; T44-W133 HydrophobicContact CG2-CZ3 3.86Å; T44-L185 HydrophobicContact CG2-CD2 3.89Å
45	L	98.5	Very high	95.1	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-62.9	-39.2	174.7	-73.7	164.4	0	0	0	112	L37 N41 L42 W49 L273 I276 L277 L320	L37-L45 HydrophobicContact CD1-CD1 3.75Å; L37-L45 HydrophobicContact CD2-CD1 3.59Å; L37-L45 HydrophobicContact CG-CD1 4.36Å; N41-L45 WeakPolarHBondContact O-CB 3.34Å; N41-L45 WeakPolarHBondContact O-CD1 3.21Å; N41-L45 WeakPolarHBondContact O-CG 3.49Å; N41-L45 PolarHBondContact O-N 3.47Å; L42-L45 PolarHBondContact O-N 2.87Å; L45-W49 VanDerWaalsContact O-CB 3.3Å; L45-W49 WeakPolarHBondContact O-CB 3.47Å; L45-W49 PolarHBondContact O-N 3.02Å; L45-L273 HydrophobicContact CD1-CD2 4.03Å; L45-L273 HydrophobicContact CD2-CB 4.18Å; L45-L273 HydrophobicContact CD2-CD2 4.15Å; L45-L273 WeakPolarHBondContact CD2-O 3.24Å; L45-L273 HydrophobicContact CG-CD2 3.99Å; L45-I276 HydrophobicContact CD1-CG2 3.74Å; L45-I276 HydrophobicContact CD2-CG2 4.23Å; L45-L277 HydrophobicContact CD2-CB 3.98Å; L45-L320 HydrophobicContact CB-CD1 4.49Å; L45-L320 HydrophobicContact CB-CD2 4.14Å; L45-L320 HydrophobicContact CD1-CD2 4.31Å
46	L	98.6	Very high	93.6	Very high	1 Å²	1	28 Å²	28	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-68	-35	175.2	-72.6	170	0	0	0	112.4	L42 F43 T44 W49 M50 V72 L82 Q317 L320 L321	L42-L46 HydrophobicContact CD1-CD1 3.89Å; L42-L46 HydrophobicContact CD1-CG 4.17Å; L42-L46 HydrophobicContact CG-CD1 3.97Å; L42-L46 WeakPolarHBondContact O-CB 3.15Å; L42-L46 WeakPolarHBondContact O-CG 3.36Å; L42-L46 PolarHBondContact O-N 3.4Å; F43-L46 HydrophobicContact CD1-CD1 4.45Å; F43-L46 PolarHBondContact O-N 3.18Å; T44-L46 VanDerWaalsContact C-N 3.32Å; T44-L46 PolarHBondContact O-N 2.86Å; L46-W49 PolarHBondContact O-N 3.23Å; L46-M50 WeakPolarHBondContact O-CG 3.41Å; L46-M50 PolarHBondContact O-N 3.41Å; L46-V72 HydrophobicContact CB-CG2 3.71Å; L46-L82 HydrophobicContact CB-CD2 4.26Å; L46-Q317 HydrophobicContact CD2-CG 3.71Å; L46-L320 HydrophobicContact CD2-CB 4.18Å; L46-L320 HydrophobicContact CD2-CD1 4.05Å; L46-L321 HydrophobicContact CD1-CD2 4.08Å
47	S	98.3	Very high	91.8	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-67.4	-45.9	175	76.6	0	0	0	0	111.3	F43 T44 W49 M50 E51 G70 Y109 S111	F43-S47 PolarHBondContact O-N 3.04Å; T44-S47 PolarHBondContact O-N 3.41Å; T44-S47 PolarHBondContact O-OG 2.92Å; S47-W49 VanDerWaalsContact C-N 3.33Å; S47-W49 PolarHBondContact O-N 3.17Å; S47-M50 PolarHBondContact O-N 3.09Å; S47-E51 PolarHBondContact O-N 3.25Å; S47-G70 WeakPolarHBondContact O-CA 3.42Å; S47-Y109 WeakPolarHBondContact CB-O 3.47Å; S47-S111 PolarHBondContact OG-N 3.13Å
48	L	98.1	Very high	89.4	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-58.5	-44.1	173.3	-65.1	168.3	0	0	0	111.4	T44 M50 E51 W133 F237 L277	T44-L48 HydrophobicContact CG2-CD1 4.28Å; T44-L48 VanDerWaalsContact O-CG 3.31Å; T44-L48 WeakPolarHBondContact O-CG 3.46Å; T44-L48 PolarHBondContact O-N 3.41Å; L48-M50 PolarHBondContact O-N 3.41Å; L48-E51 WeakPolarHBondContact O-CB 3.26Å; L48-E51 PolarHBondContact O-N 3.33Å; L48-W133 HydrophobicContact CD1-CD2 4.34Å; L48-W133 HydrophobicContact CD1-CE3 3.99Å; L48-W133 HydrophobicContact CD1-CH2 3.92Å; L48-W133 HydrophobicContact CD1-CZ2 4.31Å; L48-W133 HydrophobicContact CD1-CZ3 3.78Å; L48-W133 HydrophobicContact CD2-CB 4.47Å; L48-W133 HydrophobicContact CD2-CD2 3.87Å; L48-W133 HydrophobicContact CD2-CE3 4.29Å; L48-W133 HydrophobicContact CD2-CG 3.98Å; L48-W133 HydrophobicContact CD2-CZ2 4.47Å; L48-F237 HydrophobicContact CB-CE1 4.27Å; L48-F237 HydrophobicContact CB-CE2 4.37Å; L48-F237 HydrophobicContact CB-CZ 4.14Å; L48-F237 HydrophobicContact CD2-CB 4.17Å; L48-F237 HydrophobicContact CD2-CD1 3.49Å; L48-F237 VanDerWaalsContact CD2-CD1 3.49Å; L48-F237 HydrophobicContact CD2-CD2 4.36Å; L48-F237 HydrophobicContact CD2-CE1 3.88Å; L48-F237 HydrophobicContact CD2-CG 3.76Å; L48-F237 HydrophobicContact CD2-CZ 4.47Å; L48-F237 WeakPolarHBondContact O-CZ 3.33Å; L48-L277 HydrophobicContact CB-CD2 4.15Å
49	W	98.1	Very high	87.3	Confident	15 Å²	15	39.7 Å²	39.7	6%	0.057	20%	0.201	C	C	.	.	H	α-helix	trans	-65.7	-37.4	178.6	-167.6	-123.1	0	0	0	112.6	L45 L46 S47 E51 V52 F233 L277 A281 H313 I316 L320	L45-W49 VanDerWaalsContact O-CB 3.3Å; L45-W49 WeakPolarHBondContact O-CB 3.47Å; L45-W49 PolarHBondContact O-N 3.02Å; L46-W49 PolarHBondContact O-N 3.23Å; S47-W49 VanDerWaalsContact C-N 3.33Å; S47-W49 PolarHBondContact O-N 3.17Å; W49-E51 VanDerWaalsContact C-N 3.25Å; W49-E51 PolarHBondContact O-N 3.33Å; W49-V52 HydrophobicContact CD2-CG2 4.09Å; W49-V52 HydrophobicContact CE3-CG2 3.41Å; W49-V52 VanDerWaalsContact CE3-CG2 3.41Å; W49-V52 HydrophobicContact CH2-CG2 4.3Å; W49-V52 HydrophobicContact CZ3-CG2 3.53Å; W49-V52 WeakPolarHBondContact O-CG2 3.4Å; W49-V52 PolarHBondContact O-N 2.98Å; W49-F233 HydrophobicContact CH2-CZ 4.5Å; W49-F233 HydrophobicContact CZ3-CE1 4.2Å; W49-F233 HydrophobicContact CZ3-CE2 4.38Å; W49-F233 AromaticContact CZ3-CZ 3.67Å; W49-F233 HydrophobicContact CZ3-CZ 3.67Å; W49-L277 HydrophobicContact CB-CD1 4.21Å; W49-L277 HydrophobicContact CD2-CD1 4.28Å; W49-L277 HydrophobicContact CE3-CD1 3.86Å; W49-L277 HydrophobicContact CE3-CD2 4.37Å; W49-L277 HydrophobicContact CE3-CG 4.3Å; W49-L277 HydrophobicContact CG-CD1 4.44Å; W49-A281 HydrophobicContact CH2-CB 4.5Å; W49-H313 AromaticContact CD1-CE1 3.32Å; W49-H313 AromaticContact CD1-ND1 3.85Å; W49-H313 AromaticContact CD1-NE2 3.57Å; W49-H313 AromaticContact CD2-NE2 3.8Å; W49-H313 AromaticContact CE2-CD2 3.46Å; W49-H313 VanDerWaalsContact CE2-CD2 3.46Å; W49-H313 AromaticContact CE2-CE1 3.91Å; W49-H313 AromaticContact CE2-CG 3.88Å; W49-H313 AromaticContact CE2-NE2 3.49Å; W49-H313 AromaticContact CG-CE1 3.97Å; W49-H313 AromaticContact CG-NE2 3.83Å; W49-H313 HydrophobicContact CZ2-CB 4.41Å; W49-H313 AromaticContact CZ2-CD2 3.56Å; W49-H313 AromaticContact NE1-CD2 3.52Å; W49-H313 AromaticContact NE1-CE1 3.27Å; W49-H313 PolarHBondContact NE1-CE1 3.44Å; W49-H313 VanDerWaalsContact NE1-CE1 3.27Å; W49-H313 AromaticContact NE1-CG 3.56Å; W49-H313 AromaticContact NE1-ND1 3.4Å; W49-H313 PolarHBondContact NE1-ND1 2.98Å; W49-H313 AromaticContact NE1-NE2 3.35Å; W49-H313 PolarHBondContact NE1-NE2 3.15Å; W49-H313 PolarHBondContact NE1-O 3.38Å; W49-H313 PolarHBondContact O-CE1 3.25Å; W49-H313 PolarHBondContact O-NE2 3.07Å; W49-I316 HydrophobicContact CD2-CG2 3.97Å; W49-I316 HydrophobicContact CE3-CG2 4.46Å; W49-I316 HydrophobicContact CH2-CB 4.44Å; W49-I316 HydrophobicContact CH2-CD1 3.83Å; W49-I316 HydrophobicContact CH2-CG2 4.03Å; W49-I316 HydrophobicContact CZ2-CB 3.57Å; W49-I316 HydrophobicContact CZ2-CD1 3.6Å; W49-I316 HydrophobicContact CZ2-CG1 4.18Å; W49-I316 HydrophobicContact CZ2-CG2 3.45Å; W49-I316 VanDerWaalsContact CZ2-CG2 3.45Å; W49-I316 HydrophobicContact CZ3-CG2 4.49Å; W49-L320 HydrophobicContact CB-CD1 3.93Å; W49-L320 HydrophobicContact CG-CD1 4.03Å
50	M	97.3	Very high	84.8	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-66.2	-24.4	174.2	-73.2	-54.1	-59.5	0	0	113.5	L46 S47 L48 V52 F53 L82 C84 Q317 W337 T348	L46-M50 WeakPolarHBondContact O-CG 3.41Å; L46-M50 PolarHBondContact O-N 3.41Å; S47-M50 PolarHBondContact O-N 3.09Å; L48-M50 PolarHBondContact O-N 3.41Å; M50-V52 PolarHBondContact O-N 3.37Å; M50-F53 HydrophobicContact CE-CB 4.37Å; M50-F53 HydrophobicContact CE-CD2 3.61Å; M50-F53 HydrophobicContact CE-CE2 4.25Å; M50-F53 HydrophobicContact CE-CG 4.2Å; M50-F53 WeakPolarHBondContact O-CB 3.32Å; M50-F53 PolarHBondContact O-N 3.44Å; M50-F53 HydrophobicContact SD-CD2 4.09Å; M50-L82 HydrophobicContact CE-CB 4.19Å; M50-L82 HydrophobicContact CG-CB 4.02Å; M50-L82 HydrophobicContact CG-CD2 3.94Å; M50-L82 HydrophobicContact CG-CG 4.47Å; M50-L82 HydrophobicContact SD-CB 3.89Å; M50-C84 HydrophobicContact CB-CB 4.49Å; M50-C84 WeakPolarHBondContact O-CB 3.21Å; M50-Q317 PolarHBondContact SD-NE2 3.46Å; M50-Q317 VanDerWaalsContact SD-NE2 3.35Å; M50-W337 HydrophobicContact CE-CH2 3.98Å; M50-W337 HydrophobicContact CE-CZ2 4.44Å; M50-W337 HydrophobicContact SD-CH2 4.48Å; M50-W337 HydrophobicContact SD-CZ2 4.38Å; M50-T348 HydrophobicContact CE-CG2 3.59Å
51	E	95.5	Very high	82.4	Confident	25 Å²	25	46.4 Å²	46.4	12%	0.117	25%	0.248	C	C	.	.	H	α-helix	trans	-62.9	-31.7	174.4	-162.7	-177.7	114.2	0	0	112.4	S47 L48 W49 G68 S111 R112 Q236 F237	S47-E51 PolarHBondContact O-N 3.25Å; L48-E51 WeakPolarHBondContact O-CB 3.26Å; L48-E51 PolarHBondContact O-N 3.33Å; W49-E51 VanDerWaalsContact C-N 3.25Å; W49-E51 PolarHBondContact O-N 3.33Å; E51-G68 WeakPolarHBondContact CG-O 3.33Å; E51-S111 VanDerWaalsContact OE2-CB 3.25Å; E51-S111 WeakPolarHBondContact OE2-CB 3.28Å; E51-S111 PolarHBondContact OE2-OG 2.68Å; E51-R112 IonicContact OE1-CZ 3.26Å; E51-R112 IonicContact OE1-NE 3.52Å; E51-R112 PolarHBondContact OE1-NE 2.96Å; E51-R112 IonicContact OE1-NH2 2.8Å; E51-R112 PolarHBondContact OE1-NH2 3.36Å; E51-R112 IonicContact OE2-CZ 3.52Å; E51-R112 IonicContact OE2-NE 3.71Å; E51-R112 PolarHBondContact OE2-NE 2.97Å; E51-R112 IonicContact OE2-NH2 2.77Å; E51-Q236 PolarHBondContact OE1-NE2 2.85Å; E51-F237 HydrophobicContact CB-CE1 4.12Å; E51-F237 HydrophobicContact CG-CE1 4.47Å
52	V	94.6	Very high	79.8	Confident	37 Å²	37	54.1 Å²	54.1	22%	0.224	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	30	177.6	-64.7	0	0	0	0	112.9	W49 M50 Q236 F237 H313	W49-V52 HydrophobicContact CD2-CG2 4.09Å; W49-V52 HydrophobicContact CE3-CG2 3.41Å; W49-V52 VanDerWaalsContact CE3-CG2 3.41Å; W49-V52 HydrophobicContact CH2-CG2 4.3Å; W49-V52 HydrophobicContact CZ3-CG2 3.53Å; W49-V52 WeakPolarHBondContact O-CG2 3.4Å; W49-V52 PolarHBondContact O-N 2.98Å; M50-V52 PolarHBondContact O-N 3.37Å; V52-Q236 VanDerWaalsContact CG1-NE2 3.29Å; V52-F237 HydrophobicContact CG1-CZ 4.11Å; V52-H313 PolarHBondContact O-CD2 2.88Å
53	F	94.6	Very high	77.2	Confident	12 Å²	12	64.6 Å²	64.6	5%	0.053	32%	0.324	C	S	.	.			trans	-64.6	130	172.5	-162.8	-87	0	0	0	110.6	M50 V310 H313 T348 L351	M50-F53 HydrophobicContact CE-CB 4.37Å; M50-F53 HydrophobicContact CE-CD2 3.61Å; M50-F53 HydrophobicContact CE-CE2 4.25Å; M50-F53 HydrophobicContact CE-CG 4.2Å; M50-F53 WeakPolarHBondContact O-CB 3.32Å; M50-F53 PolarHBondContact O-N 3.44Å; M50-F53 HydrophobicContact SD-CD2 4.09Å; F53-V310 HydrophobicContact CE1-CG2 4.31Å; F53-V310 HydrophobicContact CZ-CG1 4.17Å; F53-V310 HydrophobicContact CZ-CG2 4.5Å; F53-H313 AromaticContact CD2-CE1 3.53Å; F53-H313 AromaticContact CD2-ND1 3.55Å; F53-H313 AromaticContact CE2-ND1 3.88Å; F53-T348 HydrophobicContact CD1-CG2 4.3Å; F53-T348 HydrophobicContact CD2-CG2 4.29Å; F53-T348 HydrophobicContact CE1-CG2 4.31Å; F53-T348 HydrophobicContact CE2-CG2 4.29Å; F53-T348 HydrophobicContact CG-CG2 4.31Å; F53-T348 HydrophobicContact CZ-CG2 4.3Å; F53-L351 HydrophobicContact CZ-CD1 4.02Å
54	P	91.2	Very high	75.1	Confident	25 Å²	25	67 Å²	67	16%	0.162	34%	0.341	C	S	.	.			trans	-63.2	138.9	-178.7	-22.2	33.2	0	0	0	112.4	E309 V310 H313	P54-E309 HydrophobicContact CB-CB 3.93Å; P54-E309 HydrophobicContact CG-CB 3.81Å; P54-V310 HydrophobicContact CB-CG2 3.94Å; P54-V310 HydrophobicContact CG-CG2 4.16Å; P54-H313 HydrophobicContact CG-CB 4.16Å
55	R	79.5	Confident	73.3	Confident	102 Å²	102	71.6 Å²	71.6	39%	0.385	36%	0.363	S	S	.	.			trans	-113.2	134.8	-178.1	-67.3	172	164.8	-158.4	-10	110.1	Q57 E59 S85 G86	R55-Q57 PolarHBondContact O-N 3.36Å; R55-Q57 VanDerWaalsContact O-N 3.16Å; R55-E59 IonicContact CZ-OE2 2.64Å; R55-E59 IonicContact NH1-OE2 2.82Å; R55-E59 PolarHBondContact NH1-OE2 3.36Å; R55-S85 PolarHBondContact NH2-O 2.95Å; R55-G86 PolarHBondContact NH2-O 2.9Å
56	D	59.4	Low	71.9	Confident	131 Å²	131	75.1 Å²	75.1	70%	0.701	38%	0.381	S	S	*	.	S	Bend	trans	-69.4	-8.8	-178.2	-65.8	-46.9	0	0	0	114
57	Q	52.6	Low	71	Confident	157 Å²	157	79.6 Å²	79.6	73%	0.734	40%	0.397	S	S	*	.	S	Bend	trans	-135.9	133.9	171.6	-63.8	-173.5	11.1	0	0	110.8	R55	R55-Q57 PolarHBondContact O-N 3.36Å; R55-Q57 VanDerWaalsContact O-N 3.16Å
58	P	45.3	Very low	70.4	Confident	134 Å²	134	81 Å²	81	87%	0.87	41%	0.411	S	S	*	.			trans	-77.8	122.4	168.8	31.2	-31.4	0	0	0	110.1
59	E	50.3	Low	70.1	Confident	71 Å²	71	81 Å²	81	33%	0.332	41%	0.411	S	S	.	.			trans	-81.1	145.1	172.7	-64.2	-172.5	99.9	0	0	111.6	R55 S61	R55-E59 IonicContact CZ-OE2 2.64Å; R55-E59 IonicContact NH1-OE2 2.82Å; R55-E59 PolarHBondContact NH1-OE2 3.36Å; E59-S61 VanDerWaalsContact C-N 3.27Å; E59-S61 PolarHBondContact O-N 3.01Å; E59-S61 PolarHBondContact O-OG 3.29Å
60	D	41.4	Very low	70.1	Confident	145 Å²	145	80.2 Å²	80.2	78%	0.775	41%	0.408	S	S	*	.			trans	-61	88.3	165.6	-80.6	-32.2	0	0	0	110	E62 R63	D60-E62 PolarHBondContact O-N 3.07Å; D60-R63 PolarHBondContact O-N 3.03Å
61	S	45.6	Very low	70.1	Confident	100 Å²	100	80.2 Å²	80.2	70%	0.699	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	7	-163.3	-61.8	0	0	0	0	115	E59	E59-S61 VanDerWaalsContact C-N 3.27Å; E59-S61 PolarHBondContact O-N 3.01Å; E59-S61 PolarHBondContact O-OG 3.29Å
62	E	43.3	Very low	70.3	Confident	164 Å²	164	79 Å²	79	77%	0.766	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-26	179.4	-57.4	-162.2	145.6	0	0	113.1	D60 R143	D60-E62 PolarHBondContact O-N 3.07Å; E62-R143 PolarHBondContact O-NH2 2.65Å
63	R	43.4	Very low	70.4	Confident	223 Å²	223	77.2 Å²	77.2	84%	0.842	39%	0.392	S	S	*	.	S	Bend	trans	-94.3	-26.9	-166.1	-69.2	-172.9	176.7	-173.5	0.6	116	D60	D60-R63 PolarHBondContact O-N 3.03Å
64	S	53.7	Low	70.6	Confident	58 Å²	58	76.7 Å²	76.7	41%	0.406	39%	0.389	S	S	.	.			trans	-76.9	136.3	176.8	49.2	0	0	0	0	111.5	I66 R143	S64-I66 VanDerWaalsContact C-N 3.35Å; S64-R143 PolarHBondContact O-NH1 2.95Å
65	Q	60.8	Low	70.8	Confident	103 Å²	103	78.6 Å²	78.6	48%	0.481	40%	0.396	S	S	.	.			trans	-87.9	-10.4	173.1	-65.3	177.9	-4.3	0	0	112.4
66	I	69	Low	71.4	Confident	74 Å²	74	81.1 Å²	81.1	38%	0.379	41%	0.412	S	S	.	.	B	Isolated β-bridge	trans	-104.5	125.4	-169.2	-52.4	-179.1	0	0	0	108.2	S64 E138	S64-I66 VanDerWaalsContact C-N 3.35Å; I66-E138 CarbonylContact C-O 3.53Å; I66-E138 WeakPolarHBondContact CA-O 3.25Å; I66-E138 HydrophobicContact CG2-CG 3.82Å
67	R	78.8	Confident	72.9	Confident	95 Å²	95	75.7 Å²	75.7	36%	0.358	39%	0.387	S	S	.	.			trans	-82.6	142.4	177.5	-58.1	-167.8	106.3	177.8	-3.2	109.9	T69 D136 E138	R67-T69 PolarHBondContact O-N 3.19Å; R67-T69 PolarHBondContact O-OG1 3.37Å; R67-D136 VanDerWaalsContact CD-OD2 3.24Å; R67-D136 WeakPolarHBondContact CD-OD2 3.48Å; R67-D136 IonicContact CZ-OD2 2.96Å; R67-D136 IonicContact NE-OD2 3.82Å; R67-D136 IonicContact NH1-OD2 2.72Å; R67-D136 PolarHBondContact NH1-OD2 3.19Å; R67-E138 PolarHBondContact N-O 2.79Å
68	G	85.7	Confident	74.9	Confident	28 Å²	28	72 Å²	72	29%	0.289	37%	0.369	S	S	.	.			trans	-51.5	135.9	168.1	0	0	0	0	0	110.2	E51 R112	E51-G68 WeakPolarHBondContact CG-O 3.33Å; G68-R112 WeakPolarHBondContact O-CD 3.43Å; G68-R112 PolarHBondContact O-NE 2.88Å; G68-R112 VanDerWaalsContact O-NE 3.16Å
69	T	92.8	Very high	77.4	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	33%	0.33	C	S	.	.			trans	-131.1	135.4	178	-61.3	0	0	0	0	108.2	R67 C84 S85 A91 F110 S111 R112 E138	R67-T69 PolarHBondContact O-N 3.19Å; R67-T69 PolarHBondContact O-OG1 3.37Å; T69-C84 CarbonylContact O-C 3.42Å; T69-C84 WeakPolarHBondContact O-CA 3.36Å; T69-S85 PolarHBondContact O-N 3.17Å; T69-S85 PolarHBondContact O-OG 3.14Å; T69-A91 WeakPolarHBondContact O-CB 3.44Å; T69-F110 HydrophobicContact CG2-CB 4.37Å; T69-F110 HydrophobicContact CG2-CD1 3.94Å; T69-S111 WeakPolarHBondContact CA-OG 3.09Å; T69-R112 HydrophobicContact CG2-CB 4.08Å; T69-E138 WeakPolarHBondContact OG1-CG 3.43Å; T69-E138 PolarHBondContact OG1-OE1 3.38Å
70	G	96.9	Very high	79.5	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	151.9	170	0	0	0	0	0	111.5	S47 H83 F110 S111	S47-G70 WeakPolarHBondContact O-CA 3.42Å; G70-H83 CarbonylContact C-O 3.54Å; G70-H83 WeakPolarHBondContact CA-O 3.24Å; G70-F110 CarbonylContact O-C 3.58Å; G70-F110 WeakPolarHBondContact O-CA 3.49Å; G70-S111 PolarHBondContact N-OG 3.35Å; G70-S111 PolarHBondContact O-N 3.22Å
71	L	98.1	Very high	82.1	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	130.4	-174.3	168	62.5	0	0	0	111.6	V73 H83 A91 A95 L108 Y109 F110	L71-V73 HydrophobicContact CD2-CG2 4.5Å; L71-V73 HydrophobicContact CG-CG2 4.44Å; L71-H83 HydrophobicContact CB-CB 4.19Å; L71-H83 PolarHBondContact N-O 2.94Å; L71-H83 PolarHBondContact O-N 3.39Å; L71-A91 HydrophobicContact CB-CB 3.8Å; L71-A91 HydrophobicContact CD2-CB 4.39Å; L71-A91 WeakPolarHBondContact CD2-O 3.47Å; L71-A95 HydrophobicContact CD2-CB 3.71Å; L71-L108 HydrophobicContact CD1-CB 3.94Å; L71-L108 HydrophobicContact CD1-CD2 4.25Å; L71-L108 HydrophobicContact CD1-CG 4.46Å; L71-Y109 CarbonylContact C-O 3.55Å; L71-Y109 WeakPolarHBondContact CA-O 3.3Å; L71-F110 HydrophobicContact CB-CD1 4.13Å; L71-F110 HydrophobicContact CB-CE1 4.22Å; L71-F110 HydrophobicContact CD1-CD1 3.9Å; L71-F110 HydrophobicContact CD1-CD2 3.87Å; L71-F110 HydrophobicContact CD1-CE1 3.77Å; L71-F110 HydrophobicContact CD1-CE2 3.73Å; L71-F110 HydrophobicContact CD1-CG 3.95Å; L71-F110 HydrophobicContact CD1-CZ 3.68Å; L71-F110 HydrophobicContact CD2-CE1 3.81Å; L71-F110 HydrophobicContact CD2-CZ 3.95Å; L71-F110 HydrophobicContact CG-CD1 4.41Å; L71-F110 HydrophobicContact CG-CE1 4.15Å; L71-F110 HydrophobicContact CG-CZ 4.38Å
72	V	98.5	Very high	84.5	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	128.2	164.1	-164.5	0	0	0	0	109.9	F43 L46 V74 V79 L82 Y109	F43-V72 HydrophobicContact CD1-CG1 4.38Å; F43-V72 WeakPolarHBondContact O-CG2 3.37Å; L46-V72 HydrophobicContact CB-CG2 3.71Å; V72-V74 HydrophobicContact CB-CG2 4.43Å; V72-V74 HydrophobicContact CG1-CG2 3.69Å; V72-V79 HydrophobicContact CG1-CG1 3.87Å; V72-V79 HydrophobicContact CG1-CG2 3.99Å; V72-L82 HydrophobicContact CB-CD2 4.06Å; V72-L82 HydrophobicContact CG1-CD2 3.8Å; V72-L82 HydrophobicContact CG2-CD2 3.64Å; V72-Y109 PolarHBondContact N-O 3.24Å; V72-Y109 PolarHBondContact O-N 3.42Å
73	V	98.3	Very high	87.1	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	123.9	168	-174.2	0	0	0	0	108.1	L71 V79 L80 G81 A95 L103 C106 L108	L71-V73 HydrophobicContact CD2-CG2 4.5Å; L71-V73 HydrophobicContact CG-CG2 4.44Å; V73-V79 CarbonylContact O-C 3.54Å; V73-V79 WeakPolarHBondContact O-CA 3.45Å; V73-L80 HydrophobicContact CB-CB 4.4Å; V73-L80 HydrophobicContact CG1-CB 4.05Å; V73-L80 PolarHBondContact O-N 2.83Å; V73-G81 PolarHBondContact N-O 3.07Å; V73-G81 PolarHBondContact O-N 3.49Å; V73-A95 HydrophobicContact CG2-CB 4.05Å; V73-L103 HydrophobicContact CG1-CD2 3.62Å; V73-L103 HydrophobicContact CG2-CD2 4.29Å; V73-C106 HydrophobicContact CG1-CB 4.18Å; V73-L108 HydrophobicContact CB-CD2 4.08Å; V73-L108 HydrophobicContact CG1-CD2 3.89Å; V73-L108 HydrophobicContact CG2-CD2 3.9Å
74	V	97.8	Very high	89.5	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	135.9	-177.2	-179.1	0	0	0	0	110.3	F43 V72 K78 C106 Q107 Y109	F43-V74 HydrophobicContact CD1-CG2 4.03Å; F43-V74 HydrophobicContact CD2-CG1 4.36Å; F43-V74 HydrophobicContact CD2-CG2 3.85Å; F43-V74 HydrophobicContact CE1-CG2 4.14Å; F43-V74 HydrophobicContact CE2-CB 4.46Å; F43-V74 HydrophobicContact CE2-CG1 3.72Å; F43-V74 HydrophobicContact CE2-CG2 3.95Å; F43-V74 HydrophobicContact CG-CG2 3.9Å; F43-V74 HydrophobicContact CZ-CG1 3.89Å; F43-V74 HydrophobicContact CZ-CG2 4.1Å; V72-V74 HydrophobicContact CB-CG2 4.43Å; V72-V74 HydrophobicContact CG1-CG2 3.69Å; V74-K78 CarbonylContact C-O 3.56Å; V74-K78 VanDerWaalsContact CA-O 3.3Å; V74-K78 WeakPolarHBondContact CA-O 3.33Å; V74-K78 WeakPolarHBondContact CG1-O 3.42Å; V74-C106 CarbonylContact O-C 3.58Å; V74-C106 VanDerWaalsContact O-CA 3.3Å; V74-C106 WeakPolarHBondContact O-CA 3.43Å; V74-C106 WeakPolarHBondContact O-CB 3.42Å; V74-Q107 HydrophobicContact CB-CB 4.35Å; V74-Q107 PolarHBondContact N-O 3.44Å; V74-Q107 PolarHBondContact O-N 3.26Å; V74-Y109 HydrophobicContact CB-CE2 4.22Å; V74-Y109 HydrophobicContact CG2-CD2 3.86Å; V74-Y109 HydrophobicContact CG2-CE2 3.88Å
75	H	96.2	Very high	91.3	Very high	66 Å²	66	32.8 Å²	32.8	31%	0.306	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	131.6	170.8	-177.2	-119.4	0	0	0	109.8	G77 K78 L80	H75-G77 PolarHBondContact O-N 3.29Å; H75-K78 PolarHBondContact N-O 3.35Å; H75-K78 PolarHBondContact O-N 3.22Å; H75-L80 HydrophobicContact CB-CD1 3.48Å; H75-L80 VanDerWaalsContact CB-CD1 3.48Å; H75-L80 HydrophobicContact CB-CD2 4.42Å; H75-L80 HydrophobicContact CB-CG 3.78Å
76	Q	92.4	Very high	92.5	Very high	154 Å²	154	28.5 Å²	28.5	72%	0.72	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.9	32.7	-177.1	-62.7	173.6	-7.6	0	0	113.4	K78	Q76-K78 VanDerWaalsContact C-N 3.32Å; Q76-K78 PolarHBondContact O-N 3.35Å
77	G	90.9	Very high	93	Very high	17 Å²	17	29.9 Å²	29.9	18%	0.175	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.5	20.5	-178.2	0	0	0	0	0	115.5	K39 H75	K39-G77 PolarHBondContact NZ-O 2.88Å; K39-G77 VanDerWaalsContact NZ-O 3.13Å; H75-G77 PolarHBondContact O-N 3.29Å
78	K	93.5	Very high	93.2	Very high	79 Å²	79	30.4 Å²	30.4	34%	0.343	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	145.7	169.5	-60.6	173.5	-178.3	175.2	0	109.5	V74 H75 Q76 F398	V74-K78 CarbonylContact C-O 3.56Å; V74-K78 VanDerWaalsContact CA-O 3.3Å; V74-K78 WeakPolarHBondContact CA-O 3.33Å; V74-K78 WeakPolarHBondContact CG1-O 3.42Å; H75-K78 PolarHBondContact N-O 3.35Å; H75-K78 PolarHBondContact O-N 3.22Å; Q76-K78 VanDerWaalsContact C-N 3.32Å; Q76-K78 PolarHBondContact O-N 3.35Å; K78-F398 HydrophobicContact CD-CB 4.35Å; K78-F398 HydrophobicContact CD-CD1 3.78Å; K78-F398 HydrophobicContact CD-CE1 4.26Å; K78-F398 HydrophobicContact CD-CG 3.95Å; K78-F398 HydrophobicContact CG-CG 4.5Å; K78-F398 VanDerWaalsContact NZ-CE1 3.29Å
79	V	97	Very high	93.3	Very high	11 Å²	11	30.9 Å²	30.9	7%	0.067	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	126.6	179.2	179.3	0	0	0	0	110.1	F43 V72 V73 L82 L353	F43-V79 HydrophobicContact CD1-CG2 4.17Å; F43-V79 HydrophobicContact CE1-CG2 3.75Å; V72-V79 HydrophobicContact CG1-CG1 3.87Å; V72-V79 HydrophobicContact CG1-CG2 3.99Å; V73-V79 CarbonylContact O-C 3.54Å; V73-V79 WeakPolarHBondContact O-CA 3.45Å; V79-L82 HydrophobicContact CG1-CD2 4.41Å; V79-L82 HydrophobicContact CG1-CG 4.09Å; V79-L353 HydrophobicContact CG1-CD2 3.84Å
80	L	95.8	Very high	93.3	Very high	41 Å²	41	32.1 Å²	32.1	22%	0.215	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	-16.8	173	-67	-169.3	0	0	0	113.5	V73 H75 H99 T400	V73-L80 HydrophobicContact CB-CB 4.4Å; V73-L80 HydrophobicContact CG1-CB 4.05Å; V73-L80 PolarHBondContact O-N 2.83Å; H75-L80 HydrophobicContact CB-CD1 3.48Å; H75-L80 VanDerWaalsContact CB-CD1 3.48Å; H75-L80 HydrophobicContact CB-CD2 4.42Å; H75-L80 HydrophobicContact CB-CG 3.78Å; L80-H99 PolarHBondContact O-CE1 3.04Å; L80-T400 VanDerWaalsContact O-CG2 3.22Å; L80-T400 WeakPolarHBondContact O-CG2 3.46Å
81	G	95.6	Very high	93.2	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.3	149.9	-179.5	0	0	0	0	0	112.9	V73	V73-G81 PolarHBondContact N-O 3.07Å; V73-G81 PolarHBondContact O-N 3.49Å
82	L	97	Very high	93	Very high	4 Å²	4	32.1 Å²	32.1	2%	0.021	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	123.7	172.9	-73.4	171.6	0	0	0	107.3	L46 M50 V72 V79 Q317 W337 L353	L46-L82 HydrophobicContact CB-CD2 4.26Å; M50-L82 HydrophobicContact CE-CB 4.19Å; M50-L82 HydrophobicContact CG-CB 4.02Å; M50-L82 HydrophobicContact CG-CD2 3.94Å; M50-L82 HydrophobicContact CG-CG 4.47Å; M50-L82 HydrophobicContact SD-CB 3.89Å; V72-L82 HydrophobicContact CB-CD2 4.06Å; V72-L82 HydrophobicContact CG1-CD2 3.8Å; V72-L82 HydrophobicContact CG2-CD2 3.64Å; V79-L82 HydrophobicContact CG1-CD2 4.41Å; V79-L82 HydrophobicContact CG1-CG 4.09Å; L82-Q317 HydrophobicContact CD1-CG 4.12Å; L82-W337 HydrophobicContact CB-CH2 3.88Å; L82-W337 HydrophobicContact CB-CZ2 3.92Å; L82-W337 HydrophobicContact CD1-CZ2 4.15Å; L82-L353 HydrophobicContact CB-CD2 4.22Å; L82-L353 HydrophobicContact CD1-CD1 4.28Å; L82-L353 HydrophobicContact CD1-CD2 4.01Å; L82-L353 HydrophobicContact CG-CD2 3.91Å
83	H	96	Very high	92.8	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.009	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	157.1	-171.4	-67	-92.9	0	0	0	110.8	G70 L71 A91 A95 Q98 H99	G70-H83 CarbonylContact C-O 3.54Å; G70-H83 WeakPolarHBondContact CA-O 3.24Å; L71-H83 HydrophobicContact CB-CB 4.19Å; L71-H83 PolarHBondContact N-O 2.94Å; L71-H83 PolarHBondContact O-N 3.39Å; H83-A91 HydrophobicContact CB-CB 4.3Å; H83-A95 WeakPolarHBondContact CE1-CA 3.38Å; H83-A95 PolarHBondContact ND1-N 2.91Å; H83-Q98 PolarHBondContact CE1-OE1 2.88Å; H83-H99 AromaticContact NE2-CD2 3.58Å; H83-H99 AromaticContact NE2-NE2 3.32Å; H83-H99 PolarHBondContact NE2-NE2 3.42Å
84	C	94.3	Very high	92.6	Very high	7 Å²	7	34 Å²	34	5%	0.047	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	156.4	165	53.9	0	0	0	0	111.3	M50 T69 G86 G347	M50-C84 HydrophobicContact CB-CB 4.49Å; M50-C84 WeakPolarHBondContact O-CB 3.21Å; T69-C84 CarbonylContact O-C 3.42Å; T69-C84 WeakPolarHBondContact O-CA 3.36Å; C84-G86 PolarHBondContact O-N 3.02Å; C84-G347 WeakPolarHBondContact O-CA 3.29Å; C84-G347 PolarHBondContact O-N 2.86Å; C84-G347 VanDerWaalsContact O-N 3.09Å; C84-G347 VanDerWaalsContact SG-CA 3.59Å
85	S	91.8	Very high	92.4	Very high	8 Å²	8	34 Å²	34	6%	0.056	18%	0.181	C	C	.	.			trans	-64.6	128.8	179.6	-53.8	0	0	0	0	110.6	R55 T69 L89 A91 E138	R55-S85 PolarHBondContact NH2-O 2.95Å; T69-S85 PolarHBondContact O-N 3.17Å; T69-S85 PolarHBondContact O-OG 3.14Å; S85-L89 CarbonylContact C-O 3.54Å; S85-L89 WeakPolarHBondContact CA-O 3.44Å; S85-A91 PolarHBondContact OG-N 3.13Å; S85-E138 PolarHBondContact OG-OE1 2.69Å
86	G	86.9	Confident	92.4	Very high	13 Å²	13	32.4 Å²	32.4	13%	0.134	17%	0.174	C	C	.	.			trans	-89.9	-150.1	172.6	0	0	0	0	0	111.9	R55 C84 L89	R55-G86 PolarHBondContact NH2-O 2.9Å; C84-G86 PolarHBondContact O-N 3.02Å; G86-L89 PolarHBondContact N-O 3Å
87	V	79.3	Confident	92.4	Very high	103 Å²	103	30.2 Å²	30.2	62%	0.624	17%	0.166	S	C	*	.	S	Bend	trans	-76.9	-55.5	171.9	-175.8	0	0	0	0	109.9
88	D	81.9	Confident	92.4	Very high	106 Å²	106	31.5 Å²	31.5	57%	0.567	17%	0.167	S	C	*	.	S	Bend	trans	-91.1	-27.6	-173.7	-43.2	-65.4	0	0	0	114	C345	D88-C345 HydrophobicContact CB-CB 4.33Å; D88-C345 WeakPolarHBondContact OD2-CB 3.49Å; D88-C345 PolarHBondContact OD2-SG 2.79Å
89	L	89	Confident	92.4	Very high	38 Å²	38	28.6 Å²	28.6	20%	0.199	16%	0.155	C	C	.	.			trans	-121.9	125.6	-169.3	-60.5	174.2	0	0	0	112.1	S85 G86 Q93 I97 C345	S85-L89 CarbonylContact C-O 3.54Å; S85-L89 WeakPolarHBondContact CA-O 3.44Å; G86-L89 PolarHBondContact N-O 3Å; L89-Q93 HydrophobicContact CB-CB 4.49Å; L89-Q93 HydrophobicContact CD2-CB 4.23Å; L89-I97 HydrophobicContact CD1-CD1 3.79Å; L89-I97 HydrophobicContact CD2-CD1 4.01Å; L89-C345 WeakPolarHBondContact CB-O 3.46Å; L89-C345 HydrophobicContact CD1-CB 3.76Å; L89-C345 HydrophobicContact CG-CB 4.12Å
90	H	92.1	Very high	92.2	Very high	26 Å²	26	29.6 Å²	29.6	12%	0.12	17%	0.167	C	C	.	.			trans	-65	153.5	166.1	-66.8	-129.8	0	0	0	110.7	A92 Q93 A94 C118 E138	H90-A92 PolarHBondContact O-N 3.37Å; H90-A92 VanDerWaalsContact O-N 3.13Å; H90-Q93 HydrophobicContact CB-CG 4.32Å; H90-Q93 PolarHBondContact CD2-OE1 3.32Å; H90-Q93 WeakPolarHBondContact O-CB 3.34Å; H90-Q93 PolarHBondContact O-N 3.5Å; H90-A94 PolarHBondContact O-N 3.38Å; H90-C118 WeakPolarHBondContact CB-SG 3.5Å; H90-C118 VanDerWaalsContact CG-SG 3.57Å; H90-E138 IonicContact CE1-OE2 3.22Å; H90-E138 IonicContact CG-OE1 3.66Å; H90-E138 IonicContact ND1-OE1 3.63Å; H90-E138 PolarHBondContact ND1-OE1 2.95Å; H90-E138 IonicContact ND1-OE2 2.73Å; H90-E138 PolarHBondContact ND1-OE2 3.16Å
91	A	93.9	Very high	92.1	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-53.8	-37.7	-179.2	0	0	0	0	0	113.6	T69 L71 H83 S85 A95	T69-A91 WeakPolarHBondContact O-CB 3.44Å; L71-A91 HydrophobicContact CB-CB 3.8Å; L71-A91 HydrophobicContact CD2-CB 4.39Å; L71-A91 WeakPolarHBondContact CD2-O 3.47Å; H83-A91 HydrophobicContact CB-CB 4.3Å; S85-A91 PolarHBondContact OG-N 3.13Å; A91-A95 WeakPolarHBondContact O-CB 3.4Å; A91-A95 PolarHBondContact O-N 2.83Å
92	A	95.4	Very high	92.1	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-65.2	-41.6	175.5	0	0	0	0	0	112.9	H90 A95 I96 F110 C118 I122	H90-A92 PolarHBondContact O-N 3.37Å; H90-A92 VanDerWaalsContact O-N 3.13Å; A92-A95 PolarHBondContact O-N 3.44Å; A92-I96 WeakPolarHBondContact O-CD1 3.41Å; A92-I96 WeakPolarHBondContact O-CG1 3.43Å; A92-I96 PolarHBondContact O-N 3.23Å; A92-F110 HydrophobicContact CB-CE1 3.94Å; A92-F110 HydrophobicContact CB-CZ 4.01Å; A92-C118 HydrophobicContact CB-CB 3.7Å; A92-I122 HydrophobicContact CB-CG2 3.98Å
93	Q	94.3	Very high	92	Very high	37 Å²	37	38.4 Å²	38.4	17%	0.173	22%	0.221	C	C	.	.	H	α-helix	trans	-66.9	-42.9	178.2	-66	166.4	-35.9	0	0	110.6	L89 H90 A95 I96 I97 M121	L89-Q93 HydrophobicContact CB-CB 4.49Å; L89-Q93 HydrophobicContact CD2-CB 4.23Å; H90-Q93 HydrophobicContact CB-CG 4.32Å; H90-Q93 PolarHBondContact CD2-OE1 3.32Å; H90-Q93 WeakPolarHBondContact O-CB 3.34Å; H90-Q93 PolarHBondContact O-N 3.5Å; Q93-A95 VanDerWaalsContact C-N 3.32Å; Q93-A95 PolarHBondContact O-N 3.44Å; Q93-I96 PolarHBondContact O-N 3.3Å; Q93-I97 VanDerWaalsContact O-CG1 3.3Å; Q93-I97 WeakPolarHBondContact O-CG1 3.33Å; Q93-I97 PolarHBondContact O-N 3.08Å; Q93-M121 HydrophobicContact CG-CE 4.48Å; Q93-M121 HydrophobicContact CG-SD 4.22Å
94	A	92.9	Very high	92.1	Very high	1 Å²	1	41 Å²	41	1%	0.008	24%	0.242	C	C	.	.	H	α-helix	trans	-57.7	-43.3	172.8	0	0	0	0	0	112.1	H90 I97 Q98 R346	H90-A94 PolarHBondContact O-N 3.38Å; A94-I97 PolarHBondContact O-N 3.04Å; A94-Q98 PolarHBondContact O-N 2.93Å; A94-R346 HydrophobicContact CB-CG 4.08Å
95	A	95	Very high	92.1	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.008	26%	0.259	C	S	.	.	H	α-helix	trans	-63.4	-41.9	175.2	0	0	0	0	0	113.3	L71 V73 H83 A91 A92 Q93 Q98 H99	L71-A95 HydrophobicContact CD2-CB 3.71Å; V73-A95 HydrophobicContact CG2-CB 4.05Å; H83-A95 WeakPolarHBondContact CE1-CA 3.38Å; H83-A95 PolarHBondContact ND1-N 2.91Å; A91-A95 WeakPolarHBondContact O-CB 3.4Å; A91-A95 PolarHBondContact O-N 2.83Å; A92-A95 PolarHBondContact O-N 3.44Å; Q93-A95 VanDerWaalsContact C-N 3.32Å; Q93-A95 PolarHBondContact O-N 3.44Å; A95-Q98 PolarHBondContact O-N 2.83Å; A95-H99 WeakPolarHBondContact O-CB 3.41Å; A95-H99 PolarHBondContact O-CD2 2.9Å; A95-H99 VanDerWaalsContact O-CD2 3.31Å; A95-H99 PolarHBondContact O-N 2.97Å
96	I	95.5	Very high	92.4	Very high	33 Å²	33	42.1 Å²	42.1	17%	0.169	26%	0.256	C	S	.	.	H	α-helix	trans	-65.2	-39.7	176.2	-70.1	156.2	0	0	0	111.2	A92 Q93 G100 L103 M121 I122	A92-I96 WeakPolarHBondContact O-CD1 3.41Å; A92-I96 WeakPolarHBondContact O-CG1 3.43Å; A92-I96 PolarHBondContact O-N 3.23Å; Q93-I96 PolarHBondContact O-N 3.3Å; I96-G100 VanDerWaalsContact O-CA 3.26Å; I96-G100 WeakPolarHBondContact O-CA 3.48Å; I96-G100 PolarHBondContact O-N 3.39Å; I96-L103 HydrophobicContact CB-CD1 4.31Å; I96-L103 HydrophobicContact CG1-CD1 3.55Å; I96-M121 HydrophobicContact CD1-CB 3.4Å; I96-M121 VanDerWaalsContact CD1-CB 3.4Å; I96-M121 HydrophobicContact CD1-CE 4.19Å; I96-M121 HydrophobicContact CG2-CE 4.47Å; I96-I122 HydrophobicContact CD1-CG2 3.68Å; I96-I122 HydrophobicContact CG1-CG2 4.18Å
97	I	92.8	Very high	93	Very high	108 Å²	108	44.4 Å²	44.4	55%	0.554	26%	0.263	S	S	*	.	H	α-helix	trans	-67.9	-34.9	177.3	-66.5	163.3	0	0	0	111.6	L89 Q93 A94	L89-I97 HydrophobicContact CD1-CD1 3.79Å; L89-I97 HydrophobicContact CD2-CD1 4.01Å; Q93-I97 VanDerWaalsContact O-CG1 3.3Å; Q93-I97 WeakPolarHBondContact O-CG1 3.33Å; Q93-I97 PolarHBondContact O-N 3.08Å; A94-I97 PolarHBondContact O-N 3.04Å
98	Q	90.7	Very high	93.9	Very high	43 Å²	43	39.5 Å²	39.5	20%	0.201	23%	0.234	C	C	.	.	H	α-helix	trans	-79.2	-39.2	178.2	-172.2	175.1	-9.4	0	0	113.5	H83 A94 A95	H83-Q98 PolarHBondContact CE1-OE1 2.88Å; A94-Q98 PolarHBondContact O-N 2.93Å; A95-Q98 PolarHBondContact O-N 2.83Å
99	H	93.2	Very high	94.6	Very high	19 Å²	19	34.9 Å²	34.9	9%	0.088	21%	0.208	C	C	.	.	H	α-helix	trans	-108.7	-29.1	-167.5	-62.7	-61.6	0	0	0	113.8	L80 H83 A95 A101 K102 L103	L80-H99 PolarHBondContact O-CE1 3.04Å; H83-H99 AromaticContact NE2-CD2 3.58Å; H83-H99 AromaticContact NE2-NE2 3.32Å; H83-H99 PolarHBondContact NE2-NE2 3.42Å; A95-H99 WeakPolarHBondContact O-CB 3.41Å; A95-H99 PolarHBondContact O-CD2 2.9Å; A95-H99 VanDerWaalsContact O-CD2 3.31Å; A95-H99 PolarHBondContact O-N 2.97Å; H99-A101 PolarHBondContact O-N 2.79Å; H99-K102 HydrophobicContact CB-CB 4.37Å; H99-K102 VanDerWaalsContact O-CB 3.22Å; H99-K102 WeakPolarHBondContact O-CB 3.4Å; H99-K102 WeakPolarHBondContact O-CG 3.49Å; H99-K102 PolarHBondContact O-N 3.39Å; H99-L103 HydrophobicContact CB-CD2 3.73Å; H99-L103 HydrophobicContact CB-CG 3.81Å
100	G	93.6	Very high	95.1	Very high	31 Å²	31	33.1 Å²	33.1	32%	0.32	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	51.1	-128.2	-178.9	0	0	0	0	0	112.5	I96 K102 L103	I96-G100 VanDerWaalsContact O-CA 3.26Å; I96-G100 WeakPolarHBondContact O-CA 3.48Å; I96-G100 PolarHBondContact O-N 3.39Å; G100-K102 PolarHBondContact O-N 2.64Å; G100-K102 VanDerWaalsContact O-N 3.1Å; G100-L103 WeakPolarHBondContact O-CB 3.43Å; G100-L103 WeakPolarHBondContact O-CG 3.22Å; G100-L103 PolarHBondContact O-N 3.16Å; G100-L103 VanDerWaalsContact O-N 3.13Å
101	A	93.1	Very high	95.3	Very high	90 Å²	90	31.9 Å²	31.9	74%	0.744	19%	0.194	S	C	*	.	G	3₁₀ helix	trans	-61.3	-15.5	178	0	0	0	0	0	114.5	H99 L103 A104	H99-A101 PolarHBondContact O-N 2.79Å; A101-L103 PolarHBondContact O-N 3.32Å; A101-A104 WeakPolarHBondContact O-CB 3.38Å; A101-A104 PolarHBondContact O-N 3.35Å; A101-A104 VanDerWaalsContact O-N 3.14Å
102	K	94.6	Very high	95.3	Very high	140 Å²	140	32.1 Å²	32.1	61%	0.609	19%	0.194	S	C	*	.	G	3₁₀ helix	trans	-67.7	-11.2	174.2	-59.6	-178.5	176.6	-177	0	113.3	H99 G100 A104 C106	H99-K102 HydrophobicContact CB-CB 4.37Å; H99-K102 VanDerWaalsContact O-CB 3.22Å; H99-K102 WeakPolarHBondContact O-CB 3.4Å; H99-K102 WeakPolarHBondContact O-CG 3.49Å; H99-K102 PolarHBondContact O-N 3.39Å; G100-K102 PolarHBondContact O-N 2.64Å; G100-K102 VanDerWaalsContact O-N 3.1Å; K102-A104 PolarHBondContact O-N 3.29Å; K102-C106 PolarHBondContact O-SG 2.88Å
103	L	96.4	Very high	95.1	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.005	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-71.8	-13.2	171.4	-64.5	179.1	0	0	0	113.3	V73 I96 H99 G100 A101 G105 C106 A125 V127	V73-L103 HydrophobicContact CG1-CD2 3.62Å; V73-L103 HydrophobicContact CG2-CD2 4.29Å; I96-L103 HydrophobicContact CB-CD1 4.31Å; I96-L103 HydrophobicContact CG1-CD1 3.55Å; H99-L103 HydrophobicContact CB-CD2 3.73Å; H99-L103 HydrophobicContact CB-CG 3.81Å; G100-L103 WeakPolarHBondContact O-CB 3.43Å; G100-L103 WeakPolarHBondContact O-CG 3.22Å; G100-L103 PolarHBondContact O-N 3.16Å; G100-L103 VanDerWaalsContact O-N 3.13Å; A101-L103 PolarHBondContact O-N 3.32Å; L103-G105 PolarHBondContact O-N 2.85Å; L103-C106 VanDerWaalsContact O-CB 3.25Å; L103-C106 WeakPolarHBondContact O-CB 3.48Å; L103-C106 PolarHBondContact O-N 3.24Å; L103-A125 HydrophobicContact CB-CB 3.98Å; L103-A125 HydrophobicContact CD1-CB 4.1Å; L103-V127 HydrophobicContact CB-CG2 4.13Å
104	A	96.6	Very high	95	Very high	55 Å²	55	31.2 Å²	31.2	46%	0.455	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	129.1	175.2	0	0	0	0	0	110.9	A101 K102 C106 A125 G126	A101-A104 WeakPolarHBondContact O-CB 3.38Å; A101-A104 PolarHBondContact O-N 3.35Å; A101-A104 VanDerWaalsContact O-N 3.14Å; K102-A104 PolarHBondContact O-N 3.29Å; A104-C106 PolarHBondContact O-N 2.9Å; A104-A125 WeakPolarHBondContact CA-O 3.43Å; A104-A125 PolarHBondContact N-O 2.78Å; A104-G126 WeakPolarHBondContact CA-O 3.2Å
105	G	96.1	Very high	94.8	Very high	39 Å²	39	31.7 Å²	31.7	40%	0.402	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.1	-8.6	-176.7	0	0	0	0	0	115.8	L103 G126 S128	L103-G105 PolarHBondContact O-N 2.85Å; G105-G126 PolarHBondContact N-O 3.39Å; G105-S128 WeakPolarHBondContact O-CB 3.33Å; G105-S128 PolarHBondContact O-OG 2.79Å
106	C	97.7	Very high	94.5	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	19%	0.193	C	C	.	.			trans	-66.4	156.2	179.6	-69.5	0	0	0	0	113	V73 V74 K102 L103 A104 V127 S128 Q129	V73-C106 HydrophobicContact CG1-CB 4.18Å; V74-C106 CarbonylContact O-C 3.58Å; V74-C106 VanDerWaalsContact O-CA 3.3Å; V74-C106 WeakPolarHBondContact O-CA 3.43Å; V74-C106 WeakPolarHBondContact O-CB 3.42Å; K102-C106 PolarHBondContact O-SG 2.88Å; L103-C106 VanDerWaalsContact O-CB 3.25Å; L103-C106 WeakPolarHBondContact O-CB 3.48Å; L103-C106 PolarHBondContact O-N 3.24Å; A104-C106 PolarHBondContact O-N 2.9Å; C106-V127 WeakPolarHBondContact O-CG1 3.48Å; C106-S128 PolarHBondContact O-N 2.88Å; C106-S128 PolarHBondContact O-OG 3.14Å; C106-Q129 PolarHBondContact O-N 3.44Å
107	Q	98	Very high	94.3	Very high	61 Å²	61	33.3 Å²	33.3	29%	0.285	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	132.4	168.9	-57.8	172.7	-13.5	0	0	107.9	V74 Y109 Q129	V74-Q107 HydrophobicContact CB-CB 4.35Å; V74-Q107 PolarHBondContact N-O 3.44Å; V74-Q107 PolarHBondContact O-N 3.26Å; Q107-Y109 HydrophobicContact CB-CE2 4Å; Q107-Q129 WeakPolarHBondContact CA-O 3.33Å; Q107-Q129 HydrophobicContact CB-CB 4.27Å; Q107-Q129 HydrophobicContact CG-CB 4.05Å
108	L	98.3	Very high	94.3	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.005	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	138.4	180	-59.9	-172.2	0	0	0	111.1	L71 V73 F110 I122 V127 Q129 S131	L71-L108 HydrophobicContact CD1-CB 3.94Å; L71-L108 HydrophobicContact CD1-CD2 4.25Å; L71-L108 HydrophobicContact CD1-CG 4.46Å; V73-L108 HydrophobicContact CB-CD2 4.08Å; V73-L108 HydrophobicContact CG1-CD2 3.89Å; V73-L108 HydrophobicContact CG2-CD2 3.9Å; L108-F110 HydrophobicContact CB-CD2 4.24Å; L108-F110 HydrophobicContact CB-CE2 3.72Å; L108-F110 HydrophobicContact CD1-CE2 3.91Å; L108-F110 HydrophobicContact CD1-CZ 4.11Å; L108-F110 HydrophobicContact CG-CE2 4.48Å; L108-I122 HydrophobicContact CD1-CB 4.03Å; L108-I122 HydrophobicContact CD1-CD1 4.02Å; L108-I122 HydrophobicContact CD1-CG2 3.96Å; L108-V127 HydrophobicContact CD1-CG1 4.08Å; L108-V127 HydrophobicContact CD1-CG2 3.9Å; L108-V127 HydrophobicContact CG-CG1 3.87Å; L108-V127 HydrophobicContact CG-CG2 4.19Å; L108-Q129 PolarHBondContact N-O 3.1Å; L108-S131 PolarHBondContact O-N 2.97Å; L108-S131 PolarHBondContact O-OG 3.21Å
109	Y	98.4	Very high	94.4	Very high	8 Å²	8	26.3 Å²	26.3	3%	0.031	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	110.5	177.3	-64	-101.5	0	0	0	109.5	V40 F43 S47 L71 V72 V74 Q107 S131 L184	V40-Y109 HydrophobicContact CG1-CE1 4.48Å; F43-Y109 HydrophobicContact CB-CD1 3.74Å; F43-Y109 HydrophobicContact CB-CD2 3.75Å; F43-Y109 HydrophobicContact CB-CE1 4.04Å; F43-Y109 HydrophobicContact CB-CE2 4.03Å; F43-Y109 HydrophobicContact CB-CG 3.61Å; F43-Y109 HydrophobicContact CD2-CD2 4.17Å; F43-Y109 HydrophobicContact CD2-CE1 4.29Å; F43-Y109 AromaticContact CD2-CE2 3.62Å; F43-Y109 HydrophobicContact CD2-CE2 3.62Å; F43-Y109 AromaticContact CD2-CZ 3.71Å; F43-Y109 HydrophobicContact CE2-CE2 4.48Å; F43-Y109 HydrophobicContact CG-CD2 4.27Å; F43-Y109 HydrophobicContact CG-CE2 4.18Å; S47-Y109 WeakPolarHBondContact CB-O 3.47Å; L71-Y109 CarbonylContact C-O 3.55Å; L71-Y109 WeakPolarHBondContact CA-O 3.3Å; V72-Y109 PolarHBondContact N-O 3.24Å; V72-Y109 PolarHBondContact O-N 3.42Å; V74-Y109 HydrophobicContact CB-CE2 4.22Å; V74-Y109 HydrophobicContact CG2-CD2 3.86Å; V74-Y109 HydrophobicContact CG2-CE2 3.88Å; Q107-Y109 HydrophobicContact CB-CE2 4Å; Y109-S131 WeakPolarHBondContact CA-O 3.48Å; Y109-S131 WeakPolarHBondContact CD1-OG 3.48Å; Y109-S131 WeakPolarHBondContact CE1-OG 3.31Å; Y109-L184 HydrophobicContact CE1-CD1 4.31Å
110	F	98.1	Very high	94.4	Very high	2 Å²	2	30.1 Å²	30.1	1%	0.009	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	148.4	-178.3	-68.4	-97.3	0	0	0	112.8	T69 G70 L71 A92 L108 R112 P114 I122 I130 S131 F132 W133	T69-F110 HydrophobicContact CG2-CB 4.37Å; T69-F110 HydrophobicContact CG2-CD1 3.94Å; G70-F110 CarbonylContact O-C 3.58Å; G70-F110 WeakPolarHBondContact O-CA 3.49Å; L71-F110 HydrophobicContact CB-CD1 4.13Å; L71-F110 HydrophobicContact CB-CE1 4.22Å; L71-F110 HydrophobicContact CD1-CD1 3.9Å; L71-F110 HydrophobicContact CD1-CD2 3.87Å; L71-F110 HydrophobicContact CD1-CE1 3.77Å; L71-F110 HydrophobicContact CD1-CE2 3.73Å; L71-F110 HydrophobicContact CD1-CG 3.95Å; L71-F110 HydrophobicContact CD1-CZ 3.68Å; L71-F110 HydrophobicContact CD2-CE1 3.81Å; L71-F110 HydrophobicContact CD2-CZ 3.95Å; L71-F110 HydrophobicContact CG-CD1 4.41Å; L71-F110 HydrophobicContact CG-CE1 4.15Å; L71-F110 HydrophobicContact CG-CZ 4.38Å; A92-F110 HydrophobicContact CB-CE1 3.94Å; A92-F110 HydrophobicContact CB-CZ 4.01Å; L108-F110 HydrophobicContact CB-CD2 4.24Å; L108-F110 HydrophobicContact CB-CE2 3.72Å; L108-F110 HydrophobicContact CD1-CE2 3.91Å; L108-F110 HydrophobicContact CD1-CZ 4.11Å; L108-F110 HydrophobicContact CG-CE2 4.48Å; F110-R112 VanDerWaalsContact C-N 3.29Å; F110-R112 WeakPolarHBondContact CB-O 3.19Å; F110-P114 HydrophobicContact CD1-CB 4.36Å; F110-P114 HydrophobicContact CD1-CG 4.48Å; F110-P114 HydrophobicContact CD2-CG 4.46Å; F110-P114 HydrophobicContact CE1-CB 4.09Å; F110-P114 HydrophobicContact CE1-CG 4.3Å; F110-P114 HydrophobicContact CE2-CG 4.28Å; F110-P114 HydrophobicContact CZ-CB 4.38Å; F110-P114 HydrophobicContact CZ-CG 4.2Å; F110-I122 HydrophobicContact CE2-CD1 3.91Å; F110-I122 HydrophobicContact CZ-CD1 3.79Å; F110-I130 HydrophobicContact CD2-CG2 4.32Å; F110-I130 HydrophobicContact CE2-CG2 4.07Å; F110-S131 PolarHBondContact N-O 2.86Å; F110-F132 HydrophobicContact CB-CB 4.09Å; F110-F132 WeakPolarHBondContact O-CA 3.32Å; F110-W133 PolarHBondContact O-N 2.89Å
111	S	96.9	Very high	94.5	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.188	C	C	.	.	S	Bend	trans	-77.7	-11.7	172.5	72	0	0	0	0	114	S47 E51 T69 G70 W133	S47-S111 PolarHBondContact OG-N 3.13Å; E51-S111 VanDerWaalsContact OE2-CB 3.25Å; E51-S111 WeakPolarHBondContact OE2-CB 3.28Å; E51-S111 PolarHBondContact OE2-OG 2.68Å; T69-S111 WeakPolarHBondContact CA-OG 3.09Å; G70-S111 PolarHBondContact N-OG 3.35Å; G70-S111 PolarHBondContact O-N 3.22Å; S111-W133 VanDerWaalsContact O-CB 3.25Å; S111-W133 WeakPolarHBondContact O-CB 3.41Å
112	R	94.1	Very high	94.6	Very high	4 Å²	4	27.9 Å²	27.9	2%	0.015	15%	0.153	C	C	.	.	S	Bend	trans	-149.2	157	175.9	-57.1	-173.7	-178.7	-79.1	-12	109.4	E51 G68 T69 F110 P114 D136 E138 Q236	E51-R112 IonicContact OE1-CZ 3.26Å; E51-R112 IonicContact OE1-NE 3.52Å; E51-R112 PolarHBondContact OE1-NE 2.96Å; E51-R112 IonicContact OE1-NH2 2.8Å; E51-R112 PolarHBondContact OE1-NH2 3.36Å; E51-R112 IonicContact OE2-CZ 3.52Å; E51-R112 IonicContact OE2-NE 3.71Å; E51-R112 PolarHBondContact OE2-NE 2.97Å; E51-R112 IonicContact OE2-NH2 2.77Å; G68-R112 WeakPolarHBondContact O-CD 3.43Å; G68-R112 PolarHBondContact O-NE 2.88Å; G68-R112 VanDerWaalsContact O-NE 3.16Å; T69-R112 HydrophobicContact CG2-CB 4.08Å; F110-R112 VanDerWaalsContact C-N 3.29Å; F110-R112 WeakPolarHBondContact CB-O 3.19Å; R112-P114 WeakPolarHBondContact O-CD 3.38Å; R112-D136 PolarHBondContact NH1-O 3.22Å; R112-E138 HydrophobicContact CB-CB 4.43Å; R112-Q236 PolarHBondContact NH2-O 2.99Å
113	R	91.8	Very high	94.6	Very high	12 Å²	12	22.8 Å²	22.8	5%	0.045	13%	0.132	C	C	.	.	P	Polyproline II helix	trans	-64.4	123.3	170.4	162	178.6	168.3	138.5	-12.3	109.3	F132 P137 E138 E171 M252	R113-F132 HydrophobicContact CB-CD1 4.36Å; R113-F132 HydrophobicContact CB-CD2 3.91Å; R113-F132 HydrophobicContact CB-CE2 4.18Å; R113-F132 HydrophobicContact CB-CG 4.02Å; R113-P137 HydrophobicContact CB-CB 4.13Å; R113-E138 VanDerWaalsContact O-CB 3.25Å; R113-E138 WeakPolarHBondContact O-CB 3.21Å; R113-E138 PolarHBondContact O-N 3.31Å; R113-E171 IonicContact CZ-OE1 3.13Å; R113-E171 VanDerWaalsContact CZ-OE1 3.26Å; R113-E171 IonicContact NH1-OE1 3.27Å; R113-E171 PolarHBondContact NH1-OE1 2.84Å; R113-E171 IonicContact NH2-OE1 2.66Å; R113-E171 PolarHBondContact NH2-OE1 2.57Å; R113-M252 HydrophobicContact CB-CE 3.81Å; R113-M252 HydrophobicContact CG-CE 4.41Å; R113-M252 PolarHBondContact NH1-O 3.49Å
114	P	92.2	Very high	94.5	Very high	6 Å²	6	29.7 Å²	29.7	4%	0.039	17%	0.169	C	C	.	.	P	Polyproline II helix	trans	-71.6	157.3	-177.8	29.5	-35.7	0	0	0	112.4	F110 R112 C118 E138	F110-P114 HydrophobicContact CD1-CB 4.36Å; F110-P114 HydrophobicContact CD1-CG 4.48Å; F110-P114 HydrophobicContact CD2-CG 4.46Å; F110-P114 HydrophobicContact CE1-CB 4.09Å; F110-P114 HydrophobicContact CE1-CG 4.3Å; F110-P114 HydrophobicContact CE2-CG 4.28Å; F110-P114 HydrophobicContact CZ-CB 4.38Å; F110-P114 HydrophobicContact CZ-CG 4.2Å; R112-P114 WeakPolarHBondContact O-CD 3.38Å; P114-C118 HydrophobicContact CB-CB 3.99Å; P114-E138 WeakPolarHBondContact CA-OE2 3.3Å
115	C	88.7	Confident	94.5	Very high	11 Å²	11	28 Å²	28	7%	0.074	16%	0.155	C	C	.	.	P	Polyproline II helix	trans	-64.8	163.9	175.5	74.5	0	0	0	0	113.2	T117 C118 L119 E138 I139	C115-T117 VanDerWaalsContact C-N 3.28Å; C115-T117 PolarHBondContact O-N 3.33Å; C115-C118 PolarHBondContact O-N 2.81Å; C115-C118 PolarHBondContact SG-N 3.28Å; C115-C118 VanDerWaalsContact SG-N 3.44Å; C115-C118 PolarHBondContact SG-SG 2.65Å; C115-L119 WeakPolarHBondContact O-CB 3.49Å; C115-L119 PolarHBondContact O-N 2.67Å; C115-E138 PolarHBondContact N-OE2 3.49Å; C115-I139 HydrophobicContact CB-CD1 3.59Å; C115-I139 HydrophobicContact CB-CG1 4.04Å
116	A	88.2	Confident	94.4	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-65.7	-30.8	-175.9	0	0	0	0	0	112.8	L119 K120 D166 A169 V170	A116-L119 PolarHBondContact O-N 2.78Å; A116-K120 WeakPolarHBondContact O-CB 3.35Å; A116-K120 WeakPolarHBondContact O-CD 3.38Å; A116-K120 WeakPolarHBondContact O-CG 3.42Å; A116-K120 PolarHBondContact O-N 3.39Å; A116-D166 HydrophobicContact CB-CB 4.37Å; A116-D166 WeakPolarHBondContact CB-OD1 3.46Å; A116-D166 VanDerWaalsContact CB-OD2 3.24Å; A116-D166 WeakPolarHBondContact CB-OD2 3.3Å; A116-D166 PolarHBondContact N-OD2 3.02Å; A116-A169 HydrophobicContact CB-CB 3.94Å; A116-V170 HydrophobicContact CB-CG2 3.71Å
117	T	90.4	Very high	94.3	Very high	68 Å²	68	28.3 Å²	28.3	42%	0.417	16%	0.157	S	C	.	.	H	α-helix	trans	-63.1	-52.7	174.4	-65	0	0	0	0	111.1	C115 L119 K120 M121	C115-T117 VanDerWaalsContact C-N 3.28Å; C115-T117 PolarHBondContact O-N 3.33Å; T117-L119 VanDerWaalsContact C-N 3.25Å; T117-L119 PolarHBondContact O-N 2.95Å; T117-K120 PolarHBondContact O-N 2.77Å; T117-M121 HydrophobicContact CG2-SD 4.25Å; T117-M121 WeakPolarHBondContact O-CG 3.44Å; T117-M121 PolarHBondContact O-N 2.8Å
118	C	93.5	Very high	94.2	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-54.4	-44.3	172.8	-75.5	0	0	0	0	111.6	H90 A92 P114 C115 M121 I122	H90-C118 WeakPolarHBondContact CB-SG 3.5Å; H90-C118 VanDerWaalsContact CG-SG 3.57Å; A92-C118 HydrophobicContact CB-CB 3.7Å; P114-C118 HydrophobicContact CB-CB 3.99Å; C115-C118 PolarHBondContact O-N 2.81Å; C115-C118 PolarHBondContact SG-N 3.28Å; C115-C118 VanDerWaalsContact SG-N 3.44Å; C115-C118 PolarHBondContact SG-SG 2.65Å; C118-M121 PolarHBondContact O-N 3.49Å; C118-I122 WeakPolarHBondContact O-CG1 3.39Å; C118-I122 PolarHBondContact O-N 2.87Å; C118-I122 VanDerWaalsContact O-N 3.07Å
119	L	93.4	Very high	94.1	Very high	4 Å²	4	29.6 Å²	29.6	2%	0.021	17%	0.169	C	C	.	.	H	α-helix	trans	-64.9	-44.9	-178.1	-173.5	58.1	0	0	0	113	C115 A116 T117 M121 I122 I123 I130 V170 L173 I181	C115-L119 WeakPolarHBondContact O-CB 3.49Å; C115-L119 PolarHBondContact O-N 2.67Å; A116-L119 PolarHBondContact O-N 2.78Å; T117-L119 VanDerWaalsContact C-N 3.25Å; T117-L119 PolarHBondContact O-N 2.95Å; L119-M121 VanDerWaalsContact C-N 3.27Å; L119-M121 PolarHBondContact O-N 3.06Å; L119-I122 HydrophobicContact CD1-CD1 3.97Å; L119-I122 HydrophobicContact CD1-CG1 4.13Å; L119-I122 WeakPolarHBondContact O-CG1 3.37Å; L119-I122 PolarHBondContact O-N 3.19Å; L119-I123 HydrophobicContact CD1-CD1 3.88Å; L119-I123 HydrophobicContact CD1-CG1 4.15Å; L119-I123 HydrophobicContact CD2-CD1 4.44Å; L119-I123 HydrophobicContact CG-CD1 3.72Å; L119-I123 HydrophobicContact CG-CG1 4.44Å; L119-I123 WeakPolarHBondContact O-CB 3.44Å; L119-I123 WeakPolarHBondContact O-CD1 3.25Å; L119-I123 VanDerWaalsContact O-CG1 3.24Å; L119-I123 WeakPolarHBondContact O-CG1 3.43Å; L119-I123 PolarHBondContact O-N 3.09Å; L119-I130 HydrophobicContact CD1-CD1 3.67Å; L119-I130 HydrophobicContact CD1-CG2 4.48Å; L119-V170 HydrophobicContact CD2-CB 4.15Å; L119-V170 HydrophobicContact CD2-CG1 3.6Å; L119-V170 HydrophobicContact CD2-CG2 3.97Å; L119-L173 HydrophobicContact CB-CD1 4.44Å; L119-L173 HydrophobicContact CD2-CB 4.11Å; L119-L173 HydrophobicContact CD2-CD1 4.15Å; L119-L173 HydrophobicContact CG-CD1 4.25Å; L119-I181 HydrophobicContact CD1-CD1 3.94Å; L119-I181 HydrophobicContact CD2-CD1 4.27Å
120	K	92.6	Very high	94	Very high	100 Å²	100	29.2 Å²	29.2	44%	0.435	17%	0.167	S	C	.	.	H	α-helix	trans	-54.1	-45.7	173.8	-73.8	162.2	-171.9	164.1	0	110.9	A116 T117 N124 L173	A116-K120 WeakPolarHBondContact O-CB 3.35Å; A116-K120 WeakPolarHBondContact O-CD 3.38Å; A116-K120 WeakPolarHBondContact O-CG 3.42Å; A116-K120 PolarHBondContact O-N 3.39Å; T117-K120 PolarHBondContact O-N 2.77Å; K120-N124 WeakPolarHBondContact O-CB 3.23Å; K120-N124 PolarHBondContact O-N 3.01Å; K120-L173 HydrophobicContact CG-CD1 3.62Å; K120-L173 HydrophobicContact CG-CD2 3.99Å; K120-L173 HydrophobicContact CG-CG 4.45Å
121	M	95.1	Very high	93.9	Very high	74 Å²	74	29.2 Å²	29.2	37%	0.365	17%	0.168	S	C	.	.	H	α-helix	trans	-70.9	-40.9	-175.2	-58.9	170.1	69.4	0	0	112.7	Q93 I96 T117 C118 L119 N124 A125	Q93-M121 HydrophobicContact CG-CE 4.48Å; Q93-M121 HydrophobicContact CG-SD 4.22Å; I96-M121 HydrophobicContact CD1-CB 3.4Å; I96-M121 VanDerWaalsContact CD1-CB 3.4Å; I96-M121 HydrophobicContact CD1-CE 4.19Å; I96-M121 HydrophobicContact CG2-CE 4.47Å; T117-M121 HydrophobicContact CG2-SD 4.25Å; T117-M121 WeakPolarHBondContact O-CG 3.44Å; T117-M121 PolarHBondContact O-N 2.8Å; C118-M121 PolarHBondContact O-N 3.49Å; L119-M121 VanDerWaalsContact C-N 3.27Å; L119-M121 PolarHBondContact O-N 3.06Å; M121-N124 PolarHBondContact O-N 3.47Å; M121-A125 WeakPolarHBondContact O-CB 3.46Å; M121-A125 PolarHBondContact O-N 3.4Å
122	I	95.6	Very high	93.9	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-72.5	-31.6	177.5	61.9	-172.8	0	0	0	112.8	A92 I96 L108 F110 C118 L119 A125 V127 I130	A92-I122 HydrophobicContact CB-CG2 3.98Å; I96-I122 HydrophobicContact CD1-CG2 3.68Å; I96-I122 HydrophobicContact CG1-CG2 4.18Å; L108-I122 HydrophobicContact CD1-CB 4.03Å; L108-I122 HydrophobicContact CD1-CD1 4.02Å; L108-I122 HydrophobicContact CD1-CG2 3.96Å; F110-I122 HydrophobicContact CE2-CD1 3.91Å; F110-I122 HydrophobicContact CZ-CD1 3.79Å; C118-I122 WeakPolarHBondContact O-CG1 3.39Å; C118-I122 PolarHBondContact O-N 2.87Å; C118-I122 VanDerWaalsContact O-N 3.07Å; L119-I122 HydrophobicContact CD1-CD1 3.97Å; L119-I122 HydrophobicContact CD1-CG1 4.13Å; L119-I122 WeakPolarHBondContact O-CG1 3.37Å; L119-I122 PolarHBondContact O-N 3.19Å; I122-A125 PolarHBondContact O-N 2.93Å; I122-V127 HydrophobicContact CB-CG2 4.29Å; I122-V127 WeakPolarHBondContact O-CB 3.34Å; I122-V127 VanDerWaalsContact O-CG2 3.31Å; I122-V127 WeakPolarHBondContact O-CG2 3.39Å; I122-I130 HydrophobicContact CD1-CD1 3.76Å; I122-I130 HydrophobicContact CD1-CG1 4.2Å; I122-I130 HydrophobicContact CD1-CG2 4.23Å; I122-I130 HydrophobicContact CG1-CD1 3.79Å
123	I	94.4	Very high	94	Very high	32 Å²	32	29.8 Å²	29.8	16%	0.164	17%	0.17	C	C	.	.	H	α-helix	trans	-63.4	-47.2	169.5	-69.9	166	0	0	0	110	L119 A125 G126 I130 L173 P179 I181	L119-I123 HydrophobicContact CD1-CD1 3.88Å; L119-I123 HydrophobicContact CD1-CG1 4.15Å; L119-I123 HydrophobicContact CD2-CD1 4.44Å; L119-I123 HydrophobicContact CG-CD1 3.72Å; L119-I123 HydrophobicContact CG-CG1 4.44Å; L119-I123 WeakPolarHBondContact O-CB 3.44Å; L119-I123 WeakPolarHBondContact O-CD1 3.25Å; L119-I123 VanDerWaalsContact O-CG1 3.24Å; L119-I123 WeakPolarHBondContact O-CG1 3.43Å; L119-I123 PolarHBondContact O-N 3.09Å; I123-A125 PolarHBondContact O-N 3.4Å; I123-G126 PolarHBondContact O-N 3.43Å; I123-G126 VanDerWaalsContact O-N 3.07Å; I123-I130 HydrophobicContact CG1-CD1 4.08Å; I123-L173 HydrophobicContact CD1-CB 3.83Å; I123-L173 HydrophobicContact CD1-CD2 4.06Å; I123-L173 HydrophobicContact CD1-CG 4.4Å; I123-P179 HydrophobicContact CB-CG 4.47Å; I123-P179 HydrophobicContact CG1-CG 4.11Å; I123-P179 HydrophobicContact CG2-CG 4.37Å; I123-I181 HydrophobicContact CD1-CD1 4.3Å
124	N	94.4	Very high	94.1	Very high	147 Å²	147	29.2 Å²	29.2	79%	0.786	17%	0.168	S	C	*	.	H	α-helix	trans	-62.8	-28	177.4	-174	76.9	0	0	0	112.9	K120 M121 G126	K120-N124 WeakPolarHBondContact O-CB 3.23Å; K120-N124 PolarHBondContact O-N 3.01Å; M121-N124 PolarHBondContact O-N 3.47Å; N124-G126 PolarHBondContact O-N 3.42Å
125	A	95.7	Very high	94	Very high	20 Å²	20	29 Å²	29	17%	0.165	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-0.6	175.1	0	0	0	0	0	114.5	L103 A104 M121 I122 I123	L103-A125 HydrophobicContact CB-CB 3.98Å; L103-A125 HydrophobicContact CD1-CB 4.1Å; A104-A125 WeakPolarHBondContact CA-O 3.43Å; A104-A125 PolarHBondContact N-O 2.78Å; M121-A125 WeakPolarHBondContact O-CB 3.46Å; M121-A125 PolarHBondContact O-N 3.4Å; I122-A125 PolarHBondContact O-N 2.93Å; I123-A125 PolarHBondContact O-N 3.4Å
126	G	94.8	Very high	93.8	Very high	40 Å²	40	28.7 Å²	28.7	41%	0.412	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.5	20.7	172.7	0	0	0	0	0	115.5	A104 G105 I123 N124	A104-G126 WeakPolarHBondContact CA-O 3.2Å; G105-G126 PolarHBondContact N-O 3.39Å; I123-G126 PolarHBondContact O-N 3.43Å; I123-G126 VanDerWaalsContact O-N 3.07Å; N124-G126 PolarHBondContact O-N 3.42Å
127	V	96.4	Very high	93.6	Very high	5 Å²	5	28.9 Å²	28.9	3%	0.03	17%	0.166	C	C	.	.			trans	-51.8	141.7	173.2	167.7	0	0	0	0	110.9	L103 C106 L108 I122 Q129 I130 P179	L103-V127 HydrophobicContact CB-CG2 4.13Å; C106-V127 WeakPolarHBondContact O-CG1 3.48Å; L108-V127 HydrophobicContact CD1-CG1 4.08Å; L108-V127 HydrophobicContact CD1-CG2 3.9Å; L108-V127 HydrophobicContact CG-CG1 3.87Å; L108-V127 HydrophobicContact CG-CG2 4.19Å; I122-V127 HydrophobicContact CB-CG2 4.29Å; I122-V127 WeakPolarHBondContact O-CB 3.34Å; I122-V127 VanDerWaalsContact O-CG2 3.31Å; I122-V127 WeakPolarHBondContact O-CG2 3.39Å; V127-Q129 WeakPolarHBondContact CG1-O 3.24Å; V127-I130 HydrophobicContact CG1-CD1 4.34Å; V127-I130 HydrophobicContact CG1-CG1 3.64Å; V127-P179 VanDerWaalsContact O-CB 3.28Å; V127-P179 WeakPolarHBondContact O-CB 3.5Å; V127-P179 WeakPolarHBondContact O-CG 3.38Å
128	S	95.2	Very high	93.2	Very high	51 Å²	51	25.7 Å²	25.7	36%	0.357	15%	0.146	S	C	.	.	S	Bend	trans	-87.3	-33	179.9	63.4	0	0	0	0	113.5	G105 C106 P179 H180	G105-S128 WeakPolarHBondContact O-CB 3.33Å; G105-S128 PolarHBondContact O-OG 2.79Å; C106-S128 PolarHBondContact O-N 2.88Å; C106-S128 PolarHBondContact O-OG 3.14Å; S128-P179 WeakPolarHBondContact O-CA 3.42Å; S128-H180 PolarHBondContact O-N 3.01Å
129	Q	96	Very high	92.6	Very high	37 Å²	37	27.9 Å²	27.9	17%	0.173	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	139	-176.7	-174.8	176.8	73.7	0	0	110.9	C106 Q107 L108 V127 H180	C106-Q129 PolarHBondContact O-N 3.44Å; Q107-Q129 WeakPolarHBondContact CA-O 3.33Å; Q107-Q129 HydrophobicContact CB-CB 4.27Å; Q107-Q129 HydrophobicContact CG-CB 4.05Å; L108-Q129 PolarHBondContact N-O 3.1Å; V127-Q129 WeakPolarHBondContact CG1-O 3.24Å; Q129-H180 WeakPolarHBondContact CA-O 3.45Å
130	I	96.5	Very high	91.7	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	108.8	177.8	-60.6	167.9	0	0	0	107.2	F110 L119 I122 I123 V127 P179 H180 I181 C182	F110-I130 HydrophobicContact CD2-CG2 4.32Å; F110-I130 HydrophobicContact CE2-CG2 4.07Å; L119-I130 HydrophobicContact CD1-CD1 3.67Å; L119-I130 HydrophobicContact CD1-CG2 4.48Å; I122-I130 HydrophobicContact CD1-CD1 3.76Å; I122-I130 HydrophobicContact CD1-CG1 4.2Å; I122-I130 HydrophobicContact CD1-CG2 4.23Å; I122-I130 HydrophobicContact CG1-CD1 3.79Å; I123-I130 HydrophobicContact CG1-CD1 4.08Å; V127-I130 HydrophobicContact CG1-CD1 4.34Å; V127-I130 HydrophobicContact CG1-CG1 3.64Å; I130-P179 HydrophobicContact CD1-CB 4.1Å; I130-P179 HydrophobicContact CG1-CB 4.35Å; I130-H180 PolarHBondContact N-O 2.83Å; I130-I181 HydrophobicContact CB-CG1 4.26Å; I130-I181 HydrophobicContact CB-CG2 4.46Å; I130-I181 HydrophobicContact CD1-CD1 4.28Å; I130-I181 HydrophobicContact CD1-CG1 4.27Å; I130-I181 HydrophobicContact CG2-CG2 4.46Å; I130-I181 VanDerWaalsContact O-CA 3.31Å; I130-I181 WeakPolarHBondContact O-CA 3.35Å; I130-C182 PolarHBondContact O-N 3.32Å
131	S	96.3	Very high	90.4	Very high	3 Å²	3	24.8 Å²	24.8	2%	0.021	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	144.8	177.8	68.4	0	0	0	0	111.2	L108 Y109 F110 C182	L108-S131 PolarHBondContact O-N 2.97Å; L108-S131 PolarHBondContact O-OG 3.21Å; Y109-S131 WeakPolarHBondContact CA-O 3.48Å; Y109-S131 WeakPolarHBondContact CD1-OG 3.48Å; Y109-S131 WeakPolarHBondContact CE1-OG 3.31Å; F110-S131 PolarHBondContact N-O 2.86Å; S131-C182 VanDerWaalsContact CA-O 3.3Å; S131-C182 WeakPolarHBondContact CA-O 3.41Å
132	F	96	Very high	88.7	Confident	13 Å²	13	24 Å²	24	6%	0.057	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	153.1	179.6	56.7	-99	0	0	0	111.9	F110 R113 I181 C182 V183 M252 L254	F110-F132 HydrophobicContact CB-CB 4.09Å; F110-F132 WeakPolarHBondContact O-CA 3.32Å; R113-F132 HydrophobicContact CB-CD1 4.36Å; R113-F132 HydrophobicContact CB-CD2 3.91Å; R113-F132 HydrophobicContact CB-CE2 4.18Å; R113-F132 HydrophobicContact CB-CG 4.02Å; F132-I181 HydrophobicContact CE1-CG2 4Å; F132-C182 PolarHBondContact N-O 3Å; F132-V183 HydrophobicContact CD2-CG2 4.23Å; F132-V183 HydrophobicContact CE2-CG2 3.66Å; F132-V183 HydrophobicContact CZ-CG2 4.13Å; F132-M252 HydrophobicContact CD2-CE 4.03Å; F132-M252 HydrophobicContact CE2-CE 3.43Å; F132-M252 VanDerWaalsContact CE2-CE 3.43Å; F132-M252 HydrophobicContact CZ-CE 4.22Å; F132-L254 HydrophobicContact CE2-CD1 3.94Å; F132-L254 HydrophobicContact CZ-CD1 4.12Å
133	W	96.3	Very high	86.9	Confident	2 Å²	2	30.3 Å²	30.3	1%	0.008	17%	0.168	C	C	.	.			trans	-64.6	131.9	169.5	-177.8	-107.9	0	0	0	111.1	T44 L48 F110 S111 G135 L185 F237 L238 M270 L273 V274	T44-W133 HydrophobicContact CG2-CE3 3.6Å; T44-W133 HydrophobicContact CG2-CZ3 3.86Å; L48-W133 HydrophobicContact CD1-CD2 4.34Å; L48-W133 HydrophobicContact CD1-CE3 3.99Å; L48-W133 HydrophobicContact CD1-CH2 3.92Å; L48-W133 HydrophobicContact CD1-CZ2 4.31Å; L48-W133 HydrophobicContact CD1-CZ3 3.78Å; L48-W133 HydrophobicContact CD2-CB 4.47Å; L48-W133 HydrophobicContact CD2-CD2 3.87Å; L48-W133 HydrophobicContact CD2-CE3 4.29Å; L48-W133 HydrophobicContact CD2-CG 3.98Å; L48-W133 HydrophobicContact CD2-CZ2 4.47Å; F110-W133 PolarHBondContact O-N 2.89Å; S111-W133 VanDerWaalsContact O-CB 3.25Å; S111-W133 WeakPolarHBondContact O-CB 3.41Å; W133-G135 PolarHBondContact O-N 3.48Å; W133-L185 HydrophobicContact CE3-CD2 3.84Å; W133-L185 HydrophobicContact CZ3-CD1 4.47Å; W133-L185 HydrophobicContact CZ3-CD2 3.78Å; W133-F237 HydrophobicContact CZ2-CB 4.21Å; W133-F237 PolarHBondContact NE1-O 2.9Å; W133-L238 HydrophobicContact CZ2-CD2 4.04Å; W133-M270 HydrophobicContact CD2-CE 4.3Å; W133-M270 HydrophobicContact CH2-CB 3.65Å; W133-M270 HydrophobicContact CH2-CG 3.84Å; W133-M270 WeakPolarHBondContact CH2-O 3.37Å; W133-M270 HydrophobicContact CZ2-CB 3.74Å; W133-M270 HydrophobicContact CZ2-CE 3.76Å; W133-M270 HydrophobicContact CZ2-CG 3.9Å; W133-M270 HydrophobicContact CZ3-CB 4.43Å; W133-M270 HydrophobicContact CZ3-CG 4.21Å; W133-L273 HydrophobicContact CH2-CB 4.28Å; W133-L273 HydrophobicContact CZ3-CB 4.35Å; W133-L273 HydrophobicContact CZ3-CD1 4.01Å; W133-V274 HydrophobicContact CH2-CG2 4.21Å; W133-V274 HydrophobicContact CZ2-CG2 4.1Å
134	P	93.6	Very high	84.8	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.169	C	C	.	.	S	Bend	trans	-81.8	59.6	-178.8	35.1	-34.7	0	0	0	111	V183 L185 H245 L249 L266 M270	P134-V183 HydrophobicContact CB-CG1 3.99Å; P134-V183 HydrophobicContact CB-CG2 4.09Å; P134-V183 HydrophobicContact CG-CG1 3.77Å; P134-L185 HydrophobicContact CG-CD1 3.71Å; P134-H245 PolarHBondContact O-NE2 2.86Å; P134-H245 VanDerWaalsContact O-NE2 3.09Å; P134-L249 HydrophobicContact CB-CD2 4.16Å; P134-L266 HydrophobicContact CB-CD2 4.3Å; P134-L266 HydrophobicContact CG-CD1 4.06Å; P134-L266 HydrophobicContact CG-CD2 4.26Å; P134-L266 HydrophobicContact CG-CG 4.25Å; P134-M270 HydrophobicContact CG-CE 4.04Å; P134-M270 HydrophobicContact CG-CG 4.25Å; P134-M270 HydrophobicContact CG-SD 3.78Å; P134-M270 WeakPolarHBondContact O-CE 3.08Å
135	G	90.4	Very high	82.6	Confident	1 Å²	1	27.8 Å²	27.8	1%	0.01	15%	0.154	C	C	.	.	S	Bend	trans	-114.6	-168.4	172.9	0	0	0	0	0	111.9	W133	W133-G135 PolarHBondContact O-N 3.48Å
136	D	85.8	Confident	80.4	Confident	5 Å²	5	31.4 Å²	31.4	3%	0.027	18%	0.179	C	C	.	.	S	Bend	trans	-59.3	124.4	172.6	-179.8	51.3	0	0	0	110.7	R67 R112 S140 M141 L142 I248	R67-D136 VanDerWaalsContact CD-OD2 3.24Å; R67-D136 WeakPolarHBondContact CD-OD2 3.48Å; R67-D136 IonicContact CZ-OD2 2.96Å; R67-D136 IonicContact NE-OD2 3.82Å; R67-D136 IonicContact NH1-OD2 2.72Å; R67-D136 PolarHBondContact NH1-OD2 3.19Å; R112-D136 PolarHBondContact NH1-O 3.22Å; D136-S140 PolarHBondContact OD1-OG 3.44Å; D136-S140 WeakPolarHBondContact OD2-CB 3.4Å; D136-S140 PolarHBondContact OD2-OG 3.37Å; D136-M141 PolarHBondContact OD1-N 2.99Å; D136-M141 VanDerWaalsContact OD1-N 3.1Å; D136-L142 HydrophobicContact CB-CD1 4.25Å; D136-I248 HydrophobicContact CB-CD1 4.25Å
137	P	82.9	Confident	78.1	Confident	5 Å²	5	32.3 Å²	32.3	3%	0.032	18%	0.179	C	C	.	.			trans	-63.5	173.5	-172	16.6	-27.4	0	0	0	115.6	R113 I139 M141 M252	R113-P137 HydrophobicContact CB-CB 4.13Å; P137-I139 VanDerWaalsContact C-N 3.28Å; P137-I139 WeakPolarHBondContact CG-O 3.41Å; P137-I139 PolarHBondContact O-N 3.28Å; P137-M141 HydrophobicContact CG-CE 4.1Å; P137-M141 HydrophobicContact CG-CG 3.8Å; P137-M141 HydrophobicContact CG-SD 3.63Å; P137-M252 HydrophobicContact CG-SD 4.5Å
138	E	82.6	Confident	75.7	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.207	C	C	.	.	S	Bend	trans	-59.5	-37.5	178	-177	172	-126.9	0	0	112	I66 R67 T69 S85 H90 R112 R113 P114 C115	I66-E138 CarbonylContact C-O 3.53Å; I66-E138 WeakPolarHBondContact CA-O 3.25Å; I66-E138 HydrophobicContact CG2-CG 3.82Å; R67-E138 PolarHBondContact N-O 2.79Å; T69-E138 WeakPolarHBondContact OG1-CG 3.43Å; T69-E138 PolarHBondContact OG1-OE1 3.38Å; S85-E138 PolarHBondContact OG-OE1 2.69Å; H90-E138 IonicContact CE1-OE2 3.22Å; H90-E138 IonicContact CG-OE1 3.66Å; H90-E138 IonicContact ND1-OE1 3.63Å; H90-E138 PolarHBondContact ND1-OE1 2.95Å; H90-E138 IonicContact ND1-OE2 2.73Å; H90-E138 PolarHBondContact ND1-OE2 3.16Å; R112-E138 HydrophobicContact CB-CB 4.43Å; R113-E138 VanDerWaalsContact O-CB 3.25Å; R113-E138 WeakPolarHBondContact O-CB 3.21Å; R113-E138 PolarHBondContact O-N 3.31Å; P114-E138 WeakPolarHBondContact CA-OE2 3.3Å; C115-E138 PolarHBondContact N-OE2 3.49Å
139	I	80.3	Confident	73.2	Confident	46 Å²	46	42.9 Å²	42.9	24%	0.236	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-96	108.4	164.1	-61.7	175.9	0	0	0	106.9	C115 P137 M141 V163	C115-I139 HydrophobicContact CB-CD1 3.59Å; C115-I139 HydrophobicContact CB-CG1 4.04Å; P137-I139 VanDerWaalsContact C-N 3.28Å; P137-I139 WeakPolarHBondContact CG-O 3.41Å; P137-I139 PolarHBondContact O-N 3.28Å; I139-M141 PolarHBondContact O-N 3.01Å; I139-V163 HydrophobicContact CG2-CG2 3.94Å
140	S	74.1	Confident	70.7	Confident	21 Å²	21	46.6 Å²	46.6	15%	0.147	25%	0.254	C	S	.	.			trans	-68.5	120.2	-167.8	-174.8	0	0	0	0	112.8	D136	D136-S140 PolarHBondContact OD1-OG 3.44Å; D136-S140 WeakPolarHBondContact OD2-CB 3.4Å; D136-S140 PolarHBondContact OD2-OG 3.37Å
141	M	65.6	Low	68.2	Low	19 Å²	19	54.7 Å²	54.7	9%	0.094	30%	0.298	C	S	.	.	H	α-helix	trans	-74	-34.1	178.7	-75.4	168.7	168.4	0	0	111.6	D136 P137 I139 R143 S144 Q251 M252	D136-M141 PolarHBondContact OD1-N 2.99Å; D136-M141 VanDerWaalsContact OD1-N 3.1Å; P137-M141 HydrophobicContact CG-CE 4.1Å; P137-M141 HydrophobicContact CG-CG 3.8Å; P137-M141 HydrophobicContact CG-SD 3.63Å; I139-M141 PolarHBondContact O-N 3.01Å; M141-R143 VanDerWaalsContact C-N 3.29Å; M141-R143 PolarHBondContact O-N 3.49Å; M141-S144 WeakPolarHBondContact O-CB 3.31Å; M141-S144 PolarHBondContact O-N 3.29Å; M141-S144 VanDerWaalsContact O-N 3.16Å; M141-Q251 HydrophobicContact CE-CB 3.86Å; M141-Q251 HydrophobicContact SD-CB 3.66Å; M141-Q251 PolarHBondContact SD-OE1 3.16Å; M141-M252 HydrophobicContact CE-CG 4.15Å; M141-M252 HydrophobicContact SD-CG 4.18Å
142	L	59.4	Low	65.7	Low	57 Å²	57	57.6 Å²	57.6	30%	0.298	32%	0.322	S	S	.	.	H	α-helix	trans	-59.6	-37.1	-178.8	-68.4	171	0	0	0	112.8	D136 S144 M145 I248	D136-L142 HydrophobicContact CB-CD1 4.25Å; L142-S144 VanDerWaalsContact C-N 3.27Å; L142-S144 PolarHBondContact O-N 2.68Å; L142-M145 PolarHBondContact O-N 3.1Å; L142-I248 HydrophobicContact CD1-CD1 4.19Å; L142-I248 HydrophobicContact CD2-CD1 4.05Å; L142-I248 HydrophobicContact CG-CD1 4.02Å
143	R	58.3	Low	63.5	Low	133 Å²	133	59.8 Å²	59.8	50%	0.502	34%	0.339	S	S	.	.	H	α-helix	trans	-66.5	-27.8	-179.2	-161.6	172.7	-173.3	170.3	1.4	112.6	E62 S64 M141	E62-R143 PolarHBondContact O-NH2 2.65Å; S64-R143 PolarHBondContact O-NH1 2.95Å; M141-R143 VanDerWaalsContact C-N 3.29Å; M141-R143 PolarHBondContact O-N 3.49Å
144	S	51.2	Low	61.4	Low	28 Å²	28	64.6 Å²	64.6	20%	0.196	37%	0.373	C	S	.	.	H	α-helix	trans	-74.1	-23	177.2	-170.1	0	0	0	0	113.6	M141 L142 S147	M141-S144 WeakPolarHBondContact O-CB 3.31Å; M141-S144 PolarHBondContact O-N 3.29Å; M141-S144 VanDerWaalsContact O-N 3.16Å; L142-S144 VanDerWaalsContact C-N 3.27Å; L142-S144 PolarHBondContact O-N 2.68Å; S144-S147 PolarHBondContact O-OG 3.32Å; S144-S147 VanDerWaalsContact O-OG 3.09Å
145	M	48.3	Very low	59.4	Low	97 Å²	97	69 Å²	69	48%	0.478	40%	0.4	S	S	.	.	H	α-helix	trans	-83.7	-32.1	-179.3	-62.7	-169.8	74.3	0	0	111.8	L142 S147 T148	L142-M145 PolarHBondContact O-N 3.1Å; M145-S147 VanDerWaalsContact C-N 3.32Å; M145-S147 PolarHBondContact O-N 3.23Å; M145-T148 PolarHBondContact O-OG1 2.76Å
146	S	47.5	Very low	57.6	Low	97 Å²	97	71.3 Å²	71.3	68%	0.678	42%	0.416	S	S	*	.	H	α-helix	trans	-70.2	-20.9	178.9	-55.3	0	0	0	0	114.7	T148	S146-T148 VanDerWaalsContact C-N 3.28Å; S146-T148 PolarHBondContact O-N 3.19Å
147	S	47.7	Very low	56.1	Low	58 Å²	58	76.5 Å²	76.5	41%	0.406	44%	0.443	S	S	.	.	G	3₁₀ helix	trans	-80.1	-1	-177.3	50.4	0	0	0	0	114.9	S144 M145 Q149	S144-S147 PolarHBondContact O-OG 3.32Å; S144-S147 VanDerWaalsContact O-OG 3.09Å; M145-S147 VanDerWaalsContact C-N 3.32Å; M145-S147 PolarHBondContact O-N 3.23Å; S147-Q149 VanDerWaalsContact C-N 3.34Å; S147-Q149 PolarHBondContact O-N 2.74Å
148	T	45.9	Very low	54.8	Low	104 Å²	104	79 Å²	79	64%	0.638	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-81.9	-4	-173.9	53.7	0	0	0	0	115	M145 S146	M145-T148 PolarHBondContact O-OG1 2.76Å; S146-T148 VanDerWaalsContact C-N 3.28Å; S146-T148 PolarHBondContact O-N 3.19Å
149	Q	43.6	Very low	53.7	Low	175 Å²	175	81 Å²	81	82%	0.818	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-112.9	-3.3	-173.1	-65.7	-167.8	-2.2	0	0	115.9	S147	S147-Q149 VanDerWaalsContact C-N 3.34Å; S147-Q149 PolarHBondContact O-N 2.74Å
150	T	42.3	Very low	52.9	Low	114 Å²	114	83 Å²	83	70%	0.699	48%	0.482	S	S	*	.	S	Bend	trans	-139.8	114.6	176.3	46.6	0	0	0	0	112.5	A152	T150-A152 PolarHBondContact O-N 3.12Å
151	N	44.8	Very low	52.6	Low	171 Å²	171	88.2 Å²	88.2	91%	0.914	50%	0.504	S	S	*	.			trans	19.5	80.3	166.9	-65.5	-1.6	0	0	0	116.2	S153	N151-S153 PolarHBondContact O-N 3.09Å
152	A	42.6	Very low	52.8	Low	64 Å²	64	92.2 Å²	92.2	53%	0.529	53%	0.526	S	S	.	.			trans	-58.8	122.7	178.1	0	0	0	0	0	111.9	T150	T150-A152 PolarHBondContact O-N 3.12Å
153	S	51.3	Low	53.3	Low	59 Å²	59	91.1 Å²	91.1	41%	0.413	52%	0.522	S	S	.	.			trans	-73.7	159.4	165.5	71.8	0	0	0	0	110.4	N151 T155 S156	N151-S153 PolarHBondContact O-N 3.09Å; S153-T155 PolarHBondContact O-N 2.77Å; S153-S156 PolarHBondContact N-OG 2.79Å; S153-S156 VanDerWaalsContact O-CB 3.24Å; S153-S156 WeakPolarHBondContact O-CB 3.47Å; S153-S156 PolarHBondContact O-N 2.82Å; S153-S156 PolarHBondContact O-OG 3.14Å; S153-S156 PolarHBondContact OG-OG 2.71Å
154	S	51.7	Low	54.1	Low	102 Å²	102	88.8 Å²	88.8	71%	0.713	52%	0.522	S	S	*	.	H	α-helix	trans	-55.8	-38.4	177.8	46	0	0	0	0	112.9	S156 L157	S154-S156 PolarHBondContact O-N 3.25Å; S154-L157 PolarHBondContact O-N 3.06Å
155	T	51.2	Low	55.3	Low	93 Å²	93	92.1 Å²	92.1	57%	0.571	54%	0.537	S	S	*	.	H	α-helix	trans	-60.9	-31.2	175.3	-39.6	0	0	0	0	113	S153 L157 S158 V159	S153-T155 PolarHBondContact O-N 2.77Å; T155-L157 VanDerWaalsContact C-N 3.28Å; T155-L157 PolarHBondContact O-N 3.47Å; T155-S158 PolarHBondContact O-OG 3.01Å; T155-V159 WeakPolarHBondContact O-CG2 3.24Å; T155-V159 PolarHBondContact O-N 3.03Å
156	S	52.4	Low	56.7	Low	50 Å²	50	89.4 Å²	89.4	35%	0.35	52%	0.524	S	S	.	.	H	α-helix	trans	-67.7	-30.7	179.9	-50	0	0	0	0	112.2	S153 S154 M160	S153-S156 PolarHBondContact N-OG 2.79Å; S153-S156 VanDerWaalsContact O-CB 3.24Å; S153-S156 WeakPolarHBondContact O-CB 3.47Å; S153-S156 PolarHBondContact O-N 2.82Å; S153-S156 PolarHBondContact O-OG 3.14Å; S153-S156 PolarHBondContact OG-OG 2.71Å; S154-S156 PolarHBondContact O-N 3.25Å; S156-M160 PolarHBondContact O-N 3.49Å
157	L	53.8	Low	58.1	Low	113 Å²	113	86 Å²	86	59%	0.592	50%	0.502	S	S	*	.	H	α-helix	trans	-77.8	-45.2	-177.6	-68.1	166	0	0	0	111.6	S154 T155 V159 M160 E161	S154-L157 PolarHBondContact O-N 3.06Å; T155-L157 VanDerWaalsContact C-N 3.28Å; T155-L157 PolarHBondContact O-N 3.47Å; L157-V159 VanDerWaalsContact C-N 3.32Å; L157-V159 PolarHBondContact O-N 2.69Å; L157-M160 PolarHBondContact O-N 3.13Å; L157-M160 VanDerWaalsContact O-N 3.14Å; L157-E161 PolarHBondContact O-N 3.32Å; L157-E161 VanDerWaalsContact O-N 3.09Å
158	S	56.9	Low	59.7	Low	57 Å²	57	86.6 Å²	86.6	40%	0.399	50%	0.503	S	S	.	.	H	α-helix	trans	-63.3	-37.7	178.4	59.7	0	0	0	0	112.5	T155 M160 E161 D162	T155-S158 PolarHBondContact O-OG 3.01Å; S158-M160 VanDerWaalsContact C-N 3.31Å; S158-M160 PolarHBondContact O-N 3.03Å; S158-E161 WeakPolarHBondContact O-CB 3.38Å; S158-E161 PolarHBondContact O-N 3.02Å; S158-D162 PolarHBondContact O-N 2.84Å
159	V	59.1	Low	61.4	Low	42 Å²	42	82.7 Å²	82.7	26%	0.255	48%	0.481	S	S	.	.	H	α-helix	trans	-62.5	-37.7	174.9	170.3	0	0	0	0	111.7	T155 L157 V163	T155-V159 WeakPolarHBondContact O-CG2 3.24Å; T155-V159 PolarHBondContact O-N 3.03Å; L157-V159 VanDerWaalsContact C-N 3.32Å; L157-V159 PolarHBondContact O-N 2.69Å; V159-V163 VanDerWaalsContact O-CG2 3.32Å; V159-V163 WeakPolarHBondContact O-CG2 3.47Å; V159-V163 PolarHBondContact O-N 2.87Å
160	M	62.7	Low	63.3	Low	88 Å²	88	74.7 Å²	74.7	43%	0.433	45%	0.445	S	S	.	.	H	α-helix	trans	-70	-35.4	177.1	-170.8	173.4	-179.6	0	0	111.8	S156 L157 S158 V164	S156-M160 PolarHBondContact O-N 3.49Å; L157-M160 PolarHBondContact O-N 3.13Å; L157-M160 VanDerWaalsContact O-N 3.14Å; S158-M160 VanDerWaalsContact C-N 3.31Å; S158-M160 PolarHBondContact O-N 3.03Å; M160-V164 WeakPolarHBondContact O-CG2 3.47Å; M160-V164 PolarHBondContact O-N 3Å
161	E	67.3	Low	65.2	Low	131 Å²	131	71.8 Å²	71.8	61%	0.612	42%	0.423	S	S	*	.	H	α-helix	trans	-64	-47.7	173.9	-171.1	169.8	-169.1	0	0	111.5	L157 S158 V163 V164 L165	L157-E161 PolarHBondContact O-N 3.32Å; L157-E161 VanDerWaalsContact O-N 3.09Å; S158-E161 WeakPolarHBondContact O-CB 3.38Å; S158-E161 PolarHBondContact O-N 3.02Å; E161-V163 VanDerWaalsContact C-N 3.35Å; E161-V163 PolarHBondContact O-N 2.88Å; E161-V164 PolarHBondContact O-N 3.02Å; E161-V164 VanDerWaalsContact O-N 3.15Å; E161-L165 HydrophobicContact CG-CD1 4.2Å; E161-L165 WeakPolarHBondContact O-CG 3.23Å; E161-L165 PolarHBondContact O-N 2.87Å
162	D	69.8	Low	67.2	Low	104 Å²	104	70 Å²	70	56%	0.556	41%	0.407	S	S	*	.	H	α-helix	trans	-57.5	-43.3	176	-79.8	-33.8	0	0	0	112.4	S158 V164 L165 D166	S158-D162 PolarHBondContact O-N 2.84Å; D162-V164 VanDerWaalsContact C-N 3.33Å; D162-V164 PolarHBondContact O-N 2.82Å; D162-L165 PolarHBondContact O-N 2.89Å; D162-D166 WeakPolarHBondContact O-CB 3.35Å; D162-D166 PolarHBondContact O-N 2.91Å
163	V	71	Confident	69.2	Low	34 Å²	34	68.8 Å²	68.8	21%	0.206	39%	0.391	C	S	.	.	H	α-helix	trans	-62	-39.3	177.4	172.2	0	0	0	0	111.9	I139 V159 E161 A167	I139-V163 HydrophobicContact CG2-CG2 3.94Å; V159-V163 VanDerWaalsContact O-CG2 3.32Å; V159-V163 WeakPolarHBondContact O-CG2 3.47Å; V159-V163 PolarHBondContact O-N 2.87Å; E161-V163 VanDerWaalsContact C-N 3.35Å; E161-V163 PolarHBondContact O-N 2.88Å; V163-A167 WeakPolarHBondContact O-CB 3.12Å; V163-A167 PolarHBondContact O-N 2.93Å
164	V	73.9	Confident	70.8	Confident	83 Å²	83	68.8 Å²	68.8	50%	0.503	38%	0.384	S	S	.	.	H	α-helix	trans	-68.8	-41.3	176.2	171.3	0	0	0	0	111.1	M160 E161 D162 A167 V168	M160-V164 WeakPolarHBondContact O-CG2 3.47Å; M160-V164 PolarHBondContact O-N 3Å; E161-V164 PolarHBondContact O-N 3.02Å; E161-V164 VanDerWaalsContact O-N 3.15Å; D162-V164 VanDerWaalsContact C-N 3.33Å; D162-V164 PolarHBondContact O-N 2.82Å; V164-A167 PolarHBondContact O-N 2.76Å; V164-V168 WeakPolarHBondContact O-CG2 3.35Å; V164-V168 PolarHBondContact O-N 2.9Å
165	L	77.2	Confident	72.3	Confident	99 Å²	99	68 Å²	68	52%	0.518	38%	0.379	S	S	.	.	H	α-helix	trans	-63.7	-40.5	175.8	-68.8	173	0	0	0	111.9	E161 D162 V168 A169	E161-L165 HydrophobicContact CG-CD1 4.2Å; E161-L165 WeakPolarHBondContact O-CG 3.23Å; E161-L165 PolarHBondContact O-N 2.87Å; D162-L165 PolarHBondContact O-N 2.89Å; L165-V168 PolarHBondContact O-N 3.01Å; L165-A169 WeakPolarHBondContact O-CB 3.18Å; L165-A169 PolarHBondContact O-N 2.82Å
166	D	77.4	Confident	73.9	Confident	39 Å²	39	70.2 Å²	70.2	21%	0.209	39%	0.387	C	S	.	.	H	α-helix	trans	-68.5	-37.8	177.6	-133.5	50.2	0	0	0	111.4	A116 D162 A169 V170	A116-D166 HydrophobicContact CB-CB 4.37Å; A116-D166 WeakPolarHBondContact CB-OD1 3.46Å; A116-D166 VanDerWaalsContact CB-OD2 3.24Å; A116-D166 WeakPolarHBondContact CB-OD2 3.3Å; A116-D166 PolarHBondContact N-OD2 3.02Å; D162-D166 WeakPolarHBondContact O-CB 3.35Å; D162-D166 PolarHBondContact O-N 2.91Å; D166-A169 PolarHBondContact O-N 2.89Å; D166-V170 WeakPolarHBondContact O-CG2 3.42Å; D166-V170 PolarHBondContact O-N 2.99Å
167	A	77	Confident	75.2	Confident	25 Å²	25	69.3 Å²	69.3	21%	0.207	38%	0.381	C	S	.	.	H	α-helix	trans	-60.9	-48.3	172.2	0	0	0	0	0	112	V163 V164 A169 V170 E171	V163-A167 WeakPolarHBondContact O-CB 3.12Å; V163-A167 PolarHBondContact O-N 2.93Å; V164-A167 PolarHBondContact O-N 2.76Å; A167-A169 VanDerWaalsContact C-N 3.29Å; A167-A169 PolarHBondContact O-N 3.34Å; A167-V170 PolarHBondContact O-N 2.84Å; A167-E171 PolarHBondContact O-N 3.26Å; A167-E171 VanDerWaalsContact O-N 3.08Å
168	V	80.9	Confident	76.6	Confident	71 Å²	71	76 Å²	76	43%	0.43	40%	0.398	S	S	.	.	H	α-helix	trans	-61.4	-37.1	174.9	170.5	0	0	0	0	111.5	V164 L165 K172	V164-V168 WeakPolarHBondContact O-CG2 3.35Å; V164-V168 PolarHBondContact O-N 2.9Å; L165-V168 PolarHBondContact O-N 3.01Å; V168-K172 HydrophobicContact CG1-CD 4.21Å; V168-K172 WeakPolarHBondContact O-CB 3.43Å; V168-K172 WeakPolarHBondContact O-CG 3.3Å; V168-K172 PolarHBondContact O-N 2.89Å; V168-K172 VanDerWaalsContact O-N 3.09Å
169	A	83.2	Confident	77.9	Confident	22 Å²	22	73.7 Å²	73.7	18%	0.182	38%	0.382	C	S	.	.	H	α-helix	trans	-65.6	-43.2	175.6	0	0	0	0	0	112	A116 L165 D166 A167 K172 L173	A116-A169 HydrophobicContact CB-CB 3.94Å; L165-A169 WeakPolarHBondContact O-CB 3.18Å; L165-A169 PolarHBondContact O-N 2.82Å; D166-A169 PolarHBondContact O-N 2.89Å; A167-A169 VanDerWaalsContact C-N 3.29Å; A167-A169 PolarHBondContact O-N 3.34Å; A169-K172 PolarHBondContact O-N 2.92Å; A169-L173 WeakPolarHBondContact O-CD1 3.2Å; A169-L173 WeakPolarHBondContact O-CG 3.09Å; A169-L173 PolarHBondContact O-N 2.88Å
170	V	83.1	Confident	79.3	Confident	8 Å²	8	77 Å²	77	5%	0.048	39%	0.394	C	S	.	.	H	α-helix	trans	-62.7	-44.5	176.5	172	0	0	0	0	111.7	A116 L119 D166 A167 K172 L173 K174	A116-V170 HydrophobicContact CB-CG2 3.71Å; L119-V170 HydrophobicContact CD2-CB 4.15Å; L119-V170 HydrophobicContact CD2-CG1 3.6Å; L119-V170 HydrophobicContact CD2-CG2 3.97Å; D166-V170 WeakPolarHBondContact O-CG2 3.42Å; D166-V170 PolarHBondContact O-N 2.99Å; A167-V170 PolarHBondContact O-N 2.84Å; V170-K172 VanDerWaalsContact C-N 3.34Å; V170-K172 PolarHBondContact O-N 2.78Å; V170-L173 WeakPolarHBondContact O-CB 3.49Å; V170-L173 PolarHBondContact O-N 3.44Å; V170-L173 VanDerWaalsContact O-N 3.17Å; V170-K174 VanDerWaalsContact O-CB 3.3Å; V170-K174 WeakPolarHBondContact O-CB 3.41Å; V170-K174 PolarHBondContact O-N 2.91Å
171	E	82.5	Confident	80.6	Confident	52 Å²	52	74 Å²	74	24%	0.243	38%	0.38	C	S	.	.	H	α-helix	trans	-67.8	-33.5	179.6	-61.9	-52.4	126.1	0	0	112.3	R113 A167 K174 S175	R113-E171 IonicContact CZ-OE1 3.13Å; R113-E171 VanDerWaalsContact CZ-OE1 3.26Å; R113-E171 IonicContact NH1-OE1 3.27Å; R113-E171 PolarHBondContact NH1-OE1 2.84Å; R113-E171 IonicContact NH2-OE1 2.66Å; R113-E171 PolarHBondContact NH2-OE1 2.57Å; A167-E171 PolarHBondContact O-N 3.26Å; A167-E171 VanDerWaalsContact O-N 3.08Å; E171-K174 PolarHBondContact O-N 2.87Å; E171-K174 IonicContact OE1-NZ 3.04Å; E171-K174 WeakPolarHBondContact OE2-CD 3.42Å; E171-K174 WeakPolarHBondContact OE2-CE 3.39Å; E171-K174 IonicContact OE2-NZ 2.88Å; E171-K174 PolarHBondContact OE2-NZ 3.03Å; E171-S175 WeakPolarHBondContact O-CB 3.25Å; E171-S175 PolarHBondContact O-N 3.35Å; E171-S175 PolarHBondContact O-OG 3.18Å
172	K	85.4	Confident	81.7	Confident	135 Å²	135	68.6 Å²	68.6	59%	0.587	36%	0.356	S	S	*	.	H	α-helix	trans	-64.9	-39.4	169.6	-76	177.1	179.4	177.2	0	112.7	V168 A169 V170 S175 N176	V168-K172 HydrophobicContact CG1-CD 4.21Å; V168-K172 WeakPolarHBondContact O-CB 3.43Å; V168-K172 WeakPolarHBondContact O-CG 3.3Å; V168-K172 PolarHBondContact O-N 2.89Å; V168-K172 VanDerWaalsContact O-N 3.09Å; A169-K172 PolarHBondContact O-N 2.92Å; V170-K172 VanDerWaalsContact C-N 3.34Å; V170-K172 PolarHBondContact O-N 2.78Å; K172-S175 WeakPolarHBondContact CA-OG 3.25Å; K172-S175 PolarHBondContact O-OG 3.35Å; K172-S175 VanDerWaalsContact O-OG 3.14Å; K172-N176 WeakPolarHBondContact O-CB 3.37Å; K172-N176 PolarHBondContact O-N 2.71Å; K172-N176 PolarHBondContact O-ND2 3.04Å
173	L	86	Confident	82.8	Confident	37 Å²	37	65 Å²	65	19%	0.194	34%	0.338	C	S	.	.	H	α-helix	trans	-66.9	-45.1	175.1	-70	160.2	0	0	0	111.3	L119 K120 I123 A169 V170 S175 N176 S177	L119-L173 HydrophobicContact CB-CD1 4.44Å; L119-L173 HydrophobicContact CD2-CB 4.11Å; L119-L173 HydrophobicContact CD2-CD1 4.15Å; L119-L173 HydrophobicContact CG-CD1 4.25Å; K120-L173 HydrophobicContact CG-CD1 3.62Å; K120-L173 HydrophobicContact CG-CD2 3.99Å; K120-L173 HydrophobicContact CG-CG 4.45Å; I123-L173 HydrophobicContact CD1-CB 3.83Å; I123-L173 HydrophobicContact CD1-CD2 4.06Å; I123-L173 HydrophobicContact CD1-CG 4.4Å; A169-L173 WeakPolarHBondContact O-CD1 3.2Å; A169-L173 WeakPolarHBondContact O-CG 3.09Å; A169-L173 PolarHBondContact O-N 2.88Å; V170-L173 WeakPolarHBondContact O-CB 3.49Å; V170-L173 PolarHBondContact O-N 3.44Å; V170-L173 VanDerWaalsContact O-N 3.17Å; L173-S175 VanDerWaalsContact C-N 3.31Å; L173-S175 PolarHBondContact O-N 2.97Å; L173-N176 PolarHBondContact O-N 2.9Å; L173-S177 WeakPolarHBondContact O-CB 3.41Å; L173-S177 PolarHBondContact O-N 3.33Å; L173-S177 PolarHBondContact O-OG 2.78Å
174	K	84.3	Confident	83.7	Confident	59 Å²	59	65.5 Å²	65.5	26%	0.257	34%	0.339	S	S	.	.	H	α-helix	trans	-61.4	-33.9	177.5	173.3	175.8	154.3	-153.5	0	113.5	V170 E171 I181 M252 G253	V170-K174 VanDerWaalsContact O-CB 3.3Å; V170-K174 WeakPolarHBondContact O-CB 3.41Å; V170-K174 PolarHBondContact O-N 2.91Å; E171-K174 PolarHBondContact O-N 2.87Å; E171-K174 IonicContact OE1-NZ 3.04Å; E171-K174 WeakPolarHBondContact OE2-CD 3.42Å; E171-K174 WeakPolarHBondContact OE2-CE 3.39Å; E171-K174 IonicContact OE2-NZ 2.88Å; E171-K174 PolarHBondContact OE2-NZ 3.03Å; K174-I181 HydrophobicContact CB-CD1 4.26Å; K174-I181 HydrophobicContact CG-CB 4.42Å; K174-M252 PolarHBondContact NZ-O 2.87Å; K174-G253 PolarHBondContact NZ-O 3.22Å
175	S	83.4	Confident	84.4	Confident	86 Å²	86	62.9 Å²	62.9	60%	0.601	32%	0.323	S	S	*	.	H	α-helix	trans	-84.5	-24.2	178.3	47	0	0	0	0	114.9	E171 K172 L173	E171-S175 WeakPolarHBondContact O-CB 3.25Å; E171-S175 PolarHBondContact O-N 3.35Å; E171-S175 PolarHBondContact O-OG 3.18Å; K172-S175 WeakPolarHBondContact CA-OG 3.25Å; K172-S175 PolarHBondContact O-OG 3.35Å; K172-S175 VanDerWaalsContact O-OG 3.14Å; L173-S175 VanDerWaalsContact C-N 3.31Å; L173-S175 PolarHBondContact O-N 2.97Å
176	N	83.9	Confident	85	Confident	139 Å²	139	62.3 Å²	62.3	74%	0.743	32%	0.317	S	S	*	.	H	α-helix	trans	-115.5	-5	-173.1	-65.8	-89.5	0	0	0	114.7	K172 L173	K172-N176 WeakPolarHBondContact O-CB 3.37Å; K172-N176 PolarHBondContact O-N 2.71Å; K172-N176 PolarHBondContact O-ND2 3.04Å; L173-N176 PolarHBondContact O-N 2.9Å
177	S	81.2	Confident	85.8	Confident	32 Å²	32	64.9 Å²	64.9	22%	0.224	34%	0.336	C	S	.	.			trans	-94.9	158	-179	69	0	0	0	0	113.3	L173	L173-S177 WeakPolarHBondContact O-CB 3.41Å; L173-S177 PolarHBondContact O-N 3.33Å; L173-S177 PolarHBondContact O-OG 2.78Å
178	R	81.4	Confident	86.6	Confident	252 Å²	252	65.3 Å²	65.3	95%	0.951	33%	0.334	S	S	*	.	S	Bend	trans	-77.7	-30.9	178.1	-61	-177.4	-177.8	-177.2	0.4	115.7
179	P	85.2	Confident	87.2	Confident	9 Å²	9	63.8 Å²	63.8	6%	0.058	33%	0.33	C	S	.	.	S	Bend	trans	-67.6	139.9	179.2	-17.6	31.8	0	0	0	111	I123 V127 S128 I130 I181	I123-P179 HydrophobicContact CB-CG 4.47Å; I123-P179 HydrophobicContact CG1-CG 4.11Å; I123-P179 HydrophobicContact CG2-CG 4.37Å; V127-P179 VanDerWaalsContact O-CB 3.28Å; V127-P179 WeakPolarHBondContact O-CB 3.5Å; V127-P179 WeakPolarHBondContact O-CG 3.38Å; S128-P179 WeakPolarHBondContact O-CA 3.42Å; I130-P179 HydrophobicContact CD1-CB 4.1Å; I130-P179 HydrophobicContact CG1-CB 4.35Å; P179-I181 PolarHBondContact O-N 2.84Å
180	H	87.9	Confident	87.6	Confident	112 Å²	112	68.9 Å²	68.9	52%	0.519	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	110.8	175.3	-176.4	67.6	0	0	0	110.3	S128 Q129 I130 C182	S128-H180 PolarHBondContact O-N 3.01Å; Q129-H180 WeakPolarHBondContact CA-O 3.45Å; I130-H180 PolarHBondContact N-O 2.83Å; H180-C182 PolarHBondContact CD2-SG 2.97Å; H180-C182 PolarHBondContact NE2-SG 3.39Å; H180-C182 VanDerWaalsContact NE2-SG 3.38Å
181	I	90.8	Very high	88.2	Confident	25 Å²	25	70.6 Å²	70.6	13%	0.128	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	115.5	-178.5	-48.8	-169.7	0	0	0	110.1	L119 I123 I130 F132 K174 P179	L119-I181 HydrophobicContact CD1-CD1 3.94Å; L119-I181 HydrophobicContact CD2-CD1 4.27Å; I123-I181 HydrophobicContact CD1-CD1 4.3Å; I130-I181 HydrophobicContact CB-CG1 4.26Å; I130-I181 HydrophobicContact CB-CG2 4.46Å; I130-I181 HydrophobicContact CD1-CD1 4.28Å; I130-I181 HydrophobicContact CD1-CG1 4.27Å; I130-I181 HydrophobicContact CG2-CG2 4.46Å; I130-I181 VanDerWaalsContact O-CA 3.31Å; I130-I181 WeakPolarHBondContact O-CA 3.35Å; F132-I181 HydrophobicContact CE1-CG2 4Å; K174-I181 HydrophobicContact CB-CD1 4.26Å; K174-I181 HydrophobicContact CG-CB 4.42Å; P179-I181 PolarHBondContact O-N 2.84Å
182	C	90.6	Very high	88.7	Confident	17 Å²	17	68.2 Å²	68.2	12%	0.115	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	176	-171.4	62.1	0	0	0	0	114.9	I130 S131 F132 H180	I130-C182 PolarHBondContact O-N 3.32Å; S131-C182 VanDerWaalsContact CA-O 3.3Å; S131-C182 WeakPolarHBondContact CA-O 3.41Å; F132-C182 PolarHBondContact N-O 3Å; H180-C182 PolarHBondContact CD2-SG 2.97Å; H180-C182 PolarHBondContact NE2-SG 3.39Å; H180-C182 VanDerWaalsContact NE2-SG 3.38Å
183	V	91.8	Very high	89.2	Confident	30 Å²	30	63.9 Å²	63.9	18%	0.182	35%	0.352	C	S	.	.			trans	-99.3	121.8	167.5	174.8	0	0	0	0	107.9	F132 P134 L185 L254 L257 L266	F132-V183 HydrophobicContact CD2-CG2 4.23Å; F132-V183 HydrophobicContact CE2-CG2 3.66Å; F132-V183 HydrophobicContact CZ-CG2 4.13Å; P134-V183 HydrophobicContact CB-CG1 3.99Å; P134-V183 HydrophobicContact CB-CG2 4.09Å; P134-V183 HydrophobicContact CG-CG1 3.77Å; V183-L185 HydrophobicContact CG1-CD1 4.42Å; V183-L185 HydrophobicContact CG1-CG 4.24Å; V183-L254 HydrophobicContact CG2-CD1 3.89Å; V183-L254 HydrophobicContact CG2-CD2 4.48Å; V183-L257 HydrophobicContact CB-CD1 4.26Å; V183-L257 HydrophobicContact CG2-CD1 4.09Å; V183-L266 HydrophobicContact CG1-CD1 4.3Å
184	L	89.9	Confident	89.7	Confident	43 Å²	43	67.8 Å²	67.8	23%	0.225	37%	0.369	C	S	.	.			trans	-115.5	96.7	177.4	-64.9	-177.9	0	0	0	110.5	V40 Y109	V40-L184 HydrophobicContact CG1-CB 3.79Å; V40-L184 WeakPolarHBondContact CG1-O 3.32Å; Y109-L184 HydrophobicContact CE1-CD1 4.31Å
185	L	88.6	Confident	90.2	Very high	29 Å²	29	67.1 Å²	67.1	15%	0.152	37%	0.367	C	S	.	.			trans	-127.4	129.1	170.4	-65.2	-180	0	0	0	108.8	T44 W133 P134 V183 L266 M270 L273	T44-L185 HydrophobicContact CG2-CD2 3.89Å; W133-L185 HydrophobicContact CE3-CD2 3.84Å; W133-L185 HydrophobicContact CZ3-CD1 4.47Å; W133-L185 HydrophobicContact CZ3-CD2 3.78Å; P134-L185 HydrophobicContact CG-CD1 3.71Å; V183-L185 HydrophobicContact CG1-CD1 4.42Å; V183-L185 HydrophobicContact CG1-CG 4.24Å; L185-L266 HydrophobicContact CD1-CD1 4.02Å; L185-M270 HydrophobicContact CD1-CG 3.63Å; L185-L273 HydrophobicContact CD2-CD1 3.76Å
186	Q	91.3	Very high	90.8	Very high	87 Å²	87	63 Å²	63	41%	0.407	34%	0.338	S	S	.	.			trans	-108.5	146.7	173.1	-66	-179.3	-40	0	0	109.4	S38 V40 N41	S38-Q186 PolarHBondContact OG-OE1 3Å; V40-Q186 HydrophobicContact CB-CG 4.33Å; V40-Q186 HydrophobicContact CG1-CG 4.32Å; N41-Q186 PolarHBondContact ND2-O 3.41Å; N41-Q186 PolarHBondContact OD1-N 3.45Å; N41-Q186 VanDerWaalsContact OD1-N 3.14Å; N41-Q186 PolarHBondContact OD1-O 3.21Å
187	P	93.1	Very high	91.4	Very high	92 Å²	92	58.3 Å²	58.3	60%	0.597	31%	0.312	S	S	*	.	P	Polyproline II helix	trans	-58.9	150.7	170.6	27.7	-34.8	0	0	0	110.5	N269	P187-N269 WeakPolarHBondContact CA-OD1 3.35Å
188	L	94.4	Very high	92	Very high	34 Å²	34	60.4 Å²	60.4	18%	0.178	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-66.3	150.7	172.9	-59	-167.2	0	0	0	110.4	L192 A272 L273 I276	L188-L192 HydrophobicContact CB-CB 4.47Å; L188-L192 HydrophobicContact CB-CD2 4.29Å; L188-L192 HydrophobicContact CD2-CD2 4.28Å; L188-A272 HydrophobicContact CD1-CB 3.71Å; L188-A272 HydrophobicContact CG-CB 4.01Å; L188-L273 HydrophobicContact CD2-CD2 3.71Å; L188-L273 HydrophobicContact CD2-CG 4.23Å; L188-I276 HydrophobicContact CD1-CD1 3.94Å; L188-I276 HydrophobicContact CD1-CG1 3.63Å; L188-I276 HydrophobicContact CD2-CG1 4.46Å
189	A	92.8	Very high	92.6	Very high	40 Å²	40	50.8 Å²	50.8	33%	0.331	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-63.2	143.4	166.9	0	0	0	0	0	109.8	P35 G191 L192	P35-A189 HydrophobicContact CB-CB 4.14Å; A189-G191 PolarHBondContact O-N 3.48Å; A189-L192 HydrophobicContact CB-CB 4.31Å; A189-L192 WeakPolarHBondContact O-CB 3.44Å; A189-L192 PolarHBondContact O-N 3.05Å; A189-L192 VanDerWaalsContact O-N 3.08Å
190	P	93.1	Very high	93.1	Very high	128 Å²	128	50.4 Å²	50.4	83%	0.831	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	137.2	174.6	-27.3	35.7	0	0	0	111.8	L192	P190-L192 PolarHBondContact O-N 3.01Å
191	G	93.8	Very high	93.5	Very high	45 Å²	45	47.8 Å²	47.8	46%	0.464	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.9	-9.7	-177.8	0	0	0	0	0	116.1	A189 L193 Q194 F195	A189-G191 PolarHBondContact O-N 3.48Å; G191-L193 VanDerWaalsContact C-N 3.33Å; G191-L193 PolarHBondContact O-N 3.49Å; G191-Q194 PolarHBondContact O-N 3.02Å; G191-F195 PolarHBondContact O-N 2.96Å
192	L	94.8	Very high	93.5	Very high	2 Å²	2	50.7 Å²	50.7	1%	0.01	28%	0.283	C	S	.	.	H	α-helix	trans	-58.1	-39.7	-173.4	-177.8	57.7	0	0	0	113.9	P35 L37 L188 A189 P190 V196 I276	P35-L192 HydrophobicContact CB-CB 3.96Å; P35-L192 HydrophobicContact CB-CD1 4.09Å; P35-L192 HydrophobicContact CG-CB 4.38Å; P35-L192 HydrophobicContact CG-CD1 4.4Å; P35-L192 VanDerWaalsContact O-CD1 3.29Å; P35-L192 WeakPolarHBondContact O-CD1 3.35Å; L37-L192 HydrophobicContact CD2-CD2 3.99Å; L37-L192 HydrophobicContact CG-CD2 4.41Å; L188-L192 HydrophobicContact CB-CB 4.47Å; L188-L192 HydrophobicContact CB-CD2 4.29Å; L188-L192 HydrophobicContact CD2-CD2 4.28Å; A189-L192 HydrophobicContact CB-CB 4.31Å; A189-L192 WeakPolarHBondContact O-CB 3.44Å; A189-L192 PolarHBondContact O-N 3.05Å; A189-L192 VanDerWaalsContact O-N 3.08Å; P190-L192 PolarHBondContact O-N 3.01Å; L192-V196 HydrophobicContact CD1-CG2 4.08Å; L192-V196 HydrophobicContact CG-CG2 4.46Å; L192-V196 WeakPolarHBondContact O-CB 3.27Å; L192-V196 VanDerWaalsContact O-CG2 3.23Å; L192-V196 WeakPolarHBondContact O-CG2 3.31Å; L192-V196 PolarHBondContact O-N 3.18Å; L192-I276 HydrophobicContact CG-CD1 4.14Å
193	L	95.8	Very high	93.7	Very high	44 Å²	44	50.7 Å²	50.7	23%	0.23	28%	0.283	C	S	.	.	H	α-helix	trans	-65.3	-47.3	178.5	179.6	61.4	0	0	0	111.7	G191 F195 V196 E197 E275 I276	G191-L193 VanDerWaalsContact C-N 3.33Å; G191-L193 PolarHBondContact O-N 3.49Å; L193-F195 PolarHBondContact O-N 3.21Å; L193-V196 PolarHBondContact O-N 3.46Å; L193-E197 HydrophobicContact CD1-CG 4.37Å; L193-E197 WeakPolarHBondContact O-CG 3.45Å; L193-E197 PolarHBondContact O-N 2.73Å; L193-E275 HydrophobicContact CD1-CB 3.89Å; L193-E275 HydrophobicContact CD2-CB 4.16Å; L193-E275 WeakPolarHBondContact CD2-OE2 3.4Å; L193-I276 HydrophobicContact CB-CD1 4.26Å; L193-I276 HydrophobicContact CD1-CD1 3.92Å; L193-I276 HydrophobicContact CD1-CG1 4.13Å
194	Q	95.7	Very high	93.7	Very high	118 Å²	118	50 Å²	50	55%	0.551	28%	0.279	S	S	*	.	H	α-helix	trans	-59.9	-46.7	176.8	178.8	178.6	-7.5	0	0	111.2	G191 V196 E197 E198	G191-Q194 PolarHBondContact O-N 3.02Å; Q194-V196 VanDerWaalsContact C-N 3.34Å; Q194-V196 PolarHBondContact O-N 3.25Å; Q194-E197 PolarHBondContact O-N 2.82Å; Q194-E197 VanDerWaalsContact O-N 3.15Å; Q194-E198 HydrophobicContact CG-CG 4.35Å; Q194-E198 VanDerWaalsContact CG-OE1 3.28Å; Q194-E198 WeakPolarHBondContact CG-OE1 3.39Å; Q194-E198 PolarHBondContact NE2-OE1 2.91Å; Q194-E198 WeakPolarHBondContact O-CG 3.22Å; Q194-E198 PolarHBondContact O-N 2.76Å
195	F	95.4	Very high	93.9	Very high	46 Å²	46	48.1 Å²	48.1	20%	0.202	27%	0.268	C	S	.	.	H	α-helix	trans	-58.3	-44.2	176.3	175.7	-102	0	0	0	112.2	D34 P35 G191 L193 E197 T199 Y323	D34-F195 HydrophobicContact CB-CD2 4.46Å; D34-F195 HydrophobicContact CB-CE2 3.84Å; D34-F195 HydrophobicContact CB-CZ 3.96Å; D34-F195 WeakPolarHBondContact OD2-CE2 3.24Å; P35-F195 HydrophobicContact CG-CB 3.67Å; P35-F195 HydrophobicContact CG-CD1 4.23Å; P35-F195 HydrophobicContact CG-CG 3.93Å; P35-F195 WeakPolarHBondContact O-CD1 3.5Å; G191-F195 PolarHBondContact O-N 2.96Å; L193-F195 PolarHBondContact O-N 3.21Å; F195-E197 VanDerWaalsContact C-N 3.34Å; F195-E197 PolarHBondContact O-N 3.47Å; F195-T199 HydrophobicContact CD2-CG2 4.11Å; F195-T199 HydrophobicContact CE1-CG2 4.45Å; F195-T199 HydrophobicContact CE2-CG2 3.82Å; F195-T199 HydrophobicContact CZ-CG2 4.01Å; F195-T199 WeakPolarHBondContact O-CB 3.48Å; F195-T199 WeakPolarHBondContact O-CG2 3.32Å; F195-T199 PolarHBondContact O-N 3.04Å; F195-T199 PolarHBondContact O-OG1 3.44Å; F195-Y323 HydrophobicContact CD1-CD1 4.34Å; F195-Y323 HydrophobicContact CD1-CE1 4.25Å; F195-Y323 HydrophobicContact CE1-CD1 4.05Å; F195-Y323 HydrophobicContact CE1-CE1 4.06Å
196	V	96.3	Very high	94.1	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-63	-39.5	175.8	166.4	0	0	0	0	111.6	L192 L193 Q194 T199 S200 I276 A279 V280 Y323	L192-V196 HydrophobicContact CD1-CG2 4.08Å; L192-V196 HydrophobicContact CG-CG2 4.46Å; L192-V196 WeakPolarHBondContact O-CB 3.27Å; L192-V196 VanDerWaalsContact O-CG2 3.23Å; L192-V196 WeakPolarHBondContact O-CG2 3.31Å; L192-V196 PolarHBondContact O-N 3.18Å; L193-V196 PolarHBondContact O-N 3.46Å; Q194-V196 VanDerWaalsContact C-N 3.34Å; Q194-V196 PolarHBondContact O-N 3.25Å; V196-T199 PolarHBondContact O-OG1 3.25Å; V196-S200 WeakPolarHBondContact O-CB 3.24Å; V196-S200 PolarHBondContact O-N 3.09Å; V196-S200 PolarHBondContact O-OG 2.79Å; V196-I276 HydrophobicContact CB-CD1 3.98Å; V196-I276 HydrophobicContact CG1-CD1 4.23Å; V196-I276 HydrophobicContact CG1-CG2 4.48Å; V196-I276 HydrophobicContact CG2-CD1 3.76Å; V196-A279 HydrophobicContact CG1-CB 3.9Å; V196-V280 HydrophobicContact CG1-CG2 3.61Å; V196-Y323 HydrophobicContact CB-CE1 4.16Å; V196-Y323 HydrophobicContact CG1-CE1 4.48Å; V196-Y323 HydrophobicContact CG1-CE2 4.25Å; V196-Y323 HydrophobicContact CG2-CD1 3.6Å; V196-Y323 HydrophobicContact CG2-CD2 4.38Å; V196-Y323 HydrophobicContact CG2-CE1 3.62Å; V196-Y323 HydrophobicContact CG2-CE2 4.41Å; V196-Y323 HydrophobicContact CG2-CG 3.99Å; V196-Y323 PolarHBondContact O-OH 2.96Å; V196-Y323 VanDerWaalsContact O-OH 3.13Å
197	E	96.1	Very high	94.1	Very high	40 Å²	40	46.4 Å²	46.4	19%	0.187	26%	0.258	C	S	.	.	H	α-helix	trans	-68.1	-50.2	178.8	-73.6	-178.7	170.8	0	0	112.7	L193 Q194 F195 S200 R201 F222 R226 A279	L193-E197 HydrophobicContact CD1-CG 4.37Å; L193-E197 WeakPolarHBondContact O-CG 3.45Å; L193-E197 PolarHBondContact O-N 2.73Å; Q194-E197 PolarHBondContact O-N 2.82Å; Q194-E197 VanDerWaalsContact O-N 3.15Å; F195-E197 VanDerWaalsContact C-N 3.34Å; F195-E197 PolarHBondContact O-N 3.47Å; E197-S200 PolarHBondContact O-N 2.84Å; E197-R201 WeakPolarHBondContact O-CB 3.35Å; E197-R201 PolarHBondContact O-N 2.87Å; E197-F222 HydrophobicContact CB-CE1 4.06Å; E197-F222 HydrophobicContact CB-CZ 4.29Å; E197-F222 HydrophobicContact CG-CE1 4.28Å; E197-F222 HydrophobicContact CG-CZ 4.4Å; E197-F222 WeakPolarHBondContact O-CZ 3.22Å; E197-R226 WeakPolarHBondContact OE1-CD 3.19Å; E197-R226 IonicContact OE1-CZ 2.9Å; E197-R226 IonicContact OE1-NE 3.68Å; E197-R226 IonicContact OE1-NH1 3.35Å; E197-R226 PolarHBondContact OE1-NH1 2.79Å; E197-R226 IonicContact OE2-CZ 2.71Å; E197-R226 IonicContact OE2-NH1 2.69Å; E197-R226 PolarHBondContact OE2-NH1 3.5Å; E197-A279 HydrophobicContact CG-CB 3.69Å
198	E	94.6	Very high	93.9	Very high	76 Å²	76	44.5 Å²	44.5	36%	0.355	24%	0.239	S	C	.	.	H	α-helix	trans	-60	-52	178.8	-70.6	171.3	177.9	0	0	111	Q194 S200 R201 E202	Q194-E198 HydrophobicContact CG-CG 4.35Å; Q194-E198 VanDerWaalsContact CG-OE1 3.28Å; Q194-E198 WeakPolarHBondContact CG-OE1 3.39Å; Q194-E198 PolarHBondContact NE2-OE1 2.91Å; Q194-E198 WeakPolarHBondContact O-CG 3.22Å; Q194-E198 PolarHBondContact O-N 2.76Å; E198-S200 VanDerWaalsContact C-N 3.34Å; E198-S200 PolarHBondContact O-N 3.33Å; E198-R201 PolarHBondContact O-N 2.85Å; E198-E202 WeakPolarHBondContact O-CB 3.48Å; E198-E202 WeakPolarHBondContact O-CG 3.27Å; E198-E202 PolarHBondContact O-N 3.38Å
199	T	94	Very high	93.7	Very high	50 Å²	50	43 Å²	43	31%	0.307	23%	0.231	S	C	.	.	H	α-helix	trans	-68.8	-27.8	178.8	57.6	0	0	0	0	113.5	F195 V196 S203 Y323	F195-T199 HydrophobicContact CD2-CG2 4.11Å; F195-T199 HydrophobicContact CE1-CG2 4.45Å; F195-T199 HydrophobicContact CE2-CG2 3.82Å; F195-T199 HydrophobicContact CZ-CG2 4.01Å; F195-T199 WeakPolarHBondContact O-CB 3.48Å; F195-T199 WeakPolarHBondContact O-CG2 3.32Å; F195-T199 PolarHBondContact O-N 3.04Å; F195-T199 PolarHBondContact O-OG1 3.44Å; V196-T199 PolarHBondContact O-OG1 3.25Å; T199-S203 PolarHBondContact O-N 3.16Å; T199-Y323 WeakPolarHBondContact OG1-CE1 3.36Å; T199-Y323 PolarHBondContact OG1-OH 2.84Å
200	S	95.4	Very high	93.3	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-74.8	-38.7	174.7	-82.9	0	0	0	0	112.6	V196 E197 E198 E202 S203 A279 G283 R319 Y323	V196-S200 WeakPolarHBondContact O-CB 3.24Å; V196-S200 PolarHBondContact O-N 3.09Å; V196-S200 PolarHBondContact O-OG 2.79Å; E197-S200 PolarHBondContact O-N 2.84Å; E198-S200 VanDerWaalsContact C-N 3.34Å; E198-S200 PolarHBondContact O-N 3.33Å; S200-E202 VanDerWaalsContact C-N 3.34Å; S200-S203 WeakPolarHBondContact O-CB 3.35Å; S200-S203 PolarHBondContact O-N 3.43Å; S200-S203 PolarHBondContact O-OG 3.48Å; S200-A279 WeakPolarHBondContact CB-O 3.44Å; S200-G283 WeakPolarHBondContact O-CA 3.32Å; S200-R319 VanDerWaalsContact CA-NH2 3.28Å; S200-R319 VanDerWaalsContact CB-NH2 3.28Å; S200-R319 PolarHBondContact O-NH2 2.97Å; S200-R319 PolarHBondContact OG-NH2 3.13Å; S200-Y323 PolarHBondContact N-OH 3.12Å; S200-Y323 PolarHBondContact OG-OH 2.99Å
201	R	94.8	Very high	93	Very high	57 Å²	57	41.4 Å²	41.4	22%	0.215	21%	0.208	C	C	.	.	H	α-helix	trans	-59.9	-44.2	168.7	177.1	-170.2	66	-152.5	-5.2	111	E197 E198 S203 M206 F222	E197-R201 WeakPolarHBondContact O-CB 3.35Å; E197-R201 PolarHBondContact O-N 2.87Å; E198-R201 PolarHBondContact O-N 2.85Å; R201-S203 VanDerWaalsContact C-N 3.26Å; R201-S203 PolarHBondContact O-N 2.83Å; R201-M206 WeakPolarHBondContact O-CB 3.43Å; R201-M206 VanDerWaalsContact O-CG 3.28Å; R201-M206 WeakPolarHBondContact O-CG 3.47Å; R201-F222 HydrophobicContact CB-CB 4.41Å; R201-F222 HydrophobicContact CB-CD1 4.15Å; R201-F222 HydrophobicContact CB-CD2 4.09Å; R201-F222 HydrophobicContact CB-CE1 4.49Å; R201-F222 HydrophobicContact CB-CE2 4.44Å; R201-F222 HydrophobicContact CB-CG 3.94Å; R201-F222 HydrophobicContact CG-CB 4.31Å; R201-F222 HydrophobicContact CG-CG 4.36Å
202	E	92.3	Very high	92.6	Very high	87 Å²	87	42 Å²	42	41%	0.407	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86	11.6	-176.2	-69.3	168.5	-142.3	0	0	114.3	E198 S200 K207	E198-E202 WeakPolarHBondContact O-CB 3.48Å; E198-E202 WeakPolarHBondContact O-CG 3.27Å; E198-E202 PolarHBondContact O-N 3.38Å; S200-E202 VanDerWaalsContact C-N 3.34Å; E202-K207 WeakPolarHBondContact O-CD 3.22Å; E202-K207 WeakPolarHBondContact O-CE 3.47Å; E202-K207 PolarHBondContact O-NZ 3.3Å
203	S	93.4	Very high	92	Very high	16 Å²	16	45.3 Å²	45.3	11%	0.112	22%	0.218	C	C	.	.	S	Bend	trans	-70.6	151.5	-179.7	66.9	0	0	0	0	112.9	T199 S200 R201 F205 M206 K207 G283 R319	T199-S203 PolarHBondContact O-N 3.16Å; S200-S203 WeakPolarHBondContact O-CB 3.35Å; S200-S203 PolarHBondContact O-N 3.43Å; S200-S203 PolarHBondContact O-OG 3.48Å; R201-S203 VanDerWaalsContact C-N 3.26Å; R201-S203 PolarHBondContact O-N 2.83Å; S203-F205 PolarHBondContact O-N 2.97Å; S203-M206 WeakPolarHBondContact O-CB 3.14Å; S203-M206 PolarHBondContact O-N 3.3Å; S203-K207 PolarHBondContact O-N 2.96Å; S203-K207 VanDerWaalsContact O-N 3.13Å; S203-G283 PolarHBondContact OG-O 2.68Å; S203-R319 VanDerWaalsContact CB-NH1 3.34Å; S203-R319 PolarHBondContact OG-NH1 3.43Å; S203-R319 PolarHBondContact OG-NH2 2.94Å
204	D	93.4	Very high	90.9	Very high	17 Å²	17	51 Å²	51	9%	0.091	25%	0.248	C	C	.	.	H	α-helix	trans	-46.3	-39	-179.3	-66.7	19.4	0	0	0	113.9	R208 K415 Q438	D204-R208 PolarHBondContact O-N 3.1Å; D204-K415 IonicContact OD1-NZ 3.49Å; D204-K415 PolarHBondContact OD1-NZ 3.31Å; D204-K415 IonicContact OD2-NZ 3.54Å; D204-K415 PolarHBondContact OD2-NZ 3.18Å; D204-Q438 HydrophobicContact CB-CB 3.83Å; D204-Q438 HydrophobicContact CB-CG 3.81Å; D204-Q438 WeakPolarHBondContact O-CG 3.49Å
205	F	93.9	Very high	89.8	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.009	26%	0.256	C	S	.	.	H	α-helix	trans	-68.4	-31.9	179.1	-53.2	-86.5	0	0	0	113.8	S203 M209 L284 F291 I315 T414 W463	S203-F205 PolarHBondContact O-N 2.97Å; F205-M209 WeakPolarHBondContact O-CG 3.37Å; F205-L284 HydrophobicContact CB-CD1 3.62Å; F205-L284 HydrophobicContact CD1-CD1 3.46Å; F205-L284 VanDerWaalsContact CD1-CD1 3.46Å; F205-L284 HydrophobicContact CD2-CD1 4.3Å; F205-L284 HydrophobicContact CE1-CD1 4.18Å; F205-L284 HydrophobicContact CG-CD1 3.53Å; F205-F291 HydrophobicContact CD1-CZ 4.33Å; F205-F291 AromaticContact CE1-CE1 3.95Å; F205-F291 HydrophobicContact CE1-CE1 3.95Å; F205-F291 AromaticContact CE1-CZ 3.89Å; F205-F291 HydrophobicContact CE1-CZ 3.89Å; F205-I315 HydrophobicContact CE1-CG2 4.06Å; F205-I315 HydrophobicContact CE2-CG2 4.13Å; F205-I315 HydrophobicContact CZ-CG2 3.64Å; F205-T414 WeakPolarHBondContact CE2-O 3.47Å; F205-W463 HydrophobicContact CB-CG 4.46Å; F205-W463 HydrophobicContact CD1-CB 3.78Å; F205-W463 AromaticContact CD1-CD1 3.94Å; F205-W463 HydrophobicContact CD1-CD2 4Å; F205-W463 AromaticContact CD1-CG 3.63Å; F205-W463 HydrophobicContact CD1-CG 3.63Å; F205-W463 HydrophobicContact CE1-CB 4.16Å; F205-W463 HydrophobicContact CE1-CG 4.45Å; F205-W463 PolarHBondContact O-NE1 2.75Å
206	M	91.7	Very high	89	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-75.1	-52.6	175.1	-72.3	-70.1	-57.4	0	0	110.1	R201 S203 R208 M209 T210 L221 F222 P285	R201-M206 WeakPolarHBondContact O-CB 3.43Å; R201-M206 VanDerWaalsContact O-CG 3.28Å; R201-M206 WeakPolarHBondContact O-CG 3.47Å; S203-M206 WeakPolarHBondContact O-CB 3.14Å; S203-M206 PolarHBondContact O-N 3.3Å; M206-R208 VanDerWaalsContact C-N 3.25Å; M206-R208 PolarHBondContact O-N 3.42Å; M206-M209 HydrophobicContact CB-CE 4.42Å; M206-M209 HydrophobicContact CE-CE 4.14Å; M206-M209 HydrophobicContact CG-CE 4.34Å; M206-M209 WeakPolarHBondContact O-CB 3.3Å; M206-M209 PolarHBondContact O-N 3.28Å; M206-M209 HydrophobicContact SD-CE 3.39Å; M206-M209 WeakPolarHBondContact SD-CE 3.36Å; M206-T210 PolarHBondContact O-N 3.14Å; M206-T210 PolarHBondContact O-OG1 3.25Å; M206-L221 HydrophobicContact CE-CD2 4.22Å; M206-F222 HydrophobicContact CE-CB 4.19Å; M206-P285 HydrophobicContact SD-CG 3.98Å
207	K	90.7	Very high	88.5	Confident	80 Å²	80	52.6 Å²	52.6	35%	0.348	28%	0.279	S	S	.	.	H	α-helix	trans	-49.7	-44.9	179.3	-76.7	168.8	169.8	151.3	0	112.7	E202 S203 M209 T210 E211	E202-K207 WeakPolarHBondContact O-CD 3.22Å; E202-K207 WeakPolarHBondContact O-CE 3.47Å; E202-K207 PolarHBondContact O-NZ 3.3Å; S203-K207 PolarHBondContact O-N 2.96Å; S203-K207 VanDerWaalsContact O-N 3.13Å; K207-M209 VanDerWaalsContact C-N 3.3Å; K207-M209 PolarHBondContact O-N 2.95Å; K207-T210 WeakPolarHBondContact O-CB 3.49Å; K207-T210 PolarHBondContact O-N 3.35Å; K207-T210 VanDerWaalsContact O-N 3.13Å; K207-E211 WeakPolarHBondContact O-CG 3.45Å; K207-E211 PolarHBondContact O-N 3.27Å
208	R	90.1	Very high	88	Confident	53 Å²	53	53.1 Å²	53.1	20%	0.2	28%	0.281	C	S	.	.	H	α-helix	trans	-62.2	-34.3	179.2	-175.9	52.9	-176.1	-88.6	2.3	113.5	D204 M206 T210 D212 D437	D204-R208 PolarHBondContact O-N 3.1Å; M206-R208 VanDerWaalsContact C-N 3.25Å; M206-R208 PolarHBondContact O-N 3.42Å; R208-T210 VanDerWaalsContact C-N 3.32Å; R208-D212 IonicContact CZ-OD1 2.97Å; R208-D212 IonicContact NE-OD1 3.6Å; R208-D212 PolarHBondContact NE-OD1 3.48Å; R208-D212 IonicContact NE-OD2 3.81Å; R208-D212 IonicContact NH2-OD1 3.59Å; R208-D212 WeakPolarHBondContact O-CB 3.34Å; R208-D212 VanDerWaalsContact O-CG 3.26Å; R208-D212 PolarHBondContact O-N 3.4Å; R208-D437 IonicContact CZ-OD2 2.83Å; R208-D437 IonicContact NH1-OD1 3.82Å; R208-D437 PolarHBondContact NH1-OD1 3.1Å; R208-D437 IonicContact NH1-OD2 2.66Å; R208-D437 PolarHBondContact NH1-OD2 3.05Å
209	M	89.1	Confident	87.8	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-70.7	-31.5	177.2	-58.6	-175.6	-70.6	0	0	112.3	F205 M206 K207 D213 M216 L221 P285 Y289 W463	F205-M209 WeakPolarHBondContact O-CG 3.37Å; M206-M209 HydrophobicContact CB-CE 4.42Å; M206-M209 HydrophobicContact CE-CE 4.14Å; M206-M209 HydrophobicContact CG-CE 4.34Å; M206-M209 WeakPolarHBondContact O-CB 3.3Å; M206-M209 PolarHBondContact O-N 3.28Å; M206-M209 HydrophobicContact SD-CE 3.39Å; M206-M209 WeakPolarHBondContact SD-CE 3.36Å; K207-M209 VanDerWaalsContact C-N 3.3Å; K207-M209 PolarHBondContact O-N 2.95Å; M209-D213 PolarHBondContact O-N 3.45Å; M209-M216 HydrophobicContact CB-CE 3.77Å; M209-L221 HydrophobicContact CE-CD2 4.03Å; M209-P285 HydrophobicContact CE-CG 3.38Å; M209-P285 HydrophobicContact SD-CG 3.88Å; M209-Y289 HydrophobicContact CB-CD2 4.33Å; M209-Y289 HydrophobicContact CB-CE1 4.16Å; M209-Y289 HydrophobicContact CB-CE2 3.8Å; M209-Y289 HydrophobicContact CG-CD1 3.76Å; M209-Y289 HydrophobicContact CG-CD2 3.57Å; M209-Y289 HydrophobicContact CG-CE1 3.75Å; M209-Y289 HydrophobicContact CG-CE2 3.55Å; M209-Y289 HydrophobicContact CG-CG 3.71Å; M209-Y289 PolarHBondContact O-OH 3.2Å; M209-Y289 HydrophobicContact SD-CD2 3.5Å; M209-Y289 VanDerWaalsContact SD-CD2 3.5Å; M209-Y289 HydrophobicContact SD-CE2 3.88Å; M209-Y289 HydrophobicContact SD-CG 3.93Å; M209-W463 HydrophobicContact SD-CZ2 4.25Å
210	T	86.1	Confident	87.7	Confident	29 Å²	29	55.3 Å²	55.3	18%	0.178	29%	0.291	C	S	.	.	H	α-helix	trans	-76.4	-35.9	177.9	-36.6	0	0	0	0	111.9	M206 K207 R208 D213 E218	M206-T210 PolarHBondContact O-N 3.14Å; M206-T210 PolarHBondContact O-OG1 3.25Å; K207-T210 WeakPolarHBondContact O-CB 3.49Å; K207-T210 PolarHBondContact O-N 3.35Å; K207-T210 VanDerWaalsContact O-N 3.13Å; R208-T210 VanDerWaalsContact C-N 3.32Å; T210-D213 CarbonylContact O-C 3.55Å; T210-D213 PolarHBondContact O-N 3.47Å; T210-D213 VanDerWaalsContact O-O 3.13Å; T210-E218 WeakPolarHBondContact CB-OE1 3.21Å; T210-E218 HydrophobicContact CG2-CG 3.63Å; T210-E218 VanDerWaalsContact OG1-CG 3.26Å; T210-E218 WeakPolarHBondContact OG1-CG 3.48Å; T210-E218 PolarHBondContact OG1-OE1 3.36Å
211	E	86.3	Confident	87.5	Confident	107 Å²	107	56.4 Å²	56.4	50%	0.5	30%	0.296	S	S	.	.	H	α-helix	trans	-64.9	-40.3	170.5	-70.6	163.2	179.2	0	0	111.4	K207 Q438	K207-E211 WeakPolarHBondContact O-CG 3.45Å; K207-E211 PolarHBondContact O-N 3.27Å; E211-Q438 VanDerWaalsContact CD-NE2 3.26Å; E211-Q438 PolarHBondContact OE1-NE2 2.95Å; E211-Q438 VanDerWaalsContact OE1-NE2 3.16Å; E211-Q438 PolarHBondContact OE2-NE2 3.14Å
212	D	84.8	Confident	87.5	Confident	57 Å²	57	53.9 Å²	53.9	31%	0.305	29%	0.287	S	S	.	.	H	α-helix	trans	-75.5	-19.5	175.4	-70.8	-2.4	0	0	0	112.7	R208 Y289 R465	R208-D212 IonicContact CZ-OD1 2.97Å; R208-D212 IonicContact NE-OD1 3.6Å; R208-D212 PolarHBondContact NE-OD1 3.48Å; R208-D212 IonicContact NE-OD2 3.81Å; R208-D212 IonicContact NH2-OD1 3.59Å; R208-D212 WeakPolarHBondContact O-CB 3.34Å; R208-D212 VanDerWaalsContact O-CG 3.26Å; R208-D212 PolarHBondContact O-N 3.4Å; D212-Y289 HydrophobicContact CB-CE1 4.34Å; D212-Y289 WeakPolarHBondContact CB-OH 3.38Å; D212-Y289 WeakPolarHBondContact OD2-CE1 3.21Å; D212-R465 PolarHBondContact O-NH2 2.85Å
213	D	82.5	Confident	87.6	Confident	71 Å²	71	51.7 Å²	51.7	38%	0.38	28%	0.278	S	S	.	.			trans	-140.8	92.2	177.6	-175.3	0	0	0	0	113	M209 T210 G215 M216	M209-D213 PolarHBondContact O-N 3.45Å; T210-D213 CarbonylContact O-C 3.55Å; T210-D213 PolarHBondContact O-N 3.47Å; T210-D213 VanDerWaalsContact O-O 3.13Å; D213-G215 PolarHBondContact O-N 2.9Å; D213-G215 VanDerWaalsContact O-N 3.1Å; D213-G215 PolarHBondContact OD1-N 3.24Å; D213-M216 HydrophobicContact CB-CB 4.22Å; D213-M216 WeakPolarHBondContact O-CB 3.06Å; D213-M216 PolarHBondContact O-N 3.25Å; D213-M216 VanDerWaalsContact O-N 3.16Å
214	L	73.4	Confident	87.6	Confident	163 Å²	163	60.3 Å²	60.3	85%	0.853	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-8.9	-179.8	-57.5	176.8	0	0	0	114.7
215	G	72.4	Confident	87.7	Confident	71 Å²	71	60 Å²	60	73%	0.732	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-9.7	175.7	0	0	0	0	0	114.1	D213	D213-G215 PolarHBondContact O-N 2.9Å; D213-G215 VanDerWaalsContact O-N 3.1Å; D213-G215 PolarHBondContact OD1-N 3.24Å
216	M	77.9	Confident	87.8	Confident	43 Å²	43	63.3 Å²	63.3	21%	0.212	32%	0.319	C	S	.	.			trans	-90.6	118.4	-167.2	-173.1	-175.5	74.4	0	0	113	M209 D213 E218 L221	M209-M216 HydrophobicContact CB-CE 3.77Å; D213-M216 HydrophobicContact CB-CB 4.22Å; D213-M216 WeakPolarHBondContact O-CB 3.06Å; D213-M216 PolarHBondContact O-N 3.25Å; D213-M216 VanDerWaalsContact O-N 3.16Å; M216-E218 PolarHBondContact O-N 3.44Å; M216-L221 HydrophobicContact CE-CD2 3.92Å; M216-L221 HydrophobicContact SD-CD2 3.55Å; M216-L221 VanDerWaalsContact SD-CD2 3.55Å
217	N	85.9	Confident	88.1	Confident	85 Å²	85	67.2 Å²	67.2	46%	0.455	34%	0.339	S	S	.	.			trans	-74.2	106.6	171.1	-174.9	0.6	0	0	0	111.2	Q219 D220 L221	N217-Q219 VanDerWaalsContact C-N 3.26Å; N217-Q219 PolarHBondContact O-N 3.19Å; N217-Q219 WeakPolarHBondContact OD1-CB 3.35Å; N217-Q219 PolarHBondContact OD1-N 3.32Å; N217-Q219 VanDerWaalsContact OD1-N 3.13Å; N217-D220 HydrophobicContact CB-CB 4.17Å; N217-D220 PolarHBondContact ND2-OD2 3.26Å; N217-D220 PolarHBondContact O-N 3.05Å; N217-L221 PolarHBondContact O-N 2.96Å
218	E	85.8	Confident	88.4	Confident	50 Å²	50	70.2 Å²	70.2	23%	0.234	35%	0.348	C	S	.	.	H	α-helix	trans	-50.6	-44.1	176.9	-60.2	-165.9	144.9	0	0	113.1	T210 M216 L221 F222	T210-E218 WeakPolarHBondContact CB-OE1 3.21Å; T210-E218 HydrophobicContact CG2-CG 3.63Å; T210-E218 VanDerWaalsContact OG1-CG 3.26Å; T210-E218 WeakPolarHBondContact OG1-CG 3.48Å; T210-E218 PolarHBondContact OG1-OE1 3.36Å; M216-E218 PolarHBondContact O-N 3.44Å; E218-L221 PolarHBondContact O-N 2.92Å; E218-F222 VanDerWaalsContact O-CB 3.25Å; E218-F222 WeakPolarHBondContact O-CB 3.32Å; E218-F222 PolarHBondContact O-N 3.24Å
219	Q	90.5	Very high	88.7	Confident	71 Å²	71	68.5 Å²	68.5	33%	0.332	34%	0.343	S	S	.	.	H	α-helix	trans	-66.9	-41.2	-175.1	179.2	64.8	6.5	0	0	110.7	N217 N223	N217-Q219 VanDerWaalsContact C-N 3.26Å; N217-Q219 PolarHBondContact O-N 3.19Å; N217-Q219 WeakPolarHBondContact OD1-CB 3.35Å; N217-Q219 PolarHBondContact OD1-N 3.32Å; N217-Q219 VanDerWaalsContact OD1-N 3.13Å; Q219-N223 PolarHBondContact NE2-ND2 2.77Å; Q219-N223 VanDerWaalsContact NE2-ND2 3.11Å; Q219-N223 WeakPolarHBondContact O-CB 3.2Å; Q219-N223 PolarHBondContact O-N 3.36Å; Q219-N223 PolarHBondContact O-ND2 2.92Å
220	D	90.9	Very high	89.1	Confident	101 Å²	101	71 Å²	71	54%	0.54	35%	0.354	S	S	.	.	H	α-helix	trans	-72.6	-39.9	178.7	-68.9	-22.4	0	0	0	111.9	N217 R224	N217-D220 HydrophobicContact CB-CB 4.17Å; N217-D220 PolarHBondContact ND2-OD2 3.26Å; N217-D220 PolarHBondContact O-N 3.05Å; D220-R224 WeakPolarHBondContact O-CB 3.28Å; D220-R224 PolarHBondContact O-N 3.35Å
221	L	91.1	Very high	89.7	Confident	23 Å²	23	77.8 Å²	77.8	12%	0.12	38%	0.376	C	S	.	.	H	α-helix	trans	-60.7	-51.4	173.2	175.8	62.2	0	0	0	110.7	M206 M209 M216 N217 E218 N223 R224 Q225 P285	M206-L221 HydrophobicContact CE-CD2 4.22Å; M209-L221 HydrophobicContact CE-CD2 4.03Å; M216-L221 HydrophobicContact CE-CD2 3.92Å; M216-L221 HydrophobicContact SD-CD2 3.55Å; M216-L221 VanDerWaalsContact SD-CD2 3.55Å; N217-L221 PolarHBondContact O-N 2.96Å; E218-L221 PolarHBondContact O-N 2.92Å; L221-N223 PolarHBondContact O-N 3.23Å; L221-R224 PolarHBondContact O-N 3.27Å; L221-Q225 HydrophobicContact CD1-CG 3.87Å; L221-Q225 HydrophobicContact CG-CG 4.43Å; L221-Q225 VanDerWaalsContact O-CG 3.25Å; L221-Q225 WeakPolarHBondContact O-CG 3.49Å; L221-Q225 PolarHBondContact O-N 3.33Å; L221-P285 HydrophobicContact CD2-CG 4.14Å
222	F	94.6	Very high	90.1	Very high	4 Å²	4	76.4 Å²	76.4	2%	0.018	37%	0.369	C	S	.	.	H	α-helix	trans	-59.8	-48.3	-179.7	-179.5	-100.2	0	0	0	111.2	E197 R201 M206 E218 R224 Q225 R226 A279 A282	E197-F222 HydrophobicContact CB-CE1 4.06Å; E197-F222 HydrophobicContact CB-CZ 4.29Å; E197-F222 HydrophobicContact CG-CE1 4.28Å; E197-F222 HydrophobicContact CG-CZ 4.4Å; E197-F222 WeakPolarHBondContact O-CZ 3.22Å; R201-F222 HydrophobicContact CB-CB 4.41Å; R201-F222 HydrophobicContact CB-CD1 4.15Å; R201-F222 HydrophobicContact CB-CD2 4.09Å; R201-F222 HydrophobicContact CB-CE1 4.49Å; R201-F222 HydrophobicContact CB-CE2 4.44Å; R201-F222 HydrophobicContact CB-CG 3.94Å; R201-F222 HydrophobicContact CG-CB 4.31Å; R201-F222 HydrophobicContact CG-CG 4.36Å; M206-F222 HydrophobicContact CE-CB 4.19Å; E218-F222 VanDerWaalsContact O-CB 3.25Å; E218-F222 WeakPolarHBondContact O-CB 3.32Å; E218-F222 PolarHBondContact O-N 3.24Å; F222-R224 PolarHBondContact O-N 2.82Å; F222-Q225 PolarHBondContact O-N 2.82Å; F222-R226 VanDerWaalsContact O-CB 3.27Å; F222-R226 WeakPolarHBondContact O-CB 3.31Å; F222-R226 PolarHBondContact O-N 3.26Å; F222-A279 HydrophobicContact CZ-CB 4.3Å; F222-A282 HydrophobicContact CD2-CB 3.92Å; F222-A282 HydrophobicContact CE2-CB 3.66Å; F222-A282 HydrophobicContact CZ-CB 4.29Å
223	N	95.3	Very high	90.7	Very high	41 Å²	41	74.1 Å²	74.1	22%	0.219	36%	0.357	C	S	.	.	H	α-helix	trans	-60.1	-42.7	178	-75.4	-32.9	0	0	0	112.7	Q219 L221 R226 L227	Q219-N223 PolarHBondContact NE2-ND2 2.77Å; Q219-N223 VanDerWaalsContact NE2-ND2 3.11Å; Q219-N223 WeakPolarHBondContact O-CB 3.2Å; Q219-N223 PolarHBondContact O-N 3.36Å; Q219-N223 PolarHBondContact O-ND2 2.92Å; L221-N223 PolarHBondContact O-N 3.23Å; N223-R226 PolarHBondContact OD1-NH2 2.89Å; N223-L227 VanDerWaalsContact O-CB 3.3Å; N223-L227 WeakPolarHBondContact O-CB 3.34Å; N223-L227 PolarHBondContact O-N 3.16Å
224	R	94.4	Very high	91.4	Very high	197 Å²	197	72 Å²	72	74%	0.743	35%	0.347	S	S	*	.	H	α-helix	trans	-64	-41.8	177.7	-176.2	178	178.6	-171.6	-0	112.1	D220 L221 F222 R228	D220-R224 WeakPolarHBondContact O-CB 3.28Å; D220-R224 PolarHBondContact O-N 3.35Å; L221-R224 PolarHBondContact O-N 3.27Å; F222-R224 PolarHBondContact O-N 2.82Å; R224-R228 WeakPolarHBondContact O-CB 3.48Å; R224-R228 PolarHBondContact O-N 3.33Å; R224-R228 VanDerWaalsContact O-N 3.09Å
225	Q	94.9	Very high	92.4	Very high	11 Å²	11	73.9 Å²	73.9	5%	0.051	34%	0.343	C	S	.	.	H	α-helix	trans	-74.5	-40	179.4	-61.4	-75.2	14.2	0	0	111.7	L221 F222 R228 H229 A282 P285 N287	L221-Q225 HydrophobicContact CD1-CG 3.87Å; L221-Q225 HydrophobicContact CG-CG 4.43Å; L221-Q225 VanDerWaalsContact O-CG 3.25Å; L221-Q225 WeakPolarHBondContact O-CG 3.49Å; L221-Q225 PolarHBondContact O-N 3.33Å; F222-Q225 PolarHBondContact O-N 2.82Å; Q225-R228 WeakPolarHBondContact O-CB 3.35Å; Q225-R228 PolarHBondContact O-N 3.34Å; Q225-H229 PolarHBondContact O-CD2 2.86Å; Q225-H229 PolarHBondContact O-N 2.83Å; Q225-A282 HydrophobicContact CB-CB 4.03Å; Q225-P285 HydrophobicContact CG-CB 3.88Å; Q225-N287 PolarHBondContact NE2-ND2 3.09Å; Q225-N287 VanDerWaalsContact NE2-ND2 3.2Å; Q225-N287 PolarHBondContact NE2-OD1 3.09Å
226	R	96.7	Very high	93.3	Very high	71 Å²	71	72.8 Å²	72.8	27%	0.268	32%	0.319	S	S	.	.	H	α-helix	trans	-57.4	-49.5	172.1	177.5	-177.2	57.9	149.7	-8.1	111	E197 F222 N223 R228 H229 F230 A282	E197-R226 WeakPolarHBondContact OE1-CD 3.19Å; E197-R226 IonicContact OE1-CZ 2.9Å; E197-R226 IonicContact OE1-NE 3.68Å; E197-R226 IonicContact OE1-NH1 3.35Å; E197-R226 PolarHBondContact OE1-NH1 2.79Å; E197-R226 IonicContact OE2-CZ 2.71Å; E197-R226 IonicContact OE2-NH1 2.69Å; E197-R226 PolarHBondContact OE2-NH1 3.5Å; F222-R226 VanDerWaalsContact O-CB 3.27Å; F222-R226 WeakPolarHBondContact O-CB 3.31Å; F222-R226 PolarHBondContact O-N 3.26Å; N223-R226 PolarHBondContact OD1-NH2 2.89Å; R226-R228 VanDerWaalsContact C-N 3.32Å; R226-R228 PolarHBondContact O-N 3.43Å; R226-H229 PolarHBondContact O-N 3.29Å; R226-F230 VanDerWaalsContact O-CB 3.24Å; R226-F230 WeakPolarHBondContact O-CB 3.39Å; R226-F230 PolarHBondContact O-N 3.43Å; R226-A282 HydrophobicContact CB-CB 3.85Å
227	L	97	Very high	94.2	Very high	83 Å²	83	71 Å²	71	44%	0.435	31%	0.31	S	S	.	.	H	α-helix	trans	-66.5	-32.8	179.7	-176.5	59.1	0	0	0	112.7	N223 R231	N223-L227 VanDerWaalsContact O-CB 3.3Å; N223-L227 WeakPolarHBondContact O-CB 3.34Å; N223-L227 PolarHBondContact O-N 3.16Å; L227-R231 WeakPolarHBondContact O-CD 3.19Å; L227-R231 VanDerWaalsContact O-CG 3.24Å; L227-R231 WeakPolarHBondContact O-CG 3.28Å; L227-R231 PolarHBondContact O-N 3.24Å
228	R	96.6	Very high	94.6	Very high	142 Å²	142	68.9 Å²	68.9	54%	0.536	30%	0.299	S	S	.	.	H	α-helix	trans	-62.8	-59.5	171.1	175.3	-173.4	171.7	166.7	2.9	110.7	R224 Q225 R226 F230 R231 E232	R224-R228 WeakPolarHBondContact O-CB 3.48Å; R224-R228 PolarHBondContact O-N 3.33Å; R224-R228 VanDerWaalsContact O-N 3.09Å; Q225-R228 WeakPolarHBondContact O-CB 3.35Å; Q225-R228 PolarHBondContact O-N 3.34Å; R226-R228 VanDerWaalsContact C-N 3.32Å; R226-R228 PolarHBondContact O-N 3.43Å; R228-F230 VanDerWaalsContact C-N 3.28Å; R228-F230 PolarHBondContact O-N 3.06Å; R228-R231 PolarHBondContact O-N 3.09Å; R228-E232 IonicContact NE-OE2 3.71Å; R228-E232 WeakPolarHBondContact O-CB 3.28Å; R228-E232 PolarHBondContact O-N 2.88Å
229	H	97.3	Very high	95	Very high	17 Å²	17	67 Å²	67	8%	0.079	29%	0.291	C	S	.	.	H	α-helix	trans	-58.9	-39.9	-178.4	-72.5	-47	0	0	0	111.9	Q225 R226 R231 E232 F233 A278 A281 A282 R312	Q225-H229 PolarHBondContact O-CD2 2.86Å; Q225-H229 PolarHBondContact O-N 2.83Å; R226-H229 PolarHBondContact O-N 3.29Å; H229-R231 PolarHBondContact O-N 3.16Å; H229-E232 PolarHBondContact O-N 3.03Å; H229-F233 HydrophobicContact CB-CD2 4.25Å; H229-F233 HydrophobicContact CB-CE2 3.81Å; H229-F233 HydrophobicContact CB-CZ 4.09Å; H229-F233 AromaticContact ND1-CZ 3.92Å; H229-F233 WeakPolarHBondContact O-CB 3.39Å; H229-F233 WeakPolarHBondContact O-CD2 3.48Å; H229-F233 WeakPolarHBondContact O-CG 3.32Å; H229-F233 PolarHBondContact O-N 3.44Å; H229-A278 HydrophobicContact CB-CB 3.85Å; H229-A281 VanDerWaalsContact CD2-C 3.43Å; H229-A281 PolarHBondContact NE2-O 2.88Å; H229-A282 PolarHBondContact CD2-N 2.93Å; H229-A282 PolarHBondContact NE2-N 3.4Å; H229-R312 PolarHBondContact CE1-NH2 3.16Å; H229-R312 PolarHBondContact NE2-NH2 3.48Å
230	F	97.6	Very high	94.9	Very high	55 Å²	55	66.7 Å²	66.7	24%	0.241	31%	0.306	C	S	.	.	H	α-helix	trans	-62.1	-42.8	177.9	177.7	-115	0	0	0	112.3	R226 R228 S234 V274 E275 A278	R226-F230 VanDerWaalsContact O-CB 3.24Å; R226-F230 WeakPolarHBondContact O-CB 3.39Å; R226-F230 PolarHBondContact O-N 3.43Å; R228-F230 VanDerWaalsContact C-N 3.28Å; R228-F230 PolarHBondContact O-N 3.06Å; F230-S234 WeakPolarHBondContact CE2-OG 3.5Å; F230-S234 WeakPolarHBondContact O-CB 3.49Å; F230-S234 PolarHBondContact O-N 2.98Å; F230-S234 PolarHBondContact O-OG 3.05Å; F230-V274 HydrophobicContact CD2-CG1 4Å; F230-V274 HydrophobicContact CE2-CG1 4.09Å; F230-E275 HydrophobicContact CD2-CG 3.7Å; F230-E275 HydrophobicContact CE2-CG 3.37Å; F230-E275 HydrophobicContact CZ-CG 4.03Å; F230-A278 HydrophobicContact CB-CB 3.78Å
231	R	97.3	Very high	95.1	Very high	170 Å²	170	65 Å²	65	64%	0.642	30%	0.299	S	S	*	.	H	α-helix	trans	-64.6	-40.8	174.8	-71.1	168	179	-173.4	-0.8	111.9	L227 R228 H229 R235	L227-R231 WeakPolarHBondContact O-CD 3.19Å; L227-R231 VanDerWaalsContact O-CG 3.24Å; L227-R231 WeakPolarHBondContact O-CG 3.28Å; L227-R231 PolarHBondContact O-N 3.24Å; R228-R231 PolarHBondContact O-N 3.09Å; H229-R231 PolarHBondContact O-N 3.16Å; R231-R235 WeakPolarHBondContact O-CB 3.49Å; R231-R235 PolarHBondContact O-N 3.35Å; R231-R235 VanDerWaalsContact O-N 3.16Å
232	E	96	Very high	95.2	Very high	78 Å²	78	67.3 Å²	67.3	36%	0.364	32%	0.318	S	S	.	.	H	α-helix	trans	-65.4	-53.1	-179.4	-173.2	160.8	-172	0	0	111.7	R228 H229 R235 Q236	R228-E232 IonicContact NE-OE2 3.71Å; R228-E232 WeakPolarHBondContact O-CB 3.28Å; R228-E232 PolarHBondContact O-N 2.88Å; H229-E232 PolarHBondContact O-N 3.03Å; E232-R235 WeakPolarHBondContact O-CB 3.41Å; E232-R235 PolarHBondContact O-N 3.02Å; E232-Q236 PolarHBondContact O-N 3.5Å
233	F	97.1	Very high	95.1	Very high	9 Å²	9	72.3 Å²	72.3	4%	0.039	34%	0.341	C	S	.	.	H	α-helix	trans	-69.1	-34.7	178.2	-58.6	-18.7	0	0	0	112.4	W49 H229 R235 Q236 F237 V274 L277 A278 A281	W49-F233 HydrophobicContact CH2-CZ 4.5Å; W49-F233 HydrophobicContact CZ3-CE1 4.2Å; W49-F233 HydrophobicContact CZ3-CE2 4.38Å; W49-F233 AromaticContact CZ3-CZ 3.67Å; W49-F233 HydrophobicContact CZ3-CZ 3.67Å; H229-F233 HydrophobicContact CB-CD2 4.25Å; H229-F233 HydrophobicContact CB-CE2 3.81Å; H229-F233 HydrophobicContact CB-CZ 4.09Å; H229-F233 AromaticContact ND1-CZ 3.92Å; H229-F233 WeakPolarHBondContact O-CB 3.39Å; H229-F233 WeakPolarHBondContact O-CD2 3.48Å; H229-F233 WeakPolarHBondContact O-CG 3.32Å; H229-F233 PolarHBondContact O-N 3.44Å; F233-R235 VanDerWaalsContact C-N 3.32Å; F233-R235 PolarHBondContact O-N 3.44Å; F233-Q236 PolarHBondContact O-N 3.38Å; F233-Q236 VanDerWaalsContact O-N 3.16Å; F233-F237 HydrophobicContact CB-CD2 3.84Å; F233-F237 HydrophobicContact CB-CE2 3.91Å; F233-F237 HydrophobicContact CD1-CE2 4.2Å; F233-F237 HydrophobicContact CG-CE2 4.13Å; F233-F237 VanDerWaalsContact O-CD2 3.28Å; F233-F237 WeakPolarHBondContact O-CD2 3.33Å; F233-F237 PolarHBondContact O-N 3.34Å; F233-V274 HydrophobicContact CB-CG1 3.71Å; F233-L277 HydrophobicContact CD2-CB 4.24Å; F233-L277 HydrophobicContact CD2-CD2 4.08Å; F233-L277 HydrophobicContact CD2-CG 3.94Å; F233-L277 HydrophobicContact CE2-CB 4.48Å; F233-L277 HydrophobicContact CE2-CD2 4.33Å; F233-L277 HydrophobicContact CE2-CG 3.89Å; F233-A278 HydrophobicContact CD2-CB 4.13Å; F233-A278 HydrophobicContact CE2-CB 4.43Å; F233-A281 HydrophobicContact CE2-CB 4.06Å; F233-A281 HydrophobicContact CZ-CB 4.16Å
234	S	96.8	Very high	95	Very high	26 Å²	26	74 Å²	74	18%	0.182	35%	0.348	C	S	.	.	H	α-helix	trans	-59.5	-42.7	172.2	-69.1	0	0	0	0	111.8	F230 Q236 L238	F230-S234 WeakPolarHBondContact CE2-OG 3.5Å; F230-S234 WeakPolarHBondContact O-CB 3.49Å; F230-S234 PolarHBondContact O-N 2.98Å; F230-S234 PolarHBondContact O-OG 3.05Å; S234-Q236 PolarHBondContact O-N 2.92Å; S234-L238 WeakPolarHBondContact O-CB 3.28Å; S234-L238 PolarHBondContact O-N 3.13Å
235	R	94	Very high	95	Very high	203 Å²	203	64.7 Å²	64.7	77%	0.766	31%	0.313	S	S	*	.	H	α-helix	trans	-65.3	-26.5	177.6	-170.9	-172.5	67.3	113.8	1.7	112.9	R231 E232 F233	R231-R235 WeakPolarHBondContact O-CB 3.49Å; R231-R235 PolarHBondContact O-N 3.35Å; R231-R235 VanDerWaalsContact O-N 3.16Å; E232-R235 WeakPolarHBondContact O-CB 3.41Å; E232-R235 PolarHBondContact O-N 3.02Å; F233-R235 VanDerWaalsContact C-N 3.32Å; F233-R235 PolarHBondContact O-N 3.44Å
236	Q	92.5	Very high	94.9	Very high	49 Å²	49	66.7 Å²	66.7	23%	0.229	32%	0.321	C	S	.	.	H	α-helix	trans	-92.6	-40.3	-176.8	-175.4	168.2	-11.5	0	0	113.6	E51 V52 R112 E232 F233 S234	E51-Q236 PolarHBondContact OE1-NE2 2.85Å; V52-Q236 VanDerWaalsContact CG1-NE2 3.29Å; R112-Q236 PolarHBondContact NH2-O 2.99Å; E232-Q236 PolarHBondContact O-N 3.5Å; F233-Q236 PolarHBondContact O-N 3.38Å; F233-Q236 VanDerWaalsContact O-N 3.16Å; S234-Q236 PolarHBondContact O-N 2.92Å
237	F	95.3	Very high	94.6	Very high	4 Å²	4	66.2 Å²	66.2	2%	0.018	32%	0.322	C	S	.	.	H	α-helix	trans	-108.6	-23.2	-170.1	-52.9	-54.9	0	0	0	114.4	L48 E51 V52 W133 F233 V274 L277	L48-F237 HydrophobicContact CB-CE1 4.27Å; L48-F237 HydrophobicContact CB-CE2 4.37Å; L48-F237 HydrophobicContact CB-CZ 4.14Å; L48-F237 HydrophobicContact CD2-CB 4.17Å; L48-F237 HydrophobicContact CD2-CD1 3.49Å; L48-F237 VanDerWaalsContact CD2-CD1 3.49Å; L48-F237 HydrophobicContact CD2-CD2 4.36Å; L48-F237 HydrophobicContact CD2-CE1 3.88Å; L48-F237 HydrophobicContact CD2-CG 3.76Å; L48-F237 HydrophobicContact CD2-CZ 4.47Å; L48-F237 WeakPolarHBondContact O-CZ 3.33Å; E51-F237 HydrophobicContact CB-CE1 4.12Å; E51-F237 HydrophobicContact CG-CE1 4.47Å; V52-F237 HydrophobicContact CG1-CZ 4.11Å; W133-F237 HydrophobicContact CZ2-CB 4.21Å; W133-F237 PolarHBondContact NE1-O 2.9Å; F233-F237 HydrophobicContact CB-CD2 3.84Å; F233-F237 HydrophobicContact CB-CE2 3.91Å; F233-F237 HydrophobicContact CD1-CE2 4.2Å; F233-F237 HydrophobicContact CG-CE2 4.13Å; F233-F237 VanDerWaalsContact O-CD2 3.28Å; F233-F237 WeakPolarHBondContact O-CD2 3.33Å; F233-F237 PolarHBondContact O-N 3.34Å; F237-V274 HydrophobicContact CB-CG2 4.14Å; F237-V274 HydrophobicContact CD2-CG2 4.37Å; F237-L277 HydrophobicContact CE2-CD2 3.98Å
238	L	95.3	Very high	94.2	Very high	42 Å²	42	62.4 Å²	62.4	22%	0.22	30%	0.302	C	S	.	.	S	Bend	trans	-99.6	141.9	-179.1	-54.9	179.1	0	0	0	111.5	W133 S234 M270 A271 V274	W133-L238 HydrophobicContact CZ2-CD2 4.04Å; S234-L238 WeakPolarHBondContact O-CB 3.28Å; S234-L238 PolarHBondContact O-N 3.13Å; L238-M270 HydrophobicContact CD2-CB 3.73Å; L238-M270 HydrophobicContact CD2-CE 4.4Å; L238-A271 HydrophobicContact CD1-CB 4.41Å; L238-V274 HydrophobicContact CD1-CB 4.47Å; L238-V274 HydrophobicContact CD1-CG1 4.46Å; L238-V274 HydrophobicContact CD2-CG2 3.92Å; L238-V274 HydrophobicContact CG-CG2 4.12Å
239	V	93.4	Very high	94	Very high	10 Å²	10	55.7 Å²	55.7	6%	0.061	28%	0.277	C	S	.	.			trans	-85	121.7	174	-177.5	0	0	0	0	109.4	Q244 H245 I248 R267	V239-Q244 HydrophobicContact CG1-CB 3.74Å; V239-H245 HydrophobicContact CB-CB 3.85Å; V239-H245 HydrophobicContact CG1-CB 3.78Å; V239-H245 HydrophobicContact CG2-CB 4.44Å; V239-I248 HydrophobicContact CG1-CD1 4.01Å; V239-I248 HydrophobicContact CG2-CD1 3.9Å; V239-R267 PolarHBondContact O-NH1 3.43Å; V239-R267 VanDerWaalsContact O-NH1 3.09Å; V239-R267 PolarHBondContact O-NH2 3.03Å
240	G	89.4	Confident	93.6	Very high	64 Å²	64	59.4 Å²	59.4	66%	0.66	30%	0.296	S	S	*	.	S	Bend	trans	-48.5	-68.4	-170.4	0	0	0	0	0	114.2	R267	G240-R267 PolarHBondContact O-NH2 3.41Å
241	T	93.7	Very high	92.9	Very high	65 Å²	65	60.7 Å²	60.7	40%	0.399	30%	0.303	S	S	.	.	S	Bend	trans	-89	160.8	179.3	76.2	0	0	0	0	112.6	Q244 H245 R267	T241-Q244 WeakPolarHBondContact OG1-CB 3.18Å; T241-Q244 VanDerWaalsContact OG1-CG 3.27Å; T241-Q244 WeakPolarHBondContact OG1-CG 3.41Å; T241-Q244 PolarHBondContact OG1-N 2.78Å; T241-Q244 VanDerWaalsContact OG1-N 3.09Å; T241-Q244 PolarHBondContact OG1-OE1 3.4Å; T241-H245 PolarHBondContact O-N 3.46Å; T241-R267 PolarHBondContact O-NH1 3.29Å
242	S	94.2	Very high	92.2	Very high	72 Å²	72	52.6 Å²	52.6	50%	0.503	27%	0.272	S	S	.	.	H	α-helix	trans	-63.3	-44	169	46.5	0	0	0	0	111.6	H245 K246 F263	S242-H245 PolarHBondContact O-N 3Å; S242-K246 PolarHBondContact O-N 2.85Å; S242-F263 WeakPolarHBondContact O-CZ 3.39Å
243	Q	93.1	Very high	91.7	Very high	109 Å²	109	50 Å²	50	51%	0.509	27%	0.267	S	S	.	.	H	α-helix	trans	-60.6	-52.2	-178	-177.8	58.3	26.1	0	0	112.4	H245 K246 E247	Q243-H245 PolarHBondContact O-N 3.13Å; Q243-K246 PolarHBondContact O-N 2.99Å; Q243-E247 WeakPolarHBondContact CG-OE1 3.27Å; Q243-E247 PolarHBondContact NE2-OE1 2.95Å; Q243-E247 WeakPolarHBondContact O-CG 3.44Å; Q243-E247 PolarHBondContact O-N 2.91Å
244	Q	91.8	Very high	91.3	Very high	76 Å²	76	50.7 Å²	50.7	36%	0.355	27%	0.271	S	S	.	.	H	α-helix	trans	-56.2	-35.2	176.2	-74	165.3	-21.4	0	0	112.3	V239 T241 E247 I248	V239-Q244 HydrophobicContact CG1-CB 3.74Å; T241-Q244 WeakPolarHBondContact OG1-CB 3.18Å; T241-Q244 VanDerWaalsContact OG1-CG 3.27Å; T241-Q244 WeakPolarHBondContact OG1-CG 3.41Å; T241-Q244 PolarHBondContact OG1-N 2.78Å; T241-Q244 VanDerWaalsContact OG1-N 3.09Å; T241-Q244 PolarHBondContact OG1-OE1 3.4Å; Q244-E247 WeakPolarHBondContact CA-OE2 3.03Å; Q244-I248 VanDerWaalsContact O-CG1 3.31Å; Q244-I248 WeakPolarHBondContact O-CG1 3.34Å; Q244-I248 PolarHBondContact O-N 3.23Å
245	H	94.4	Very high	90.9	Very high	2 Å²	2	54.4 Å²	54.4	1%	0.009	29%	0.285	C	S	.	.	H	α-helix	trans	-73.4	-38.8	178.7	-166.6	-177.4	0	0	0	111.5	P134 V239 T241 S242 Q243 E247 I248 L249 F263 R267 M270	P134-H245 PolarHBondContact O-NE2 2.86Å; P134-H245 VanDerWaalsContact O-NE2 3.09Å; V239-H245 HydrophobicContact CB-CB 3.85Å; V239-H245 HydrophobicContact CG1-CB 3.78Å; V239-H245 HydrophobicContact CG2-CB 4.44Å; T241-H245 PolarHBondContact O-N 3.46Å; S242-H245 PolarHBondContact O-N 3Å; Q243-H245 PolarHBondContact O-N 3.13Å; H245-E247 VanDerWaalsContact C-N 3.32Å; H245-E247 PolarHBondContact O-N 2.94Å; H245-I248 PolarHBondContact O-N 2.92Å; H245-L249 WeakPolarHBondContact O-CB 3.46Å; H245-L249 VanDerWaalsContact O-CG 3.27Å; H245-L249 WeakPolarHBondContact O-CG 3.43Å; H245-L249 PolarHBondContact O-N 3.33Å; H245-F263 HydrophobicContact CB-CE2 4.18Å; H245-F263 HydrophobicContact CB-CZ 4.13Å; H245-R267 VanDerWaalsContact CB-NH1 3.3Å; H245-R267 PolarHBondContact ND1-NH1 2.94Å; H245-M270 VanDerWaalsContact CE1-SD 3.54Å
246	K	93.7	Very high	90.7	Very high	53 Å²	53	50.8 Å²	50.8	23%	0.23	28%	0.282	C	S	.	.	H	α-helix	trans	-63.5	-39.5	172.2	-65.6	-165.3	-178.1	-156.2	0	111.2	S242 Q243 L249 I250 C258 E260 F263	S242-K246 PolarHBondContact O-N 2.85Å; Q243-K246 PolarHBondContact O-N 2.99Å; K246-L249 PolarHBondContact O-N 3.1Å; K246-I250 WeakPolarHBondContact O-CB 3.19Å; K246-I250 WeakPolarHBondContact O-CD1 3.47Å; K246-I250 VanDerWaalsContact O-CG1 3.22Å; K246-I250 WeakPolarHBondContact O-CG1 3.3Å; K246-I250 PolarHBondContact O-N 3.43Å; K246-C258 HydrophobicContact CB-CB 4.48Å; K246-C258 HydrophobicContact CD-CB 4.15Å; K246-C258 WeakPolarHBondContact CE-O 3.37Å; K246-C258 HydrophobicContact CG-CB 4.16Å; K246-C258 PolarHBondContact NZ-O 3.42Å; K246-E260 IonicContact NZ-OE1 2.75Å; K246-E260 PolarHBondContact NZ-OE1 3.05Å; K246-F263 HydrophobicContact CD-CD2 4.47Å; K246-F263 HydrophobicContact CD-CE1 4.34Å; K246-F263 HydrophobicContact CD-CE2 4.31Å; K246-F263 HydrophobicContact CD-CZ 4.22Å; K246-F263 VanDerWaalsContact CE-CG 3.41Å; K246-F263 HydrophobicContact CG-CD2 3.94Å; K246-F263 HydrophobicContact CG-CE1 4.14Å; K246-F263 HydrophobicContact CG-CE2 3.43Å; K246-F263 VanDerWaalsContact CG-CE2 3.43Å; K246-F263 HydrophobicContact CG-CG 4.47Å; K246-F263 HydrophobicContact CG-CZ 3.53Å
247	E	90.4	Very high	90.6	Very high	61 Å²	61	50.5 Å²	50.5	29%	0.285	28%	0.281	S	S	.	.	H	α-helix	trans	-61	-49	175.6	-71.2	160.3	179.4	0	0	112.5	Q243 Q244 H245 L249 I250 Q251	Q243-E247 WeakPolarHBondContact CG-OE1 3.27Å; Q243-E247 PolarHBondContact NE2-OE1 2.95Å; Q243-E247 WeakPolarHBondContact O-CG 3.44Å; Q243-E247 PolarHBondContact O-N 2.91Å; Q244-E247 WeakPolarHBondContact CA-OE2 3.03Å; H245-E247 VanDerWaalsContact C-N 3.32Å; H245-E247 PolarHBondContact O-N 2.94Å; E247-L249 PolarHBondContact O-N 3.28Å; E247-I250 PolarHBondContact O-N 3.48Å; E247-Q251 WeakPolarHBondContact O-CG 3.38Å; E247-Q251 PolarHBondContact O-N 3.2Å
248	I	89.3	Confident	90.5	Very high	4 Å²	4	51.1 Å²	51.1	2%	0.021	29%	0.286	C	S	.	.	H	α-helix	trans	-59.1	-46.9	175	-71.6	167.9	0	0	0	111.2	D136 L142 V239 Q244 H245 I250 Q251 M252	D136-I248 HydrophobicContact CB-CD1 4.25Å; L142-I248 HydrophobicContact CD1-CD1 4.19Å; L142-I248 HydrophobicContact CD2-CD1 4.05Å; L142-I248 HydrophobicContact CG-CD1 4.02Å; V239-I248 HydrophobicContact CG1-CD1 4.01Å; V239-I248 HydrophobicContact CG2-CD1 3.9Å; Q244-I248 VanDerWaalsContact O-CG1 3.31Å; Q244-I248 WeakPolarHBondContact O-CG1 3.34Å; Q244-I248 PolarHBondContact O-N 3.23Å; H245-I248 PolarHBondContact O-N 2.92Å; I248-I250 PolarHBondContact O-N 2.89Å; I248-Q251 PolarHBondContact O-N 3.27Å; I248-M252 HydrophobicContact CG2-CG 4.47Å; I248-M252 HydrophobicContact CG2-SD 3.44Å; I248-M252 WeakPolarHBondContact CG2-SD 3.38Å; I248-M252 WeakPolarHBondContact O-CB 3.35Å; I248-M252 VanDerWaalsContact O-CG 3.23Å; I248-M252 WeakPolarHBondContact O-CG 3.39Å; I248-M252 PolarHBondContact O-N 2.94Å
249	L	91.1	Very high	90.4	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-62.8	-40.4	-179.9	-72.6	170.7	0	0	0	112.4	P134 H245 K246 E247 M252 G253 L254 L257 C258 F263 L266	P134-L249 HydrophobicContact CB-CD2 4.16Å; H245-L249 WeakPolarHBondContact O-CB 3.46Å; H245-L249 VanDerWaalsContact O-CG 3.27Å; H245-L249 WeakPolarHBondContact O-CG 3.43Å; H245-L249 PolarHBondContact O-N 3.33Å; K246-L249 PolarHBondContact O-N 3.1Å; E247-L249 PolarHBondContact O-N 3.28Å; L249-M252 CarbonylContact O-C 3.53Å; L249-M252 PolarHBondContact O-N 3.43Å; L249-G253 PolarHBondContact O-N 2.96Å; L249-L254 HydrophobicContact CB-CB 4.27Å; L249-L254 HydrophobicContact CD2-CB 4.01Å; L249-L254 HydrophobicContact CD2-CD1 3.82Å; L249-L254 WeakPolarHBondContact O-CA 3.3Å; L249-L254 WeakPolarHBondContact O-CB 3.2Å; L249-L254 PolarHBondContact O-N 2.94Å; L249-L257 HydrophobicContact CD1-CB 4.31Å; L249-L257 HydrophobicContact CD2-CD1 4.38Å; L249-C258 VanDerWaalsContact CB-SG 3.55Å; L249-F263 HydrophobicContact CD1-CD2 4.03Å; L249-F263 HydrophobicContact CD1-CE2 3.99Å; L249-L266 HydrophobicContact CD1-CD2 3.95Å; L249-L266 HydrophobicContact CD2-CD2 4.43Å
250	I	88.9	Confident	90.4	Very high	95 Å²	95	56.9 Å²	56.9	49%	0.487	32%	0.317	S	S	.	.	H	α-helix	trans	-64.2	-45.7	175.5	-69	162.9	0	0	0	110.4	K246 E247 I248 M252 G253 E255	K246-I250 WeakPolarHBondContact O-CB 3.19Å; K246-I250 WeakPolarHBondContact O-CD1 3.47Å; K246-I250 VanDerWaalsContact O-CG1 3.22Å; K246-I250 WeakPolarHBondContact O-CG1 3.3Å; K246-I250 PolarHBondContact O-N 3.43Å; E247-I250 PolarHBondContact O-N 3.48Å; I248-I250 PolarHBondContact O-N 2.89Å; I250-M252 PolarHBondContact O-N 3.41Å; I250-G253 PolarHBondContact O-N 3.46Å; I250-E255 HydrophobicContact CG1-CB 4.13Å
251	Q	83.1	Confident	90.5	Very high	82 Å²	82	57.6 Å²	57.6	38%	0.383	31%	0.309	S	S	.	.	H	α-helix	trans	-63.8	-20.6	176	-68.5	174.2	16.6	0	0	113.3	M141 E247 I248	M141-Q251 HydrophobicContact CE-CB 3.86Å; M141-Q251 HydrophobicContact SD-CB 3.66Å; M141-Q251 PolarHBondContact SD-OE1 3.16Å; E247-Q251 WeakPolarHBondContact O-CG 3.38Å; E247-Q251 PolarHBondContact O-N 3.2Å; I248-Q251 PolarHBondContact O-N 3.27Å
252	M	83.9	Confident	90.5	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	5.4	173.9	-68	167.7	64	0	0	114	R113 F132 P137 M141 K174 I248 L249 I250 L254	R113-M252 HydrophobicContact CB-CE 3.81Å; R113-M252 HydrophobicContact CG-CE 4.41Å; R113-M252 PolarHBondContact NH1-O 3.49Å; F132-M252 HydrophobicContact CD2-CE 4.03Å; F132-M252 HydrophobicContact CE2-CE 3.43Å; F132-M252 VanDerWaalsContact CE2-CE 3.43Å; F132-M252 HydrophobicContact CZ-CE 4.22Å; P137-M252 HydrophobicContact CG-SD 4.5Å; M141-M252 HydrophobicContact CE-CG 4.15Å; M141-M252 HydrophobicContact SD-CG 4.18Å; K174-M252 PolarHBondContact NZ-O 2.87Å; I248-M252 HydrophobicContact CG2-CG 4.47Å; I248-M252 HydrophobicContact CG2-SD 3.44Å; I248-M252 WeakPolarHBondContact CG2-SD 3.38Å; I248-M252 WeakPolarHBondContact O-CB 3.35Å; I248-M252 VanDerWaalsContact O-CG 3.23Å; I248-M252 WeakPolarHBondContact O-CG 3.39Å; I248-M252 PolarHBondContact O-N 2.94Å; L249-M252 CarbonylContact O-C 3.53Å; L249-M252 PolarHBondContact O-N 3.43Å; I250-M252 PolarHBondContact O-N 3.41Å; M252-L254 VanDerWaalsContact C-N 3.33Å; M252-L254 HydrophobicContact CB-CD1 3.98Å; M252-L254 HydrophobicContact CB-CG 4.14Å; M252-L254 HydrophobicContact CE-CD1 3.99Å; M252-L254 PolarHBondContact O-N 3Å
253	G	84.6	Confident	90.6	Very high	25 Å²	25	58.5 Å²	58.5	26%	0.258	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.1	42.1	-175.8	0	0	0	0	0	112.2	K174 L249 I250	K174-G253 PolarHBondContact NZ-O 3.22Å; L249-G253 PolarHBondContact O-N 2.96Å; I250-G253 PolarHBondContact O-N 3.46Å
254	L	88.2	Confident	90.7	Very high	22 Å²	22	55.9 Å²	55.9	12%	0.115	29%	0.29	C	S	.	.			trans	-123.7	27.3	-179.9	-61	173.7	0	0	0	111.4	F132 V183 L249 M252 N256 L257	F132-L254 HydrophobicContact CE2-CD1 3.94Å; F132-L254 HydrophobicContact CZ-CD1 4.12Å; V183-L254 HydrophobicContact CG2-CD1 3.89Å; V183-L254 HydrophobicContact CG2-CD2 4.48Å; L249-L254 HydrophobicContact CB-CB 4.27Å; L249-L254 HydrophobicContact CD2-CB 4.01Å; L249-L254 HydrophobicContact CD2-CD1 3.82Å; L249-L254 WeakPolarHBondContact O-CA 3.3Å; L249-L254 WeakPolarHBondContact O-CB 3.2Å; L249-L254 PolarHBondContact O-N 2.94Å; M252-L254 VanDerWaalsContact C-N 3.33Å; M252-L254 HydrophobicContact CB-CD1 3.98Å; M252-L254 HydrophobicContact CB-CG 4.14Å; M252-L254 HydrophobicContact CE-CD1 3.99Å; M252-L254 PolarHBondContact O-N 3Å; L254-N256 PolarHBondContact O-N 2.97Å; L254-L257 HydrophobicContact CB-CD1 4.25Å; L254-L257 HydrophobicContact CD1-CD1 4.42Å; L254-L257 WeakPolarHBondContact O-CB 3.27Å; L254-L257 PolarHBondContact O-N 3.42Å
255	E	89.8	Confident	90.8	Very high	104 Å²	104	56.1 Å²	56.1	49%	0.486	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-54.7	-27.7	-177.8	62.2	-98.8	-151.7	0	0	114	I250 L257 C258	I250-E255 HydrophobicContact CG1-CB 4.13Å; E255-L257 PolarHBondContact O-N 2.89Å; E255-C258 VanDerWaalsContact O-CB 3.28Å; E255-C258 WeakPolarHBondContact O-CB 3.36Å; E255-C258 PolarHBondContact O-N 3.47Å
256	N	89.2	Confident	90.9	Very high	128 Å²	128	56.8 Å²	56.8	68%	0.684	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-58.5	-27.2	174	-66	-42.5	0	0	0	113.2	L254 C258	L254-N256 PolarHBondContact O-N 2.97Å; N256-C258 VanDerWaalsContact C-N 3.34Å
257	L	90.6	Very high	91	Very high	43 Å²	43	57.2 Å²	57.2	23%	0.225	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-82.7	-7.9	175.3	-60.3	-177.2	0	0	0	113.2	V183 L249 L254 E255 V259 F263 L266	V183-L257 HydrophobicContact CB-CD1 4.26Å; V183-L257 HydrophobicContact CG2-CD1 4.09Å; L249-L257 HydrophobicContact CD1-CB 4.31Å; L249-L257 HydrophobicContact CD2-CD1 4.38Å; L254-L257 HydrophobicContact CB-CD1 4.25Å; L254-L257 HydrophobicContact CD1-CD1 4.42Å; L254-L257 WeakPolarHBondContact O-CB 3.27Å; L254-L257 PolarHBondContact O-N 3.42Å; E255-L257 PolarHBondContact O-N 2.89Å; L257-V259 VanDerWaalsContact C-N 3.35Å; L257-F263 WeakPolarHBondContact O-CA 3.47Å; L257-F263 WeakPolarHBondContact O-CB 3.21Å; L257-F263 PolarHBondContact O-N 3.45Å; L257-L266 HydrophobicContact CB-CD2 4.32Å; L257-L266 HydrophobicContact CD1-CD1 4.41Å; L257-L266 HydrophobicContact CD1-CD2 4.3Å
258	C	92.6	Very high	91.3	Very high	17 Å²	17	59.1 Å²	59.1	12%	0.115	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-85.8	-6.6	178.1	-59.8	0	0	0	0	113.6	K246 L249 E255 N256	K246-C258 HydrophobicContact CB-CB 4.48Å; K246-C258 HydrophobicContact CD-CB 4.15Å; K246-C258 WeakPolarHBondContact CE-O 3.37Å; K246-C258 HydrophobicContact CG-CB 4.16Å; K246-C258 PolarHBondContact NZ-O 3.42Å; L249-C258 VanDerWaalsContact CB-SG 3.55Å; E255-C258 VanDerWaalsContact O-CB 3.28Å; E255-C258 WeakPolarHBondContact O-CB 3.36Å; E255-C258 PolarHBondContact O-N 3.47Å; N256-C258 VanDerWaalsContact C-N 3.34Å
259	V	92.9	Very high	91.6	Very high	83 Å²	83	60.6 Å²	60.6	50%	0.503	32%	0.317	S	S	.	.	S	Bend	trans	-84.7	141.2	179.1	-171.8	0	0	0	0	110.1	L257 Y262 F263	L257-V259 VanDerWaalsContact C-N 3.35Å; V259-Y262 WeakPolarHBondContact O-CA 3.47Å; V259-Y262 WeakPolarHBondContact O-CB 3.46Å; V259-Y262 PolarHBondContact O-N 2.83Å; V259-F263 PolarHBondContact O-N 2.8Å
260	E	93.3	Very high	91.9	Very high	90 Å²	90	60.7 Å²	60.7	42%	0.421	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	147.5	174.7	-53.4	-51.5	150.2	0	0	111.2	K246 Y262 F263 S264	K246-E260 IonicContact NZ-OE1 2.75Å; K246-E260 PolarHBondContact NZ-OE1 3.05Å; E260-Y262 VanDerWaalsContact C-N 3.35Å; E260-F263 WeakPolarHBondContact OE1-CB 3.45Å; E260-F263 WeakPolarHBondContact OE1-CD1 3.42Å; E260-S264 WeakPolarHBondContact OE2-CB 3.46Å; E260-S264 PolarHBondContact OE2-N 3.08Å; E260-S264 PolarHBondContact OE2-OG 2.96Å
261	P	92.9	Very high	92.3	Very high	78 Å²	78	57.4 Å²	57.4	51%	0.506	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	cis	-83.9	-0.2	2	35.8	-37	0	0	0	114	F263 S264 N265	P261-F263 VanDerWaalsContact C-N 3.34Å; P261-F263 PolarHBondContact O-N 3.01Å; P261-S264 PolarHBondContact O-N 3.32Å; P261-N265 WeakPolarHBondContact O-CB 3.49Å; P261-N265 VanDerWaalsContact O-CG 3.26Å; P261-N265 PolarHBondContact O-N 3.32Å; P261-N265 PolarHBondContact O-ND2 3.49Å
262	Y	92.5	Very high	93	Very high	150 Å²	150	54.4 Å²	54.4	59%	0.588	29%	0.294	S	S	*	.	H	α-helix	trans	-58.7	-42.8	-174.5	-55.6	-76.4	0	0	0	112.6	V259 E260 N265 L266	V259-Y262 WeakPolarHBondContact O-CA 3.47Å; V259-Y262 WeakPolarHBondContact O-CB 3.46Å; V259-Y262 PolarHBondContact O-N 2.83Å; E260-Y262 VanDerWaalsContact C-N 3.35Å; Y262-N265 PolarHBondContact O-N 2.94Å; Y262-L266 VanDerWaalsContact O-CB 3.27Å; Y262-L266 WeakPolarHBondContact O-CB 3.26Å; Y262-L266 PolarHBondContact O-N 3.45Å
263	F	95.6	Very high	93.7	Very high	7 Å²	7	54.4 Å²	54.4	3%	0.031	29%	0.294	C	S	.	.	H	α-helix	trans	-64.4	-47.7	179.3	-178.4	-103.1	0	0	0	113.2	S242 H245 K246 L249 L257 V259 E260 P261 L266 R267	S242-F263 WeakPolarHBondContact O-CZ 3.39Å; H245-F263 HydrophobicContact CB-CE2 4.18Å; H245-F263 HydrophobicContact CB-CZ 4.13Å; K246-F263 HydrophobicContact CD-CD2 4.47Å; K246-F263 HydrophobicContact CD-CE1 4.34Å; K246-F263 HydrophobicContact CD-CE2 4.31Å; K246-F263 HydrophobicContact CD-CZ 4.22Å; K246-F263 VanDerWaalsContact CE-CG 3.41Å; K246-F263 HydrophobicContact CG-CD2 3.94Å; K246-F263 HydrophobicContact CG-CE1 4.14Å; K246-F263 HydrophobicContact CG-CE2 3.43Å; K246-F263 VanDerWaalsContact CG-CE2 3.43Å; K246-F263 HydrophobicContact CG-CG 4.47Å; K246-F263 HydrophobicContact CG-CZ 3.53Å; L249-F263 HydrophobicContact CD1-CD2 4.03Å; L249-F263 HydrophobicContact CD1-CE2 3.99Å; L257-F263 WeakPolarHBondContact O-CA 3.47Å; L257-F263 WeakPolarHBondContact O-CB 3.21Å; L257-F263 PolarHBondContact O-N 3.45Å; V259-F263 PolarHBondContact O-N 2.8Å; E260-F263 WeakPolarHBondContact OE1-CB 3.45Å; E260-F263 WeakPolarHBondContact OE1-CD1 3.42Å; P261-F263 VanDerWaalsContact C-N 3.34Å; P261-F263 PolarHBondContact O-N 3.01Å; F263-L266 WeakPolarHBondContact O-CB 3.35Å; F263-L266 PolarHBondContact O-N 3.42Å; F263-R267 HydrophobicContact CE1-CG 4.37Å; F263-R267 HydrophobicContact CE2-CG 4.49Å; F263-R267 HydrophobicContact CZ-CG 4.23Å; F263-R267 PolarHBondContact O-N 3.07Å; F263-R267 VanDerWaalsContact O-N 3.07Å
264	S	95.2	Very high	94.3	Very high	54 Å²	54	53.2 Å²	53.2	38%	0.378	28%	0.282	S	S	.	.	H	α-helix	trans	-59.8	-46.2	174.7	-63.7	0	0	0	0	111.4	E260 P261 L266 R267 N268	E260-S264 WeakPolarHBondContact OE2-CB 3.46Å; E260-S264 PolarHBondContact OE2-N 3.08Å; E260-S264 PolarHBondContact OE2-OG 2.96Å; P261-S264 PolarHBondContact O-N 3.32Å; S264-L266 VanDerWaalsContact C-N 3.33Å; S264-L266 PolarHBondContact O-N 2.96Å; S264-R267 PolarHBondContact O-N 3.33Å; S264-N268 WeakPolarHBondContact O-CB 3.41Å; S264-N268 PolarHBondContact O-N 3.38Å; S264-N268 PolarHBondContact O-ND2 3.36Å; S264-N268 PolarHBondContact O-OD1 2.95Å
265	N	95.5	Very high	94.8	Very high	81 Å²	81	55.3 Å²	55.3	43%	0.433	29%	0.29	S	S	.	.	H	α-helix	trans	-62.9	-37.5	176.8	-71.3	-18.6	0	0	0	112.5	P261 Y262 N268 N269	P261-N265 WeakPolarHBondContact O-CB 3.49Å; P261-N265 VanDerWaalsContact O-CG 3.26Å; P261-N265 PolarHBondContact O-N 3.32Å; P261-N265 PolarHBondContact O-ND2 3.49Å; Y262-N265 PolarHBondContact O-N 2.94Å; N265-N268 PolarHBondContact O-N 3.02Å; N265-N269 WeakPolarHBondContact O-CB 3.2Å; N265-N269 PolarHBondContact O-N 2.63Å; N265-N269 PolarHBondContact O-ND2 2.81Å
266	L	95.6	Very high	95.2	Very high	15 Å²	15	50.3 Å²	50.3	8%	0.079	27%	0.267	C	S	.	.	H	α-helix	trans	-60.1	-52.7	175.7	-169.5	77.6	0	0	0	110.6	P134 V183 L185 L249 L257 Y262 F263 S264 N268 N269 M270	P134-L266 HydrophobicContact CB-CD2 4.3Å; P134-L266 HydrophobicContact CG-CD1 4.06Å; P134-L266 HydrophobicContact CG-CD2 4.26Å; P134-L266 HydrophobicContact CG-CG 4.25Å; V183-L266 HydrophobicContact CG1-CD1 4.3Å; L185-L266 HydrophobicContact CD1-CD1 4.02Å; L249-L266 HydrophobicContact CD1-CD2 3.95Å; L249-L266 HydrophobicContact CD2-CD2 4.43Å; L257-L266 HydrophobicContact CB-CD2 4.32Å; L257-L266 HydrophobicContact CD1-CD1 4.41Å; L257-L266 HydrophobicContact CD1-CD2 4.3Å; Y262-L266 VanDerWaalsContact O-CB 3.27Å; Y262-L266 WeakPolarHBondContact O-CB 3.26Å; Y262-L266 PolarHBondContact O-N 3.45Å; F263-L266 WeakPolarHBondContact O-CB 3.35Å; F263-L266 PolarHBondContact O-N 3.42Å; S264-L266 VanDerWaalsContact C-N 3.33Å; S264-L266 PolarHBondContact O-N 2.96Å; L266-N268 VanDerWaalsContact C-N 3.33Å; L266-N268 PolarHBondContact O-N 3.44Å; L266-N269 PolarHBondContact O-N 3.35Å; L266-M270 HydrophobicContact CG-SD 4.28Å; L266-M270 VanDerWaalsContact O-CG 3.26Å; L266-M270 WeakPolarHBondContact O-CG 3.48Å; L266-M270 PolarHBondContact O-N 2.88Å
267	R	96	Very high	95.7	Very high	62 Å²	62	44.2 Å²	44.2	23%	0.234	24%	0.235	C	C	.	.	H	α-helix	trans	-61.8	-40.2	179.2	-70.7	-170.7	67.2	99.3	5.1	112.3	V239 G240 T241 H245 F263 S264 M270 A271	V239-R267 PolarHBondContact O-NH1 3.43Å; V239-R267 VanDerWaalsContact O-NH1 3.09Å; V239-R267 PolarHBondContact O-NH2 3.03Å; G240-R267 PolarHBondContact O-NH2 3.41Å; T241-R267 PolarHBondContact O-NH1 3.29Å; H245-R267 VanDerWaalsContact CB-NH1 3.3Å; H245-R267 PolarHBondContact ND1-NH1 2.94Å; F263-R267 HydrophobicContact CE1-CG 4.37Å; F263-R267 HydrophobicContact CE2-CG 4.49Å; F263-R267 HydrophobicContact CZ-CG 4.23Å; F263-R267 PolarHBondContact O-N 3.07Å; F263-R267 VanDerWaalsContact O-N 3.07Å; S264-R267 PolarHBondContact O-N 3.33Å; R267-M270 PolarHBondContact O-N 2.84Å; R267-A271 WeakPolarHBondContact O-CB 3.36Å; R267-A271 PolarHBondContact O-N 3.45Å
268	N	96.1	Very high	96	Very high	101 Å²	101	42.2 Å²	42.2	54%	0.54	22%	0.224	S	C	.	.	H	α-helix	trans	-65.7	-45.1	177.8	-66.8	-11.4	0	0	0	111.6	S264 N265 L266 M270 A271 A272	S264-N268 WeakPolarHBondContact O-CB 3.41Å; S264-N268 PolarHBondContact O-N 3.38Å; S264-N268 PolarHBondContact O-ND2 3.36Å; S264-N268 PolarHBondContact O-OD1 2.95Å; N265-N268 PolarHBondContact O-N 3.02Å; L266-N268 VanDerWaalsContact C-N 3.33Å; L266-N268 PolarHBondContact O-N 3.44Å; N268-M270 VanDerWaalsContact C-N 3.33Å; N268-M270 PolarHBondContact O-N 3.22Å; N268-A271 PolarHBondContact O-N 2.82Å; N268-A272 WeakPolarHBondContact O-CB 3.28Å; N268-A272 PolarHBondContact O-N 3.29Å
269	N	96.6	Very high	96.3	Very high	35 Å²	35	41.4 Å²	41.4	19%	0.187	22%	0.219	C	C	.	.	H	α-helix	trans	-63.4	-38	176.4	-71	-18.5	0	0	0	112.1	P187 N265 L266 L273	P187-N269 WeakPolarHBondContact CA-OD1 3.35Å; N265-N269 WeakPolarHBondContact O-CB 3.2Å; N265-N269 PolarHBondContact O-N 2.63Å; N265-N269 PolarHBondContact O-ND2 2.81Å; L266-N269 PolarHBondContact O-N 3.35Å; N269-L273 WeakPolarHBondContact O-CG 3.38Å; N269-L273 PolarHBondContact O-N 3.02Å; N269-L273 VanDerWaalsContact O-N 3.16Å
270	M	97.6	Very high	96.5	Very high	3 Å²	3	37.4 Å²	37.4	2%	0.015	20%	0.195	C	C	.	.	H	α-helix	trans	-64.6	-48	174.1	-69.1	168.6	82	0	0	111.9	W133 P134 L185 L238 H245 L266 R267 N268 A272 L273 V274	W133-M270 HydrophobicContact CD2-CE 4.3Å; W133-M270 HydrophobicContact CH2-CB 3.65Å; W133-M270 HydrophobicContact CH2-CG 3.84Å; W133-M270 WeakPolarHBondContact CH2-O 3.37Å; W133-M270 HydrophobicContact CZ2-CB 3.74Å; W133-M270 HydrophobicContact CZ2-CE 3.76Å; W133-M270 HydrophobicContact CZ2-CG 3.9Å; W133-M270 HydrophobicContact CZ3-CB 4.43Å; W133-M270 HydrophobicContact CZ3-CG 4.21Å; P134-M270 HydrophobicContact CG-CE 4.04Å; P134-M270 HydrophobicContact CG-CG 4.25Å; P134-M270 HydrophobicContact CG-SD 3.78Å; P134-M270 WeakPolarHBondContact O-CE 3.08Å; L185-M270 HydrophobicContact CD1-CG 3.63Å; L238-M270 HydrophobicContact CD2-CB 3.73Å; L238-M270 HydrophobicContact CD2-CE 4.4Å; H245-M270 VanDerWaalsContact CE1-SD 3.54Å; L266-M270 HydrophobicContact CG-SD 4.28Å; L266-M270 VanDerWaalsContact O-CG 3.26Å; L266-M270 WeakPolarHBondContact O-CG 3.48Å; L266-M270 PolarHBondContact O-N 2.88Å; R267-M270 PolarHBondContact O-N 2.84Å; N268-M270 VanDerWaalsContact C-N 3.33Å; N268-M270 PolarHBondContact O-N 3.22Å; M270-A272 PolarHBondContact O-N 2.79Å; M270-L273 PolarHBondContact O-N 3.23Å; M270-V274 WeakPolarHBondContact O-CG2 3.37Å; M270-V274 PolarHBondContact O-N 3.4Å; M270-V274 VanDerWaalsContact O-N 3.08Å
271	A	97.3	Very high	96.7	Very high	25 Å²	25	33.1 Å²	33.1	21%	0.207	18%	0.175	C	C	.	.	H	α-helix	trans	-59.4	-48	178.5	0	0	0	0	0	111.2	L238 R267 N268 L273 V274 E275	L238-A271 HydrophobicContact CD1-CB 4.41Å; R267-A271 WeakPolarHBondContact O-CB 3.36Å; R267-A271 PolarHBondContact O-N 3.45Å; N268-A271 PolarHBondContact O-N 2.82Å; A271-L273 VanDerWaalsContact C-N 3.31Å; A271-L273 PolarHBondContact O-N 3.05Å; A271-V274 CarbonylContact O-C 3.57Å; A271-V274 WeakPolarHBondContact O-CA 3.35Å; A271-V274 WeakPolarHBondContact O-CB 3.28Å; A271-V274 PolarHBondContact O-N 2.92Å; A271-E275 WeakPolarHBondContact O-CG 3.49Å; A271-E275 PolarHBondContact O-N 2.89Å
272	A	97.8	Very high	96.9	Very high	20 Å²	20	29.4 Å²	29.4	17%	0.165	15%	0.15	C	C	.	.	H	α-helix	trans	-61.1	-35.3	179.5	0	0	0	0	0	113.1	L188 N268 M270 E275 I276	L188-A272 HydrophobicContact CD1-CB 3.71Å; L188-A272 HydrophobicContact CG-CB 4.01Å; N268-A272 WeakPolarHBondContact O-CB 3.28Å; N268-A272 PolarHBondContact O-N 3.29Å; M270-A272 PolarHBondContact O-N 2.79Å; A272-E275 PolarHBondContact O-N 3.39Å; A272-I276 WeakPolarHBondContact O-CG1 3.47Å; A272-I276 PolarHBondContact O-N 3.34Å
273	L	97.9	Very high	97	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-70.3	-35.2	173.1	-72.3	167	0	0	0	112.4	N41 L45 W133 L185 L188 N269 M270 A271 I276 L277	N41-L273 HydrophobicContact CB-CD2 3.83Å; L45-L273 HydrophobicContact CD1-CD2 4.03Å; L45-L273 HydrophobicContact CD2-CB 4.18Å; L45-L273 HydrophobicContact CD2-CD2 4.15Å; L45-L273 WeakPolarHBondContact CD2-O 3.24Å; L45-L273 HydrophobicContact CG-CD2 3.99Å; W133-L273 HydrophobicContact CH2-CB 4.28Å; W133-L273 HydrophobicContact CZ3-CB 4.35Å; W133-L273 HydrophobicContact CZ3-CD1 4.01Å; L185-L273 HydrophobicContact CD2-CD1 3.76Å; L188-L273 HydrophobicContact CD2-CD2 3.71Å; L188-L273 HydrophobicContact CD2-CG 4.23Å; N269-L273 WeakPolarHBondContact O-CG 3.38Å; N269-L273 PolarHBondContact O-N 3.02Å; N269-L273 VanDerWaalsContact O-N 3.16Å; M270-L273 PolarHBondContact O-N 3.23Å; A271-L273 VanDerWaalsContact C-N 3.31Å; A271-L273 PolarHBondContact O-N 3.05Å; L273-I276 PolarHBondContact O-N 3.04Å; L273-L277 PolarHBondContact O-N 2.7Å
274	V	98.1	Very high	96.9	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-69.3	-34.1	173.9	171.7	0	0	0	0	111.7	W133 F230 F233 F237 L238 M270 A271 L277 A278	W133-V274 HydrophobicContact CH2-CG2 4.21Å; W133-V274 HydrophobicContact CZ2-CG2 4.1Å; F230-V274 HydrophobicContact CD2-CG1 4Å; F230-V274 HydrophobicContact CE2-CG1 4.09Å; F233-V274 HydrophobicContact CB-CG1 3.71Å; F237-V274 HydrophobicContact CB-CG2 4.14Å; F237-V274 HydrophobicContact CD2-CG2 4.37Å; L238-V274 HydrophobicContact CD1-CB 4.47Å; L238-V274 HydrophobicContact CD1-CG1 4.46Å; L238-V274 HydrophobicContact CD2-CG2 3.92Å; L238-V274 HydrophobicContact CG-CG2 4.12Å; M270-V274 WeakPolarHBondContact O-CG2 3.37Å; M270-V274 PolarHBondContact O-N 3.4Å; M270-V274 VanDerWaalsContact O-N 3.08Å; A271-V274 CarbonylContact O-C 3.57Å; A271-V274 WeakPolarHBondContact O-CA 3.35Å; A271-V274 WeakPolarHBondContact O-CB 3.28Å; A271-V274 PolarHBondContact O-N 2.92Å; V274-L277 PolarHBondContact O-N 2.69Å; V274-A278 WeakPolarHBondContact O-CB 3.14Å; V274-A278 PolarHBondContact O-N 3.01Å
275	E	98.1	Very high	96.6	Very high	65 Å²	65	19.4 Å²	19.4	30%	0.304	10%	0.103	S	C	.	.	H	α-helix	trans	-64.5	-46.6	171.3	-69.6	169.9	170.7	0	0	111.7	L193 F230 A271 A272 L277 A278 A279	L193-E275 HydrophobicContact CD1-CB 3.89Å; L193-E275 HydrophobicContact CD2-CB 4.16Å; L193-E275 WeakPolarHBondContact CD2-OE2 3.4Å; F230-E275 HydrophobicContact CD2-CG 3.7Å; F230-E275 HydrophobicContact CE2-CG 3.37Å; F230-E275 HydrophobicContact CZ-CG 4.03Å; A271-E275 WeakPolarHBondContact O-CG 3.49Å; A271-E275 PolarHBondContact O-N 2.89Å; A272-E275 PolarHBondContact O-N 3.39Å; E275-L277 PolarHBondContact O-N 2.78Å; E275-A278 PolarHBondContact O-N 3.39Å; E275-A279 WeakPolarHBondContact O-CB 2.99Å; E275-A279 PolarHBondContact O-N 3.4Å
276	I	98.4	Very high	95.9	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-55.1	-50.8	172.6	-68.1	-80.1	0	0	0	110.5	L45 L188 L192 L193 V196 A272 L273 A278 A279 V280	L45-I276 HydrophobicContact CD1-CG2 3.74Å; L45-I276 HydrophobicContact CD2-CG2 4.23Å; L188-I276 HydrophobicContact CD1-CD1 3.94Å; L188-I276 HydrophobicContact CD1-CG1 3.63Å; L188-I276 HydrophobicContact CD2-CG1 4.46Å; L192-I276 HydrophobicContact CG-CD1 4.14Å; L193-I276 HydrophobicContact CB-CD1 4.26Å; L193-I276 HydrophobicContact CD1-CD1 3.92Å; L193-I276 HydrophobicContact CD1-CG1 4.13Å; V196-I276 HydrophobicContact CB-CD1 3.98Å; V196-I276 HydrophobicContact CG1-CD1 4.23Å; V196-I276 HydrophobicContact CG1-CG2 4.48Å; V196-I276 HydrophobicContact CG2-CD1 3.76Å; A272-I276 WeakPolarHBondContact O-CG1 3.47Å; A272-I276 PolarHBondContact O-N 3.34Å; L273-I276 PolarHBondContact O-N 3.04Å; I276-A278 VanDerWaalsContact C-N 3.3Å; I276-A278 PolarHBondContact O-N 3.18Å; I276-A279 PolarHBondContact O-N 3.27Å; I276-V280 HydrophobicContact CG2-CG2 4.42Å; I276-V280 VanDerWaalsContact O-CG2 3.29Å; I276-V280 WeakPolarHBondContact O-CG2 3.3Å; I276-V280 PolarHBondContact O-N 2.9Å
277	L	98.4	Very high	94.8	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-60.4	-40.7	-179.5	-170.9	60.8	0	0	0	111.9	L45 L48 W49 F233 F237 L273 V274 E275 A281 L320	L45-L277 HydrophobicContact CD2-CB 3.98Å; L48-L277 HydrophobicContact CB-CD2 4.15Å; W49-L277 HydrophobicContact CB-CD1 4.21Å; W49-L277 HydrophobicContact CD2-CD1 4.28Å; W49-L277 HydrophobicContact CE3-CD1 3.86Å; W49-L277 HydrophobicContact CE3-CD2 4.37Å; W49-L277 HydrophobicContact CE3-CG 4.3Å; W49-L277 HydrophobicContact CG-CD1 4.44Å; F233-L277 HydrophobicContact CD2-CB 4.24Å; F233-L277 HydrophobicContact CD2-CD2 4.08Å; F233-L277 HydrophobicContact CD2-CG 3.94Å; F233-L277 HydrophobicContact CE2-CB 4.48Å; F233-L277 HydrophobicContact CE2-CD2 4.33Å; F233-L277 HydrophobicContact CE2-CG 3.89Å; F237-L277 HydrophobicContact CE2-CD2 3.98Å; L273-L277 PolarHBondContact O-N 2.7Å; V274-L277 PolarHBondContact O-N 2.69Å; E275-L277 PolarHBondContact O-N 2.78Å; L277-A281 WeakPolarHBondContact O-CB 3.16Å; L277-A281 PolarHBondContact O-N 3.31Å; L277-L320 HydrophobicContact CD1-CD1 3.93Å; L277-L320 HydrophobicContact CD1-CD2 4.12Å
278	A	98.3	Very high	94.3	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-65.5	-41.4	176.4	0	0	0	0	0	113.2	H229 F230 F233 V274 E275 I276 A282	H229-A278 HydrophobicContact CB-CB 3.85Å; F230-A278 HydrophobicContact CB-CB 3.78Å; F233-A278 HydrophobicContact CD2-CB 4.13Å; F233-A278 HydrophobicContact CE2-CB 4.43Å; V274-A278 WeakPolarHBondContact O-CB 3.14Å; V274-A278 PolarHBondContact O-N 3.01Å; E275-A278 PolarHBondContact O-N 3.39Å; I276-A278 VanDerWaalsContact C-N 3.3Å; I276-A278 PolarHBondContact O-N 3.18Å; A278-A282 VanDerWaalsContact O-CB 3.26Å; A278-A282 WeakPolarHBondContact O-CB 3.46Å; A278-A282 PolarHBondContact O-N 2.66Å
279	A	98.2	Very high	94	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-64.9	-44.6	176.3	0	0	0	0	0	112	V196 E197 S200 F222 E275 I276 A281 A282 G283	V196-A279 HydrophobicContact CG1-CB 3.9Å; E197-A279 HydrophobicContact CG-CB 3.69Å; S200-A279 WeakPolarHBondContact CB-O 3.44Å; F222-A279 HydrophobicContact CZ-CB 4.3Å; E275-A279 WeakPolarHBondContact O-CB 2.99Å; E275-A279 PolarHBondContact O-N 3.4Å; I276-A279 PolarHBondContact O-N 3.27Å; A279-A281 VanDerWaalsContact C-N 3.34Å; A279-A281 PolarHBondContact O-N 3.37Å; A279-A282 PolarHBondContact O-N 2.87Å; A279-G283 PolarHBondContact O-N 2.87Å
280	V	98.1	Very high	93.9	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-64.2	-39	178.2	-179.2	0	0	0	0	111.7	V196 I276 I316 R319 L320 Y323	V196-V280 HydrophobicContact CG1-CG2 3.61Å; I276-V280 HydrophobicContact CG2-CG2 4.42Å; I276-V280 VanDerWaalsContact O-CG2 3.29Å; I276-V280 WeakPolarHBondContact O-CG2 3.3Å; I276-V280 PolarHBondContact O-N 2.9Å; V280-I316 HydrophobicContact CG1-CG2 4.28Å; V280-R319 HydrophobicContact CG1-CB 3.5Å; V280-R319 PolarHBondContact O-NE 3.04Å; V280-R319 VanDerWaalsContact O-NE 3.15Å; V280-L320 HydrophobicContact CB-CD2 4.26Å; V280-L320 HydrophobicContact CG1-CD2 4.12Å; V280-L320 HydrophobicContact CG1-CG 4.21Å; V280-L320 HydrophobicContact CG2-CD2 4.14Å; V280-Y323 HydrophobicContact CG1-CE2 4.37Å; V280-Y323 HydrophobicContact CG2-CD2 3.89Å; V280-Y323 HydrophobicContact CG2-CE2 3.65Å
281	A	97.4	Very high	93.7	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-75.2	-21.7	176.6	0	0	0	0	0	113.9	W49 H229 F233 L277 A279 I316	W49-A281 HydrophobicContact CH2-CB 4.5Å; H229-A281 VanDerWaalsContact CD2-C 3.43Å; H229-A281 PolarHBondContact NE2-O 2.88Å; F233-A281 HydrophobicContact CE2-CB 4.06Å; F233-A281 HydrophobicContact CZ-CB 4.16Å; L277-A281 WeakPolarHBondContact O-CB 3.16Å; L277-A281 PolarHBondContact O-N 3.31Å; A279-A281 VanDerWaalsContact C-N 3.34Å; A279-A281 PolarHBondContact O-N 3.37Å; A281-I316 HydrophobicContact CB-CD1 4Å; A281-I316 HydrophobicContact CB-CG2 4.46Å
282	A	96.7	Very high	93.4	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-75.3	-33.6	177.3	0	0	0	0	0	112.6	F222 Q225 R226 H229 A278 A279 L284 P285	F222-A282 HydrophobicContact CD2-CB 3.92Å; F222-A282 HydrophobicContact CE2-CB 3.66Å; F222-A282 HydrophobicContact CZ-CB 4.29Å; Q225-A282 HydrophobicContact CB-CB 4.03Å; R226-A282 HydrophobicContact CB-CB 3.85Å; H229-A282 PolarHBondContact CD2-N 2.93Å; H229-A282 PolarHBondContact NE2-N 3.4Å; A278-A282 VanDerWaalsContact O-CB 3.26Å; A278-A282 WeakPolarHBondContact O-CB 3.46Å; A278-A282 PolarHBondContact O-N 2.66Å; A279-A282 PolarHBondContact O-N 2.87Å; A282-L284 PolarHBondContact O-N 3.5Å; A282-P285 WeakPolarHBondContact O-CD 3.34Å
283	G	94.8	Very high	93	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	12.2	175.9	0	0	0	0	0	115.4	S200 S203 A279 R319	S200-G283 WeakPolarHBondContact O-CA 3.32Å; S203-G283 PolarHBondContact OG-O 2.68Å; A279-G283 PolarHBondContact O-N 2.87Å; G283-R319 PolarHBondContact O-NH1 3.05Å
284	L	93.8	Very high	91.7	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.105	C	C	.	.	S	Bend	trans	-143.9	75.3	169.3	-174.2	69.2	0	0	0	109.6	F205 A282 F291 R312 I315 I316 W463	F205-L284 HydrophobicContact CB-CD1 3.62Å; F205-L284 HydrophobicContact CD1-CD1 3.46Å; F205-L284 VanDerWaalsContact CD1-CD1 3.46Å; F205-L284 HydrophobicContact CD2-CD1 4.3Å; F205-L284 HydrophobicContact CE1-CD1 4.18Å; F205-L284 HydrophobicContact CG-CD1 3.53Å; A282-L284 PolarHBondContact O-N 3.5Å; L284-F291 HydrophobicContact CD1-CZ 4.33Å; L284-F291 HydrophobicContact CD2-CE2 4.48Å; L284-R312 HydrophobicContact CD2-CB 4.44Å; L284-R312 HydrophobicContact CD2-CG 3.73Å; L284-R312 HydrophobicContact CG-CG 4.17Å; L284-R312 PolarHBondContact O-NE 2.92Å; L284-R312 PolarHBondContact O-NH2 3.32Å; L284-I315 HydrophobicContact CD2-CB 3.82Å; L284-I315 HydrophobicContact CD2-CG2 3.59Å; L284-I316 HydrophobicContact CB-CG1 4.42Å; L284-I316 HydrophobicContact CD2-CD1 4.48Å; L284-I316 HydrophobicContact CD2-CG1 4.02Å; L284-W463 HydrophobicContact CD1-CD2 3.95Å; L284-W463 HydrophobicContact CD1-CE3 3.85Å; L284-W463 HydrophobicContact CD1-CH2 3.67Å; L284-W463 HydrophobicContact CD1-CZ2 3.78Å; L284-W463 HydrophobicContact CD1-CZ3 3.71Å; L284-W463 HydrophobicContact CG-CH2 4.12Å; L284-W463 HydrophobicContact CG-CZ3 4.26Å
285	P	88.2	Confident	90	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.144	C	C	.	.			trans	-91.2	135.3	-176.7	35.3	-31.7	0	0	0	112.5	M206 M209 L221 Q225 A282 N287 W463	M206-P285 HydrophobicContact SD-CG 3.98Å; M209-P285 HydrophobicContact CE-CG 3.38Å; M209-P285 HydrophobicContact SD-CG 3.88Å; L221-P285 HydrophobicContact CD2-CG 4.14Å; Q225-P285 HydrophobicContact CG-CB 3.88Å; A282-P285 WeakPolarHBondContact O-CD 3.34Å; P285-N287 PolarHBondContact O-N 3.19Å; P285-N287 VanDerWaalsContact O-N 3.13Å; P285-W463 WeakPolarHBondContact O-CH2 3.21Å; P285-W463 WeakPolarHBondContact O-CZ2 3.07Å
286	Q	80.1	Confident	87.7	Confident	62 Å²	62	28.3 Å²	28.3	29%	0.29	14%	0.144	S	C	.	.			trans	-88.2	31.1	-171	-162.8	174.8	-14.9	0	0	112.9	Q288	Q286-Q288 PolarHBondContact O-N 2.91Å
287	N	74	Confident	85.1	Confident	76 Å²	76	31.8 Å²	31.8	41%	0.406	17%	0.172	S	C	.	.	S	Bend	trans	-80.1	84.5	-175.4	-76	11.6	0	0	0	110.1	Q225 P285 Y289	Q225-N287 PolarHBondContact NE2-ND2 3.09Å; Q225-N287 VanDerWaalsContact NE2-ND2 3.2Å; Q225-N287 PolarHBondContact NE2-OD1 3.09Å; P285-N287 PolarHBondContact O-N 3.19Å; P285-N287 VanDerWaalsContact O-N 3.13Å; N287-Y289 WeakPolarHBondContact O-CD2 3.29Å; N287-Y289 PolarHBondContact O-N 3.06Å; N287-Y289 VanDerWaalsContact O-N 3.12Å
288	Q	84.3	Confident	82.5	Confident	111 Å²	111	37.2 Å²	37.2	52%	0.519	21%	0.206	S	C	.	.	S	Bend	trans	67.9	-8	-172.5	-47.9	178.3	4.8	0	0	115.6	Q286 N466 I469	Q286-Q288 PolarHBondContact O-N 2.91Å; Q288-N466 VanDerWaalsContact O-CB 3.25Å; Q288-N466 WeakPolarHBondContact O-CB 3.39Å; Q288-N466 PolarHBondContact O-N 2.95Å; Q288-I469 HydrophobicContact CB-CD1 4.07Å; Q288-I469 HydrophobicContact CG-CD1 4.01Å
289	Y	90.8	Very high	79.6	Confident	15 Å²	15	42.3 Å²	42.3	6%	0.059	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	153.8	173.7	-65.9	-94.1	0	0	0	112.5	M209 D212 N287 W463 Q464 R465	M209-Y289 HydrophobicContact CB-CD2 4.33Å; M209-Y289 HydrophobicContact CB-CE1 4.16Å; M209-Y289 HydrophobicContact CB-CE2 3.8Å; M209-Y289 HydrophobicContact CG-CD1 3.76Å; M209-Y289 HydrophobicContact CG-CD2 3.57Å; M209-Y289 HydrophobicContact CG-CE1 3.75Å; M209-Y289 HydrophobicContact CG-CE2 3.55Å; M209-Y289 HydrophobicContact CG-CG 3.71Å; M209-Y289 PolarHBondContact O-OH 3.2Å; M209-Y289 HydrophobicContact SD-CD2 3.5Å; M209-Y289 VanDerWaalsContact SD-CD2 3.5Å; M209-Y289 HydrophobicContact SD-CE2 3.88Å; M209-Y289 HydrophobicContact SD-CG 3.93Å; D212-Y289 HydrophobicContact CB-CE1 4.34Å; D212-Y289 WeakPolarHBondContact CB-OH 3.38Å; D212-Y289 WeakPolarHBondContact OD2-CE1 3.21Å; N287-Y289 WeakPolarHBondContact O-CD2 3.29Å; N287-Y289 PolarHBondContact O-N 3.06Å; N287-Y289 VanDerWaalsContact O-N 3.12Å; Y289-W463 HydrophobicContact CG-CZ2 4.31Å; Y289-Q464 WeakPolarHBondContact CA-O 3.5Å; Y289-Q464 VanDerWaalsContact CD1-C 3.43Å; Y289-R465 HydrophobicContact CD1-CB 4.05Å; Y289-R465 HydrophobicContact CE1-CB 3.67Å; Y289-R465 HydrophobicContact CE1-CG 4.37Å; Y289-R465 PolarHBondContact OH-NE 2.78Å; Y289-R465 PolarHBondContact OH-NH2 3.45Å
290	G	93.4	Very high	77	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.01	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.7	-177.8	-179.6	0	0	0	0	0	112.3	Y292 W463 Q464	G290-Y292 VanDerWaalsContact O-CD2 3.29Å; G290-Y292 WeakPolarHBondContact O-CD2 3.45Å; G290-W463 WeakPolarHBondContact O-CA 3.44Å; G290-Q464 PolarHBondContact N-O 3.06Å; G290-Q464 PolarHBondContact O-N 3.33Å; G290-Q464 VanDerWaalsContact O-O 3.12Å
291	F	93.8	Very high	74.7	Confident	3 Å²	3	53.2 Å²	53.2	1%	0.013	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	107.9	178.7	-66.1	-82.3	0	0	0	110.4	F205 L284 Q308 A311 I315 Y434 F461 V462 W463	F205-F291 HydrophobicContact CD1-CZ 4.33Å; F205-F291 AromaticContact CE1-CE1 3.95Å; F205-F291 HydrophobicContact CE1-CE1 3.95Å; F205-F291 AromaticContact CE1-CZ 3.89Å; F205-F291 HydrophobicContact CE1-CZ 3.89Å; L284-F291 HydrophobicContact CD1-CZ 4.33Å; L284-F291 HydrophobicContact CD2-CE2 4.48Å; F291-Q308 PolarHBondContact O-NE2 2.96Å; F291-A311 HydrophobicContact CB-CB 4.45Å; F291-A311 HydrophobicContact CD2-CB 3.76Å; F291-A311 HydrophobicContact CE2-CB 4.44Å; F291-A311 HydrophobicContact CG-CB 4.31Å; F291-I315 HydrophobicContact CE1-CD1 4.13Å; F291-I315 HydrophobicContact CE1-CG1 4.12Å; F291-I315 HydrophobicContact CE2-CG1 4.02Å; F291-I315 HydrophobicContact CZ-CB 4.2Å; F291-I315 HydrophobicContact CZ-CD1 4.04Å; F291-I315 HydrophobicContact CZ-CG1 3.57Å; F291-I315 HydrophobicContact CZ-CG2 4.27Å; F291-Y434 HydrophobicContact CB-CD1 3.63Å; F291-Y434 HydrophobicContact CB-CE1 3.94Å; F291-Y434 HydrophobicContact CD1-CD1 4.16Å; F291-Y434 AromaticContact CG-CD1 3.87Å; F291-Y434 HydrophobicContact CG-CD1 3.87Å; F291-F461 HydrophobicContact CB-CB 4.12Å; F291-V462 WeakPolarHBondContact CA-O 3.49Å; F291-W463 HydrophobicContact CD1-CB 4.25Å; F291-W463 HydrophobicContact CD1-CE3 4.43Å; F291-W463 AromaticContact CD2-CE3 3.91Å; F291-W463 HydrophobicContact CD2-CE3 3.91Å; F291-W463 HydrophobicContact CD2-CZ3 4.22Å; F291-W463 HydrophobicContact CE1-CB 3.87Å; F291-W463 HydrophobicContact CE1-CE3 4.07Å; F291-W463 AromaticContact CE2-CE3 3.49Å; F291-W463 HydrophobicContact CE2-CE3 3.49Å; F291-W463 VanDerWaalsContact CE2-CE3 3.49Å; F291-W463 AromaticContact CE2-CZ3 3.76Å; F291-W463 HydrophobicContact CE2-CZ3 3.76Å; F291-W463 HydrophobicContact CG-CE3 4.35Å; F291-W463 HydrophobicContact CZ-CB 4.38Å; F291-W463 HydrophobicContact CZ-CD2 4.34Å; F291-W463 AromaticContact CZ-CE3 3.55Å; F291-W463 HydrophobicContact CZ-CE3 3.55Å; F291-W463 HydrophobicContact CZ-CZ3 4.21Å
292	Y	91.7	Very high	72.7	Confident	53 Å²	53	55.8 Å²	55.8	21%	0.208	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	151.8	-174.6	-61.4	-82.5	0	0	0	111	G290 F461 V462 Q464 N466 P467	G290-Y292 VanDerWaalsContact O-CD2 3.29Å; G290-Y292 WeakPolarHBondContact O-CD2 3.45Å; Y292-F461 CarbonylContact O-C 3.59Å; Y292-F461 VanDerWaalsContact O-CA 3.29Å; Y292-F461 WeakPolarHBondContact O-CA 3.28Å; Y292-V462 PolarHBondContact N-O 2.64Å; Y292-V462 PolarHBondContact O-N 3.19Å; Y292-Q464 HydrophobicContact CD2-CG 3.88Å; Y292-Q464 HydrophobicContact CG-CG 4.45Å; Y292-N466 HydrophobicContact CE2-CB 4.23Å; Y292-N466 WeakPolarHBondContact OH-CB 3.43Å; Y292-P467 HydrophobicContact CG-CG 4.33Å
293	S	88.4	Confident	70.8	Confident	17 Å²	17	61.2 Å²	61.2	12%	0.119	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	136.6	179.4	-165.4	0	0	0	0	111.1	N295 K460	S293-N295 PolarHBondContact O-N 3.23Å; S293-K460 WeakPolarHBondContact CA-O 3.41Å; S293-K460 PolarHBondContact OG-O 3.01Å
294	E	70.6	Confident	69.7	Low	59 Å²	59	62.2 Å²	62.2	28%	0.276	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-30	177.6	-61.2	-172.3	103.2	0	0	112.8	R440 K460 V462	E294-R440 IonicContact OE1-CZ 2.65Å; E294-R440 IonicContact OE1-NH1 2.71Å; E294-R440 PolarHBondContact OE1-NH1 3.13Å; E294-R440 IonicContact OE1-NH2 2.81Å; E294-K460 WeakPolarHBondContact OE2-CD 3.36Å; E294-K460 WeakPolarHBondContact OE2-CE 3.34Å; E294-K460 IonicContact OE2-NZ 3.14Å; E294-K460 PolarHBondContact OE2-NZ 2.83Å; E294-V462 HydrophobicContact CG-CG2 3.9Å
295	N	62	Low	69.2	Low	152 Å²	152	63.2 Å²	63.2	81%	0.813	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	8.8	-167.2	-66.1	0.8	0	0	0	114.3	S293	S293-N295 PolarHBondContact O-N 3.23Å
296	C	49.7	Very low	69.3	Low	46 Å²	46	63.9 Å²	63.9	31%	0.311	38%	0.378	S	S	.	.			trans	-149.5	113.4	-179.2	-161.6	0	0	0	0	113.7	T299	C296-T299 PolarHBondContact SG-OG1 3.41Å
297	A	44.2	Very low	69.9	Low	72 Å²	72	63.2 Å²	63.2	60%	0.595	38%	0.38	S	S	*	.	S	Bend	trans	-79.1	-22.2	177.2	0	0	0	0	0	113.9
298	T	44.8	Very low	70.8	Confident	114 Å²	114	62.4 Å²	62.4	70%	0.699	37%	0.374	S	S	*	.	S	Bend	trans	-154.1	102.3	-169.1	35.6	0	0	0	0	113.3
299	T	35.9	Very low	71.2	Confident	108 Å²	108	62.3 Å²	62.3	66%	0.663	37%	0.373	S	S	*	.			trans	-177.8	162	148.4	17.7	0	0	0	0	110.8	C296	C296-T299 PolarHBondContact SG-OG1 3.41Å
300	P	43.4	Very low	71.4	Confident	106 Å²	106	62 Å²	62	69%	0.688	37%	0.373	S	S	*	.	S	Bend	trans	-72.4	174.5	178.8	35.2	-37.8	0	0	0	111.7	H302	P300-H302 PolarHBondContact O-N 3.3Å
301	P	50.7	Low	71.5	Confident	122 Å²	122	61.9 Å²	61.9	79%	0.792	37%	0.372	S	S	*	.	S	Bend	trans	-60.8	127.4	-145.4	25.2	-34.1	0	0	0	113.5
302	H	55.4	Low	71.6	Confident	54 Å²	54	63.4 Å²	63.4	25%	0.25	38%	0.378	C	S	.	.			trans	-55.8	137.5	-174.8	-60	-42.4	0	0	0	112	P300 G304 A305	P300-H302 PolarHBondContact O-N 3.3Å; H302-G304 PolarHBondContact O-N 3.4Å; H302-A305 HydrophobicContact CB-CB 4.5Å; H302-A305 WeakPolarHBondContact O-CB 3.46Å; H302-A305 PolarHBondContact O-N 2.92Å
303	P	57.6	Low	71.9	Confident	114 Å²	114	61.1 Å²	61.1	74%	0.74	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	110.2	177.4	23.7	-33	0	0	0	110	R459	P303-R459 PolarHBondContact O-NH1 3.49Å
304	G	70.5	Confident	72.4	Confident	22 Å²	22	60.3 Å²	60.3	23%	0.227	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	111.7	-15.1	-179.3	0	0	0	0	0	116.5	H302 R339 L408	H302-G304 PolarHBondContact O-N 3.4Å; G304-R339 PolarHBondContact O-NH1 2.83Å; G304-L408 VanDerWaalsContact O-CD1 3.24Å; G304-L408 WeakPolarHBondContact O-CD1 3.39Å; G304-L408 WeakPolarHBondContact O-CD2 3.19Å
305	A	83.3	Confident	73.7	Confident	20 Å²	20	57.5 Å²	57.5	17%	0.165	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-61.6	161.4	174.3	0	0	0	0	0	112.2	H302 R339 F461	H302-A305 HydrophobicContact CB-CB 4.5Å; H302-A305 WeakPolarHBondContact O-CB 3.46Å; H302-A305 PolarHBondContact O-N 2.92Å; A305-R339 PolarHBondContact O-NH2 3.46Å; A305-F461 HydrophobicContact CB-CE1 4.23Å; A305-F461 HydrophobicContact CB-CZ 3.82Å
306	V	90.6	Very high	75.4	Confident	14 Å²	14	50.3 Å²	50.3	9%	0.085	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-93.7	162.8	158.8	-74.1	0	0	0	0	110.7	V310 A311 L351 M410 F412 Y434	V306-V310 HydrophobicContact CB-CB 4.07Å; V306-V310 HydrophobicContact CB-CG1 3.77Å; V306-V310 HydrophobicContact CG1-CG1 3.87Å; V306-V310 HydrophobicContact CG2-CG1 4.18Å; V306-A311 HydrophobicContact CG2-CB 4.05Å; V306-L351 HydrophobicContact CG1-CD1 4Å; V306-L351 HydrophobicContact CG1-CD2 4.25Å; V306-M410 HydrophobicContact CG1-CE 4.33Å; V306-M410 HydrophobicContact CG1-SD 3.61Å; V306-M410 HydrophobicContact CG2-SD 4.36Å; V306-F412 HydrophobicContact CG2-CE1 3.95Å; V306-F412 HydrophobicContact CG2-CZ 3.84Å; V306-Y434 HydrophobicContact CG2-CE1 4.09Å; V306-Y434 HydrophobicContact CG2-CE2 4.06Å; V306-Y434 WeakPolarHBondContact CG2-OH 3.34Å; V306-Y434 PolarHBondContact N-OH 3.16Å; V306-Y434 VanDerWaalsContact N-OH 3.14Å
307	S	91.8	Very high	77.7	Confident	49 Å²	49	48.1 Å²	48.1	34%	0.343	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-63.9	158.6	173.3	72	0	0	0	0	111.3	E309 V310 A311	S307-E309 PolarHBondContact O-N 3.35Å; S307-V310 PolarHBondContact O-N 2.8Å; S307-V310 WeakPolarHBondContact OG-CG2 3.5Å; S307-V310 PolarHBondContact OG-N 3.37Å; S307-A311 WeakPolarHBondContact O-CB 3.32Å; S307-A311 PolarHBondContact O-N 2.98Å
308	Q	93	Very high	80.3	Confident	58 Å²	58	44.7 Å²	44.7	27%	0.271	27%	0.268	S	S	.	.	H	α-helix	trans	-60	-33.4	178.4	-67.2	-60.4	-22.1	0	0	112.3	F291 R312	F291-Q308 PolarHBondContact O-NE2 2.96Å; Q308-R312 WeakPolarHBondContact O-CB 3.38Å; Q308-R312 PolarHBondContact O-N 3.19Å
309	E	93.4	Very high	82.9	Confident	110 Å²	110	39.7 Å²	39.7	51%	0.514	24%	0.237	S	C	.	.	H	α-helix	trans	-69.8	-44.2	177.8	-59.9	-176.2	169	0	0	111.6	P54 S307 R312 H313	P54-E309 HydrophobicContact CB-CB 3.93Å; P54-E309 HydrophobicContact CG-CB 3.81Å; S307-E309 PolarHBondContact O-N 3.35Å; E309-R312 PolarHBondContact O-N 3.14Å; E309-H313 WeakPolarHBondContact O-CB 3.45Å; E309-H313 PolarHBondContact O-N 2.84Å
310	V	94.8	Very high	85.8	Confident	7 Å²	7	34.6 Å²	34.6	4%	0.042	21%	0.205	C	C	.	.	H	α-helix	trans	-66.3	-40.9	176	170.2	0	0	0	0	111.1	F53 P54 V306 S307 H313 C314 L351	F53-V310 HydrophobicContact CE1-CG2 4.31Å; F53-V310 HydrophobicContact CZ-CG1 4.17Å; F53-V310 HydrophobicContact CZ-CG2 4.5Å; P54-V310 HydrophobicContact CB-CG2 3.94Å; P54-V310 HydrophobicContact CG-CG2 4.16Å; V306-V310 HydrophobicContact CB-CB 4.07Å; V306-V310 HydrophobicContact CB-CG1 3.77Å; V306-V310 HydrophobicContact CG1-CG1 3.87Å; V306-V310 HydrophobicContact CG2-CG1 4.18Å; S307-V310 PolarHBondContact O-N 2.8Å; S307-V310 WeakPolarHBondContact OG-CG2 3.5Å; S307-V310 PolarHBondContact OG-N 3.37Å; V310-H313 PolarHBondContact O-N 3.11Å; V310-C314 PolarHBondContact O-N 2.99Å; V310-C314 PolarHBondContact O-SG 3.45Å; V310-L351 HydrophobicContact CG1-CD1 3.58Å
311	A	96	Very high	88.4	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-60.4	-46.3	174.4	0	0	0	0	0	111.5	F291 V306 S307 H313 C314 I315 F412 Y434	F291-A311 HydrophobicContact CB-CB 4.45Å; F291-A311 HydrophobicContact CD2-CB 3.76Å; F291-A311 HydrophobicContact CE2-CB 4.44Å; F291-A311 HydrophobicContact CG-CB 4.31Å; V306-A311 HydrophobicContact CG2-CB 4.05Å; S307-A311 WeakPolarHBondContact O-CB 3.32Å; S307-A311 PolarHBondContact O-N 2.98Å; A311-H313 VanDerWaalsContact C-N 3.33Å; A311-H313 PolarHBondContact O-N 2.85Å; A311-C314 PolarHBondContact O-N 3.24Å; A311-I315 WeakPolarHBondContact O-CG1 3.27Å; A311-I315 PolarHBondContact O-N 3.47Å; A311-F412 HydrophobicContact CB-CE1 4.15Å; A311-Y434 HydrophobicContact CB-CD1 3.81Å; A311-Y434 HydrophobicContact CB-CE1 3.76Å
312	R	96.4	Very high	90.7	Very high	34 Å²	34	24.4 Å²	24.4	13%	0.128	14%	0.14	C	C	.	.	H	α-helix	trans	-60.8	-40.5	174.4	-171.6	-178.3	-178.3	-154.5	-8	112.1	H229 L284 Q308 E309 I315 I316	H229-R312 PolarHBondContact CE1-NH2 3.16Å; H229-R312 PolarHBondContact NE2-NH2 3.48Å; L284-R312 HydrophobicContact CD2-CB 4.44Å; L284-R312 HydrophobicContact CD2-CG 3.73Å; L284-R312 HydrophobicContact CG-CG 4.17Å; L284-R312 PolarHBondContact O-NE 2.92Å; L284-R312 PolarHBondContact O-NH2 3.32Å; Q308-R312 WeakPolarHBondContact O-CB 3.38Å; Q308-R312 PolarHBondContact O-N 3.19Å; E309-R312 PolarHBondContact O-N 3.14Å; R312-I315 PolarHBondContact O-N 3.45Å; R312-I316 HydrophobicContact CG-CD1 4Å; R312-I316 WeakPolarHBondContact O-CG1 3.41Å; R312-I316 PolarHBondContact O-N 3.47Å
313	H	97.4	Very high	92.6	Very high	5 Å²	5	22.9 Å²	22.9	2%	0.023	13%	0.132	C	C	.	.	H	α-helix	trans	-62.6	-48.6	177.5	-169.9	-75.6	0	0	0	112.1	W49 V52 F53 P54 E309 V310 A311 I315 I316 Q317	W49-H313 AromaticContact CD1-CE1 3.32Å; W49-H313 AromaticContact CD1-ND1 3.85Å; W49-H313 AromaticContact CD1-NE2 3.57Å; W49-H313 AromaticContact CD2-NE2 3.8Å; W49-H313 AromaticContact CE2-CD2 3.46Å; W49-H313 VanDerWaalsContact CE2-CD2 3.46Å; W49-H313 AromaticContact CE2-CE1 3.91Å; W49-H313 AromaticContact CE2-CG 3.88Å; W49-H313 AromaticContact CE2-NE2 3.49Å; W49-H313 AromaticContact CG-CE1 3.97Å; W49-H313 AromaticContact CG-NE2 3.83Å; W49-H313 HydrophobicContact CZ2-CB 4.41Å; W49-H313 AromaticContact CZ2-CD2 3.56Å; W49-H313 AromaticContact NE1-CD2 3.52Å; W49-H313 AromaticContact NE1-CE1 3.27Å; W49-H313 PolarHBondContact NE1-CE1 3.44Å; W49-H313 VanDerWaalsContact NE1-CE1 3.27Å; W49-H313 AromaticContact NE1-CG 3.56Å; W49-H313 AromaticContact NE1-ND1 3.4Å; W49-H313 PolarHBondContact NE1-ND1 2.98Å; W49-H313 AromaticContact NE1-NE2 3.35Å; W49-H313 PolarHBondContact NE1-NE2 3.15Å; W49-H313 PolarHBondContact NE1-O 3.38Å; W49-H313 PolarHBondContact O-CE1 3.25Å; W49-H313 PolarHBondContact O-NE2 3.07Å; V52-H313 PolarHBondContact O-CD2 2.88Å; F53-H313 AromaticContact CD2-CE1 3.53Å; F53-H313 AromaticContact CD2-ND1 3.55Å; F53-H313 AromaticContact CE2-ND1 3.88Å; P54-H313 HydrophobicContact CG-CB 4.16Å; E309-H313 WeakPolarHBondContact O-CB 3.45Å; E309-H313 PolarHBondContact O-N 2.84Å; V310-H313 PolarHBondContact O-N 3.11Å; A311-H313 VanDerWaalsContact C-N 3.33Å; A311-H313 PolarHBondContact O-N 2.85Å; H313-I315 VanDerWaalsContact C-N 3.33Å; H313-I315 PolarHBondContact O-N 3.02Å; H313-I316 PolarHBondContact O-N 2.94Å; H313-Q317 WeakPolarHBondContact O-CB 3.29Å; H313-Q317 PolarHBondContact O-N 3.21Å
314	C	98.1	Very high	94.4	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-65.3	-34.1	177.9	-63.5	0	0	0	0	112.5	V310 A311 Q317 A318 V335 F412	V310-C314 PolarHBondContact O-N 2.99Å; V310-C314 PolarHBondContact O-SG 3.45Å; A311-C314 PolarHBondContact O-N 3.24Å; C314-Q317 WeakPolarHBondContact O-CB 3.46Å; C314-Q317 PolarHBondContact O-N 3.36Å; C314-A318 PolarHBondContact O-N 2.99Å; C314-V335 HydrophobicContact CB-CG2 4Å; C314-V335 VanDerWaalsContact O-CG2 3.27Å; C314-V335 WeakPolarHBondContact O-CG2 3.45Å; C314-F412 HydrophobicContact CB-CB 3.97Å; C314-F412 HydrophobicContact CB-CD1 3.57Å; C314-F412 HydrophobicContact CB-CD2 3.58Å; C314-F412 HydrophobicContact CB-CE1 3.92Å; C314-F412 HydrophobicContact CB-CE2 3.9Å; C314-F412 HydrophobicContact CB-CG 3.42Å; C314-F412 VanDerWaalsContact CB-CG 3.42Å; C314-F412 HydrophobicContact CB-CZ 4.07Å
315	I	98.3	Very high	95.4	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-72.7	-38.7	175.1	-62.2	-84.3	0	0	0	111.2	F205 L284 F291 A311 R312 H313 Q317 A318 R319 F412 L413 Y434	F205-I315 HydrophobicContact CE1-CG2 4.06Å; F205-I315 HydrophobicContact CE2-CG2 4.13Å; F205-I315 HydrophobicContact CZ-CG2 3.64Å; L284-I315 HydrophobicContact CD2-CB 3.82Å; L284-I315 HydrophobicContact CD2-CG2 3.59Å; F291-I315 HydrophobicContact CE1-CD1 4.13Å; F291-I315 HydrophobicContact CE1-CG1 4.12Å; F291-I315 HydrophobicContact CE2-CG1 4.02Å; F291-I315 HydrophobicContact CZ-CB 4.2Å; F291-I315 HydrophobicContact CZ-CD1 4.04Å; F291-I315 HydrophobicContact CZ-CG1 3.57Å; F291-I315 HydrophobicContact CZ-CG2 4.27Å; A311-I315 WeakPolarHBondContact O-CG1 3.27Å; A311-I315 PolarHBondContact O-N 3.47Å; R312-I315 PolarHBondContact O-N 3.45Å; H313-I315 VanDerWaalsContact C-N 3.33Å; H313-I315 PolarHBondContact O-N 3.02Å; I315-Q317 VanDerWaalsContact C-N 3.3Å; I315-Q317 PolarHBondContact O-N 2.87Å; I315-A318 CarbonylContact O-C 3.59Å; I315-A318 WeakPolarHBondContact O-CB 3.34Å; I315-A318 PolarHBondContact O-N 3.31Å; I315-R319 WeakPolarHBondContact O-CG 3.48Å; I315-R319 PolarHBondContact O-N 3.16Å; I315-F412 HydrophobicContact CD1-CB 3.76Å; I315-F412 HydrophobicContact CD1-CD1 4.37Å; I315-F412 HydrophobicContact CG1-CB 4.15Å; I315-F412 HydrophobicContact CG1-CD1 4.19Å; I315-L413 VanDerWaalsContact CD1-O 3.27Å; I315-L413 WeakPolarHBondContact CD1-O 3.06Å; I315-Y434 WeakPolarHBondContact CD1-O 3.36Å
316	I	98.3	Very high	95.6	Very high	1 Å²	1	19.2 Å²	19.2	1%	0.005	10%	0.096	C	C	.	.	H	α-helix	trans	-64.9	-37	172.9	-69.9	164.7	0	0	0	110.9	W49 V280 A281 L284 R312 H313 A318 R319 L320	W49-I316 HydrophobicContact CD2-CG2 3.97Å; W49-I316 HydrophobicContact CE3-CG2 4.46Å; W49-I316 HydrophobicContact CH2-CB 4.44Å; W49-I316 HydrophobicContact CH2-CD1 3.83Å; W49-I316 HydrophobicContact CH2-CG2 4.03Å; W49-I316 HydrophobicContact CZ2-CB 3.57Å; W49-I316 HydrophobicContact CZ2-CD1 3.6Å; W49-I316 HydrophobicContact CZ2-CG1 4.18Å; W49-I316 HydrophobicContact CZ2-CG2 3.45Å; W49-I316 VanDerWaalsContact CZ2-CG2 3.45Å; W49-I316 HydrophobicContact CZ3-CG2 4.49Å; V280-I316 HydrophobicContact CG1-CG2 4.28Å; A281-I316 HydrophobicContact CB-CD1 4Å; A281-I316 HydrophobicContact CB-CG2 4.46Å; L284-I316 HydrophobicContact CB-CG1 4.42Å; L284-I316 HydrophobicContact CD2-CD1 4.48Å; L284-I316 HydrophobicContact CD2-CG1 4.02Å; R312-I316 HydrophobicContact CG-CD1 4Å; R312-I316 WeakPolarHBondContact O-CG1 3.41Å; R312-I316 PolarHBondContact O-N 3.47Å; H313-I316 PolarHBondContact O-N 2.94Å; I316-A318 VanDerWaalsContact C-N 3.34Å; I316-A318 PolarHBondContact O-N 2.99Å; I316-R319 WeakPolarHBondContact O-CB 3.15Å; I316-R319 PolarHBondContact O-N 2.95Å; I316-R319 VanDerWaalsContact O-N 3.16Å; I316-L320 WeakPolarHBondContact O-CG 3.2Å; I316-L320 PolarHBondContact O-N 3.06Å
317	Q	98.4	Very high	95.3	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-60	-42.1	171.4	-167.3	-175	95.8	0	0	111.7	L46 M50 L82 H313 C314 I315 L320 L321 V335	L46-Q317 HydrophobicContact CD2-CG 3.71Å; M50-Q317 PolarHBondContact SD-NE2 3.46Å; M50-Q317 VanDerWaalsContact SD-NE2 3.35Å; L82-Q317 HydrophobicContact CD1-CG 4.12Å; H313-Q317 WeakPolarHBondContact O-CB 3.29Å; H313-Q317 PolarHBondContact O-N 3.21Å; C314-Q317 WeakPolarHBondContact O-CB 3.46Å; C314-Q317 PolarHBondContact O-N 3.36Å; I315-Q317 VanDerWaalsContact C-N 3.3Å; I315-Q317 PolarHBondContact O-N 2.87Å; Q317-L320 PolarHBondContact O-N 2.92Å; Q317-L321 PolarHBondContact O-N 3.47Å; Q317-V335 HydrophobicContact CB-CG1 4.45Å; Q317-V335 HydrophobicContact CG-CG1 4.09Å
318	A	98.6	Very high	94.5	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-65.2	-39.4	171.8	0	0	0	0	0	112.7	C314 I315 I316 L320 L321 A322 G333 V335 T414	C314-A318 PolarHBondContact O-N 2.99Å; I315-A318 CarbonylContact O-C 3.59Å; I315-A318 WeakPolarHBondContact O-CB 3.34Å; I315-A318 PolarHBondContact O-N 3.31Å; I316-A318 VanDerWaalsContact C-N 3.34Å; I316-A318 PolarHBondContact O-N 2.99Å; A318-L320 PolarHBondContact O-N 3.37Å; A318-L321 WeakPolarHBondContact O-CB 3.37Å; A318-L321 PolarHBondContact O-N 3.21Å; A318-A322 PolarHBondContact O-N 2.91Å; A318-G333 WeakPolarHBondContact O-CA 3.48Å; A318-V335 HydrophobicContact CB-CG1 4.31Å; A318-V335 HydrophobicContact CB-CG2 4.46Å; A318-T414 HydrophobicContact CB-CG2 3.83Å
319	R	98.2	Very high	93.8	Very high	10 Å²	10	21.4 Å²	21.4	4%	0.038	10%	0.102	C	C	.	.	H	α-helix	trans	-62.9	-40.2	174.9	-66.8	168.5	70.7	99.3	6.2	112.2	S200 S203 V280 G283 I315 I316 L321 A322 Y323 T414	S200-R319 VanDerWaalsContact CA-NH2 3.28Å; S200-R319 VanDerWaalsContact CB-NH2 3.28Å; S200-R319 PolarHBondContact O-NH2 2.97Å; S200-R319 PolarHBondContact OG-NH2 3.13Å; S203-R319 VanDerWaalsContact CB-NH1 3.34Å; S203-R319 PolarHBondContact OG-NH1 3.43Å; S203-R319 PolarHBondContact OG-NH2 2.94Å; V280-R319 HydrophobicContact CG1-CB 3.5Å; V280-R319 PolarHBondContact O-NE 3.04Å; V280-R319 VanDerWaalsContact O-NE 3.15Å; G283-R319 PolarHBondContact O-NH1 3.05Å; I315-R319 WeakPolarHBondContact O-CG 3.48Å; I315-R319 PolarHBondContact O-N 3.16Å; I316-R319 WeakPolarHBondContact O-CB 3.15Å; I316-R319 PolarHBondContact O-N 2.95Å; I316-R319 VanDerWaalsContact O-N 3.16Å; R319-L321 VanDerWaalsContact C-N 3.3Å; R319-L321 PolarHBondContact O-N 2.97Å; R319-A322 WeakPolarHBondContact O-CB 3.43Å; R319-A322 PolarHBondContact O-N 3.25Å; R319-Y323 WeakPolarHBondContact O-CD2 3.49Å; R319-Y323 PolarHBondContact O-N 3.47Å; R319-T414 HydrophobicContact CB-CG2 4.38Å; R319-T414 HydrophobicContact CG-CG2 3.84Å
320	L	98.3	Very high	93.4	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-59	-41.3	174.2	-72.3	170.9	0	0	0	111.8	L42 L45 L46 W49 L277 V280 I316 Q317 A318 Y323	L42-L320 HydrophobicContact CD1-CB 4.39Å; L42-L320 VanDerWaalsContact CD1-O 3.32Å; L42-L320 WeakPolarHBondContact CD1-O 3.48Å; L45-L320 HydrophobicContact CB-CD1 4.49Å; L45-L320 HydrophobicContact CB-CD2 4.14Å; L45-L320 HydrophobicContact CD1-CD2 4.31Å; L46-L320 HydrophobicContact CD2-CB 4.18Å; L46-L320 HydrophobicContact CD2-CD1 4.05Å; W49-L320 HydrophobicContact CB-CD1 3.93Å; W49-L320 HydrophobicContact CG-CD1 4.03Å; L277-L320 HydrophobicContact CD1-CD1 3.93Å; L277-L320 HydrophobicContact CD1-CD2 4.12Å; V280-L320 HydrophobicContact CB-CD2 4.26Å; V280-L320 HydrophobicContact CG1-CD2 4.12Å; V280-L320 HydrophobicContact CG1-CG 4.21Å; V280-L320 HydrophobicContact CG2-CD2 4.14Å; I316-L320 WeakPolarHBondContact O-CG 3.2Å; I316-L320 PolarHBondContact O-N 3.06Å; Q317-L320 PolarHBondContact O-N 2.92Å; A318-L320 PolarHBondContact O-N 3.37Å; L320-Y323 PolarHBondContact O-N 3.39Å
321	L	97.9	Very high	93.3	Very high	5 Å²	5	20 Å²	20	3%	0.026	11%	0.107	C	C	.	.	H	α-helix	trans	-64.4	-39.9	175.5	-67.7	165.8	0	0	0	112.4	L42 L46 Q317 A318 R319 Y323 R324 V335 C356 Y358	L42-L321 HydrophobicContact CD1-CD2 4.29Å; L42-L321 HydrophobicContact CD2-CD2 4.14Å; L46-L321 HydrophobicContact CD1-CD2 4.08Å; Q317-L321 PolarHBondContact O-N 3.47Å; A318-L321 WeakPolarHBondContact O-CB 3.37Å; A318-L321 PolarHBondContact O-N 3.21Å; R319-L321 VanDerWaalsContact C-N 3.3Å; R319-L321 PolarHBondContact O-N 2.97Å; L321-Y323 PolarHBondContact O-N 2.09Å; L321-R324 PolarHBondContact O-N 3.35Å; L321-V335 HydrophobicContact CD1-CG1 3.47Å; L321-V335 VanDerWaalsContact CD1-CG1 3.47Å; L321-C356 HydrophobicContact CD1-CB 3.69Å; L321-Y358 HydrophobicContact CB-CD1 4.42Å; L321-Y358 HydrophobicContact CD2-CD1 4.39Å; L321-Y358 VanDerWaalsContact O-CB 3.29Å; L321-Y358 WeakPolarHBondContact O-CB 3.47Å
322	A	97.4	Very high	93.4	Very high	10 Å²	10	21 Å²	21	8%	0.083	11%	0.113	C	C	.	.	H	α-helix	trans	-56.6	-32.8	178.5	0	0	0	0	0	112.8	A318 R319 R324 T325 T414	A318-A322 PolarHBondContact O-N 2.91Å; R319-A322 WeakPolarHBondContact O-CB 3.43Å; R319-A322 PolarHBondContact O-N 3.25Å; A322-R324 PolarHBondContact O-N 2.99Å; A322-T325 WeakPolarHBondContact O-CB 3.41Å; A322-T325 WeakPolarHBondContact O-CG2 3.35Å; A322-T325 PolarHBondContact O-N 3.2Å; A322-T414 HydrophobicContact CB-CG2 4.41Å
323	Y	96.8	Very high	93.4	Very high	21 Å²	21	19.3 Å²	19.3	8%	0.082	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	0	176.2	-71.7	-66.5	0	0	0	115.3	L37 F195 V196 T199 S200 V280 R319 L320 L321	L37-Y323 PolarHBondContact N-O 3.03Å; F195-Y323 HydrophobicContact CD1-CD1 4.34Å; F195-Y323 HydrophobicContact CD1-CE1 4.25Å; F195-Y323 HydrophobicContact CE1-CD1 4.05Å; F195-Y323 HydrophobicContact CE1-CE1 4.06Å; V196-Y323 HydrophobicContact CB-CE1 4.16Å; V196-Y323 HydrophobicContact CG1-CE1 4.48Å; V196-Y323 HydrophobicContact CG1-CE2 4.25Å; V196-Y323 HydrophobicContact CG2-CD1 3.6Å; V196-Y323 HydrophobicContact CG2-CD2 4.38Å; V196-Y323 HydrophobicContact CG2-CE1 3.62Å; V196-Y323 HydrophobicContact CG2-CE2 4.41Å; V196-Y323 HydrophobicContact CG2-CG 3.99Å; V196-Y323 PolarHBondContact O-OH 2.96Å; V196-Y323 VanDerWaalsContact O-OH 3.13Å; T199-Y323 WeakPolarHBondContact OG1-CE1 3.36Å; T199-Y323 PolarHBondContact OG1-OH 2.84Å; S200-Y323 PolarHBondContact N-OH 3.12Å; S200-Y323 PolarHBondContact OG-OH 2.99Å; V280-Y323 HydrophobicContact CG1-CE2 4.37Å; V280-Y323 HydrophobicContact CG2-CD2 3.89Å; V280-Y323 HydrophobicContact CG2-CE2 3.65Å; R319-Y323 WeakPolarHBondContact O-CD2 3.49Å; R319-Y323 PolarHBondContact O-N 3.47Å; L320-Y323 PolarHBondContact O-N 3.39Å; L321-Y323 PolarHBondContact O-N 2.09Å
324	R	94.5	Very high	93.5	Very high	27 Å²	27	19.1 Å²	19.1	10%	0.102	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.4	11.4	164.4	-178.5	50.5	-166.2	78.1	-10.7	112.2	L37 L42 L321 A322 E326 Y358	L37-R324 WeakPolarHBondContact O-CD 3.38Å; L42-R324 HydrophobicContact CD2-CB 3.8Å; L42-R324 HydrophobicContact CD2-CG 3.96Å; L321-R324 PolarHBondContact O-N 3.35Å; A322-R324 PolarHBondContact O-N 2.99Å; R324-E326 IonicContact CZ-OE1 3.61Å; R324-E326 VanDerWaalsContact CZ-OE1 3.27Å; R324-E326 IonicContact NH1-OE1 2.66Å; R324-E326 PolarHBondContact NH1-OE1 2.99Å; R324-E326 IonicContact NH2-OE1 3.77Å; R324-E326 PolarHBondContact NH2-OE1 2.83Å; R324-Y358 HydrophobicContact CB-CD1 4.28Å; R324-Y358 HydrophobicContact CB-CE1 4.1Å; R324-Y358 HydrophobicContact CG-CD1 4.42Å; R324-Y358 HydrophobicContact CG-CE1 3.74Å; R324-Y358 HydrophobicContact CG-CE2 4.1Å; R324-Y358 VanDerWaalsContact O-CE2 3.25Å; R324-Y358 WeakPolarHBondContact O-CE2 3.39Å
325	T	92.6	Very high	93.5	Very high	14 Å²	14	19.1 Å²	19.1	9%	0.086	11%	0.106	C	C	.	.			trans	-52	158.8	177.8	-168.5	0	0	0	0	114	R36 A322 D327 N359	R36-T325 WeakPolarHBondContact CD-O 3.29Å; A322-T325 WeakPolarHBondContact O-CB 3.41Å; A322-T325 WeakPolarHBondContact O-CG2 3.35Å; A322-T325 PolarHBondContact O-N 3.2Å; T325-D327 HydrophobicContact CG2-CB 4.49Å; T325-D327 WeakPolarHBondContact CG2-O 3.36Å; T325-D327 VanDerWaalsContact OG1-CB 3.26Å; T325-D327 WeakPolarHBondContact OG1-CB 3.34Å; T325-D327 PolarHBondContact OG1-N 3.42Å; T325-N359 WeakPolarHBondContact CB-OD1 3.3Å; T325-N359 VanDerWaalsContact OG1-CG 3.32Å; T325-N359 PolarHBondContact OG1-O 3.23Å; T325-N359 PolarHBondContact OG1-OD1 2.65Å
326	E	87.3	Confident	93.5	Very high	38 Å²	38	19.1 Å²	19.1	18%	0.178	11%	0.106	C	C	.	.	S	Bend	trans	-113.1	9.5	169.2	-42.4	-156.3	133.4	0	0	111.4	R36 R324 N359 A360 Y361	R36-E326 IonicContact CZ-OE1 2.8Å; R36-E326 IonicContact NH1-OE1 3.56Å; R36-E326 PolarHBondContact NH1-OE1 3.27Å; R324-E326 IonicContact CZ-OE1 3.61Å; R324-E326 VanDerWaalsContact CZ-OE1 3.27Å; R324-E326 IonicContact NH1-OE1 2.66Å; R324-E326 PolarHBondContact NH1-OE1 2.99Å; R324-E326 IonicContact NH2-OE1 3.77Å; R324-E326 PolarHBondContact NH2-OE1 2.83Å; E326-N359 PolarHBondContact N-O 2.88Å; E326-A360 HydrophobicContact CB-CB 4.48Å; E326-A360 HydrophobicContact CG-CB 4.02Å; E326-Y361 HydrophobicContact CB-CD2 3.99Å; E326-Y361 HydrophobicContact CB-CE2 4.26Å; E326-Y361 WeakPolarHBondContact O-CE2 3.24Å
327	D	84.6	Confident	93.5	Very high	12 Å²	12	19.1 Å²	19.1	6%	0.064	11%	0.106	C	C	.	.			trans	-88.5	116.9	171.4	-167.8	-47.8	0	0	0	110.4	T325 K329 V330 N359 K384 I388	T325-D327 HydrophobicContact CG2-CB 4.49Å; T325-D327 WeakPolarHBondContact CG2-O 3.36Å; T325-D327 VanDerWaalsContact OG1-CB 3.26Å; T325-D327 WeakPolarHBondContact OG1-CB 3.34Å; T325-D327 PolarHBondContact OG1-N 3.42Å; D327-K329 PolarHBondContact O-N 3.28Å; D327-K329 VanDerWaalsContact O-N 3.09Å; D327-K329 WeakPolarHBondContact OD1-CA 3.42Å; D327-K329 PolarHBondContact OD1-N 3.09Å; D327-V330 WeakPolarHBondContact CB-O 3.21Å; D327-V330 PolarHBondContact OD1-N 2.94Å; D327-N359 VanDerWaalsContact CB-ND2 3.29Å; D327-N359 WeakPolarHBondContact CB-ND2 3.24Å; D327-N359 PolarHBondContact OD2-ND2 3.45Å; D327-K384 IonicContact OD1-NZ 3.43Å; D327-K384 PolarHBondContact OD1-NZ 2.73Å; D327-K384 IonicContact OD2-NZ 2.68Å; D327-K384 PolarHBondContact OD2-NZ 2.82Å; D327-I388 HydrophobicContact CB-CD1 3.66Å; D327-I388 WeakPolarHBondContact OD2-CD1 3.2Å
328	P	74.4	Confident	93.3	Very high	42 Å²	42	19.1 Å²	19.1	27%	0.273	11%	0.106	S	C	.	.	S	Bend	trans	-81.9	25.2	-179.3	36.5	-38.6	0	0	0	113.2	Q372	P328-Q372 HydrophobicContact CG-CB 4.35Å
329	K	77.8	Confident	92.9	Very high	114 Å²	114	22.5 Å²	22.5	50%	0.496	12%	0.118	S	C	.	.	S	Bend	trans	-143.9	-37.4	-179.8	-168.3	175.2	-175.4	175.1	0	113.9	D327 D374	D327-K329 PolarHBondContact O-N 3.28Å; D327-K329 VanDerWaalsContact O-N 3.09Å; D327-K329 WeakPolarHBondContact OD1-CA 3.42Å; D327-K329 PolarHBondContact OD1-N 3.09Å; K329-D374 HydrophobicContact CD-CB 4.23Å; K329-D374 IonicContact NZ-OD2 2.95Å; K329-D374 PolarHBondContact NZ-OD2 2.93Å
330	V	85.3	Confident	92.1	Very high	54 Å²	54	22.8 Å²	22.8	33%	0.327	13%	0.125	S	C	.	.			trans	-144.3	110.6	-179.4	-173.4	0	0	0	0	110.9	D327 V332 N359 K415	D327-V330 WeakPolarHBondContact CB-O 3.21Å; D327-V330 PolarHBondContact OD1-N 2.94Å; V330-V332 HydrophobicContact CG1-CG2 3.9Å; V330-N359 PolarHBondContact O-ND2 2.7Å; V330-K415 HydrophobicContact CG1-CD 3.96Å
331	G	93.4	Very high	90.7	Very high	32 Å²	32	33.1 Å²	33.1	33%	0.33	16%	0.164	S	C	.	.			trans	-74.3	127.8	164.6	0	0	0	0	0	111.3
332	V	96.7	Very high	89.1	Confident	21 Å²	21	35.5 Å²	35.5	13%	0.127	18%	0.181	C	C	.	.			trans	-124.9	138.8	171.8	-168.3	0	0	0	0	108.7	V330 Y358 N359 A391 T414 K415	V330-V332 HydrophobicContact CG1-CG2 3.9Å; V332-Y358 CarbonylContact O-C 3.16Å; V332-Y358 WeakPolarHBondContact O-CA 3.25Å; V332-Y358 WeakPolarHBondContact O-CB 3.46Å; V332-N359 HydrophobicContact CB-CB 4.39Å; V332-N359 PolarHBondContact N-OD1 3.38Å; V332-N359 PolarHBondContact O-N 2.98Å; V332-N359 VanDerWaalsContact O-N 3.11Å; V332-N359 PolarHBondContact O-OD1 2.87Å; V332-A391 HydrophobicContact CB-CB 4.04Å; V332-A391 HydrophobicContact CG1-CB 3.77Å; V332-T414 WeakPolarHBondContact CA-OG1 3.5Å; V332-K415 HydrophobicContact CG1-CB 4.34Å; V332-K415 HydrophobicContact CG2-CD 4.23Å
333	G	98.2	Very high	87.2	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	151.8	176.9	0	0	0	0	0	112.4	A318 G357 T414	A318-G333 WeakPolarHBondContact O-CA 3.48Å; G333-G357 WeakPolarHBondContact CA-O 3.17Å; G333-T414 PolarHBondContact N-OG1 3.13Å; G333-T414 PolarHBondContact O-N 3.02Å; G333-T414 VanDerWaalsContact O-N 3.09Å
334	A	98.7	Very high	85.5	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	136.4	-177.3	0	0	0	0	0	111.1	C356 G357 A391 A395 F412 L413	A334-C356 CarbonylContact O-C 3.6Å; A334-C356 VanDerWaalsContact O-CA 3.28Å; A334-C356 WeakPolarHBondContact O-CA 3.25Å; A334-G357 PolarHBondContact N-O 3.01Å; A334-G357 PolarHBondContact O-N 3.44Å; A334-A391 HydrophobicContact CB-CB 3.86Å; A334-A395 HydrophobicContact CB-CB 3.94Å; A334-F412 WeakPolarHBondContact CA-O 3.19Å; A334-L413 HydrophobicContact CB-CD2 3.39Å
335	V	98.6	Very high	84.1	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	142	169.2	-57.2	0	0	0	0	110.7	C314 Q317 A318 L321 C356 M411 F412	C314-V335 HydrophobicContact CB-CG2 4Å; C314-V335 VanDerWaalsContact O-CG2 3.27Å; C314-V335 WeakPolarHBondContact O-CG2 3.45Å; Q317-V335 HydrophobicContact CB-CG1 4.45Å; Q317-V335 HydrophobicContact CG-CG1 4.09Å; A318-V335 HydrophobicContact CB-CG1 4.31Å; A318-V335 HydrophobicContact CB-CG2 4.46Å; L321-V335 HydrophobicContact CD1-CG1 3.47Å; L321-V335 VanDerWaalsContact CD1-CG1 3.47Å; V335-C356 HydrophobicContact CB-CB 4.38Å; V335-C356 HydrophobicContact CG1-CB 3.89Å; V335-M411 WeakPolarHBondContact O-CA 3.27Å; V335-F412 HydrophobicContact CG2-CB 3.78Å; V335-F412 HydrophobicContact CG2-CD2 4.09Å; V335-F412 HydrophobicContact CG2-CG 4.3Å; V335-F412 PolarHBondContact N-O 3.17Å; V335-F412 PolarHBondContact O-N 2.72Å
336	I	98.4	Very high	83.5	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.005	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	117.3	-178.6	-48.8	172.2	0	0	0	108	V354 G355 A395 L396 T409 M410 M411 I430	I336-V354 HydrophobicContact CB-CB 4.24Å; I336-V354 HydrophobicContact CG2-CB 3.91Å; I336-V354 HydrophobicContact CG2-CG1 4.21Å; I336-V354 PolarHBondContact O-N 3.33Å; I336-G355 PolarHBondContact N-O 3.26Å; I336-G355 PolarHBondContact O-N 2.88Å; I336-A395 HydrophobicContact CD1-CB 3.77Å; I336-A395 HydrophobicContact CG1-CB 4.03Å; I336-L396 HydrophobicContact CD1-CD2 3.87Å; I336-L396 HydrophobicContact CD1-CG 4.25Å; I336-T409 HydrophobicContact CG2-CG2 3.51Å; I336-M410 WeakPolarHBondContact CA-O 3.21Å; I336-M411 HydrophobicContact CD1-CE 3.62Å; I336-M411 HydrophobicContact CG1-CE 3.73Å; I336-M411 HydrophobicContact CG1-CG 4.3Å; I336-I430 HydrophobicContact CD1-CD1 4.28Å
337	W	96.9	Very high	83.1	Confident	1 Å²	1	40.7 Å²	40.7	0%	0.004	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	139.9	177.8	-72.7	84.8	0	0	0	109.7	M50 L82 T348 L351 L353 M410 F412	M50-W337 HydrophobicContact CE-CH2 3.98Å; M50-W337 HydrophobicContact CE-CZ2 4.44Å; M50-W337 HydrophobicContact SD-CH2 4.48Å; M50-W337 HydrophobicContact SD-CZ2 4.38Å; L82-W337 HydrophobicContact CB-CH2 3.88Å; L82-W337 HydrophobicContact CB-CZ2 3.92Å; L82-W337 HydrophobicContact CD1-CZ2 4.15Å; W337-T348 HydrophobicContact CH2-CG2 4.09Å; W337-T348 HydrophobicContact CZ3-CG2 4.03Å; W337-L351 HydrophobicContact CE3-CB 3.84Å; W337-L351 HydrophobicContact CZ3-CB 4.34Å; W337-L351 WeakPolarHBondContact CZ3-O 3.37Å; W337-L353 HydrophobicContact CD2-CB 4.39Å; W337-L353 HydrophobicContact CD2-CD1 4.16Å; W337-L353 HydrophobicContact CE3-CB 4.25Å; W337-L353 VanDerWaalsContact CE3-N 3.33Å; W337-L353 HydrophobicContact CG-CD1 4.47Å; W337-L353 HydrophobicContact CH2-CB 4.04Å; W337-L353 HydrophobicContact CZ2-CB 4.15Å; W337-L353 HydrophobicContact CZ2-CD1 3.89Å; W337-L353 HydrophobicContact CZ3-CB 4.09Å; W337-M410 PolarHBondContact N-O 3.06Å; W337-M410 WeakPolarHBondContact O-CE 3.37Å; W337-M410 PolarHBondContact O-N 3.42Å; W337-F412 HydrophobicContact CB-CE2 4.26Å
338	A	94.5	Very high	83.2	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	142.5	175	0	0	0	0	0	111.1	G340 D352 V354 E407 L408	A338-G340 PolarHBondContact O-N 3.43Å; A338-D352 PolarHBondContact N-O 3.32Å; A338-D352 PolarHBondContact O-N 2.82Å; A338-V354 HydrophobicContact CB-CG2 3.43Å; A338-V354 VanDerWaalsContact CB-CG2 3.43Å; A338-E407 HydrophobicContact CB-CG 3.91Å; A338-L408 WeakPolarHBondContact CA-O 3.46Å
339	R	91.2	Very high	83.8	Confident	70 Å²	70	39.2 Å²	39.2	26%	0.264	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	100.9	173.4	-174	170.8	-75.3	119.6	-15.9	110.1	G304 A305 C350 L351 L408	G304-R339 PolarHBondContact O-NH1 2.83Å; A305-R339 PolarHBondContact O-NH2 3.46Å; R339-C350 CarbonylContact C-O 3.51Å; R339-C350 WeakPolarHBondContact CA-O 3.38Å; R339-C350 HydrophobicContact CG-CB 4.05Å; R339-C350 PolarHBondContact NE-SG 3.27Å; R339-L351 HydrophobicContact CB-CD2 4.19Å; R339-L408 HydrophobicContact CB-CB 4.26Å; R339-L408 PolarHBondContact N-O 3.19Å
340	G	80.6	Confident	84.2	Confident	17 Å²	17	35.5 Å²	35.5	18%	0.175	22%	0.22	C	C	.	.			trans	-74.5	172.6	173.2	0	0	0	0	0	113	A338 S342 C350	A338-G340 PolarHBondContact O-N 3.43Å; G340-S342 VanDerWaalsContact C-N 3.34Å; G340-C350 PolarHBondContact N-O 2.71Å
341	R	69.6	Low	84.5	Confident	216 Å²	216	33.3 Å²	33.3	82%	0.815	21%	0.206	S	C	*	.			trans	-92.9	15.1	-179.9	-57.6	-176.3	-176.5	-180	0.6	113.7
342	S	64.6	Low	84.4	Confident	55 Å²	55	32.7 Å²	32.7	39%	0.385	20%	0.195	S	C	.	.			trans	-75.6	141.4	-173.9	-63.9	0	0	0	0	112.4	G340 G344	G340-S342 VanDerWaalsContact C-N 3.34Å; S342-G344 PolarHBondContact O-N 3.07Å
343	A	56.9	Low	84.4	Confident	97 Å²	97	31.8 Å²	31.8	80%	0.802	19%	0.19	S	C	*	.			trans	-78.8	45	-170.5	0	0	0	0	0	115	C345	A343-C345 VanDerWaalsContact C-N 3.27Å; A343-C345 PolarHBondContact O-N 2.84Å
344	G	61.3	Low	84.3	Confident	44 Å²	44	31.8 Å²	31.8	45%	0.454	19%	0.19	S	C	.	.	S	Bend	trans	75.1	-12.3	167.5	0	0	0	0	0	118.1	S342 R346	S342-G344 PolarHBondContact O-N 3.07Å; G344-R346 PolarHBondContact O-N 2.72Å
345	C	64.1	Low	84.2	Confident	48 Å²	48	31.8 Å²	31.8	32%	0.324	19%	0.19	S	C	.	.			trans	-61.9	-6.6	-176.5	-55.5	0	0	0	0	116.2	D88 L89 A343	D88-C345 HydrophobicContact CB-CB 4.33Å; D88-C345 WeakPolarHBondContact OD2-CB 3.49Å; D88-C345 PolarHBondContact OD2-SG 2.79Å; L89-C345 WeakPolarHBondContact CB-O 3.46Å; L89-C345 HydrophobicContact CD1-CB 3.76Å; L89-C345 HydrophobicContact CG-CB 4.12Å; A343-C345 VanDerWaalsContact C-N 3.27Å; A343-C345 PolarHBondContact O-N 2.84Å
346	R	80.3	Confident	84.2	Confident	25 Å²	25	32.4 Å²	32.4	9%	0.094	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-95.6	149.7	177.8	-66.2	-176.2	175.8	152.3	3.5	110.6	A94 G344 T348 G349 D352	A94-R346 HydrophobicContact CB-CG 4.08Å; G344-R346 PolarHBondContact O-N 2.72Å; R346-T348 PolarHBondContact O-N 2.83Å; R346-G349 WeakPolarHBondContact O-CA 3.38Å; R346-G349 PolarHBondContact O-N 3.46Å; R346-D352 IonicContact CZ-OD1 3.84Å; R346-D352 IonicContact NH1-OD1 2.78Å; R346-D352 PolarHBondContact NH1-OD1 3.11Å; R346-D352 IonicContact NH1-OD2 2.81Å; R346-D352 PolarHBondContact NH1-OD2 3Å
347	G	79.6	Confident	84.1	Confident	5 Å²	5	32.6 Å²	32.6	5%	0.052	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-22.4	176.1	0	0	0	0	0	114.6	C84 G349	C84-G347 WeakPolarHBondContact O-CA 3.29Å; C84-G347 PolarHBondContact O-N 2.86Å; C84-G347 VanDerWaalsContact O-N 3.09Å; C84-G347 VanDerWaalsContact SG-CA 3.59Å; G347-G349 PolarHBondContact O-N 3.37Å
348	T	86.3	Confident	84.2	Confident	7 Å²	7	34.5 Å²	34.5	4%	0.043	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84	7.2	171.3	57.4	0	0	0	0	113.5	M50 F53 W337 R346 C350 L351	M50-T348 HydrophobicContact CE-CG2 3.59Å; F53-T348 HydrophobicContact CD1-CG2 4.3Å; F53-T348 HydrophobicContact CD2-CG2 4.29Å; F53-T348 HydrophobicContact CE1-CG2 4.31Å; F53-T348 HydrophobicContact CE2-CG2 4.29Å; F53-T348 HydrophobicContact CG-CG2 4.31Å; F53-T348 HydrophobicContact CZ-CG2 4.3Å; W337-T348 HydrophobicContact CH2-CG2 4.09Å; W337-T348 HydrophobicContact CZ3-CG2 4.03Å; R346-T348 PolarHBondContact O-N 2.83Å; T348-C350 PolarHBondContact O-N 3.02Å; T348-L351 VanDerWaalsContact CB-O 3.23Å; T348-L351 WeakPolarHBondContact CB-O 3.37Å; T348-L351 WeakPolarHBondContact O-CB 3.26Å; T348-L351 PolarHBondContact O-N 2.87Å; T348-L351 PolarHBondContact OG1-O 3.01Å
349	G	86.2	Confident	84.2	Confident	17 Å²	17	34.9 Å²	34.9	18%	0.175	21%	0.206	C	C	.	.	B	Isolated β-bridge	trans	61.7	-105.7	-177.2	0	0	0	0	0	112.1	R346 G347	R346-G349 WeakPolarHBondContact O-CA 3.38Å; R346-G349 PolarHBondContact O-N 3.46Å; G347-G349 PolarHBondContact O-N 3.37Å
350	C	86.4	Confident	84.3	Confident	35 Å²	35	31.9 Å²	31.9	24%	0.236	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.5	4.4	179	56.7	0	0	0	0	113.9	R339 G340 T348	R339-C350 CarbonylContact C-O 3.51Å; R339-C350 WeakPolarHBondContact CA-O 3.38Å; R339-C350 HydrophobicContact CG-CB 4.05Å; R339-C350 PolarHBondContact NE-SG 3.27Å; G340-C350 PolarHBondContact N-O 2.71Å; T348-C350 PolarHBondContact O-N 3.02Å
351	L	91.6	Very high	84.9	Confident	8 Å²	8	32 Å²	32	4%	0.042	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	126.4	-174	-62.9	171.8	0	0	0	112.1	F53 V306 V310 W337 R339 T348 M410	F53-L351 HydrophobicContact CZ-CD1 4.02Å; V306-L351 HydrophobicContact CG1-CD1 4Å; V306-L351 HydrophobicContact CG1-CD2 4.25Å; V310-L351 HydrophobicContact CG1-CD1 3.58Å; W337-L351 HydrophobicContact CE3-CB 3.84Å; W337-L351 HydrophobicContact CZ3-CB 4.34Å; W337-L351 WeakPolarHBondContact CZ3-O 3.37Å; R339-L351 HydrophobicContact CB-CD2 4.19Å; T348-L351 VanDerWaalsContact CB-O 3.23Å; T348-L351 WeakPolarHBondContact CB-O 3.37Å; T348-L351 WeakPolarHBondContact O-CB 3.26Å; T348-L351 PolarHBondContact O-N 2.87Å; T348-L351 PolarHBondContact OG1-O 3.01Å; L351-M410 HydrophobicContact CD2-CE 3.66Å
352	D	92.2	Very high	86	Confident	20 Å²	20	23.7 Å²	23.7	11%	0.107	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	133.6	176.2	-76	-3.7	0	0	0	110.5	A338 R346 V354	A338-D352 PolarHBondContact N-O 3.32Å; A338-D352 PolarHBondContact O-N 2.82Å; R346-D352 IonicContact CZ-OD1 3.84Å; R346-D352 IonicContact NH1-OD1 2.78Å; R346-D352 PolarHBondContact NH1-OD1 3.11Å; R346-D352 IonicContact NH1-OD2 2.81Å; R346-D352 PolarHBondContact NH1-OD2 3Å; D352-V354 PolarHBondContact O-N 2.92Å
353	L	95.6	Very high	87.1	Confident	1 Å²	1	24.9 Å²	24.9	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	122.3	176.3	-175.5	76.2	0	0	0	110.7	V79 L82 W337 T400	V79-L353 HydrophobicContact CG1-CD2 3.84Å; L82-L353 HydrophobicContact CB-CD2 4.22Å; L82-L353 HydrophobicContact CD1-CD1 4.28Å; L82-L353 HydrophobicContact CD1-CD2 4.01Å; L82-L353 HydrophobicContact CG-CD2 3.91Å; W337-L353 HydrophobicContact CD2-CB 4.39Å; W337-L353 HydrophobicContact CD2-CD1 4.16Å; W337-L353 HydrophobicContact CE3-CB 4.25Å; W337-L353 VanDerWaalsContact CE3-N 3.33Å; W337-L353 HydrophobicContact CG-CD1 4.47Å; W337-L353 HydrophobicContact CH2-CB 4.04Å; W337-L353 HydrophobicContact CZ2-CB 4.15Å; W337-L353 HydrophobicContact CZ2-CD1 3.89Å; W337-L353 HydrophobicContact CZ3-CB 4.09Å; L353-T400 PolarHBondContact O-OG1 2.96Å; L353-T400 VanDerWaalsContact O-OG1 3.06Å
354	V	96.7	Very high	88.5	Confident	1 Å²	1	24 Å²	24	1%	0.006	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	-35.2	173.5	177.6	0	0	0	0	111.5	I336 A338 D352 R399 T400 V403	I336-V354 HydrophobicContact CB-CB 4.24Å; I336-V354 HydrophobicContact CG2-CB 3.91Å; I336-V354 HydrophobicContact CG2-CG1 4.21Å; I336-V354 PolarHBondContact O-N 3.33Å; A338-V354 HydrophobicContact CB-CG2 3.43Å; A338-V354 VanDerWaalsContact CB-CG2 3.43Å; D352-V354 PolarHBondContact O-N 2.92Å; V354-R399 HydrophobicContact CG1-CB 4.31Å; V354-R399 CarbonylContact O-C 3.59Å; V354-R399 WeakPolarHBondContact O-CA 3.23Å; V354-R399 WeakPolarHBondContact O-CB 3.14Å; V354-T400 PolarHBondContact O-N 2.87Å; V354-T400 PolarHBondContact O-OG1 2.67Å; V354-V403 HydrophobicContact CG1-CG2 3.89Å
355	G	97.3	Very high	89.7	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.8	165.8	179.2	0	0	0	0	0	112.9	I336	I336-G355 PolarHBondContact N-O 3.26Å; I336-G355 PolarHBondContact O-N 2.88Å
356	C	98.1	Very high	90.6	Very high	13 Å²	13	28.9 Å²	28.9	9%	0.088	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	154.6	174.9	65.5	0	0	0	0	111.8	L321 A334 V335	L321-C356 HydrophobicContact CD1-CB 3.69Å; A334-C356 CarbonylContact O-C 3.6Å; A334-C356 VanDerWaalsContact O-CA 3.28Å; A334-C356 WeakPolarHBondContact O-CA 3.25Å; V335-C356 HydrophobicContact CB-CB 4.38Å; V335-C356 HydrophobicContact CG1-CB 3.89Å
357	G	97.1	Very high	90.4	Very high	5 Å²	5	35.5 Å²	35.5	5%	0.052	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	167.2	-176.7	0	0	0	0	0	113.3	G333 A334	G333-G357 WeakPolarHBondContact CA-O 3.17Å; A334-G357 PolarHBondContact N-O 3.01Å; A334-G357 PolarHBondContact O-N 3.44Å
358	Y	97.2	Very high	90.1	Very high	41 Å²	41	38 Å²	38	16%	0.161	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	163.3	167.1	53.8	-96.2	0	0	0	108	L321 R324 V332 A360 N394	L321-Y358 HydrophobicContact CB-CD1 4.42Å; L321-Y358 HydrophobicContact CD2-CD1 4.39Å; L321-Y358 VanDerWaalsContact O-CB 3.29Å; L321-Y358 WeakPolarHBondContact O-CB 3.47Å; R324-Y358 HydrophobicContact CB-CD1 4.28Å; R324-Y358 HydrophobicContact CB-CE1 4.1Å; R324-Y358 HydrophobicContact CG-CD1 4.42Å; R324-Y358 HydrophobicContact CG-CE1 3.74Å; R324-Y358 HydrophobicContact CG-CE2 4.1Å; R324-Y358 VanDerWaalsContact O-CE2 3.25Å; R324-Y358 WeakPolarHBondContact O-CE2 3.39Å; V332-Y358 CarbonylContact O-C 3.16Å; V332-Y358 WeakPolarHBondContact O-CA 3.25Å; V332-Y358 WeakPolarHBondContact O-CB 3.46Å; Y358-A360 HydrophobicContact CD2-CB 4.02Å; Y358-A360 HydrophobicContact CE2-CB 3.76Å; Y358-N394 PolarHBondContact O-ND2 2.91Å
359	N	94.9	Very high	90	Very high	7 Å²	7	42.8 Å²	42.8	4%	0.037	26%	0.257	C	S	.	.			trans	-72.6	130.1	177.6	61.9	-32.6	0	0	0	111.8	T325 E326 D327 V330 V332 I388 I389	T325-N359 WeakPolarHBondContact CB-OD1 3.3Å; T325-N359 VanDerWaalsContact OG1-CG 3.32Å; T325-N359 PolarHBondContact OG1-O 3.23Å; T325-N359 PolarHBondContact OG1-OD1 2.65Å; E326-N359 PolarHBondContact N-O 2.88Å; D327-N359 VanDerWaalsContact CB-ND2 3.29Å; D327-N359 WeakPolarHBondContact CB-ND2 3.24Å; D327-N359 PolarHBondContact OD2-ND2 3.45Å; V330-N359 PolarHBondContact O-ND2 2.7Å; V332-N359 HydrophobicContact CB-CB 4.39Å; V332-N359 PolarHBondContact N-OD1 3.38Å; V332-N359 PolarHBondContact O-N 2.98Å; V332-N359 VanDerWaalsContact O-N 3.11Å; V332-N359 PolarHBondContact O-OD1 2.87Å; N359-I388 HydrophobicContact CB-CD1 4.01Å; N359-I388 HydrophobicContact CB-CG1 4.37Å; N359-I389 VanDerWaalsContact CA-O 3.23Å; N359-I389 WeakPolarHBondContact CA-O 3.25Å
360	A	93.7	Very high	89.9	Confident	8 Å²	8	44.9 Å²	44.9	7%	0.066	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-160.3	164.8	-171.3	0	0	0	0	0	111.8	E326 Y358 I389	E326-A360 HydrophobicContact CB-CB 4.48Å; E326-A360 HydrophobicContact CG-CB 4.02Å; Y358-A360 HydrophobicContact CD2-CB 4.02Å; Y358-A360 HydrophobicContact CE2-CB 3.76Å; A360-I389 PolarHBondContact N-O 2.76Å; A360-I389 PolarHBondContact O-N 2.7Å
361	Y	92.6	Very high	89.5	Confident	18 Å²	18	45.3 Å²	45.3	7%	0.071	26%	0.263	C	S	.	.	S	Bend	trans	-72.6	171.4	169.3	-63.1	-71.4	0	0	0	111.1	E326 Y370 Q372 I388	E326-Y361 HydrophobicContact CB-CD2 3.99Å; E326-Y361 HydrophobicContact CB-CE2 4.26Å; E326-Y361 WeakPolarHBondContact O-CE2 3.24Å; Y361-Y370 HydrophobicContact CD1-CD2 4.18Å; Y361-Y370 AromaticContact CD1-CG 3.96Å; Y361-Y370 HydrophobicContact CD1-CG 3.96Å; Y361-Y370 HydrophobicContact CG-CD2 4.32Å; Y361-Q372 HydrophobicContact CE2-CG 4.46Å; Y361-I388 HydrophobicContact CD1-CB 4.47Å; Y361-I388 HydrophobicContact CE1-CB 4.15Å
362	P	92.7	Very high	88.6	Confident	42 Å²	42	47.3 Å²	47.3	27%	0.273	27%	0.272	S	S	.	.			trans	-56.4	155.2	-175.4	-27.7	37.5	0	0	0	114.6	G364 S365 Y370 I389	P362-G364 PolarHBondContact O-N 3.13Å; P362-S365 WeakPolarHBondContact O-CB 3.23Å; P362-S365 PolarHBondContact O-N 2.75Å; P362-S365 VanDerWaalsContact O-N 3.17Å; P362-S365 PolarHBondContact O-OG 2.94Å; P362-Y370 HydrophobicContact CG-CE2 4.45Å; P362-I389 HydrophobicContact CB-CD1 4.43Å; P362-I389 HydrophobicContact CG-CD1 4.41Å
363	A	89.3	Confident	87.4	Confident	81 Å²	81	51.6 Å²	51.6	67%	0.669	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	108.4	-176.2	0	0	0	0	0	111.4	F398	A363-F398 HydrophobicContact CB-CZ 4.14Å
364	G	85.3	Confident	85.8	Confident	79 Å²	79	53 Å²	53	81%	0.814	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	117.9	-8	-178	0	0	0	0	0	113.7	P362	P362-G364 PolarHBondContact O-N 3.13Å
365	S	86.6	Confident	83.8	Confident	33 Å²	33	55.9 Å²	55.9	23%	0.231	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-66.2	147	-177.3	-59.1	0	0	0	0	114.3	P362 E369 Y370	P362-S365 WeakPolarHBondContact O-CB 3.23Å; P362-S365 PolarHBondContact O-N 2.75Å; P362-S365 VanDerWaalsContact O-N 3.17Å; P362-S365 PolarHBondContact O-OG 2.94Å; S365-E369 WeakPolarHBondContact CA-OE2 3.41Å; S365-E369 WeakPolarHBondContact CB-OE2 3.37Å; S365-Y370 VanDerWaalsContact OG-CE2 3.23Å; S365-Y370 WeakPolarHBondContact OG-CE2 3.41Å
366	E	83	Confident	81.7	Confident	161 Å²	161	60.8 Å²	60.8	75%	0.752	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-89.2	168	179.2	-67	-161.6	177.4	0	0	112.9	A368 E369	E366-A368 PolarHBondContact O-N 3.04Å; E366-E369 PolarHBondContact N-OE2 3.18Å; E366-E369 WeakPolarHBondContact O-CB 3.25Å; E366-E369 PolarHBondContact O-N 2.9Å
367	Y	75.9	Confident	79.8	Confident	163 Å²	163	63 Å²	63	64%	0.639	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	124.9	-178.8	177.9	-95.3	0	0	0	111.3	E369	Y367-E369 PolarHBondContact O-N 2.85Å
368	A	74	Confident	78	Confident	57 Å²	57	71.7 Å²	71.7	47%	0.471	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.9	20.5	-178.4	0	0	0	0	0	115.5	E366 Y370	E366-A368 PolarHBondContact O-N 3.04Å; A368-Y370 PolarHBondContact O-N 3.25Å
369	E	83.4	Confident	76.3	Confident	108 Å²	108	73.4 Å²	73.4	51%	0.505	41%	0.41	S	S	.	.	S	Bend	trans	-60	-33.5	170.6	-175	-175.2	179.4	0	0	112.2	S365 E366 Y367	S365-E369 WeakPolarHBondContact CA-OE2 3.41Å; S365-E369 WeakPolarHBondContact CB-OE2 3.37Å; E366-E369 PolarHBondContact N-OE2 3.18Å; E366-E369 WeakPolarHBondContact O-CB 3.25Å; E366-E369 PolarHBondContact O-N 2.9Å; Y367-E369 PolarHBondContact O-N 2.85Å
370	Y	83.4	Confident	74.7	Confident	61 Å²	61	78.9 Å²	78.9	24%	0.239	43%	0.43	C	S	.	.	S	Bend	trans	-109.9	148.9	-179.1	-67.2	-84.2	0	0	0	112.5	Y361 P362 S365 A368 Q372 Y387	Y361-Y370 HydrophobicContact CD1-CD2 4.18Å; Y361-Y370 AromaticContact CD1-CG 3.96Å; Y361-Y370 HydrophobicContact CD1-CG 3.96Å; Y361-Y370 HydrophobicContact CG-CD2 4.32Å; P362-Y370 HydrophobicContact CG-CE2 4.45Å; S365-Y370 VanDerWaalsContact OG-CE2 3.23Å; S365-Y370 WeakPolarHBondContact OG-CE2 3.41Å; A368-Y370 PolarHBondContact O-N 3.25Å; Y370-Q372 PolarHBondContact O-N 2.82Å; Y370-Q372 VanDerWaalsContact O-N 3.13Å; Y370-Y387 AromaticContact CD1-CD1 3.45Å; Y370-Y387 HydrophobicContact CD1-CD1 3.45Å; Y370-Y387 VanDerWaalsContact CD1-CD1 3.45Å; Y370-Y387 HydrophobicContact CD1-CE1 4.24Å; Y370-Y387 AromaticContact CD1-CG 3.59Å; Y370-Y387 HydrophobicContact CD1-CG 3.59Å; Y370-Y387 AromaticContact CE1-CD1 3.79Å; Y370-Y387 HydrophobicContact CE1-CD1 3.79Å; Y370-Y387 HydrophobicContact CE1-CG 4.34Å; Y370-Y387 HydrophobicContact CG-CG 4.39Å
371	P	79.7	Confident	73.1	Confident	44 Å²	44	85.4 Å²	85.4	29%	0.286	46%	0.459	S	S	.	.			trans	-59.7	115.3	178.6	-23.4	33.4	0	0	0	112.7	R382 K384 Y387	P371-R382 WeakPolarHBondContact CB-O 3.43Å; P371-K384 WeakPolarHBondContact O-CA 3.44Å; P371-K384 WeakPolarHBondContact O-CB 3.39Å; P371-K384 PolarHBondContact O-N 2.94Å; P371-Y387 HydrophobicContact CG-CD2 4.27Å; P371-Y387 HydrophobicContact CG-CE2 3.86Å
372	Q	72.2	Confident	71.7	Confident	51 Å²	51	91.1 Å²	91.1	24%	0.238	48%	0.481	C	S	.	.			trans	-86.6	-7.8	-178.2	-62.3	-178	-13.9	0	0	113.9	P328 Y361 Y370	P328-Q372 HydrophobicContact CG-CB 4.35Å; Y361-Q372 HydrophobicContact CE2-CG 4.46Å; Y370-Q372 PolarHBondContact O-N 2.82Å; Y370-Q372 VanDerWaalsContact O-N 3.13Å
373	M	66	Low	70.7	Confident	110 Å²	110	91 Å²	91	54%	0.542	48%	0.475	S	S	.	.	B	Isolated β-bridge	trans	-73.3	159.4	-174.6	-62.1	-172.8	-177.4	0	0	112.8	Q377 R383 K384	M373-Q377 HydrophobicContact CB-CG 3.98Å; M373-Q377 HydrophobicContact SD-CG 3.84Å; M373-R383 WeakPolarHBondContact O-CA 3.44Å; M373-K384 PolarHBondContact O-N 2.93Å
374	D	62.5	Low	70	Confident	30 Å²	30	87.3 Å²	87.3	16%	0.16	44%	0.443	C	S	.	.			trans	-104.1	-164.7	-174.3	82.9	-17	0	0	0	113.2	K329 T376 Q377 R383	K329-D374 HydrophobicContact CD-CB 4.23Å; K329-D374 IonicContact NZ-OD2 2.95Å; K329-D374 PolarHBondContact NZ-OD2 2.93Å; D374-T376 PolarHBondContact O-N 2.99Å; D374-T376 WeakPolarHBondContact OD1-CB 3.23Å; D374-T376 VanDerWaalsContact OD1-CG2 3.28Å; D374-T376 WeakPolarHBondContact OD1-CG2 3.45Å; D374-T376 PolarHBondContact OD1-N 3.15Å; D374-T376 PolarHBondContact OD1-OG1 3.47Å; D374-Q377 PolarHBondContact O-N 3.3Å; D374-R383 WeakPolarHBondContact O-CG 3.43Å
375	C	54.8	Low	69.6	Low	61 Å²	61	86.5 Å²	86.5	41%	0.412	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-8.7	179.3	51.1	0	0	0	0	116.1	Q377 R383	C375-Q377 PolarHBondContact O-N 2.97Å; C375-R383 PolarHBondContact O-NH2 3.32Å
376	T	53.7	Low	69.4	Low	104 Å²	104	91.2 Å²	91.2	64%	0.638	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-21.4	174.9	53.5	0	0	0	0	114.2	D374	D374-T376 PolarHBondContact O-N 2.99Å; D374-T376 WeakPolarHBondContact OD1-CB 3.23Å; D374-T376 VanDerWaalsContact OD1-CG2 3.28Å; D374-T376 WeakPolarHBondContact OD1-CG2 3.45Å; D374-T376 PolarHBondContact OD1-N 3.15Å; D374-T376 PolarHBondContact OD1-OG1 3.47Å
377	Q	58.2	Low	69.7	Low	59 Å²	59	87.1 Å²	87.1	28%	0.276	41%	0.407	S	S	.	.			trans	-84.3	124.8	176.7	-61.5	-59	-68.1	0	0	111.1	M373 D374 C375 D379 R382 R383	M373-Q377 HydrophobicContact CB-CG 3.98Å; M373-Q377 HydrophobicContact SD-CG 3.84Å; D374-Q377 PolarHBondContact O-N 3.3Å; C375-Q377 PolarHBondContact O-N 2.97Å; Q377-D379 VanDerWaalsContact C-N 3.3Å; Q377-D379 PolarHBondContact O-N 3.33Å; Q377-R382 HydrophobicContact CB-CB 4.44Å; Q377-R383 PolarHBondContact O-NE 2.87Å; Q377-R383 PolarHBondContact O-NH2 3.49Å
378	E	58.2	Low	70.4	Confident	187 Å²	187	79.9 Å²	79.9	87%	0.874	38%	0.379	S	S	*	.	S	Bend	trans	-59.8	-42	173.5	-63.1	-172.5	158.3	0	0	111.5	R380	E378-R380 PolarHBondContact O-N 2.8Å
379	D	62.1	Low	71.4	Confident	77 Å²	77	79.3 Å²	79.3	41%	0.412	37%	0.368	S	S	.	.			trans	-60.4	93.1	171.1	-87.3	-18.3	0	0	0	110.9	Q377 Q381 R382	Q377-D379 VanDerWaalsContact C-N 3.3Å; Q377-D379 PolarHBondContact O-N 3.33Å; D379-Q381 PolarHBondContact O-N 2.72Å; D379-R382 HydrophobicContact CB-CB 4.3Å; D379-R382 HydrophobicContact CB-CG 3.9Å; D379-R382 PolarHBondContact O-N 3.24Å; D379-R382 IonicContact OD2-CZ 3.04Å; D379-R382 IonicContact OD2-NE 3.33Å; D379-R382 PolarHBondContact OD2-NE 3.4Å; D379-R382 IonicContact OD2-NH1 3.82Å; D379-R382 IonicContact OD2-NH2 2.7Å; D379-R382 PolarHBondContact OD2-NH2 2.66Å
380	R	61.5	Low	72	Confident	123 Å²	123	75.4 Å²	75.4	46%	0.464	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-53.1	-29.3	176.4	-69.2	-174.2	75.1	-174.9	8.6	112.5	E378 R382 R383 R386 G445 D446	E378-R380 PolarHBondContact O-N 2.8Å; R380-R382 VanDerWaalsContact C-N 3.26Å; R380-R382 PolarHBondContact O-N 3.37Å; R380-R383 WeakPolarHBondContact O-CB 3.5Å; R380-R383 PolarHBondContact O-N 2.88Å; R380-R386 VanDerWaalsContact C-NH1 3.25Å; R380-R386 PolarHBondContact O-NH1 3.28Å; R380-G445 PolarHBondContact NH2-O 2.96Å; R380-D446 IonicContact CZ-OD1 2.9Å; R380-D446 IonicContact NE-OD1 2.64Å; R380-D446 PolarHBondContact NE-OD1 2.68Å; R380-D446 IonicContact NH2-OD1 3.84Å; R380-D446 PolarHBondContact NH2-OD1 2.96Å
381	Q	61	Low	72.6	Confident	145 Å²	145	72.5 Å²	72.5	68%	0.678	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-63.7	-26.4	176.8	-66	-176.1	0.7	0	0	113.5	D379 R383 Y387	D379-Q381 PolarHBondContact O-N 2.72Å; Q381-R383 VanDerWaalsContact C-N 3.3Å; Q381-Y387 PolarHBondContact O-OH 3.09Å
382	R	62.1	Low	73.5	Confident	138 Å²	138	70.9 Å²	70.9	52%	0.521	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-86.9	3.5	178.4	-60.6	-178.1	-166.2	174.2	13.3	113.4	P371 Q377 D379 R380	P371-R382 WeakPolarHBondContact CB-O 3.43Å; Q377-R382 HydrophobicContact CB-CB 4.44Å; D379-R382 HydrophobicContact CB-CB 4.3Å; D379-R382 HydrophobicContact CB-CG 3.9Å; D379-R382 PolarHBondContact O-N 3.24Å; D379-R382 IonicContact OD2-CZ 3.04Å; D379-R382 IonicContact OD2-NE 3.33Å; D379-R382 PolarHBondContact OD2-NE 3.4Å; D379-R382 IonicContact OD2-NH1 3.82Å; D379-R382 IonicContact OD2-NH2 2.7Å; D379-R382 PolarHBondContact OD2-NH2 2.66Å; R380-R382 VanDerWaalsContact C-N 3.26Å; R380-R382 PolarHBondContact O-N 3.37Å
383	R	72.4	Confident	74.7	Confident	38 Å²	38	70.3 Å²	70.3	14%	0.143	32%	0.324	C	S	.	.	B	Isolated β-bridge	trans	-93.1	139.9	179.6	-52.5	-177.4	-177.3	-178.8	-2.3	111.1	M373 D374 C375 Q377 R380 Q381 Y385 D446	M373-R383 WeakPolarHBondContact O-CA 3.44Å; D374-R383 WeakPolarHBondContact O-CG 3.43Å; C375-R383 PolarHBondContact O-NH2 3.32Å; Q377-R383 PolarHBondContact O-NE 2.87Å; Q377-R383 PolarHBondContact O-NH2 3.49Å; R380-R383 WeakPolarHBondContact O-CB 3.5Å; R380-R383 PolarHBondContact O-N 2.88Å; Q381-R383 VanDerWaalsContact C-N 3.3Å; R383-Y385 HydrophobicContact CB-CD2 4.06Å; R383-Y385 PolarHBondContact O-N 3.38Å; R383-D446 WeakPolarHBondContact CD-OD2 3.42Å; R383-D446 IonicContact CZ-OD2 3.73Å; R383-D446 IonicContact NE-OD2 2.68Å; R383-D446 IonicContact NH1-OD1 2.94Å; R383-D446 IonicContact NH1-OD2 3.2Å; R383-D446 PolarHBondContact NH1-OD2 2.93Å
384	K	74.6	Confident	76.2	Confident	4 Å²	4	65.4 Å²	65.4	2%	0.017	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-52.6	-27.7	178.4	60.2	173.6	176.8	165.2	0	116	D327 P371 M373 R386 Y387 I388	D327-K384 IonicContact OD1-NZ 3.43Å; D327-K384 PolarHBondContact OD1-NZ 2.73Å; D327-K384 IonicContact OD2-NZ 2.68Å; D327-K384 PolarHBondContact OD2-NZ 2.82Å; P371-K384 WeakPolarHBondContact O-CA 3.44Å; P371-K384 WeakPolarHBondContact O-CB 3.39Å; P371-K384 PolarHBondContact O-N 2.94Å; M373-K384 PolarHBondContact O-N 2.93Å; K384-R386 PolarHBondContact O-N 2.86Å; K384-Y387 PolarHBondContact O-N 3.32Å; K384-I388 WeakPolarHBondContact O-CG2 3.29Å; K384-I388 PolarHBondContact O-N 3.02Å
385	Y	76.1	Confident	77.9	Confident	63 Å²	63	64 Å²	64	25%	0.247	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-61.9	-18.3	-166.2	-62.2	-72.6	0	0	0	116	R383 D446 I447	R383-Y385 HydrophobicContact CB-CD2 4.06Å; R383-Y385 PolarHBondContact O-N 3.38Å; Y385-D446 HydrophobicContact CD1-CB 4.36Å; Y385-D446 HydrophobicContact CD2-CB 3.51Å; Y385-D446 HydrophobicContact CE2-CB 3.99Å; Y385-D446 HydrophobicContact CG-CB 3.73Å; Y385-I447 HydrophobicContact CE1-CG2 4.42Å
386	R	83.1	Confident	80	Confident	132 Å²	132	62 Å²	62	50%	0.498	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-86.2	-8.9	173.7	-76.1	-173.2	-173.4	70.1	6.5	114.6	R380 K384	R380-R386 VanDerWaalsContact C-NH1 3.25Å; R380-R386 PolarHBondContact O-NH1 3.28Å; K384-R386 PolarHBondContact O-N 2.86Å
387	Y	87.8	Confident	82	Confident	74 Å²	74	61.2 Å²	61.2	29%	0.29	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.7	-27.8	-165.7	-51.4	-71	0	0	0	113	Y370 P371 Q381 K384	Y370-Y387 AromaticContact CD1-CD1 3.45Å; Y370-Y387 HydrophobicContact CD1-CD1 3.45Å; Y370-Y387 VanDerWaalsContact CD1-CD1 3.45Å; Y370-Y387 HydrophobicContact CD1-CE1 4.24Å; Y370-Y387 AromaticContact CD1-CG 3.59Å; Y370-Y387 HydrophobicContact CD1-CG 3.59Å; Y370-Y387 AromaticContact CE1-CD1 3.79Å; Y370-Y387 HydrophobicContact CE1-CD1 3.79Å; Y370-Y387 HydrophobicContact CE1-CG 4.34Å; Y370-Y387 HydrophobicContact CG-CG 4.39Å; P371-Y387 HydrophobicContact CG-CD2 4.27Å; P371-Y387 HydrophobicContact CG-CE2 3.86Å; Q381-Y387 PolarHBondContact O-OH 3.09Å; K384-Y387 PolarHBondContact O-N 3.32Å
388	I	90.8	Very high	83.7	Confident	11 Å²	11	61 Å²	61	6%	0.056	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-78.3	129.2	175.6	-165.4	172.3	0	0	0	110.9	D327 N359 Y361 K384	D327-I388 HydrophobicContact CB-CD1 3.66Å; D327-I388 WeakPolarHBondContact OD2-CD1 3.2Å; N359-I388 HydrophobicContact CB-CD1 4.01Å; N359-I388 HydrophobicContact CB-CG1 4.37Å; Y361-I388 HydrophobicContact CD1-CB 4.47Å; Y361-I388 HydrophobicContact CE1-CB 4.15Å; K384-I388 WeakPolarHBondContact O-CG2 3.29Å; K384-I388 PolarHBondContact O-N 3.02Å
389	I	94.9	Very high	85.5	Confident	46 Å²	46	57.5 Å²	57.5	24%	0.236	25%	0.25	C	S	.	.	B	Isolated β-bridge	trans	-87.8	131.9	172.8	-55	177.2	0	0	0	108	N359 A360 P362 Q393 N394	N359-I389 VanDerWaalsContact CA-O 3.23Å; N359-I389 WeakPolarHBondContact CA-O 3.25Å; A360-I389 PolarHBondContact N-O 2.76Å; A360-I389 PolarHBondContact O-N 2.7Å; P362-I389 HydrophobicContact CB-CD1 4.43Å; P362-I389 HydrophobicContact CG-CD1 4.41Å; I389-Q393 HydrophobicContact CG2-CB 3.56Å; I389-N394 HydrophobicContact CG2-CB 4.48Å; I389-N394 WeakPolarHBondContact CG2-OD1 3.23Å
390	H	96.1	Very high	86.9	Confident	26 Å²	26	55 Å²	55	12%	0.12	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-71.7	163.1	-179.1	-64.8	174.7	0	0	0	112.5	E392 Q393 N394 C418	H390-E392 VanDerWaalsContact C-N 3.33Å; H390-E392 PolarHBondContact O-N 3Å; H390-Q393 HydrophobicContact CB-CB 4.45Å; H390-Q393 HydrophobicContact CB-CG 4.21Å; H390-Q393 PolarHBondContact O-N 3.37Å; H390-N394 PolarHBondContact O-N 2.9Å; H390-C418 VanDerWaalsContact CE1-SG 3.54Å; H390-C418 PolarHBondContact ND1-SG 3.4Å; H390-C418 VanDerWaalsContact ND1-SG 3.38Å
391	A	97.6	Very high	88.3	Confident	0 Å²	0	52 Å²	52	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-65.4	-39.4	-176.5	0	0	0	0	0	111.8	V332 A334 N394 A395	V332-A391 HydrophobicContact CB-CB 4.04Å; V332-A391 HydrophobicContact CG1-CB 3.77Å; A334-A391 HydrophobicContact CB-CB 3.86Å; A391-N394 PolarHBondContact O-N 2.96Å; A391-A395 WeakPolarHBondContact O-CB 3.36Å; A391-A395 PolarHBondContact O-N 3.38Å
392	E	98.3	Very high	89.7	Confident	10 Å²	10	50 Å²	50	5%	0.047	22%	0.22	C	C	.	.	H	α-helix	trans	-61.4	-46.6	175.9	-47.7	94.3	105.7	0	0	110.9	H390 A395 L396 M411 L413 P417 C421 I425	H390-E392 VanDerWaalsContact C-N 3.33Å; H390-E392 PolarHBondContact O-N 3Å; E392-A395 PolarHBondContact O-N 2.59Å; E392-L396 WeakPolarHBondContact O-CB 3.4Å; E392-L396 WeakPolarHBondContact O-CG 3.45Å; E392-L396 PolarHBondContact O-N 3.24Å; E392-M411 HydrophobicContact CB-CE 4.11Å; E392-M411 HydrophobicContact CB-SD 4.23Å; E392-M411 HydrophobicContact CG-SD 4.27Å; E392-L413 HydrophobicContact CG-CD1 4.03Å; E392-L413 HydrophobicContact CG-CD2 3.74Å; E392-P417 HydrophobicContact CG-CB 4.36Å; E392-P417 WeakPolarHBondContact OE1-CA 3.5Å; E392-C421 HydrophobicContact CB-CB 4.15Å; E392-C421 HydrophobicContact CG-CB 4.29Å; E392-C421 WeakPolarHBondContact OE1-CB 3.37Å; E392-C421 PolarHBondContact OE1-SG 3.42Å; E392-I425 HydrophobicContact CB-CD1 4.34Å; E392-I425 HydrophobicContact CG-CD1 4.3Å
393	Q	97.8	Very high	91.1	Very high	38 Å²	38	44.8 Å²	44.8	18%	0.178	20%	0.204	C	C	.	.	H	α-helix	trans	-62.1	-46.4	176.6	-68.7	169.3	-14.9	0	0	111.3	I389 H390 L396 T397 L424	I389-Q393 HydrophobicContact CG2-CB 3.56Å; H390-Q393 HydrophobicContact CB-CB 4.45Å; H390-Q393 HydrophobicContact CB-CG 4.21Å; H390-Q393 PolarHBondContact O-N 3.37Å; Q393-L396 PolarHBondContact O-N 2.79Å; Q393-T397 VanDerWaalsContact O-CB 3.28Å; Q393-T397 WeakPolarHBondContact O-CB 3.22Å; Q393-T397 PolarHBondContact O-N 3.09Å; Q393-T397 PolarHBondContact O-OG1 3.36Å; Q393-L424 HydrophobicContact CG-CD1 3.79Å
394	N	97.4	Very high	91.9	Very high	8 Å²	8	48 Å²	48	4%	0.043	22%	0.219	C	C	.	.	H	α-helix	trans	-65.2	-38.8	177	-86.2	-34.2	0	0	0	112.4	Y358 I389 H390 A391 L396 T397 F398	Y358-N394 PolarHBondContact O-ND2 2.91Å; I389-N394 HydrophobicContact CG2-CB 4.48Å; I389-N394 WeakPolarHBondContact CG2-OD1 3.23Å; H390-N394 PolarHBondContact O-N 2.9Å; A391-N394 PolarHBondContact O-N 2.96Å; N394-L396 PolarHBondContact O-N 2.65Å; N394-T397 PolarHBondContact O-N 3.03Å; N394-F398 HydrophobicContact CB-CD2 4.34Å; N394-F398 HydrophobicContact CB-CE2 4.21Å; N394-F398 WeakPolarHBondContact O-CD2 3.09Å; N394-F398 PolarHBondContact O-N 2.59Å; N394-F398 WeakPolarHBondContact OD1-CE2 3.44Å
395	A	97.9	Very high	92.4	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-65.8	-36.4	176.6	0	0	0	0	0	112.9	A334 I336 A391 E392 M411	A334-A395 HydrophobicContact CB-CB 3.94Å; I336-A395 HydrophobicContact CD1-CB 3.77Å; I336-A395 HydrophobicContact CG1-CB 4.03Å; A391-A395 WeakPolarHBondContact O-CB 3.36Å; A391-A395 PolarHBondContact O-N 3.38Å; E392-A395 PolarHBondContact O-N 2.59Å; A395-M411 HydrophobicContact CB-CE 4.48Å
396	L	97.7	Very high	92.7	Very high	19 Å²	19	56.6 Å²	56.6	10%	0.099	27%	0.273	C	S	.	.	H	α-helix	trans	-72.8	-35.3	173.6	-73	174.1	0	0	0	113.2	I336 E392 Q393 N394 R399 M411 L424 A428 I430	I336-L396 HydrophobicContact CD1-CD2 3.87Å; I336-L396 HydrophobicContact CD1-CG 4.25Å; E392-L396 WeakPolarHBondContact O-CB 3.4Å; E392-L396 WeakPolarHBondContact O-CG 3.45Å; E392-L396 PolarHBondContact O-N 3.24Å; Q393-L396 PolarHBondContact O-N 2.79Å; N394-L396 PolarHBondContact O-N 2.65Å; L396-R399 WeakPolarHBondContact O-CG 3.46Å; L396-R399 PolarHBondContact O-NH1 3.07Å; L396-M411 HydrophobicContact CD2-CE 4.49Å; L396-M411 HydrophobicContact CG-CE 4.16Å; L396-L424 HydrophobicContact CD1-CB 3.95Å; L396-A428 HydrophobicContact CD1-CB 4.32Å; L396-A428 HydrophobicContact CD2-CB 3.32Å; L396-A428 HydrophobicContact CG-CB 4.45Å; L396-I430 HydrophobicContact CD2-CD1 3.75Å
397	T	96	Very high	93	Very high	88 Å²	88	51.3 Å²	51.3	54%	0.54	25%	0.254	S	S	.	.	H	α-helix	trans	-75	-38.2	-178.7	-58.5	0	0	0	0	111.9	Q393 N394	Q393-T397 VanDerWaalsContact O-CB 3.28Å; Q393-T397 WeakPolarHBondContact O-CB 3.22Å; Q393-T397 PolarHBondContact O-N 3.09Å; Q393-T397 PolarHBondContact O-OG1 3.36Å; N394-T397 PolarHBondContact O-N 3.03Å
398	F	94.4	Very high	93.2	Very high	53 Å²	53	49.5 Å²	49.5	23%	0.232	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.8	32.2	179.9	-51.6	-40.2	0	0	0	112.9	K78 A363 N394	K78-F398 HydrophobicContact CD-CB 4.35Å; K78-F398 HydrophobicContact CD-CD1 3.78Å; K78-F398 HydrophobicContact CD-CE1 4.26Å; K78-F398 HydrophobicContact CD-CG 3.95Å; K78-F398 HydrophobicContact CG-CG 4.5Å; K78-F398 VanDerWaalsContact NZ-CE1 3.29Å; A363-F398 HydrophobicContact CB-CZ 4.14Å; N394-F398 HydrophobicContact CB-CD2 4.34Å; N394-F398 HydrophobicContact CB-CE2 4.21Å; N394-F398 WeakPolarHBondContact O-CD2 3.09Å; N394-F398 PolarHBondContact O-N 2.59Å; N394-F398 WeakPolarHBondContact OD1-CE2 3.44Å
399	R	95.4	Very high	93.4	Very high	115 Å²	115	49 Å²	49	43%	0.434	25%	0.246	S	C	.	.			trans	-63.3	142.8	173.5	69.9	-177.8	-176.2	-83.1	1.2	112	V354 L396 R401 D402	V354-R399 HydrophobicContact CG1-CB 4.31Å; V354-R399 CarbonylContact O-C 3.59Å; V354-R399 WeakPolarHBondContact O-CA 3.23Å; V354-R399 WeakPolarHBondContact O-CB 3.14Å; L396-R399 WeakPolarHBondContact O-CG 3.46Å; L396-R399 PolarHBondContact O-NH1 3.07Å; R399-R401 VanDerWaalsContact C-N 3.34Å; R399-R401 WeakPolarHBondContact CD-O 3.5Å; R399-R401 WeakPolarHBondContact CG-O 3.39Å; R399-D402 IonicContact CZ-OD1 2.65Å; R399-D402 IonicContact NE-OD1 3.9Å; R399-D402 PolarHBondContact NE-OD1 2.66Å; R399-D402 IonicContact NH2-OD1 3.6Å; R399-D402 PolarHBondContact NH2-OD1 2.83Å
400	T	91.4	Very high	93.5	Very high	24 Å²	24	46.8 Å²	46.8	15%	0.147	24%	0.235	C	C	.	.	S	Bend	trans	-81.4	-20.9	-174.1	70.8	0	0	0	0	112.2	L80 L353 V354	L80-T400 VanDerWaalsContact O-CG2 3.22Å; L80-T400 WeakPolarHBondContact O-CG2 3.46Å; L353-T400 PolarHBondContact O-OG1 2.96Å; L353-T400 VanDerWaalsContact O-OG1 3.06Å; V354-T400 PolarHBondContact O-N 2.87Å; V354-T400 PolarHBondContact O-OG1 2.67Å
401	R	91.8	Very high	93.6	Very high	61 Å²	61	45.5 Å²	45.5	23%	0.23	23%	0.229	C	C	.	.	S	Bend	trans	-161.7	167.7	177.5	60.5	-179.7	-173.6	85.7	-16	108.6	R399 E407	R399-R401 VanDerWaalsContact C-N 3.34Å; R399-R401 WeakPolarHBondContact CD-O 3.5Å; R399-R401 WeakPolarHBondContact CG-O 3.39Å; R401-E407 IonicContact CZ-OE1 2.83Å; R401-E407 IonicContact CZ-OE2 3.88Å; R401-E407 VanDerWaalsContact NH1-CD 3.33Å; R401-E407 IonicContact NH1-OE1 2.67Å; R401-E407 PolarHBondContact NH1-OE1 3.29Å; R401-E407 IonicContact NH1-OE2 2.65Å; R401-E407 PolarHBondContact NH1-OE2 2.81Å; R401-E407 VanDerWaalsContact NH1-OE2 3.14Å; R401-E407 IonicContact NH2-OE1 2.7Å; R401-E407 PolarHBondContact NH2-OE1 3.08Å; R401-E407 IonicContact NH2-OE2 2.86Å; R401-E407 PolarHBondContact NH2-OE2 2.97Å
402	D	90.9	Very high	93.6	Very high	102 Å²	102	45.6 Å²	45.6	55%	0.545	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-72.2	154.7	169.9	-60.1	-62	0	0	0	112.5	R399	R399-D402 IonicContact CZ-OD1 2.65Å; R399-D402 IonicContact NE-OD1 3.9Å; R399-D402 PolarHBondContact NE-OD1 2.66Å; R399-D402 IonicContact NH2-OD1 3.6Å; R399-D402 PolarHBondContact NH2-OD1 2.83Å
403	V	91	Very high	93.6	Very high	29 Å²	29	45.1 Å²	45.1	18%	0.176	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-77.4	135.3	171	172.7	0	0	0	0	108.8	V354 T409 A428	V354-V403 HydrophobicContact CG1-CG2 3.89Å; V403-T409 HydrophobicContact CG1-CG2 4.29Å; V403-T409 WeakPolarHBondContact CG1-OG1 3.07Å; V403-T409 HydrophobicContact CG2-CG2 4.04Å; V403-A428 VanDerWaalsContact CB-O 3.24Å; V403-A428 WeakPolarHBondContact CB-O 3.13Å; V403-A428 WeakPolarHBondContact CG1-O 3.43Å; V403-A428 WeakPolarHBondContact CG2-O 3.11Å
404	K	89.2	Confident	93.6	Very high	104 Å²	104	43.9 Å²	43.9	45%	0.452	22%	0.222	S	C	.	.	P	Polyproline II helix	trans	-97.3	134.1	179.9	-58.9	-176.4	175	-170.1	0	111	E406 E407	K404-E406 WeakPolarHBondContact CD-OE1 3.39Å; K404-E406 PolarHBondContact O-N 2.95Å; K404-E406 VanDerWaalsContact O-N 3.12Å; K404-E407 HydrophobicContact CB-CB 4.17Å; K404-E407 HydrophobicContact CB-CG 4Å; K404-E407 PolarHBondContact N-OE1 2.62Å; K404-E407 WeakPolarHBondContact O-CG 3.48Å; K404-E407 PolarHBondContact O-N 3.42Å; K404-E407 VanDerWaalsContact O-N 3.09Å
405	P	83.8	Confident	93.5	Very high	135 Å²	135	45 Å²	45	88%	0.877	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-29.2	179	-26.2	35.1	0	0	0	114.2
406	E	84.1	Confident	93.3	Very high	114 Å²	114	45.2 Å²	45.2	53%	0.533	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	8.8	-178.9	80	-69.2	173.4	0	0	114.9	K404	K404-E406 WeakPolarHBondContact CD-OE1 3.39Å; K404-E406 PolarHBondContact O-N 2.95Å; K404-E406 VanDerWaalsContact O-N 3.12Å
407	E	88.6	Confident	93.2	Very high	21 Å²	21	44.3 Å²	44.3	10%	0.098	22%	0.223	C	C	.	.	S	Bend	trans	-114.2	144.2	177.7	91.4	-168.5	146.4	0	0	112.8	A338 R401 K404 T409	A338-E407 HydrophobicContact CB-CG 3.91Å; R401-E407 IonicContact CZ-OE1 2.83Å; R401-E407 IonicContact CZ-OE2 3.88Å; R401-E407 VanDerWaalsContact NH1-CD 3.33Å; R401-E407 IonicContact NH1-OE1 2.67Å; R401-E407 PolarHBondContact NH1-OE1 3.29Å; R401-E407 IonicContact NH1-OE2 2.65Å; R401-E407 PolarHBondContact NH1-OE2 2.81Å; R401-E407 VanDerWaalsContact NH1-OE2 3.14Å; R401-E407 IonicContact NH2-OE1 2.7Å; R401-E407 PolarHBondContact NH2-OE1 3.08Å; R401-E407 IonicContact NH2-OE2 2.86Å; R401-E407 PolarHBondContact NH2-OE2 2.97Å; K404-E407 HydrophobicContact CB-CB 4.17Å; K404-E407 HydrophobicContact CB-CG 4Å; K404-E407 PolarHBondContact N-OE1 2.62Å; K404-E407 WeakPolarHBondContact O-CG 3.48Å; K404-E407 PolarHBondContact O-N 3.42Å; K404-E407 VanDerWaalsContact O-N 3.09Å; E407-T409 WeakPolarHBondContact CG-OG1 3.48Å; E407-T409 PolarHBondContact O-N 3.2Å; E407-T409 VanDerWaalsContact O-N 3.13Å
408	L	91.7	Very high	93.1	Very high	35 Å²	35	40.2 Å²	40.2	18%	0.183	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	101.3	179.1	-165.5	153.3	0	0	0	109.7	G304 A338 R339 M410 H432	G304-L408 VanDerWaalsContact O-CD1 3.24Å; G304-L408 WeakPolarHBondContact O-CD1 3.39Å; G304-L408 WeakPolarHBondContact O-CD2 3.19Å; A338-L408 WeakPolarHBondContact CA-O 3.46Å; R339-L408 HydrophobicContact CB-CB 4.26Å; R339-L408 PolarHBondContact N-O 3.19Å; L408-M410 HydrophobicContact CD2-CE 3.79Å; L408-M410 HydrophobicContact CD2-CG 3.58Å; L408-M410 HydrophobicContact CD2-SD 3.55Å; L408-M410 VanDerWaalsContact CD2-SD 3.55Å; L408-H432 VanDerWaalsContact CD1-CE1 3.47Å; L408-H432 WeakPolarHBondContact CD1-CE1 3.28Å; L408-H432 VanDerWaalsContact CG-CE1 3.47Å; L408-H432 WeakPolarHBondContact CG-CE1 3.46Å
409	T	95.4	Very high	93.2	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	128	179.4	-58.1	0	0	0	0	111.6	I336 V403 E407 I430 T431 H432	I336-T409 HydrophobicContact CG2-CG2 3.51Å; V403-T409 HydrophobicContact CG1-CG2 4.29Å; V403-T409 WeakPolarHBondContact CG1-OG1 3.07Å; V403-T409 HydrophobicContact CG2-CG2 4.04Å; E407-T409 WeakPolarHBondContact CG-OG1 3.48Å; E407-T409 PolarHBondContact O-N 3.2Å; E407-T409 VanDerWaalsContact O-N 3.13Å; T409-I430 HydrophobicContact CG2-CG1 3.94Å; T409-T431 PolarHBondContact O-N 3.13Å; T409-T431 PolarHBondContact O-OG1 3.26Å; T409-H432 PolarHBondContact O-N 3.24Å
410	M	96.6	Very high	93.2	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	137.2	-177.9	-63.9	146	-66.5	0	0	110.3	V306 I336 W337 L351 L408 F412 H432 Y434	V306-M410 HydrophobicContact CG1-CE 4.33Å; V306-M410 HydrophobicContact CG1-SD 3.61Å; V306-M410 HydrophobicContact CG2-SD 4.36Å; I336-M410 WeakPolarHBondContact CA-O 3.21Å; W337-M410 PolarHBondContact N-O 3.06Å; W337-M410 WeakPolarHBondContact O-CE 3.37Å; W337-M410 PolarHBondContact O-N 3.42Å; L351-M410 HydrophobicContact CD2-CE 3.66Å; L408-M410 HydrophobicContact CD2-CE 3.79Å; L408-M410 HydrophobicContact CD2-CG 3.58Å; L408-M410 HydrophobicContact CD2-SD 3.55Å; L408-M410 VanDerWaalsContact CD2-SD 3.55Å; M410-F412 HydrophobicContact CB-CD2 4.35Å; M410-F412 HydrophobicContact CB-CE2 3.52Å; M410-F412 HydrophobicContact CB-CZ 3.79Å; M410-F412 HydrophobicContact CG-CZ 4.43Å; M410-F412 HydrophobicContact SD-CZ 4.27Å; M410-H432 WeakPolarHBondContact CA-O 3.46Å; M410-H432 HydrophobicContact CB-CB 4.42Å; M410-H432 HydrophobicContact CG-CB 3.8Å; M410-Y434 HydrophobicContact CB-CD2 4.43Å; M410-Y434 HydrophobicContact CB-CE2 4.33Å; M410-Y434 HydrophobicContact CG-CE2 4.06Å; M410-Y434 HydrophobicContact SD-CE2 4.49Å
411	M	98.2	Very high	93.4	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	129	170.2	-178.3	179.6	-99.3	0	0	110	V335 I336 E392 A395 L396 L413 I425 I430 H432 I433 Y434	V335-M411 WeakPolarHBondContact O-CA 3.27Å; I336-M411 HydrophobicContact CD1-CE 3.62Å; I336-M411 HydrophobicContact CG1-CE 3.73Å; I336-M411 HydrophobicContact CG1-CG 4.3Å; E392-M411 HydrophobicContact CB-CE 4.11Å; E392-M411 HydrophobicContact CB-SD 4.23Å; E392-M411 HydrophobicContact CG-SD 4.27Å; A395-M411 HydrophobicContact CB-CE 4.48Å; L396-M411 HydrophobicContact CD2-CE 4.49Å; L396-M411 HydrophobicContact CG-CE 4.16Å; M411-L413 HydrophobicContact CG-CD1 4.46Å; M411-L413 HydrophobicContact CG-CD2 3.66Å; M411-L413 HydrophobicContact CG-CG 3.95Å; M411-L413 HydrophobicContact SD-CD1 4.2Å; M411-L413 HydrophobicContact SD-CD2 3.78Å; M411-L413 HydrophobicContact SD-CG 4.24Å; M411-I425 HydrophobicContact CE-CG1 4.25Å; M411-I425 HydrophobicContact SD-CD1 3.79Å; M411-I425 HydrophobicContact SD-CG1 3.81Å; M411-I425 HydrophobicContact SD-CG2 4.42Å; M411-I430 HydrophobicContact CB-CD1 4.2Å; M411-I430 HydrophobicContact CB-CG2 3.88Å; M411-I430 HydrophobicContact CE-CD1 3.68Å; M411-I430 HydrophobicContact SD-CD1 4.2Å; M411-H432 PolarHBondContact N-O 3.48Å; M411-I433 CarbonylContact O-C 3.51Å; M411-I433 WeakPolarHBondContact O-CA 3.36Å; M411-Y434 PolarHBondContact O-N 3.16Å
412	F	98.5	Very high	93.6	Very high	1 Å²	1	35.1 Å²	35.1	0%	0.004	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	123.9	179.5	-56.3	-97.9	0	0	0	108.7	V306 A311 C314 I315 A334 V335 W337 M410 Y434	V306-F412 HydrophobicContact CG2-CE1 3.95Å; V306-F412 HydrophobicContact CG2-CZ 3.84Å; A311-F412 HydrophobicContact CB-CE1 4.15Å; C314-F412 HydrophobicContact CB-CB 3.97Å; C314-F412 HydrophobicContact CB-CD1 3.57Å; C314-F412 HydrophobicContact CB-CD2 3.58Å; C314-F412 HydrophobicContact CB-CE1 3.92Å; C314-F412 HydrophobicContact CB-CE2 3.9Å; C314-F412 HydrophobicContact CB-CG 3.42Å; C314-F412 VanDerWaalsContact CB-CG 3.42Å; C314-F412 HydrophobicContact CB-CZ 4.07Å; I315-F412 HydrophobicContact CD1-CB 3.76Å; I315-F412 HydrophobicContact CD1-CD1 4.37Å; I315-F412 HydrophobicContact CG1-CB 4.15Å; I315-F412 HydrophobicContact CG1-CD1 4.19Å; A334-F412 WeakPolarHBondContact CA-O 3.19Å; V335-F412 HydrophobicContact CG2-CB 3.78Å; V335-F412 HydrophobicContact CG2-CD2 4.09Å; V335-F412 HydrophobicContact CG2-CG 4.3Å; V335-F412 PolarHBondContact N-O 3.17Å; V335-F412 PolarHBondContact O-N 2.72Å; W337-F412 HydrophobicContact CB-CE2 4.26Å; M410-F412 HydrophobicContact CB-CD2 4.35Å; M410-F412 HydrophobicContact CB-CE2 3.52Å; M410-F412 HydrophobicContact CB-CZ 3.79Å; M410-F412 HydrophobicContact CG-CZ 4.43Å; M410-F412 HydrophobicContact SD-CZ 4.27Å; F412-Y434 WeakPolarHBondContact CA-O 3.19Å; F412-Y434 HydrophobicContact CD1-CD1 4.23Å; F412-Y434 AromaticContact CD1-CD2 3.76Å; F412-Y434 HydrophobicContact CD1-CD2 3.76Å; F412-Y434 AromaticContact CD1-CG 3.54Å; F412-Y434 HydrophobicContact CD1-CG 3.54Å; F412-Y434 AromaticContact CE1-CD1 3.9Å; F412-Y434 HydrophobicContact CE1-CD1 3.9Å; F412-Y434 AromaticContact CE1-CD2 3.32Å; F412-Y434 HydrophobicContact CE1-CD2 3.32Å; F412-Y434 HydrophobicContact CE1-CE1 4.3Å; F412-Y434 AromaticContact CE1-CE2 3.76Å; F412-Y434 HydrophobicContact CE1-CE2 3.76Å; F412-Y434 AromaticContact CE1-CG 3.41Å; F412-Y434 HydrophobicContact CE1-CG 3.41Å; F412-Y434 VanDerWaalsContact CE1-CG 3.41Å; F412-Y434 AromaticContact CZ-CD2 3.8Å; F412-Y434 HydrophobicContact CZ-CD2 3.8Å; F412-Y434 AromaticContact CZ-CE2 3.97Å; F412-Y434 HydrophobicContact CZ-CE2 3.97Å; F412-Y434 HydrophobicContact CZ-CG 4.34Å
413	L	98.3	Very high	93.9	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	146.3	-169.4	-59.3	178.4	0	0	0	112.2	I315 A334 E392 M411 K415 P417 I433 Y434	I315-L413 VanDerWaalsContact CD1-O 3.27Å; I315-L413 WeakPolarHBondContact CD1-O 3.06Å; A334-L413 HydrophobicContact CB-CD2 3.39Å; E392-L413 HydrophobicContact CG-CD1 4.03Å; E392-L413 HydrophobicContact CG-CD2 3.74Å; M411-L413 HydrophobicContact CG-CD1 4.46Å; M411-L413 HydrophobicContact CG-CD2 3.66Å; M411-L413 HydrophobicContact CG-CG 3.95Å; M411-L413 HydrophobicContact SD-CD1 4.2Å; M411-L413 HydrophobicContact SD-CD2 3.78Å; M411-L413 HydrophobicContact SD-CG 4.24Å; L413-K415 VanDerWaalsContact C-N 3.32Å; L413-K415 VanDerWaalsContact CB-O 3.29Å; L413-K415 WeakPolarHBondContact CB-O 3.17Å; L413-P417 HydrophobicContact CD1-CB 3.74Å; L413-P417 HydrophobicContact CD1-CG 3.83Å; L413-I433 HydrophobicContact CD1-CG2 4.23Å; L413-Y434 PolarHBondContact N-O 3.17Å
414	T	97.4	Very high	94.1	Very high	12 Å²	12	35.8 Å²	35.8	7%	0.074	19%	0.187	C	C	.	.	S	Bend	trans	-80.2	-13.1	173.1	63.7	0	0	0	0	113.8	F205 A318 R319 A322 V332 G333	F205-T414 WeakPolarHBondContact CE2-O 3.47Å; A318-T414 HydrophobicContact CB-CG2 3.83Å; R319-T414 HydrophobicContact CB-CG2 4.38Å; R319-T414 HydrophobicContact CG-CG2 3.84Å; A322-T414 HydrophobicContact CB-CG2 4.41Å; V332-T414 WeakPolarHBondContact CA-OG1 3.5Å; G333-T414 PolarHBondContact N-OG1 3.13Å; G333-T414 PolarHBondContact O-N 3.02Å; G333-T414 VanDerWaalsContact O-N 3.09Å
415	K	95.4	Very high	94.5	Very high	33 Å²	33	30.9 Å²	30.9	14%	0.143	17%	0.166	C	C	.	.	S	Bend	trans	-146.5	158.3	178.6	-74.1	-160.7	145.6	-72.4	0	110.8	D204 V330 V332 L413 T435 D439	D204-K415 IonicContact OD1-NZ 3.49Å; D204-K415 PolarHBondContact OD1-NZ 3.31Å; D204-K415 IonicContact OD2-NZ 3.54Å; D204-K415 PolarHBondContact OD2-NZ 3.18Å; V330-K415 HydrophobicContact CG1-CD 3.96Å; V332-K415 HydrophobicContact CG1-CB 4.34Å; V332-K415 HydrophobicContact CG2-CD 4.23Å; L413-K415 VanDerWaalsContact C-N 3.32Å; L413-K415 VanDerWaalsContact CB-O 3.29Å; L413-K415 WeakPolarHBondContact CB-O 3.17Å; K415-T435 PolarHBondContact O-OG1 2.87Å; K415-D439 IonicContact NZ-OD2 2.68Å; K415-D439 PolarHBondContact NZ-OD2 2.93Å
416	C	93.8	Very high	95	Very high	3 Å²	3	29.9 Å²	29.9	2%	0.02	14%	0.144	C	C	.	.	P	Polyproline II helix	trans	-51.9	131.9	169.8	-171.8	0	0	0	0	110.8	T435 S436 D439 Y449 F452	C416-T435 PolarHBondContact N-OG1 2.72Å; C416-S436 PolarHBondContact N-O 2.93Å; C416-D439 HydrophobicContact CB-CB 4.03Å; C416-Y449 HydrophobicContact CB-CD1 4.26Å; C416-Y449 VanDerWaalsContact O-CE1 3.23Å; C416-Y449 WeakPolarHBondContact O-CE1 3.34Å; C416-F452 VanDerWaalsContact SG-CD1 3.52Å
417	P	95.6	Very high	95.4	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.154	C	C	.	.	P	Polyproline II helix	trans	-74.1	141.4	179	27.7	-31.4	0	0	0	111.8	E392 L413 C421 I422 I425 F452	E392-P417 HydrophobicContact CG-CB 4.36Å; E392-P417 WeakPolarHBondContact OE1-CA 3.5Å; L413-P417 HydrophobicContact CD1-CB 3.74Å; L413-P417 HydrophobicContact CD1-CG 3.83Å; P417-C421 HydrophobicContact CB-CB 4.47Å; P417-I422 HydrophobicContact CB-CD1 4.03Å; P417-I422 HydrophobicContact CG-CD1 3.72Å; P417-I425 HydrophobicContact CB-CD1 3.8Å; P417-I425 HydrophobicContact CG-CD1 4.33Å; P417-F452 HydrophobicContact CG-CD2 3.72Å; P417-F452 HydrophobicContact CG-CE2 3.89Å
418	C	94.7	Very high	95.7	Very high	2 Å²	2	28.2 Å²	28.2	1%	0.014	16%	0.161	C	C	.	.	P	Polyproline II helix	trans	-81	166.4	-176.8	78.1	0	0	0	0	113.9	H390 E420 C421 I422 I447 S448 Y449	H390-C418 VanDerWaalsContact CE1-SG 3.54Å; H390-C418 PolarHBondContact ND1-SG 3.4Å; H390-C418 VanDerWaalsContact ND1-SG 3.38Å; C418-E420 PolarHBondContact O-N 3.15Å; C418-E420 VanDerWaalsContact O-N 3.09Å; C418-C421 WeakPolarHBondContact O-CA 3.27Å; C418-C421 WeakPolarHBondContact O-CB 3.41Å; C418-C421 PolarHBondContact O-N 2.94Å; C418-I422 WeakPolarHBondContact O-CG1 3.38Å; C418-I422 PolarHBondContact O-N 3.26Å; C418-I447 HydrophobicContact CB-CD1 3.78Å; C418-I447 HydrophobicContact CB-CG1 3.67Å; C418-S448 WeakPolarHBondContact CA-O 3.49Å; C418-S448 WeakPolarHBondContact CB-O 3.38Å; C418-Y449 HydrophobicContact CB-CD1 4.1Å; C418-Y449 HydrophobicContact CB-CE1 3.85Å
419	D	95.3	Very high	95.8	Very high	11 Å²	11	28.2 Å²	28.2	6%	0.059	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-22.2	-174.6	-68.7	-18.4	0	0	0	115.2	P423 S448 Y449 L450 R451	D419-P423 VanDerWaalsContact O-CD 3.25Å; D419-P423 WeakPolarHBondContact O-CD 3.46Å; D419-S448 VanDerWaalsContact CG-C 3.5Å; D419-S448 VanDerWaalsContact CG-O 3.25Å; D419-S448 PolarHBondContact N-O 2.68Å; D419-S448 VanDerWaalsContact OD2-C 3.26Å; D419-S448 VanDerWaalsContact OD2-CB 3.27Å; D419-S448 WeakPolarHBondContact OD2-CB 3.23Å; D419-S448 PolarHBondContact OD2-OG 3.03Å; D419-Y449 VanDerWaalsContact OD1-C 3.23Å; D419-Y449 WeakPolarHBondContact OD1-CA 3.44Å; D419-Y449 PolarHBondContact OD2-N 2.92Å; D419-L450 VanDerWaalsContact CG-N 3.33Å; D419-L450 PolarHBondContact OD1-N 3.36Å; D419-L450 PolarHBondContact OD2-N 3.49Å; D419-R451 HydrophobicContact CB-CB 4.48Å; D419-R451 HydrophobicContact CB-CG 4.08Å; D419-R451 PolarHBondContact O-NH1 3.33Å; D419-R451 VanDerWaalsContact OD1-CB 3.23Å; D419-R451 WeakPolarHBondContact OD1-CB 3.42Å; D419-R451 WeakPolarHBondContact OD1-CG 3.26Å; D419-R451 PolarHBondContact OD1-N 2.62Å
420	E	94.8	Very high	95.9	Very high	132 Å²	132	28.4 Å²	28.4	62%	0.617	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-27.6	172.1	-60.5	-170.4	155.2	0	0	112.8	C418 P423	C418-E420 PolarHBondContact O-N 3.15Å; C418-E420 VanDerWaalsContact O-N 3.09Å; E420-P423 WeakPolarHBondContact O-CD 3.26Å; E420-P423 WeakPolarHBondContact O-CG 3.29Å
421	C	97	Very high	95.7	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-81.8	-33.2	177.6	-66.9	0	0	0	0	112.2	E392 P417 C418 L424 I425	E392-C421 HydrophobicContact CB-CB 4.15Å; E392-C421 HydrophobicContact CG-CB 4.29Å; E392-C421 WeakPolarHBondContact OE1-CB 3.37Å; E392-C421 PolarHBondContact OE1-SG 3.42Å; P417-C421 HydrophobicContact CB-CB 4.47Å; C418-C421 WeakPolarHBondContact O-CA 3.27Å; C418-C421 WeakPolarHBondContact O-CB 3.41Å; C418-C421 PolarHBondContact O-N 2.94Å; C421-L424 WeakPolarHBondContact O-CB 3.36Å; C421-L424 PolarHBondContact O-N 3.05Å; C421-I425 HydrophobicContact CB-CD1 4.24Å; C421-I425 VanDerWaalsContact O-CG1 3.28Å; C421-I425 WeakPolarHBondContact O-CG1 3.43Å; C421-I425 PolarHBondContact O-N 3.32Å
422	I	96.2	Very high	95.6	Very high	4 Å²	4	31.2 Å²	31.2	2%	0.021	19%	0.187	C	C	.	.	H	α-helix	trans	-46.8	-53.5	175.2	-56.4	-50.7	0	0	0	113.6	P417 C418 L424 I425 R426 R451 F452 L455	P417-I422 HydrophobicContact CB-CD1 4.03Å; P417-I422 HydrophobicContact CG-CD1 3.72Å; C418-I422 WeakPolarHBondContact O-CG1 3.38Å; C418-I422 PolarHBondContact O-N 3.26Å; I422-L424 VanDerWaalsContact C-N 3.31Å; I422-L424 PolarHBondContact O-N 3.47Å; I422-I425 PolarHBondContact O-N 2.9Å; I422-R426 PolarHBondContact O-N 3.19Å; I422-R451 HydrophobicContact CG1-CB 4.09Å; I422-F452 HydrophobicContact CD1-CB 4.43Å; I422-F452 HydrophobicContact CD1-CD2 4.06Å; I422-L455 HydrophobicContact CD1-CD2 4.38Å; I422-L455 HydrophobicContact CG2-CD1 3.98Å; I422-L455 HydrophobicContact CG2-CD2 4.22Å
423	P	95.8	Very high	95.5	Very high	62 Å²	62	31.2 Å²	31.2	40%	0.403	19%	0.187	S	C	.	.	H	α-helix	trans	-66.8	-29.1	179.7	26.6	-35.7	0	0	0	113.5	D419 E420 G427	D419-P423 VanDerWaalsContact O-CD 3.25Å; D419-P423 WeakPolarHBondContact O-CD 3.46Å; E420-P423 WeakPolarHBondContact O-CD 3.26Å; E420-P423 WeakPolarHBondContact O-CG 3.29Å; P423-G427 PolarHBondContact O-N 3.22Å
424	L	96.9	Very high	95.4	Very high	83 Å²	83	31.3 Å²	31.3	44%	0.435	19%	0.187	S	C	.	.	H	α-helix	trans	-72.2	-41.3	176.4	-59.8	176.1	0	0	0	111.4	Q393 L396 C421 I422 G427 A428	Q393-L424 HydrophobicContact CG-CD1 3.79Å; L396-L424 HydrophobicContact CD1-CB 3.95Å; C421-L424 WeakPolarHBondContact O-CB 3.36Å; C421-L424 PolarHBondContact O-N 3.05Å; I422-L424 VanDerWaalsContact C-N 3.31Å; I422-L424 PolarHBondContact O-N 3.47Å; L424-G427 PolarHBondContact O-N 2.95Å; L424-A428 VanDerWaalsContact O-CB 3.28Å; L424-A428 WeakPolarHBondContact O-CB 3.46Å; L424-A428 PolarHBondContact O-N 3.36Å
425	I	96.5	Very high	95.4	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-63.2	-45.5	175.6	-64.3	165.1	0	0	0	110.2	E392 M411 P417 C421 I422 A428 I430 I433 I458	E392-I425 HydrophobicContact CB-CD1 4.34Å; E392-I425 HydrophobicContact CG-CD1 4.3Å; M411-I425 HydrophobicContact CE-CG1 4.25Å; M411-I425 HydrophobicContact SD-CD1 3.79Å; M411-I425 HydrophobicContact SD-CG1 3.81Å; M411-I425 HydrophobicContact SD-CG2 4.42Å; P417-I425 HydrophobicContact CB-CD1 3.8Å; P417-I425 HydrophobicContact CG-CD1 4.33Å; C421-I425 HydrophobicContact CB-CD1 4.24Å; C421-I425 VanDerWaalsContact O-CG1 3.28Å; C421-I425 WeakPolarHBondContact O-CG1 3.43Å; C421-I425 PolarHBondContact O-N 3.32Å; I422-I425 PolarHBondContact O-N 2.9Å; I425-A428 PolarHBondContact O-N 2.97Å; I425-I430 HydrophobicContact CB-CD1 4.48Å; I425-I430 HydrophobicContact CG2-CB 3.77Å; I425-I430 HydrophobicContact CG2-CD1 3.89Å; I425-I430 HydrophobicContact CG2-CG1 4.42Å; I425-I430 HydrophobicContact CG2-CG2 3.87Å; I425-I430 PolarHBondContact O-N 2.92Å; I425-I433 HydrophobicContact CG2-CD1 4.02Å; I425-I433 HydrophobicContact CG2-CG1 4.25Å; I425-I458 HydrophobicContact CG2-CD1 4.11Å
426	R	94	Very high	95.3	Very high	114 Å²	114	29.2 Å²	29.2	43%	0.43	18%	0.177	S	C	.	.	H	α-helix	trans	-61.6	-50	173.7	-173.3	-168.6	-89.9	126.2	-14.4	111.7	I422 A428 G429 D457 I458	I422-R426 PolarHBondContact O-N 3.19Å; R426-A428 PolarHBondContact O-N 2.95Å; R426-G429 PolarHBondContact O-N 3.13Å; R426-D457 IonicContact CZ-OD2 3.94Å; R426-D457 IonicContact NE-OD2 2.68Å; R426-D457 PolarHBondContact NE-OD2 3.34Å; R426-D457 IonicContact NH2-OD2 2.94Å; R426-D457 PolarHBondContact NH2-OD2 3.46Å; R426-I458 HydrophobicContact CB-CD1 3.99Å; R426-I458 HydrophobicContact CG-CD1 4.49Å
427	G	93.3	Very high	95	Very high	71 Å²	71	30.3 Å²	30.3	73%	0.732	18%	0.183	S	C	*	.	H	α-helix	trans	-63.7	-23.7	-179.1	0	0	0	0	0	114.1	P423 L424 G429	P423-G427 PolarHBondContact O-N 3.22Å; L424-G427 PolarHBondContact O-N 2.95Å; G427-G429 VanDerWaalsContact C-N 3.34Å
428	A	94.9	Very high	94.6	Very high	29 Å²	29	31.6 Å²	31.6	24%	0.24	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84	0.9	174.4	0	0	0	0	0	114.6	L396 V403 L424 I425 R426 I430	L396-A428 HydrophobicContact CD1-CB 4.32Å; L396-A428 HydrophobicContact CD2-CB 3.32Å; L396-A428 HydrophobicContact CG-CB 4.45Å; V403-A428 VanDerWaalsContact CB-O 3.24Å; V403-A428 WeakPolarHBondContact CB-O 3.13Å; V403-A428 WeakPolarHBondContact CG1-O 3.43Å; V403-A428 WeakPolarHBondContact CG2-O 3.11Å; L424-A428 VanDerWaalsContact O-CB 3.28Å; L424-A428 WeakPolarHBondContact O-CB 3.46Å; L424-A428 PolarHBondContact O-N 3.36Å; I425-A428 PolarHBondContact O-N 2.97Å; R426-A428 PolarHBondContact O-N 2.95Å; A428-I430 VanDerWaalsContact C-N 3.34Å; A428-I430 HydrophobicContact CB-CD1 4.41Å; A428-I430 PolarHBondContact O-N 3.18Å
429	G	94.2	Very high	94.3	Very high	35 Å²	35	32.1 Å²	32.1	36%	0.361	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.4	20.4	179.2	0	0	0	0	0	114.9	R426 G427 T431	R426-G429 PolarHBondContact O-N 3.13Å; G427-G429 VanDerWaalsContact C-N 3.34Å; G429-T431 PolarHBondContact O-N 2.94Å
430	I	95.6	Very high	94	Very high	4 Å²	4	35.3 Å²	35.3	2%	0.021	20%	0.203	C	C	.	.			trans	-72.7	124.7	173.3	-65.8	164.3	0	0	0	108.6	I336 L396 T409 M411 I425 A428 H432 I458	I336-I430 HydrophobicContact CD1-CD1 4.28Å; L396-I430 HydrophobicContact CD2-CD1 3.75Å; T409-I430 HydrophobicContact CG2-CG1 3.94Å; M411-I430 HydrophobicContact CB-CD1 4.2Å; M411-I430 HydrophobicContact CB-CG2 3.88Å; M411-I430 HydrophobicContact CE-CD1 3.68Å; M411-I430 HydrophobicContact SD-CD1 4.2Å; I425-I430 HydrophobicContact CB-CD1 4.48Å; I425-I430 HydrophobicContact CG2-CB 3.77Å; I425-I430 HydrophobicContact CG2-CD1 3.89Å; I425-I430 HydrophobicContact CG2-CG1 4.42Å; I425-I430 HydrophobicContact CG2-CG2 3.87Å; I425-I430 PolarHBondContact O-N 2.92Å; A428-I430 VanDerWaalsContact C-N 3.34Å; A428-I430 HydrophobicContact CB-CD1 4.41Å; A428-I430 PolarHBondContact O-N 3.18Å; I430-H432 WeakPolarHBondContact CG2-O 3.47Å; I430-I458 WeakPolarHBondContact O-CD1 3.29Å
431	T	93.6	Very high	93.7	Very high	52 Å²	52	32.6 Å²	32.6	32%	0.319	19%	0.192	S	C	.	.			trans	-101.6	-15.3	-172.7	48.4	0	0	0	0	113.7	T409 G429 R459	T409-T431 PolarHBondContact O-N 3.13Å; T409-T431 PolarHBondContact O-OG1 3.26Å; G429-T431 PolarHBondContact O-N 2.94Å; T431-R459 PolarHBondContact O-N 2.9Å
432	H	95.2	Very high	93.4	Very high	7 Å²	7	37 Å²	37	3%	0.032	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	137.3	-177.8	-57.2	74.7	0	0	0	111.1	L408 T409 M410 M411 I430 Y434 R459 F461	L408-H432 VanDerWaalsContact CD1-CE1 3.47Å; L408-H432 WeakPolarHBondContact CD1-CE1 3.28Å; L408-H432 VanDerWaalsContact CG-CE1 3.47Å; L408-H432 WeakPolarHBondContact CG-CE1 3.46Å; T409-H432 PolarHBondContact O-N 3.24Å; M410-H432 WeakPolarHBondContact CA-O 3.46Å; M410-H432 HydrophobicContact CB-CB 4.42Å; M410-H432 HydrophobicContact CG-CB 3.8Å; M411-H432 PolarHBondContact N-O 3.48Å; I430-H432 WeakPolarHBondContact CG2-O 3.47Å; H432-Y434 HydrophobicContact CB-CE2 4.43Å; H432-R459 CarbonylContact C-O 3.57Å; H432-R459 VanDerWaalsContact CA-O 3.3Å; H432-R459 WeakPolarHBondContact CA-O 2.99Å; H432-R459 WeakPolarHBondContact NE2-CD 3.17Å; H432-R459 PolarHBondContact NE2-NH1 3.36Å; H432-R459 VanDerWaalsContact NE2-NH1 3.1Å; H432-F461 HydrophobicContact CB-CE2 4.14Å; H432-F461 AromaticContact CD2-CE2 3.62Å
433	I	96.8	Very high	93.1	Very high	1 Å²	1	42 Å²	42	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	132.8	174.8	-63.6	164.5	0	0	0	109.3	M411 L413 I425 T435 F452 L455 I458 R459 F461	M411-I433 CarbonylContact O-C 3.51Å; M411-I433 WeakPolarHBondContact O-CA 3.36Å; L413-I433 HydrophobicContact CD1-CG2 4.23Å; I425-I433 HydrophobicContact CG2-CD1 4.02Å; I425-I433 HydrophobicContact CG2-CG1 4.25Å; I433-T435 HydrophobicContact CG2-CG2 4.02Å; I433-F452 HydrophobicContact CD1-CE2 4.31Å; I433-F452 HydrophobicContact CG2-CE2 4.25Å; I433-L455 HydrophobicContact CD1-CD2 3.91Å; I433-I458 HydrophobicContact CD1-CG2 3.78Å; I433-I458 HydrophobicContact CG1-CG2 3.76Å; I433-R459 PolarHBondContact N-O 3.11Å; I433-F461 PolarHBondContact O-N 2.95Å
434	Y	97.4	Very high	92.6	Very high	3 Å²	3	43.7 Å²	43.7	1%	0.012	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	119.8	172.7	-73.4	-100	0	0	0	109.2	F291 V306 A311 I315 M410 M411 F412 L413 H432 F461	F291-Y434 HydrophobicContact CB-CD1 3.63Å; F291-Y434 HydrophobicContact CB-CE1 3.94Å; F291-Y434 HydrophobicContact CD1-CD1 4.16Å; F291-Y434 AromaticContact CG-CD1 3.87Å; F291-Y434 HydrophobicContact CG-CD1 3.87Å; V306-Y434 HydrophobicContact CG2-CE1 4.09Å; V306-Y434 HydrophobicContact CG2-CE2 4.06Å; V306-Y434 WeakPolarHBondContact CG2-OH 3.34Å; V306-Y434 PolarHBondContact N-OH 3.16Å; V306-Y434 VanDerWaalsContact N-OH 3.14Å; A311-Y434 HydrophobicContact CB-CD1 3.81Å; A311-Y434 HydrophobicContact CB-CE1 3.76Å; I315-Y434 WeakPolarHBondContact CD1-O 3.36Å; M410-Y434 HydrophobicContact CB-CD2 4.43Å; M410-Y434 HydrophobicContact CB-CE2 4.33Å; M410-Y434 HydrophobicContact CG-CE2 4.06Å; M410-Y434 HydrophobicContact SD-CE2 4.49Å; M411-Y434 PolarHBondContact O-N 3.16Å; F412-Y434 WeakPolarHBondContact CA-O 3.19Å; F412-Y434 HydrophobicContact CD1-CD1 4.23Å; F412-Y434 AromaticContact CD1-CD2 3.76Å; F412-Y434 HydrophobicContact CD1-CD2 3.76Å; F412-Y434 AromaticContact CD1-CG 3.54Å; F412-Y434 HydrophobicContact CD1-CG 3.54Å; F412-Y434 AromaticContact CE1-CD1 3.9Å; F412-Y434 HydrophobicContact CE1-CD1 3.9Å; F412-Y434 AromaticContact CE1-CD2 3.32Å; F412-Y434 HydrophobicContact CE1-CD2 3.32Å; F412-Y434 HydrophobicContact CE1-CE1 4.3Å; F412-Y434 AromaticContact CE1-CE2 3.76Å; F412-Y434 HydrophobicContact CE1-CE2 3.76Å; F412-Y434 AromaticContact CE1-CG 3.41Å; F412-Y434 HydrophobicContact CE1-CG 3.41Å; F412-Y434 VanDerWaalsContact CE1-CG 3.41Å; F412-Y434 AromaticContact CZ-CD2 3.8Å; F412-Y434 HydrophobicContact CZ-CD2 3.8Å; F412-Y434 AromaticContact CZ-CE2 3.97Å; F412-Y434 HydrophobicContact CZ-CE2 3.97Å; F412-Y434 HydrophobicContact CZ-CG 4.34Å; L413-Y434 PolarHBondContact N-O 3.17Å; H432-Y434 HydrophobicContact CB-CE2 4.43Å; Y434-F461 WeakPolarHBondContact CA-O 3.34Å; Y434-F461 HydrophobicContact CD1-CB 3.61Å; Y434-F461 AromaticContact CD1-CD2 4Å; Y434-F461 HydrophobicContact CD1-CD2 4Å; Y434-F461 HydrophobicContact CD1-CG 4Å; Y434-F461 AromaticContact CD2-CD2 3.84Å; Y434-F461 HydrophobicContact CD2-CD2 3.84Å; Y434-F461 HydrophobicContact CD2-CE2 4.45Å; Y434-F461 HydrophobicContact CE1-CB 3.73Å; Y434-F461 HydrophobicContact CE1-CD1 4.25Å; Y434-F461 AromaticContact CE1-CD2 3.55Å; Y434-F461 HydrophobicContact CE1-CD2 3.55Å; Y434-F461 HydrophobicContact CE1-CE2 4.1Å; Y434-F461 AromaticContact CE1-CG 3.61Å; Y434-F461 HydrophobicContact CE1-CG 3.61Å; Y434-F461 AromaticContact CE2-CD2 3.39Å; Y434-F461 HydrophobicContact CE2-CD2 3.39Å; Y434-F461 AromaticContact CE2-CE2 3.6Å; Y434-F461 HydrophobicContact CE2-CE2 3.6Å; Y434-F461 HydrophobicContact CE2-CG 4.3Å; Y434-F461 HydrophobicContact CG-CB 4.08Å; Y434-F461 HydrophobicContact CG-CD2 4.12Å; Y434-F461 HydrophobicContact CG-CG 4.48Å; Y434-F461 AromaticContact CZ-CD2 3.22Å; Y434-F461 AromaticContact CZ-CE2 3.37Å; Y434-F461 AromaticContact CZ-CG 3.78Å; Y434-F461 WeakPolarHBondContact OH-CE2 3.4Å
435	T	96.7	Very high	91.8	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160	174.9	-174.9	-173.1	0	0	0	0	113	K415 C416 I433 F452 F461 V462 W463	K415-T435 PolarHBondContact O-OG1 2.87Å; C416-T435 PolarHBondContact N-OG1 2.72Å; I433-T435 HydrophobicContact CG2-CG2 4.02Å; T435-F452 HydrophobicContact CG2-CE1 4.21Å; T435-F452 HydrophobicContact CG2-CE2 4.25Å; T435-F452 HydrophobicContact CG2-CZ 3.58Å; T435-F461 PolarHBondContact N-O 2.64Å; T435-F461 VanDerWaalsContact N-O 3.11Å; T435-V462 WeakPolarHBondContact O-CA 3.48Å; T435-W463 PolarHBondContact O-N 2.99Å
436	S	92.8	Very high	91	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.254	C	S	.	.			trans	-86.7	148	156.4	179.1	0	0	0	0	110.9	C416 Q438	C416-S436 PolarHBondContact N-O 2.93Å; S436-Q438 WeakPolarHBondContact OG-CG 3.43Å; S436-Q438 PolarHBondContact OG-N 3.22Å
437	D	87.4	Confident	90.6	Very high	26 Å²	26	39.7 Å²	39.7	14%	0.139	24%	0.24	C	C	.	.			trans	-89.4	2.4	175.1	63.4	-19.2	0	0	0	113.6	R208 D439 R440 V462	R208-D437 IonicContact CZ-OD2 2.83Å; R208-D437 IonicContact NH1-OD1 3.82Å; R208-D437 PolarHBondContact NH1-OD1 3.1Å; R208-D437 IonicContact NH1-OD2 2.66Å; R208-D437 PolarHBondContact NH1-OD2 3.05Å; D437-D439 PolarHBondContact O-N 3.48Å; D437-R440 HydrophobicContact CB-CB 4.29Å; D437-R440 WeakPolarHBondContact O-CB 3.42Å; D437-R440 PolarHBondContact O-N 3.05Å; D437-V462 HydrophobicContact CB-CG1 3.64Å; D437-V462 HydrophobicContact CB-CG2 4.41Å; D437-V462 VanDerWaalsContact CG-CG1 3.48Å
438	Q	88.4	Confident	90.6	Very high	27 Å²	27	37.9 Å²	37.9	13%	0.126	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-27.3	-173.6	-87.8	-69.9	-3.4	0	0	116	D204 E211 S436 K442	D204-Q438 HydrophobicContact CB-CB 3.83Å; D204-Q438 HydrophobicContact CB-CG 3.81Å; D204-Q438 WeakPolarHBondContact O-CG 3.49Å; E211-Q438 VanDerWaalsContact CD-NE2 3.26Å; E211-Q438 PolarHBondContact OE1-NE2 2.95Å; E211-Q438 VanDerWaalsContact OE1-NE2 3.16Å; E211-Q438 PolarHBondContact OE2-NE2 3.14Å; S436-Q438 WeakPolarHBondContact OG-CG 3.43Å; S436-Q438 PolarHBondContact OG-N 3.22Å; Q438-K442 WeakPolarHBondContact O-CE 3.18Å; Q438-K442 PolarHBondContact O-NZ 2.73Å
439	D	87.7	Confident	90.5	Very high	14 Å²	14	37.4 Å²	37.4	8%	0.075	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	1.9	177.8	-82.4	-35.5	0	0	0	114.5	K415 C416 D437 K444 Y449	K415-D439 IonicContact NZ-OD2 2.68Å; K415-D439 PolarHBondContact NZ-OD2 2.93Å; C416-D439 HydrophobicContact CB-CB 4.03Å; D437-D439 PolarHBondContact O-N 3.48Å; D439-K444 WeakPolarHBondContact OD1-CE 3.39Å; D439-K444 IonicContact OD1-NZ 3.5Å; D439-K444 PolarHBondContact OD1-NZ 3.27Å; D439-K444 IonicContact OD2-NZ 2.71Å; D439-K444 PolarHBondContact OD2-NZ 3.06Å; D439-Y449 HydrophobicContact CB-CD1 4.3Å; D439-Y449 HydrophobicContact CB-CD2 4.26Å; D439-Y449 HydrophobicContact CB-CE1 4.25Å; D439-Y449 HydrophobicContact CB-CE2 4.23Å; D439-Y449 HydrophobicContact CB-CG 4.3Å; D439-Y449 WeakPolarHBondContact O-CB 3.45Å; D439-Y449 WeakPolarHBondContact O-CD2 3Å; D439-Y449 VanDerWaalsContact O-CG 3.28Å
440	R	87.7	Confident	90.5	Very high	77 Å²	77	39.9 Å²	39.9	29%	0.291	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	141.6	177.2	175.8	-165.6	172.9	141.7	12.4	112.7	E294 D437 K442	E294-R440 IonicContact OE1-CZ 2.65Å; E294-R440 IonicContact OE1-NH1 2.71Å; E294-R440 PolarHBondContact OE1-NH1 3.13Å; E294-R440 IonicContact OE1-NH2 2.81Å; D437-R440 HydrophobicContact CB-CB 4.29Å; D437-R440 WeakPolarHBondContact O-CB 3.42Å; D437-R440 PolarHBondContact O-N 3.05Å; R440-K442 PolarHBondContact O-N 3.37Å
441	D	89.7	Confident	90.3	Very high	75 Å²	75	46.1 Å²	46.1	40%	0.401	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.3	16.8	172.4	-60.7	-37.9	0	0	0	114.1	Y449 S453	D441-Y449 PolarHBondContact N-O 2.78Å; D441-S453 WeakPolarHBondContact OD1-CB 3.25Å; D441-S453 PolarHBondContact OD1-OG 2.76Å; D441-S453 WeakPolarHBondContact OD2-CB 3.42Å
442	K	90.3	Very high	90.2	Very high	94 Å²	94	43.6 Å²	43.6	41%	0.409	22%	0.221	S	C	.	.			trans	-98.5	144.1	174.3	-63.8	175.6	-171.1	172.5	0	111	Q438 R440 Y449	Q438-K442 WeakPolarHBondContact O-CE 3.18Å; Q438-K442 PolarHBondContact O-NZ 2.73Å; R440-K442 PolarHBondContact O-N 3.37Å; K442-Y449 PolarHBondContact O-N 2.97Å
443	D	89.8	Confident	89.9	Confident	108 Å²	108	44.8 Å²	44.8	58%	0.578	23%	0.229	S	C	*	.	B	Isolated β-bridge	trans	-109.5	134.2	163.2	-175.4	4.5	0	0	0	109	G445	D443-G445 PolarHBondContact OD1-N 3.38Å
444	K	85.3	Confident	89.5	Confident	97 Å²	97	49.6 Å²	49.6	42%	0.422	26%	0.259	S	S	.	.			trans	-120.7	16.5	178.1	-52.5	-178.6	-175.3	174.2	0	112	D439 D446 I447 Y449	D439-K444 WeakPolarHBondContact OD1-CE 3.39Å; D439-K444 IonicContact OD1-NZ 3.5Å; D439-K444 PolarHBondContact OD1-NZ 3.27Å; D439-K444 IonicContact OD2-NZ 2.71Å; D439-K444 PolarHBondContact OD2-NZ 3.06Å; K444-D446 PolarHBondContact O-N 2.87Å; K444-I447 WeakPolarHBondContact CA-O 3.36Å; K444-I447 HydrophobicContact CB-CG2 3.96Å; K444-I447 WeakPolarHBondContact CB-O 3.38Å; K444-I447 HydrophobicContact CD-CG2 4.35Å; K444-I447 PolarHBondContact N-O 3.03Å; K444-Y449 HydrophobicContact CD-CE2 4.02Å; K444-Y449 HydrophobicContact CG-CE2 4.46Å
445	G	81.4	Confident	89	Confident	55 Å²	55	49.7 Å²	49.7	57%	0.567	26%	0.26	S	S	*	.	S	Bend	trans	78.8	-40.1	167.9	0	0	0	0	0	116.3	R380 D443	R380-G445 PolarHBondContact NH2-O 2.96Å; D443-G445 PolarHBondContact OD1-N 3.38Å
446	D	79.3	Confident	88.5	Confident	31 Å²	31	58.2 Å²	58.2	17%	0.166	30%	0.3	C	S	.	.	S	Bend	trans	-103.8	-5.2	166	-72.4	-47.4	0	0	0	112.4	R380 R383 Y385 K444	R380-D446 IonicContact CZ-OD1 2.9Å; R380-D446 IonicContact NE-OD1 2.64Å; R380-D446 PolarHBondContact NE-OD1 2.68Å; R380-D446 IonicContact NH2-OD1 3.84Å; R380-D446 PolarHBondContact NH2-OD1 2.96Å; R383-D446 WeakPolarHBondContact CD-OD2 3.42Å; R383-D446 IonicContact CZ-OD2 3.73Å; R383-D446 IonicContact NE-OD2 2.68Å; R383-D446 IonicContact NH1-OD1 2.94Å; R383-D446 IonicContact NH1-OD2 3.2Å; R383-D446 PolarHBondContact NH1-OD2 2.93Å; Y385-D446 HydrophobicContact CD1-CB 4.36Å; Y385-D446 HydrophobicContact CD2-CB 3.51Å; Y385-D446 HydrophobicContact CE2-CB 3.99Å; Y385-D446 HydrophobicContact CG-CB 3.73Å; K444-D446 PolarHBondContact O-N 2.87Å
447	I	85.4	Confident	88.2	Confident	27 Å²	27	63.7 Å²	63.7	14%	0.138	33%	0.329	C	S	.	.			trans	-157.1	138.2	177.4	-171.3	168.2	0	0	0	110.7	Y385 C418 K444 Y449	Y385-I447 HydrophobicContact CE1-CG2 4.42Å; C418-I447 HydrophobicContact CB-CD1 3.78Å; C418-I447 HydrophobicContact CB-CG1 3.67Å; K444-I447 WeakPolarHBondContact CA-O 3.36Å; K444-I447 HydrophobicContact CB-CG2 3.96Å; K444-I447 WeakPolarHBondContact CB-O 3.38Å; K444-I447 HydrophobicContact CD-CG2 4.35Å; K444-I447 PolarHBondContact N-O 3.03Å; I447-Y449 HydrophobicContact CG1-CE2 4.28Å; I447-Y449 HydrophobicContact CG2-CE2 4.34Å
448	S	92.4	Very high	88.4	Confident	34 Å²	34	62.7 Å²	62.7	24%	0.238	32%	0.324	C	S	.	.	B	Isolated β-bridge	trans	-134.3	159	-176.3	64.5	0	0	0	0	112.8	C418 D419	C418-S448 WeakPolarHBondContact CA-O 3.49Å; C418-S448 WeakPolarHBondContact CB-O 3.38Å; D419-S448 VanDerWaalsContact CG-C 3.5Å; D419-S448 VanDerWaalsContact CG-O 3.25Å; D419-S448 PolarHBondContact N-O 2.68Å; D419-S448 VanDerWaalsContact OD2-C 3.26Å; D419-S448 VanDerWaalsContact OD2-CB 3.27Å; D419-S448 WeakPolarHBondContact OD2-CB 3.23Å; D419-S448 PolarHBondContact OD2-OG 3.03Å
449	Y	93.5	Very high	88.6	Confident	19 Å²	19	66.8 Å²	66.8	8%	0.075	34%	0.338	C	S	.	.			trans	-135.1	29.6	-172.4	-54.9	-91.5	0	0	0	112.6	C416 C418 D419 D439 D441 K442 K444 I447	C416-Y449 HydrophobicContact CB-CD1 4.26Å; C416-Y449 VanDerWaalsContact O-CE1 3.23Å; C416-Y449 WeakPolarHBondContact O-CE1 3.34Å; C418-Y449 HydrophobicContact CB-CD1 4.1Å; C418-Y449 HydrophobicContact CB-CE1 3.85Å; D419-Y449 VanDerWaalsContact OD1-C 3.23Å; D419-Y449 WeakPolarHBondContact OD1-CA 3.44Å; D419-Y449 PolarHBondContact OD2-N 2.92Å; D439-Y449 HydrophobicContact CB-CD1 4.3Å; D439-Y449 HydrophobicContact CB-CD2 4.26Å; D439-Y449 HydrophobicContact CB-CE1 4.25Å; D439-Y449 HydrophobicContact CB-CE2 4.23Å; D439-Y449 HydrophobicContact CB-CG 4.3Å; D439-Y449 WeakPolarHBondContact O-CB 3.45Å; D439-Y449 WeakPolarHBondContact O-CD2 3Å; D439-Y449 VanDerWaalsContact O-CG 3.28Å; D441-Y449 PolarHBondContact N-O 2.78Å; K442-Y449 PolarHBondContact O-N 2.97Å; K444-Y449 HydrophobicContact CD-CE2 4.02Å; K444-Y449 HydrophobicContact CG-CE2 4.46Å; I447-Y449 HydrophobicContact CG1-CE2 4.28Å; I447-Y449 HydrophobicContact CG2-CE2 4.34Å
450	L	93.1	Very high	88.9	Confident	86 Å²	86	66.9 Å²	66.9	45%	0.45	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-15	-173.3	-54.3	177	0	0	0	113.5	D419 S453	D419-L450 VanDerWaalsContact CG-N 3.33Å; D419-L450 PolarHBondContact OD1-N 3.36Å; D419-L450 PolarHBondContact OD2-N 3.49Å; L450-S453 PolarHBondContact O-OG 3.38Å
451	R	92.9	Very high	89.2	Confident	135 Å²	135	63.5 Å²	63.5	51%	0.509	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-10.2	-178.2	-62.5	179	177	164.2	-5	113.9	D419 I422 T454 L455	D419-R451 HydrophobicContact CB-CB 4.48Å; D419-R451 HydrophobicContact CB-CG 4.08Å; D419-R451 PolarHBondContact O-NH1 3.33Å; D419-R451 VanDerWaalsContact OD1-CB 3.23Å; D419-R451 WeakPolarHBondContact OD1-CB 3.42Å; D419-R451 WeakPolarHBondContact OD1-CG 3.26Å; D419-R451 PolarHBondContact OD1-N 2.62Å; I422-R451 HydrophobicContact CG1-CB 4.09Å; R451-T454 PolarHBondContact O-OG1 2.89Å; R451-L455 PolarHBondContact O-N 3.45Å
452	F	91.8	Very high	89.4	Confident	0 Å²	0	60 Å²	60	0%	0	31%	0.306	C	S	.	.	S	Bend	trans	-74.4	-35.6	-178.1	-175.8	-107.8	0	0	0	112.3	C416 P417 I422 I433 T435 K460	C416-F452 VanDerWaalsContact SG-CD1 3.52Å; P417-F452 HydrophobicContact CG-CD2 3.72Å; P417-F452 HydrophobicContact CG-CE2 3.89Å; I422-F452 HydrophobicContact CD1-CB 4.43Å; I422-F452 HydrophobicContact CD1-CD2 4.06Å; I433-F452 HydrophobicContact CD1-CE2 4.31Å; I433-F452 HydrophobicContact CG2-CE2 4.25Å; T435-F452 HydrophobicContact CG2-CE1 4.21Å; T435-F452 HydrophobicContact CG2-CE2 4.25Å; T435-F452 HydrophobicContact CG2-CZ 3.58Å; F452-K460 HydrophobicContact CD1-CD 4.33Å; F452-K460 HydrophobicContact CD2-CD 4.11Å; F452-K460 HydrophobicContact CE1-CD 3.91Å; F452-K460 HydrophobicContact CE2-CD 3.67Å; F452-K460 HydrophobicContact CE2-CG 3.8Å; F452-K460 HydrophobicContact CG-CD 4.43Å; F452-K460 HydrophobicContact CZ-CB 4.27Å; F452-K460 HydrophobicContact CZ-CD 3.55Å; F452-K460 HydrophobicContact CZ-CG 3.72Å; F452-K460 VanDerWaalsContact O-CD 3.3Å; F452-K460 WeakPolarHBondContact O-CD 3.48Å; F452-K460 WeakPolarHBondContact O-CE 3.38Å; F452-K460 PolarHBondContact O-NZ 2.78Å
453	S	87.8	Confident	89.6	Confident	31 Å²	31	55.6 Å²	55.6	22%	0.217	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-46.4	173.2	49.6	0	0	0	0	112	D441 L450 L455 K460	D441-S453 WeakPolarHBondContact OD1-CB 3.25Å; D441-S453 PolarHBondContact OD1-OG 2.76Å; D441-S453 WeakPolarHBondContact OD2-CB 3.42Å; L450-S453 PolarHBondContact O-OG 3.38Å; S453-L455 VanDerWaalsContact C-N 3.29Å; S453-L455 PolarHBondContact O-N 3.01Å; S453-K460 PolarHBondContact O-NZ 2.8Å
454	T	88	Confident	89.8	Confident	102 Å²	102	52.6 Å²	52.6	63%	0.626	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	11.6	-176.5	47.9	0	0	0	0	115.1	R451 E456	R451-T454 PolarHBondContact O-OG1 2.89Å; T454-E456 PolarHBondContact O-N 3.25Å
455	L	87.6	Confident	90	Very high	5 Å²	5	50.3 Å²	50.3	3%	0.026	26%	0.258	C	S	.	.			trans	-84.5	109.6	177.6	179.2	60.6	0	0	0	111.5	I422 I433 R451 S453 I458 K460	I422-L455 HydrophobicContact CD1-CD2 4.38Å; I422-L455 HydrophobicContact CG2-CD1 3.98Å; I422-L455 HydrophobicContact CG2-CD2 4.22Å; I433-L455 HydrophobicContact CD1-CD2 3.91Å; R451-L455 PolarHBondContact O-N 3.45Å; S453-L455 VanDerWaalsContact C-N 3.29Å; S453-L455 PolarHBondContact O-N 3.01Å; L455-I458 HydrophobicContact CD1-CB 4.29Å; L455-I458 HydrophobicContact CD1-CD1 4.11Å; L455-I458 HydrophobicContact CD1-CG1 4.09Å; L455-I458 HydrophobicContact CD2-CB 4.01Å; L455-I458 HydrophobicContact CD2-CD1 4.24Å; L455-I458 HydrophobicContact CD2-CG1 4.46Å; L455-I458 HydrophobicContact CG-CB 4.09Å; L455-I458 HydrophobicContact CG-CG1 4.44Å; L455-K460 WeakPolarHBondContact O-CE 3.41Å
456	E	85.9	Confident	90.3	Very high	180 Å²	180	49.5 Å²	49.5	84%	0.841	24%	0.241	S	C	*	.			trans	-100	-38.8	-177.1	-63.5	-175.9	172.3	0	0	114.3	T454 I458	T454-E456 PolarHBondContact O-N 3.25Å; E456-I458 PolarHBondContact O-N 2.71Å; E456-I458 VanDerWaalsContact O-N 3.13Å
457	D	86.8	Confident	90.3	Very high	114 Å²	114	51 Å²	51	61%	0.61	25%	0.252	S	S	*	.	S	Bend	trans	-68.1	-15.6	-172.7	-42.1	-77.5	0	0	0	114.5	R426	R426-D457 IonicContact CZ-OD2 3.94Å; R426-D457 IonicContact NE-OD2 2.68Å; R426-D457 PolarHBondContact NE-OD2 3.34Å; R426-D457 IonicContact NH2-OD2 2.94Å; R426-D457 PolarHBondContact NH2-OD2 3.46Å
458	I	91.5	Very high	89.9	Confident	6 Å²	6	54 Å²	54	3%	0.031	28%	0.276	C	S	.	.	S	Bend	trans	-121.1	123.2	-171.5	-54.7	-176.2	0	0	0	108.3	I425 R426 I430 I433 L455 E456 K460	I425-I458 HydrophobicContact CG2-CD1 4.11Å; R426-I458 HydrophobicContact CB-CD1 3.99Å; R426-I458 HydrophobicContact CG-CD1 4.49Å; I430-I458 WeakPolarHBondContact O-CD1 3.29Å; I433-I458 HydrophobicContact CD1-CG2 3.78Å; I433-I458 HydrophobicContact CG1-CG2 3.76Å; L455-I458 HydrophobicContact CD1-CB 4.29Å; L455-I458 HydrophobicContact CD1-CD1 4.11Å; L455-I458 HydrophobicContact CD1-CG1 4.09Å; L455-I458 HydrophobicContact CD2-CB 4.01Å; L455-I458 HydrophobicContact CD2-CD1 4.24Å; L455-I458 HydrophobicContact CD2-CG1 4.46Å; L455-I458 HydrophobicContact CG-CB 4.09Å; L455-I458 HydrophobicContact CG-CG1 4.44Å; E456-I458 PolarHBondContact O-N 2.71Å; E456-I458 VanDerWaalsContact O-N 3.13Å; I458-K460 PolarHBondContact O-N 2.68Å
459	R	93.1	Very high	88.9	Confident	112 Å²	112	55.2 Å²	55.2	42%	0.423	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	116.2	-178.6	-61	-165.8	-169.9	148.9	-13.5	110.4	P303 T431 H432 I433	P303-R459 PolarHBondContact O-NH1 3.49Å; T431-R459 PolarHBondContact O-N 2.9Å; H432-R459 CarbonylContact C-O 3.57Å; H432-R459 VanDerWaalsContact CA-O 3.3Å; H432-R459 WeakPolarHBondContact CA-O 2.99Å; H432-R459 WeakPolarHBondContact NE2-CD 3.17Å; H432-R459 PolarHBondContact NE2-NH1 3.36Å; H432-R459 VanDerWaalsContact NE2-NH1 3.1Å; I433-R459 PolarHBondContact N-O 3.11Å
460	K	93.3	Very high	87.3	Confident	16 Å²	16	59.2 Å²	59.2	7%	0.07	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	131.1	175.1	-68.3	171.9	-79	164.8	0	110.5	S293 E294 F452 S453 L455 I458	S293-K460 WeakPolarHBondContact CA-O 3.41Å; S293-K460 PolarHBondContact OG-O 3.01Å; E294-K460 WeakPolarHBondContact OE2-CD 3.36Å; E294-K460 WeakPolarHBondContact OE2-CE 3.34Å; E294-K460 IonicContact OE2-NZ 3.14Å; E294-K460 PolarHBondContact OE2-NZ 2.83Å; F452-K460 HydrophobicContact CD1-CD 4.33Å; F452-K460 HydrophobicContact CD2-CD 4.11Å; F452-K460 HydrophobicContact CE1-CD 3.91Å; F452-K460 HydrophobicContact CE2-CD 3.67Å; F452-K460 HydrophobicContact CE2-CG 3.8Å; F452-K460 HydrophobicContact CG-CD 4.43Å; F452-K460 HydrophobicContact CZ-CB 4.27Å; F452-K460 HydrophobicContact CZ-CD 3.55Å; F452-K460 HydrophobicContact CZ-CG 3.72Å; F452-K460 VanDerWaalsContact O-CD 3.3Å; F452-K460 WeakPolarHBondContact O-CD 3.48Å; F452-K460 WeakPolarHBondContact O-CE 3.38Å; F452-K460 PolarHBondContact O-NZ 2.78Å; S453-K460 PolarHBondContact O-NZ 2.8Å; L455-K460 WeakPolarHBondContact O-CE 3.41Å; I458-K460 PolarHBondContact O-N 2.68Å
461	F	94.5	Very high	85.7	Confident	7 Å²	7	59.7 Å²	59.7	3%	0.031	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	114.9	165.2	-60.4	-84	0	0	0	109.2	F291 Y292 A305 H432 I433 Y434 T435	F291-F461 HydrophobicContact CB-CB 4.12Å; Y292-F461 CarbonylContact O-C 3.59Å; Y292-F461 VanDerWaalsContact O-CA 3.29Å; Y292-F461 WeakPolarHBondContact O-CA 3.28Å; A305-F461 HydrophobicContact CB-CE1 4.23Å; A305-F461 HydrophobicContact CB-CZ 3.82Å; H432-F461 HydrophobicContact CB-CE2 4.14Å; H432-F461 AromaticContact CD2-CE2 3.62Å; I433-F461 PolarHBondContact O-N 2.95Å; Y434-F461 WeakPolarHBondContact CA-O 3.34Å; Y434-F461 HydrophobicContact CD1-CB 3.61Å; Y434-F461 AromaticContact CD1-CD2 4Å; Y434-F461 HydrophobicContact CD1-CD2 4Å; Y434-F461 HydrophobicContact CD1-CG 4Å; Y434-F461 AromaticContact CD2-CD2 3.84Å; Y434-F461 HydrophobicContact CD2-CD2 3.84Å; Y434-F461 HydrophobicContact CD2-CE2 4.45Å; Y434-F461 HydrophobicContact CE1-CB 3.73Å; Y434-F461 HydrophobicContact CE1-CD1 4.25Å; Y434-F461 AromaticContact CE1-CD2 3.55Å; Y434-F461 HydrophobicContact CE1-CD2 3.55Å; Y434-F461 HydrophobicContact CE1-CE2 4.1Å; Y434-F461 AromaticContact CE1-CG 3.61Å; Y434-F461 HydrophobicContact CE1-CG 3.61Å; Y434-F461 AromaticContact CE2-CD2 3.39Å; Y434-F461 HydrophobicContact CE2-CD2 3.39Å; Y434-F461 AromaticContact CE2-CE2 3.6Å; Y434-F461 HydrophobicContact CE2-CE2 3.6Å; Y434-F461 HydrophobicContact CE2-CG 4.3Å; Y434-F461 HydrophobicContact CG-CB 4.08Å; Y434-F461 HydrophobicContact CG-CD2 4.12Å; Y434-F461 HydrophobicContact CG-CG 4.48Å; Y434-F461 AromaticContact CZ-CD2 3.22Å; Y434-F461 AromaticContact CZ-CE2 3.37Å; Y434-F461 AromaticContact CZ-CG 3.78Å; Y434-F461 WeakPolarHBondContact OH-CE2 3.4Å; T435-F461 PolarHBondContact N-O 2.64Å; T435-F461 VanDerWaalsContact N-O 3.11Å
462	V	94.6	Very high	83.8	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.006	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	140.8	-176.5	175.8	0	0	0	0	109.6	F291 Y292 E294 T435 D437 Q464	F291-V462 WeakPolarHBondContact CA-O 3.49Å; Y292-V462 PolarHBondContact N-O 2.64Å; Y292-V462 PolarHBondContact O-N 3.19Å; E294-V462 HydrophobicContact CG-CG2 3.9Å; T435-V462 WeakPolarHBondContact O-CA 3.48Å; D437-V462 HydrophobicContact CB-CG1 3.64Å; D437-V462 HydrophobicContact CB-CG2 4.41Å; D437-V462 VanDerWaalsContact CG-CG1 3.48Å; V462-Q464 PolarHBondContact O-N 3Å
463	W	94.5	Very high	81.4	Confident	2 Å²	2	67.7 Å²	67.7	1%	0.008	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	108.9	169.3	-180	-101.8	0	0	0	111.1	F205 M209 L284 P285 Y289 G290 F291 T435	F205-W463 HydrophobicContact CB-CG 4.46Å; F205-W463 HydrophobicContact CD1-CB 3.78Å; F205-W463 AromaticContact CD1-CD1 3.94Å; F205-W463 HydrophobicContact CD1-CD2 4Å; F205-W463 AromaticContact CD1-CG 3.63Å; F205-W463 HydrophobicContact CD1-CG 3.63Å; F205-W463 HydrophobicContact CE1-CB 4.16Å; F205-W463 HydrophobicContact CE1-CG 4.45Å; F205-W463 PolarHBondContact O-NE1 2.75Å; M209-W463 HydrophobicContact SD-CZ2 4.25Å; L284-W463 HydrophobicContact CD1-CD2 3.95Å; L284-W463 HydrophobicContact CD1-CE3 3.85Å; L284-W463 HydrophobicContact CD1-CH2 3.67Å; L284-W463 HydrophobicContact CD1-CZ2 3.78Å; L284-W463 HydrophobicContact CD1-CZ3 3.71Å; L284-W463 HydrophobicContact CG-CH2 4.12Å; L284-W463 HydrophobicContact CG-CZ3 4.26Å; P285-W463 WeakPolarHBondContact O-CH2 3.21Å; P285-W463 WeakPolarHBondContact O-CZ2 3.07Å; Y289-W463 HydrophobicContact CG-CZ2 4.31Å; G290-W463 WeakPolarHBondContact O-CA 3.44Å; F291-W463 HydrophobicContact CD1-CB 4.25Å; F291-W463 HydrophobicContact CD1-CE3 4.43Å; F291-W463 AromaticContact CD2-CE3 3.91Å; F291-W463 HydrophobicContact CD2-CE3 3.91Å; F291-W463 HydrophobicContact CD2-CZ3 4.22Å; F291-W463 HydrophobicContact CE1-CB 3.87Å; F291-W463 HydrophobicContact CE1-CE3 4.07Å; F291-W463 AromaticContact CE2-CE3 3.49Å; F291-W463 HydrophobicContact CE2-CE3 3.49Å; F291-W463 VanDerWaalsContact CE2-CE3 3.49Å; F291-W463 AromaticContact CE2-CZ3 3.76Å; F291-W463 HydrophobicContact CE2-CZ3 3.76Å; F291-W463 HydrophobicContact CG-CE3 4.35Å; F291-W463 HydrophobicContact CZ-CB 4.38Å; F291-W463 HydrophobicContact CZ-CD2 4.34Å; F291-W463 AromaticContact CZ-CE3 3.55Å; F291-W463 HydrophobicContact CZ-CE3 3.55Å; F291-W463 HydrophobicContact CZ-CZ3 4.21Å; T435-W463 PolarHBondContact O-N 2.99Å
464	Q	92.3	Very high	79.1	Confident	44 Å²	44	70.4 Å²	70.4	21%	0.206	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	168.2	-179.8	64	-177.3	14.6	0	0	111.7	Y289 G290 Y292 V462	Y289-Q464 WeakPolarHBondContact CA-O 3.5Å; Y289-Q464 VanDerWaalsContact CD1-C 3.43Å; G290-Q464 PolarHBondContact N-O 3.06Å; G290-Q464 PolarHBondContact O-N 3.33Å; G290-Q464 VanDerWaalsContact O-O 3.12Å; Y292-Q464 HydrophobicContact CD2-CG 3.88Å; Y292-Q464 HydrophobicContact CG-CG 4.45Å; V462-Q464 PolarHBondContact O-N 3Å
465	R	90	Very high	76.6	Confident	50 Å²	50	71.1 Å²	71.1	19%	0.189	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	144.5	172.2	-167.4	176	-62.9	-178.6	3.5	109.8	D212 Y289 P467	D212-R465 PolarHBondContact O-NH2 2.85Å; Y289-R465 HydrophobicContact CD1-CB 4.05Å; Y289-R465 HydrophobicContact CE1-CB 3.67Å; Y289-R465 HydrophobicContact CE1-CG 4.37Å; Y289-R465 PolarHBondContact OH-NE 2.78Å; Y289-R465 PolarHBondContact OH-NH2 3.45Å; R465-P467 WeakPolarHBondContact O-CD 3.28Å; R465-P467 VanDerWaalsContact O-N 3.13Å
466	N	87.1	Confident	74.1	Confident	38 Å²	38	78.5 Å²	78.5	20%	0.203	43%	0.432	C	S	.	.			trans	-54.5	115.2	177.2	-179.1	-2.6	0	0	0	110.9	Q288 Y292 S468 I469	Q288-N466 VanDerWaalsContact O-CB 3.25Å; Q288-N466 WeakPolarHBondContact O-CB 3.39Å; Q288-N466 PolarHBondContact O-N 2.95Å; Y292-N466 HydrophobicContact CE2-CB 4.23Å; Y292-N466 WeakPolarHBondContact OH-CB 3.43Å; N466-S468 PolarHBondContact O-N 2.82Å; N466-S468 WeakPolarHBondContact OD1-CB 3.33Å; N466-S468 PolarHBondContact OD1-N 3.4Å; N466-S468 PolarHBondContact OD1-OG 3.38Å; N466-I469 HydrophobicContact CB-CD1 4.04Å; N466-I469 HydrophobicContact CB-CG1 4.15Å; N466-I469 PolarHBondContact O-N 2.7Å
467	P	80.9	Confident	71.6	Confident	61 Å²	61	75.4 Å²	75.4	40%	0.396	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-19.8	-178.6	-25.3	35.7	0	0	0	114.1	Y292 R465 I469	Y292-P467 HydrophobicContact CG-CG 4.33Å; R465-P467 WeakPolarHBondContact O-CD 3.28Å; R465-P467 VanDerWaalsContact O-N 3.13Å; P467-I469 VanDerWaalsContact C-N 3.28Å; P467-I469 PolarHBondContact O-N 2.76Å
468	S	76.6	Confident	68.9	Low	91 Å²	91	74.7 Å²	74.7	64%	0.636	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-6	176.3	-50.4	0	0	0	0	114.2	N466	N466-S468 PolarHBondContact O-N 2.82Å; N466-S468 WeakPolarHBondContact OD1-CB 3.33Å; N466-S468 PolarHBondContact OD1-N 3.4Å; N466-S468 PolarHBondContact OD1-OG 3.38Å
469	I	70.9	Confident	66	Low	60 Å²	60	81.3 Å²	81.3	31%	0.308	47%	0.47	S	S	.	.	S	Bend	trans	-110.8	111.2	178.2	-59.9	177.5	0	0	0	107.8	Q288 N466 P467	Q288-I469 HydrophobicContact CB-CD1 4.07Å; Q288-I469 HydrophobicContact CG-CD1 4.01Å; N466-I469 HydrophobicContact CB-CD1 4.04Å; N466-I469 HydrophobicContact CB-CG1 4.15Å; N466-I469 PolarHBondContact O-N 2.7Å; P467-I469 VanDerWaalsContact C-N 3.28Å; P467-I469 PolarHBondContact O-N 2.76Å
470	P	60.7	Low	63	Low	103 Å²	103	78.9 Å²	78.9	67%	0.669	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-57.6	143.2	173.8	-22.8	33.5	0	0	0	110.9	E472	P470-E472 PolarHBondContact O-N 2.89Å
471	P	59.1	Low	59.9	Low	96 Å²	96	84.2 Å²	84.2	62%	0.623	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-59.5	134	165.8	27.8	-33.4	0	0	0	108.6
472	E	53.5	Low	56.6	Low	176 Å²	176	91.6 Å²	91.6	82%	0.822	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-59.8	139.8	174.2	-70.7	-162.2	173.3	0	0	109.7	P470 S474	P470-E472 PolarHBondContact O-N 2.89Å; E472-S474 PolarHBondContact O-N 2.88Å
473	P	41.4	Very low	53.4	Low	126 Å²	126	103 Å²	103	82%	0.818	60%	0.599	S	S	*	*			trans	-65.5	106.9	179.4	26.7	-33.5	0	0	0	109	S475	P473-S475 PolarHBondContact O-N 2.79Å; P473-S475 VanDerWaalsContact O-N 3.14Å
474	S	38.2	Very low	50.2	Low	88 Å²	88	112 Å²	112	62%	0.615	64%	0.638	S	S	*	*			trans	-49.2	121.9	-179.7	56.2	0	0	0	0	110.2	E472 H476	E472-S474 PolarHBondContact O-N 2.88Å; S474-H476 PolarHBondContact O-N 2.83Å; S474-H476 PolarHBondContact OG-CD2 2.95Å
475	S	35.8	Very low	47.1	Very low	118 Å²	118	118.8 Å²	118.8	83%	0.825	67%	0.67	S	S	*	*			trans	-76.1	46.1	-175.2	52.9	0	0	0	0	112.9	P473 V477	P473-S475 PolarHBondContact O-N 2.79Å; P473-S475 VanDerWaalsContact O-N 3.14Å; S475-V477 PolarHBondContact O-N 3.22Å
476	H	35.8	Very low	44.1	Very low	160 Å²	160	122.2 Å²	122.2	74%	0.741	70%	0.701	S	S	*	*			trans	-68.6	78.3	167.3	-70.5	-49.5	0	0	0	110.1	S474 A478	S474-H476 PolarHBondContact O-N 2.83Å; S474-H476 PolarHBondContact OG-CD2 2.95Å; H476-A478 PolarHBondContact O-N 2.82Å
477	V	33.6	Very low	41.3	Very low	115 Å²	115	130.6 Å²	130.6	70%	0.697	73%	0.73	S	S	*	*			trans	-50	114.6	154.6	175.7	0	0	0	0	106.7	S475 N479	S475-V477 PolarHBondContact O-N 3.22Å; V477-N479 PolarHBondContact O-N 2.99Å
478	A	30.6	Very low	38.7	Very low	98 Å²	98	134.2 Å²	134.2	81%	0.81	74%	0.742	S	S	*	*			trans	-69.3	83.7	177.9	0	0	0	0	0	109.2	H476 G480	H476-A478 PolarHBondContact O-N 2.82Å; A478-G480 VanDerWaalsContact C-N 3.34Å; A478-G480 PolarHBondContact O-N 2.91Å
479	N	30.4	Very low	36.3	Very low	145 Å²	145	134.6 Å²	134.6	78%	0.775	74%	0.74	S	S	*	*			trans	-61.2	95.1	175.1	-87	-23.5	0	0	0	109	V477 C481	V477-N479 PolarHBondContact O-N 2.99Å; N479-C481 PolarHBondContact O-N 2.92Å
480	G	28.6	Very low	34.1	Very low	62 Å²	62	139.2 Å²	139.2	64%	0.639	76%	0.761	S	S	*	*			trans	-60.1	121.7	-174	0	0	0	0	0	111.4	A478 I482	A478-G480 VanDerWaalsContact C-N 3.34Å; A478-G480 PolarHBondContact O-N 2.91Å; G480-I482 PolarHBondContact O-N 3.36Å
481	C	28.2	Very low	32.4	Very low	128 Å²	128	142.8 Å²	142.8	87%	0.865	77%	0.768	S	S	*	*			trans	-63	102.3	169.4	-68.2	0	0	0	0	109.5	N479 R483	N479-C481 PolarHBondContact O-N 2.92Å; C481-R483 VanDerWaalsContact C-N 3.31Å; C481-R483 PolarHBondContact O-N 2.9Å
482	I	26.7	Very low	30.9	Very low	161 Å²	161	147.6 Å²	147.6	83%	0.826	78%	0.782	S	S	*	*			trans	-63.1	91.8	173.3	-59.9	175.5	0	0	0	108.6	G480 K484	G480-I482 PolarHBondContact O-N 3.36Å; I482-K484 PolarHBondContact O-N 3.46Å
483	R	25.9	Very low	29.6	Very low	240 Å²	240	149.4 Å²	149.4	91%	0.906	78%	0.783	S	S	*	*			trans	-76.3	113.9	170.7	-145.4	174.8	-168.2	-178.7	3.3	107.2	C481	C481-R483 VanDerWaalsContact C-N 3.31Å; C481-R483 PolarHBondContact O-N 2.9Å
484	K	28.4	Very low	28.8	Very low	192 Å²	192	147 Å²	147	84%	0.835	78%	0.781	S	S	*	*			trans	-55.7	138.8	-170.6	-65.3	-179.7	178.3	179.2	0	111.9	I482	I482-K484 PolarHBondContact O-N 3.46Å
485	H	26.3	Very low	28.3	Very low	186 Å²	186	150.5 Å²	150.5	86%	0.861	79%	0.793	S	S	*	*			trans	-67	143	178	-78	-74.9	0	0	0	113.5
486	S	26.9	Very low	28	Very low	122 Å²	122	154 Å²	154	85%	0.853	79%	0.793	S	S	*	*			trans	-126	153.8	156.6	-51.3	0	0	0	0	110.2
487	R	28.5	Very low	27.8	Very low	215 Å²	215	156.2 Å²	156.2	81%	0.811	80%	0.801	S	S	*	*			trans	-134.9	157.8	-178.9	-75.3	-173.5	178.6	-167.2	7.1	108.9
488	Q	27.7	Very low	27.5	Very low	137 Å²	137	158.1 Å²	158.1	64%	0.64	81%	0.806	S	S	*	*			cis	-160.3	168.6	-0.8	-123.5	-177.2	-106.2	0	0	108.6
489	T	25.1	Very low	27.4	Very low	98 Å²	98	159.9 Å²	159.9	60%	0.601	81%	0.811	S	S	*	*			cis	-114	-88.2	-12.2	-37.6	0	0	0	0	112.4
490	E	25.8	Very low	27.4	Very low	158 Å²	158	159.2 Å²	159.2	74%	0.738	81%	0.812	S	S	*	*			cis	-153.2	-171.9	-6.9	-137.5	73.4	-121.2	0	0	108.8
491	Q	24.7	Very low	27.4	Very low	178 Å²	178	164.7 Å²	164.7	83%	0.832	82%	0.822	S	S	*	*			trans	-125.9	145.4	-178.9	-59.4	173.7	-67.1	0	0	112.1
492	E	25.9	Very low	27.4	Very low	197 Å²	197	166.5 Å²	166.5	92%	0.921	82%	0.823	S	S	*	*			trans	-146.2	153.1	151.5	-141	170	-141.8	0	0	112.1
493	Y	27.9	Very low	27.6	Very low	213 Å²	213	164.7 Å²	164.7	84%	0.835	82%	0.819	S	S	*	*			trans	-88	143.7	-166	-101.3	-112.9	0	0	0	113.3
494	G	24.8	Very low	27.9	Very low	75 Å²	75	162.7 Å²	162.7	77%	0.773	82%	0.817	S	S	*	*			trans	-69.2	144.7	168.6	0	0	0	0	0	112.1
495	N	27.6	Very low	28.1	Very low	163 Å²	163	158.7 Å²	158.7	87%	0.872	81%	0.813	S	S	*	*			trans	-130.5	127.6	177.1	-125.7	-35.7	0	0	0	111.2
496	K	29.5	Very low	28.4	Very low	191 Å²	191	157.7 Å²	157.7	83%	0.83	81%	0.813	S	S	*	*			trans	-81.1	141.7	178.4	-65.3	174.8	179.2	175.8	0	109.9
497	K	30.4	Very low	29.2	Very low	207 Å²	207	157 Å²	157	90%	0.9	81%	0.806	S	S	*	*			trans	-127.1	137	151.3	-85.5	-170.7	173.3	-179.9	0	109.9
498	L	27.9	Very low	29.4	Very low	154 Å²	154	152 Å²	152	81%	0.806	80%	0.804	S	S	*	*			trans	-78	146.1	178.2	-72.8	64.4	0	0	0	109.3
499	C	27.8	Very low	29.7	Very low	135 Å²	135	149 Å²	149	91%	0.912	81%	0.81	S	S	*	*			trans	-108.6	138.9	145.2	-81.1	0	0	0	0	107.4
500	T	30.3	Very low	30.2	Very low	131 Å²	131	154 Å²	154	80%	0.804	85%	0.849	S	S	*	*			trans	-82.1	147.2	-172	45.9	0	0	0	0	112.4
501	E	29.3	Very low	30.4	Very low	178 Å²	178	153.8 Å²	153.8	83%	0.832	86%	0.855	S	S	*	*			trans	-63.1	153.7	171.7	-57.7	177.4	123.7	0	0	112.1
502	N	28.6	Very low	30.7	Very low	166 Å²	166	152.5 Å²	152.5	89%	0.888	86%	0.856	S	S	*	*			trans	-155.6	106.6	153.9	-126.5	-29.9	0	0	0	109.7
503	T	31.1	Very low	31	Very low	123 Å²	123	150.1 Å²	150.1	76%	0.755	85%	0.852	S	S	*	*			trans	-92.8	139.5	179.7	40.9	0	0	0	0	111.4
504	K	32.3	Very low	31.1	Very low	198 Å²	198	146.4 Å²	146.4	86%	0.861	85%	0.853	S	S	*	*			trans	-162.3	110.7	159.3	-113	159.6	-172.1	176.6	0	114.2
505	S	31.3	Very low	31.5	Very low	108 Å²	108	150.8 Å²	150.8	76%	0.755	86%	0.858	S	S	*	*			trans	28.8	125.2	138.5	59.4	0	0	0	0	122.1
506	L	33.1	Very low	31.8	Very low	164 Å²	164	150 Å²	150	86%	0.859	86%	0.857	S	S	*	*			trans	-55.4	174.7	145	-69.4	156.8	0	0	0	112
507	P	44.2	Very low	32	Very low	107 Å²	107	147.1 Å²	147.1	70%	0.695	86%	0.859	S	S	*	*			cis	-141.2	-166.9	14.3	39.6	-17.3	0	0	0	116.6
508	S	31.7	Very low	32.1	Very low	110 Å²	110	142.5 Å²	142.5	77%	0.769	86%	0.856	S	S	*	*			trans	60.6	107.5	146.2	64	0	0	0	0	121.8
509	G	34.7	Very low	32.4	Very low	75 Å²	75	141.5 Å²	141.5	77%	0.773	86%	0.86	S	S	*	*				79.4	105.6	99	0	0	0	0	0	120
510	S	35	Very low	32.9	Very low	203 Å²	203	142.1 Å²	142.1	100%	1.42	86%	0.855	S	S	*	*			trans	-158.1	0	144.9	-72.5	0	0	0	0	108.4

Retrieved 510 of 510 residues in 340.7 ms (Link to these results)

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