A0A087XU82_POEFO Loading...

Glutamate receptor

Receptor for glutamate that functions as a ligand-gated ion channel in the central nervous system and plays an important role in excitatory synaptic transmission. L-glutamate acts as an excitatory neurotransmitter at many synapses in the central nervous system.

AlphaFold DB , UniProt , Accession A0A087XU82, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,055 aa.

						>A0A087XU82_POEFO|A0A087XU82
FRTFRTLRTFLVVQLLLGPGCHLHPQPCHLLAQIGHAVRVGALLPAQREARLQVQAALSRTAAALSRDRNWDQDPDPERVNFLPYNLSVELVSRQLAAADPESLIRCACQRVLERGVSAALAFPQSREELLQVDLLAAALRVPVVSLIEHAEPLRTQNRFHLQMVTGVPESVLSDLLLAVLQRSGWREGTVVLCRGWEEAGGLLRFLDSQTSGPWDGSGAVTWHLQALLNLTQSAHDDTQIHDFLSRHFRRNQPPPAAVLLFGADPECAAAVLRSAQDLGLTLPLVHWVLGQPLSPDVLHTFGLPLGLLAYGEVDRKPLDFYIRDALQLITRAVAAATVVRPDLALVQNTVSCYDTPEAPTAGRYLSRFLANTSFSGLTGPVGVDQNRSLVLTSQRFHIWSLRRDALGQPAWVTVGSWEDGQLQVEDQEVWQGPKPRRRAEGSGGRSGGRWRPGTPVEGTRVRVVTLVEHPFVFTRDVDDDSSCPAGQFCLDASTNSSETLERYFREVAAGNGSSLPLEYRKCCYGYCIDLLEKLAEDLDFHFDLYIVGDGKYGAWKGGRWTGLVGDLLSGLADMAVTSFSINSARSRVIDFTSPFFSTSLGILVRSKDTAAPIGAFMWPLHWSMWVGIFLALHITALFLTLYEWKSPFGMTPHGRNRVRVFSYSSALNLCYAILFGRTVSSKTPKCWTGRFLMNLWAIFCLLVLSSYTANLAAVMVGEKTFEEVSGIHDAKLHHPSKGFRFGTVRESSAEDYMKKSFPEMHEYMRRFNEPTTPEGVATLKTDPPQLDAFIMDKALLDYEVSIDADCKLATVGKPFAIEGYGIGLPQNSPLSSNLSEFISRYKSDGYMDLLHDKWYKVVPCGNRVFAVTETLQMGISHFSGLFVLLCVGVGGALLTLAGEHGFYRLVLPHIRRRQNLKYWLHTSQKIHRALNLTYDDVKRQRAEREKRWNNESRKETPAAADAGDFKRVHFSLETLNTRRLLARLAVSEAKGATPPNPGTAPPLPADLAALQQQIDQMREKLRTALARRAEIQTSLAKSSDLRSVRILNSCKVTS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	F	44.8	Very low	42.8	Very low	265 Å²	265	171.4 Å²	171.4	100%	1.162	79%	0.785	S	S	*	*				0	49.1	0	-110.9	-88.7	0	0	0	112.8
2	R	37.3	Very low	43.2	Very low	244 Å²	244	164.2 Å²	164.2	92%	0.921	76%	0.762	S	S	*	*			trans	-152	22.1	175	-118.7	-178.2	-170.4	-176.6	2.7	115.1
3	T	39.2	Very low	43.3	Very low	120 Å²	120	158.8 Å²	158.8	74%	0.736	75%	0.747	S	S	*	*	S	Bend	trans	-129.1	7.8	-178.4	37.7	0	0	0	0	114.2
4	F	38.6	Very low	43.1	Very low	199 Å²	199	158.6 Å²	158.6	87%	0.873	75%	0.746	S	S	*	*	S	Bend	trans	-109.3	0.6	179.3	-113.1	-89.1	0	0	0	114.5
5	R	43.6	Very low	42.8	Very low	224 Å²	224	157.6 Å²	157.6	85%	0.845	75%	0.747	S	S	*	*	S	Bend	trans	-102.4	-14.3	-175.5	-118.8	178.2	-179.6	175.1	-0.4	114.6
6	T	44	Very low	42.7	Very low	98 Å²	98	156.6 Å²	156.6	60%	0.601	75%	0.746	S	S	*	*	S	Bend	trans	-88.9	-21.4	-178.6	41.9	0	0	0	0	113.7	T9	T6-T9 PolarHBondContact O-OG1 3.49Å
7	L	43.3	Very low	42.4	Very low	144 Å²	144	156 Å²	156	75%	0.754	75%	0.747	S	S	*	*	H	α-helix	trans	-76.1	-27	178.1	-129.8	88.5	0	0	0	113.1
8	R	43.1	Very low	41.7	Very low	208 Å²	208	150.6 Å²	150.6	79%	0.785	74%	0.74	S	S	*	*	H	α-helix	trans	-84.8	-21.7	-174.3	-143.9	175.6	-177.1	178.7	0	113.3	V12	R8-V12 WeakPolarHBondContact O-CG2 3.36Å
9	T	48.8	Very low	41.2	Very low	95 Å²	95	149.4 Å²	149.4	58%	0.583	74%	0.744	S	S	*	*	H	α-helix	trans	-84.3	-26.4	176.4	44.3	0	0	0	0	112.7	T6	T6-T9 PolarHBondContact O-OG1 3.49Å
10	F	45.3	Very low	40.6	Very low	161 Å²	161	145.1 Å²	145.1	71%	0.706	74%	0.739	S	S	*	*	H	α-helix	trans	-76.3	-30.4	178	-142.2	-96.2	0	0	0	112.5
11	L	43.3	Very low	40	Very low	127 Å²	127	144 Å²	144	67%	0.665	74%	0.743	S	S	*	*	H	α-helix	trans	-73.8	-24.9	178.3	-140.4	88.8	0	0	0	113.5
12	V	47.4	Very low	39.5	Very low	85 Å²	85	139.9 Å²	139.9	52%	0.515	73%	0.728	S	S	.	*	H	α-helix	trans	-83.9	-26.9	-177.4	175.6	0	0	0	0	112.2	R8	R8-V12 WeakPolarHBondContact O-CG2 3.36Å
13	V	43.9	Very low	39.3	Very low	94 Å²	94	136 Å²	136	57%	0.57	72%	0.724	S	S	*	*	H	α-helix	trans	-78.2	-28.2	178	176.9	0	0	0	0	111.9	L15	V13-L15 VanDerWaalsContact C-N 3.33Å
14	Q	40.9	Very low	39.3	Very low	157 Å²	157	136.3 Å²	136.3	73%	0.734	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	-17.6	173.8	-82.7	-122.3	-18.3	0	0	114.3
15	L	39	Very low	39.6	Very low	143 Å²	143	132 Å²	132	75%	0.749	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	-7.5	176	-87.8	155.4	0	0	0	113.8	V13	V13-L15 VanDerWaalsContact C-N 3.33Å
16	L	40.3	Very low	40	Very low	142 Å²	142	128.1 Å²	128.1	74%	0.743	70%	0.701	S	S	*	*	S	Bend	trans	-108.7	1.5	-177.3	-78	163.6	0	0	0	114.4
17	L	38.5	Very low	40.5	Very low	146 Å²	146	124.6 Å²	124.6	76%	0.764	68%	0.679	S	S	*	*			trans	-121.1	50.3	175.1	-79	156	0	0	0	110.4
18	G	29.8	Very low	41.1	Very low	59 Å²	59	121.7 Å²	121.7	61%	0.608	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-78.6	134.8	161.2	0	0	0	0	0	109.6	G20	G18-G20 PolarHBondContact O-N 2.82Å
19	P	32.8	Very low	41.9	Very low	127 Å²	127	120.1 Å²	120.1	83%	0.825	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-62.1	131.9	170.4	25.6	-30	0	0	0	109	C21	P19-C21 PolarHBondContact O-N 3.07Å
20	G	28.9	Very low	42.5	Very low	63 Å²	63	117.3 Å²	117.3	65%	0.649	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-54.9	131.3	-175.5	0	0	0	0	0	112.7	G18 H22	G18-G20 PolarHBondContact O-N 2.82Å; G20-H22 PolarHBondContact O-N 3.18Å
21	C	27.5	Very low	43.4	Very low	122 Å²	122	110.9 Å²	110.9	82%	0.824	63%	0.625	S	S	*	*			trans	-61.3	94.3	167.3	-70.8	0	0	0	0	110.1	P19 L23	P19-C21 PolarHBondContact O-N 3.07Å; C21-L23 HydrophobicContact CB-CD1 4.29Å; C21-L23 PolarHBondContact O-N 3.15Å
22	H	33.5	Very low	44.3	Very low	180 Å²	180	108.9 Å²	108.9	83%	0.833	63%	0.627	S	S	*	*			trans	-78.1	94.2	156	-73.9	-73.5	0	0	0	108	G20 H24	G20-H22 PolarHBondContact O-N 3.18Å; H22-H24 PolarHBondContact O-N 3.23Å
23	L	33.2	Very low	45.1	Very low	161 Å²	161	112.5 Å²	112.5	84%	0.843	64%	0.639	S	S	*	*			trans	-63.8	101.2	161.1	-90.7	89.1	0	0	0	108.1	C21	C21-L23 HydrophobicContact CB-CD1 4.29Å; C21-L23 PolarHBondContact O-N 3.15Å
24	H	40	Very low	46.1	Very low	128 Å²	128	108.9 Å²	108.9	59%	0.593	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-83.5	131.2	159.3	-114	-54.3	0	0	0	108.5	H22 Q26	H22-H24 PolarHBondContact O-N 3.23Å; H24-Q26 PolarHBondContact O-N 2.93Å
25	P	45.6	Very low	47.1	Very low	109 Å²	109	103.1 Å²	103.1	71%	0.708	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-61.6	133	176.8	24.2	-32.4	0	0	0	110.2
26	Q	50.2	Low	48.7	Very low	141 Å²	141	102.3 Å²	102.3	66%	0.659	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-55.7	129.2	176.4	-71.9	-178.5	-25.1	0	0	110.5	H24 C28 Y85	H24-Q26 PolarHBondContact O-N 2.93Å; Q26-C28 VanDerWaalsContact C-N 3.26Å; Q26-C28 PolarHBondContact O-N 3.39Å; Q26-Y85 HydrophobicContact CG-CE1 4.29Å
27	P	55.3	Low	50.5	Low	24 Å²	24	96.3 Å²	96.3	16%	0.156	56%	0.562	C	S	.	*			trans	-80.6	70.8	179.4	33	-34.2	0	0	0	110.5	H29 L30 L31 Y85 P342	P27-H29 VanDerWaalsContact C-N 3.27Å; P27-H29 PolarHBondContact O-N 3.43Å; P27-L30 HydrophobicContact CB-CB 4.07Å; P27-L30 PolarHBondContact O-N 3.36Å; P27-L30 VanDerWaalsContact O-N 3.15Å; P27-L31 PolarHBondContact O-N 3.35Å; P27-Y85 HydrophobicContact CG-CE2 4.42Å; P27-P342 HydrophobicContact CG-CB 4.3Å; P27-P342 HydrophobicContact CG-CG 4.48Å
28	C	55.2	Low	52.6	Low	84 Å²	84	89.7 Å²	89.7	57%	0.568	53%	0.528	S	S	*	.	H	α-helix	trans	-59.5	-32.4	-175.8	-65.2	0	0	0	0	113.7	Q26 A32	Q26-C28 VanDerWaalsContact C-N 3.26Å; Q26-C28 PolarHBondContact O-N 3.39Å; C28-A32 PolarHBondContact O-N 3.26Å
29	H	60.6	Low	55.2	Low	175 Å²	175	89.7 Å²	89.7	81%	0.81	51%	0.509	S	S	*	.	H	α-helix	trans	-72.1	-32.1	177.5	-81.1	-68.2	0	0	0	113.6	P27	P27-H29 VanDerWaalsContact C-N 3.27Å; P27-H29 PolarHBondContact O-N 3.43Å
30	L	62.3	Low	57.9	Low	35 Å²	35	83.6 Å²	83.6	18%	0.183	47%	0.47	C	S	.	.	H	α-helix	trans	-74.5	-43.7	-178.6	-128.1	128	0	0	0	109.9	P27 A32 Q33 I34 D343 L346 V347	P27-L30 HydrophobicContact CB-CB 4.07Å; P27-L30 PolarHBondContact O-N 3.36Å; P27-L30 VanDerWaalsContact O-N 3.15Å; L30-A32 PolarHBondContact O-N 3.06Å; L30-Q33 PolarHBondContact O-N 3.2Å; L30-I34 WeakPolarHBondContact O-CG1 3.45Å; L30-I34 PolarHBondContact O-N 3.22Å; L30-D343 HydrophobicContact CD1-CB 4.37Å; L30-L346 HydrophobicContact CD2-CB 3.79Å; L30-V347 HydrophobicContact CD2-CG2 4.3Å
31	L	63.9	Low	60.7	Low	26 Å²	26	80.6 Å²	80.6	14%	0.136	44%	0.439	C	S	.	.	H	α-helix	trans	-59	-32.7	176.9	-68.3	169.1	0	0	0	113.3	P27 Q33 I34 G35 Y85 L87	P27-L31 PolarHBondContact O-N 3.35Å; L31-Q33 VanDerWaalsContact C-N 3.33Å; L31-Q33 PolarHBondContact O-N 2.86Å; L31-I34 HydrophobicContact CD2-CD1 3.98Å; L31-G35 PolarHBondContact O-N 2.92Å; L31-Y85 HydrophobicContact CD1-CG 4.45Å; L31-L87 HydrophobicContact CD2-CD1 4.4Å; L31-L87 HydrophobicContact CD2-CD2 3.78Å; L31-L87 HydrophobicContact CD2-CG 4.3Å
32	A	61.2	Low	63.7	Low	85 Å²	85	74.8 Å²	74.8	70%	0.702	40%	0.4	S	S	*	.	H	α-helix	trans	-69.7	-25.9	175.7	0	0	0	0	0	113.6	C28 L30	C28-A32 PolarHBondContact O-N 3.26Å; L30-A32 PolarHBondContact O-N 3.06Å
33	Q	64.2	Low	66.4	Low	162 Å²	162	67.1 Å²	67.1	76%	0.757	37%	0.365	S	S	*	.	H	α-helix	trans	-83.7	-37.7	179.4	-77.6	-178.4	-23	0	0	113.4	L30 L31	L30-Q33 PolarHBondContact O-N 3.2Å; L31-Q33 VanDerWaalsContact C-N 3.33Å; L31-Q33 PolarHBondContact O-N 2.86Å
34	I	64.6	Low	69	Low	17 Å²	17	60 Å²	60	9%	0.087	33%	0.327	C	S	.	.	H	α-helix	trans	-78.8	-24.2	-176.1	19.3	161.1	0	0	0	113.7	L30 L31 L87 L346 Q348	L30-I34 WeakPolarHBondContact O-CG1 3.45Å; L30-I34 PolarHBondContact O-N 3.22Å; L31-I34 HydrophobicContact CD2-CD1 3.98Å; I34-L87 HydrophobicContact CD1-CD2 4.25Å; I34-L346 HydrophobicContact CD1-CB 4.19Å; I34-L346 HydrophobicContact CD1-CD1 4.26Å; I34-L346 VanDerWaalsContact CG2-O 3.24Å; I34-L346 WeakPolarHBondContact CG2-O 3.38Å; I34-Q348 HydrophobicContact CG2-CG 3.7Å; I34-Q348 PolarHBondContact O-NE2 2.9Å
35	G	62.6	Low	71.3	Confident	37 Å²	37	54.1 Å²	54.1	38%	0.381	30%	0.3	S	S	.	.			trans	68.3	157.6	-156.4	0	0	0	0	0	109.7	L31 A37	L31-G35 PolarHBondContact O-N 2.92Å; G35-A37 PolarHBondContact O-N 3.31Å
36	H	73	Confident	73.1	Confident	126 Å²	126	49.9 Å²	49.9	58%	0.583	28%	0.275	S	S	*	.	S	Bend	trans	-70.3	37.8	-174.6	-69.2	-82.9	0	0	0	114.6	S88	H36-S88 PolarHBondContact O-N 3.14Å; H36-S88 PolarHBondContact O-OG 3.31Å
37	A	77.5	Confident	74.7	Confident	16 Å²	16	48 Å²	48	13%	0.132	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	139	-178.2	0	0	0	0	0	113.7	G35 S88 E90	G35-A37 PolarHBondContact O-N 3.31Å; A37-S88 CarbonylContact C-O 3.59Å; A37-S88 WeakPolarHBondContact CA-O 3.41Å; A37-S88 WeakPolarHBondContact CB-OG 3.42Å; A37-E90 HydrophobicContact CB-CB 4.15Å
38	V	82.8	Confident	76.1	Confident	7 Å²	7	56.2 Å²	56.2	4%	0.042	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	123.5	166.7	177.7	0	0	0	0	108.2	L83 L87 S88 V89 E90 L346	V38-L83 HydrophobicContact CB-CD1 4.18Å; V38-L83 HydrophobicContact CG2-CD1 3.92Å; V38-L83 HydrophobicContact CG2-CD2 4.45Å; V38-L87 HydrophobicContact CG2-CB 4.43Å; V38-L87 HydrophobicContact CG2-CD1 4.25Å; V38-S88 PolarHBondContact N-O 2.99Å; V38-V89 WeakPolarHBondContact O-CA 3.43Å; V38-E90 PolarHBondContact O-N 3.34Å; V38-L346 HydrophobicContact CG2-CD2 4.09Å
39	R	85.3	Confident	77.4	Confident	58 Å²	58	59.1 Å²	59.1	22%	0.219	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	126.6	-176.6	-72.1	175.8	178.7	161	11.6	111.7	E90 V92 R115 V117 S118	R39-E90 WeakPolarHBondContact CA-O 3.49Å; R39-E90 HydrophobicContact CG-CB 4.11Å; R39-E90 HydrophobicContact CG-CG 4.5Å; R39-E90 WeakPolarHBondContact CG-OE2 3.25Å; R39-E90 IonicContact CZ-OE2 3.63Å; R39-E90 IonicContact NE-OE2 3.92Å; R39-E90 PolarHBondContact NE-OE2 2.88Å; R39-E90 IonicContact NH2-OE2 3.26Å; R39-V92 HydrophobicContact CB-CG2 4.42Å; R39-V92 HydrophobicContact CG-CG2 4.43Å; R39-R115 WeakPolarHBondContact CD-O 3.44Å; R39-R115 PolarHBondContact NH1-O 3.29Å; R39-V117 HydrophobicContact CB-CG2 4.29Å; R39-V117 WeakPolarHBondContact O-CA 3.3Å; R39-S118 PolarHBondContact O-N 2.72Å
40	V	88.5	Confident	78.5	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	124.1	174	-178.4	0	0	0	0	109.1	V89 E90 L91 V92 A119 L121 L327 I330	V40-V89 HydrophobicContact CG2-CG1 4.11Å; V40-E90 PolarHBondContact N-O 3.4Å; V40-L91 HydrophobicContact CB-CD2 4.28Å; V40-L91 HydrophobicContact CG1-CD2 4.4Å; V40-L91 WeakPolarHBondContact O-CA 3.43Å; V40-V92 PolarHBondContact O-N 3.36Å; V40-A119 WeakPolarHBondContact CA-O 3.42Å; V40-A119 WeakPolarHBondContact CG1-O 3.45Å; V40-L121 HydrophobicContact CG1-CG 4.36Å; V40-L327 HydrophobicContact CB-CD2 4.23Å; V40-L327 HydrophobicContact CG1-CD2 3.82Å; V40-L327 HydrophobicContact CG2-CD2 4.35Å; V40-I330 HydrophobicContact CG1-CD1 4.13Å; V40-I330 HydrophobicContact CG2-CG2 4.19Å
41	G	88.1	Confident	79.8	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	151.4	179.4	0	0	0	0	0	111.5	V92 A119 A120 L121	G41-V92 CarbonylContact C-O 3.59Å; G41-V92 WeakPolarHBondContact CA-O 2.94Å; G41-A119 PolarHBondContact N-O 3.45Å; G41-A120 CarbonylContact O-C 3.57Å; G41-A120 VanDerWaalsContact O-CA 3.26Å; G41-A120 WeakPolarHBondContact O-CA 3.28Å; G41-L121 PolarHBondContact O-N 2.87Å
42	A	90	Very high	80.9	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	117.1	170.5	0	0	0	0	0	110.7	L58 V92 S93 R94 L121	A42-L58 HydrophobicContact CB-CD1 4.14Å; A42-V92 PolarHBondContact N-O 3.32Å; A42-S93 WeakPolarHBondContact O-CA 3.45Å; A42-R94 PolarHBondContact O-N 3.2Å; A42-L121 CarbonylContact C-O 3.47Å; A42-L121 WeakPolarHBondContact CA-O 3.11Å; A42-L121 HydrophobicContact CB-CB 4.43Å
43	L	89.7	Confident	82.2	Confident	19 Å²	19	55 Å²	55	10%	0.099	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	107.6	176.3	-66.6	172.5	0	0	0	109.2	V112 L121 F123 L136	L43-V112 HydrophobicContact CD2-CG2 3.86Å; L43-L121 PolarHBondContact N-O 3.36Å; L43-F123 WeakPolarHBondContact O-CD2 3.17Å; L43-L136 HydrophobicContact CD1-CD2 4.25Å
44	L	88.8	Confident	83.3	Confident	11 Å²	11	47.5 Å²	47.5	6%	0.058	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	149.8	-177.5	-59.4	176	0	0	0	112	R51 V54 L58 R94 L96	L44-R51 HydrophobicContact CB-CG 4.36Å; L44-V54 HydrophobicContact CD2-CG1 3.72Å; L44-L58 HydrophobicContact CD2-CD1 3.54Å; L44-R94 WeakPolarHBondContact CB-O 3.38Å; L44-R94 PolarHBondContact N-O 3.05Å; L44-L96 WeakPolarHBondContact O-CB 3.4Å
45	P	87.4	Confident	84.5	Confident	4 Å²	4	51.5 Å²	51.5	3%	0.026	25%	0.251	C	S	.	.			trans	-56.4	152.7	178.2	-20.8	28.5	0	0	0	114.1	A50 R51 V54 F123 Q125	P45-A50 HydrophobicContact CB-CB 3.96Å; P45-A50 HydrophobicContact CG-CB 4.02Å; P45-R51 PolarHBondContact O-NE 2.72Å; P45-R51 PolarHBondContact O-NH2 2.98Å; P45-R51 VanDerWaalsContact O-NH2 3.11Å; P45-V54 HydrophobicContact CG-CB 4.45Å; P45-V54 HydrophobicContact CG-CG2 3.94Å; P45-F123 HydrophobicContact CG-CB 3.92Å; P45-Q125 HydrophobicContact CB-CG 4.14Å
46	A	83.7	Confident	85.7	Confident	21 Å²	21	51.7 Å²	51.7	17%	0.174	25%	0.249	C	C	.	.	S	Bend	trans	-73.1	-35.6	170.2	0	0	0	0	0	112.5	R51 L96 A99	A46-R51 VanDerWaalsContact C-NH2 3.3Å; A46-R51 PolarHBondContact O-NH2 3.31Å; A46-L96 HydrophobicContact CB-CD2 4.27Å; A46-A99 HydrophobicContact CB-CB 3.84Å
47	Q	84.9	Confident	86.4	Confident	102 Å²	102	45.7 Å²	45.7	48%	0.477	22%	0.221	S	C	.	.	S	Bend	trans	-71	133.5	-179.6	-170.2	173.2	-3.7	0	0	111.3	E49 A50 R51	Q47-E49 PolarHBondContact O-N 2.87Å; Q47-A50 HydrophobicContact CB-CB 4.39Å; Q47-R51 WeakPolarHBondContact O-CB 3.45Å; Q47-R51 PolarHBondContact O-N 3.3Å
48	R	83.6	Confident	86.9	Confident	195 Å²	195	45.6 Å²	45.6	74%	0.736	22%	0.218	S	C	*	.	H	α-helix	trans	-62.5	-42.2	-172.9	-173.9	177.8	-179.6	178	-0.9	112.9	L52	R48-L52 HydrophobicContact CG-CD1 4.49Å; R48-L52 WeakPolarHBondContact O-CG 3.47Å; R48-L52 PolarHBondContact O-N 3.47Å; R48-L52 VanDerWaalsContact O-N 3.17Å
49	E	83.9	Confident	87.1	Confident	145 Å²	145	48.6 Å²	48.6	68%	0.678	24%	0.24	S	C	*	.	H	α-helix	trans	-66.6	-55.5	-177.6	-65.9	179.6	164	0	0	111.2	Q47 R51 L52 Q53	Q47-E49 PolarHBondContact O-N 2.87Å; E49-R51 VanDerWaalsContact C-N 3.25Å; E49-R51 PolarHBondContact O-N 2.98Å; E49-L52 PolarHBondContact O-N 3.04Å; E49-L52 VanDerWaalsContact O-N 3.15Å; E49-Q53 PolarHBondContact O-N 3.48Å
50	A	83.2	Confident	87.1	Confident	9 Å²	9	52.3 Å²	52.3	7%	0.074	25%	0.254	C	S	.	.	H	α-helix	trans	-56.5	-39	175.4	0	0	0	0	0	112.3	P45 Q47 L52 Q53 V54 Q125	P45-A50 HydrophobicContact CB-CB 3.96Å; P45-A50 HydrophobicContact CG-CB 4.02Å; Q47-A50 HydrophobicContact CB-CB 4.39Å; A50-L52 PolarHBondContact O-N 2.93Å; A50-Q53 PolarHBondContact O-N 3.31Å; A50-V54 WeakPolarHBondContact O-CB 3.44Å; A50-V54 VanDerWaalsContact O-CG2 3.29Å; A50-V54 WeakPolarHBondContact O-CG2 3.43Å; A50-V54 PolarHBondContact O-N 3.45Å; A50-Q125 HydrophobicContact CB-CG 4.1Å
51	R	88.4	Confident	86.9	Confident	32 Å²	32	52.3 Å²	52.3	12%	0.121	25%	0.254	C	S	.	.	H	α-helix	trans	-61.1	-45.1	177.5	-177	-173.2	-59	143.8	-5.5	112.7	L44 P45 A46 Q47 E49 Q53 V54 Q55 L96	L44-R51 HydrophobicContact CB-CG 4.36Å; P45-R51 PolarHBondContact O-NE 2.72Å; P45-R51 PolarHBondContact O-NH2 2.98Å; P45-R51 VanDerWaalsContact O-NH2 3.11Å; A46-R51 VanDerWaalsContact C-NH2 3.3Å; A46-R51 PolarHBondContact O-NH2 3.31Å; Q47-R51 WeakPolarHBondContact O-CB 3.45Å; Q47-R51 PolarHBondContact O-N 3.3Å; E49-R51 VanDerWaalsContact C-N 3.25Å; E49-R51 PolarHBondContact O-N 2.98Å; R51-Q53 VanDerWaalsContact C-N 3.33Å; R51-V54 PolarHBondContact O-N 3.27Å; R51-Q55 WeakPolarHBondContact O-CB 3.37Å; R51-Q55 PolarHBondContact O-N 3.45Å; R51-L96 PolarHBondContact NH2-O 2.71Å; R51-L96 VanDerWaalsContact NH2-O 3.09Å
52	L	88.1	Confident	86.6	Confident	105 Å²	105	54.3 Å²	54.3	55%	0.55	27%	0.27	S	S	.	.	H	α-helix	trans	-64.2	-41	179.9	-71.9	171.6	0	0	0	111.2	R48 E49 A50 A56	R48-L52 HydrophobicContact CG-CD1 4.49Å; R48-L52 WeakPolarHBondContact O-CG 3.47Å; R48-L52 PolarHBondContact O-N 3.47Å; R48-L52 VanDerWaalsContact O-N 3.17Å; E49-L52 PolarHBondContact O-N 3.04Å; E49-L52 VanDerWaalsContact O-N 3.15Å; A50-L52 PolarHBondContact O-N 2.93Å; L52-A56 WeakPolarHBondContact O-CB 3.38Å; L52-A56 PolarHBondContact O-N 3.1Å
53	Q	87.8	Confident	86	Confident	89 Å²	89	56.4 Å²	56.4	42%	0.416	29%	0.287	S	S	.	.	H	α-helix	trans	-62.4	-49.8	176.5	-177	179.5	-10.7	0	0	111.8	E49 A50 R51 Q55 A56 A57	E49-Q53 PolarHBondContact O-N 3.48Å; A50-Q53 PolarHBondContact O-N 3.31Å; R51-Q53 VanDerWaalsContact C-N 3.33Å; Q53-Q55 PolarHBondContact O-N 3.39Å; Q53-A56 PolarHBondContact O-N 2.96Å; Q53-A57 PolarHBondContact O-N 3.14Å
54	V	88.6	Confident	85.2	Confident	4 Å²	4	56.4 Å²	56.4	2%	0.024	29%	0.29	C	S	.	.	H	α-helix	trans	-63.8	-42.2	178.6	172.9	0	0	0	0	111.2	L44 P45 A50 R51 A56 A57 L58 F123 L319	L44-V54 HydrophobicContact CD2-CG1 3.72Å; P45-V54 HydrophobicContact CG-CB 4.45Å; P45-V54 HydrophobicContact CG-CG2 3.94Å; A50-V54 WeakPolarHBondContact O-CB 3.44Å; A50-V54 VanDerWaalsContact O-CG2 3.29Å; A50-V54 WeakPolarHBondContact O-CG2 3.43Å; A50-V54 PolarHBondContact O-N 3.45Å; R51-V54 PolarHBondContact O-N 3.27Å; V54-A56 VanDerWaalsContact C-N 3.34Å; V54-A56 PolarHBondContact O-N 2.97Å; V54-A57 PolarHBondContact O-N 3.15Å; V54-L58 HydrophobicContact CG1-CD1 3.85Å; V54-L58 HydrophobicContact CG1-CG 4.35Å; V54-L58 WeakPolarHBondContact O-CB 3.35Å; V54-L58 WeakPolarHBondContact O-CG 3.46Å; V54-L58 PolarHBondContact O-N 2.93Å; V54-F123 HydrophobicContact CG1-CD1 3.89Å; V54-F123 HydrophobicContact CG1-CD2 3.57Å; V54-F123 HydrophobicContact CG1-CE1 3.86Å; V54-F123 HydrophobicContact CG1-CE2 3.55Å; V54-F123 HydrophobicContact CG1-CG 3.75Å; V54-F123 HydrophobicContact CG1-CZ 3.7Å; V54-F123 HydrophobicContact CG2-CB 4.14Å; V54-F123 HydrophobicContact CG2-CD1 3.82Å; V54-F123 HydrophobicContact CG2-CE1 4.37Å; V54-F123 HydrophobicContact CG2-CG 3.93Å; V54-L319 HydrophobicContact CG2-CD2 4.05Å
55	Q	89.8	Confident	84.3	Confident	101 Å²	101	59.3 Å²	59.3	47%	0.472	31%	0.306	S	S	.	.	H	α-helix	trans	-64.6	-38.6	179.1	-173.5	173.2	-7.1	0	0	112.1	R51 Q53 S59	R51-Q55 WeakPolarHBondContact O-CB 3.37Å; R51-Q55 PolarHBondContact O-N 3.45Å; Q53-Q55 PolarHBondContact O-N 3.39Å; Q55-S59 WeakPolarHBondContact O-CB 3.35Å; Q55-S59 PolarHBondContact O-N 2.92Å; Q55-S59 PolarHBondContact O-OG 3.49Å
56	A	87.4	Confident	83.2	Confident	41 Å²	41	62.7 Å²	62.7	34%	0.339	33%	0.329	S	S	.	.	H	α-helix	trans	-67.3	-37.2	173.4	0	0	0	0	0	112.4	L52 Q53 V54 S59 R60	L52-A56 WeakPolarHBondContact O-CB 3.38Å; L52-A56 PolarHBondContact O-N 3.1Å; Q53-A56 PolarHBondContact O-N 2.96Å; V54-A56 VanDerWaalsContact C-N 3.34Å; V54-A56 PolarHBondContact O-N 2.97Å; A56-S59 PolarHBondContact O-OG 3.48Å; A56-R60 WeakPolarHBondContact O-CG 3.47Å; A56-R60 PolarHBondContact O-N 3.47Å; A56-R60 VanDerWaalsContact O-N 3.16Å; A56-R60 PolarHBondContact O-NE 2.85Å
57	A	86.9	Confident	82	Confident	1 Å²	1	71 Å²	71	1%	0.008	36%	0.356	C	S	.	.	H	α-helix	trans	-68	-41.6	175.5	0	0	0	0	0	112.1	Q53 V54 T61 L319 D320 I323	Q53-A57 PolarHBondContact O-N 3.14Å; V54-A57 PolarHBondContact O-N 3.15Å; A57-T61 WeakPolarHBondContact O-CB 3.35Å; A57-T61 PolarHBondContact O-N 3.02Å; A57-T61 PolarHBondContact O-OG1 3.3Å; A57-L319 HydrophobicContact CB-CD2 4.29Å; A57-L319 HydrophobicContact CB-CG 4.37Å; A57-D320 HydrophobicContact CB-CB 4.13Å; A57-I323 HydrophobicContact CB-CD1 3.64Å
58	L	88.8	Confident	80.5	Confident	13 Å²	13	69.8 Å²	69.8	7%	0.068	35%	0.353	C	S	.	.	H	α-helix	trans	-64.9	-41.1	175.4	-76.3	167.9	0	0	0	112.4	A42 L44 V54 T61 A62 F123 I323	A42-L58 HydrophobicContact CB-CD1 4.14Å; L44-L58 HydrophobicContact CD2-CD1 3.54Å; V54-L58 HydrophobicContact CG1-CD1 3.85Å; V54-L58 HydrophobicContact CG1-CG 4.35Å; V54-L58 WeakPolarHBondContact O-CB 3.35Å; V54-L58 WeakPolarHBondContact O-CG 3.46Å; V54-L58 PolarHBondContact O-N 2.93Å; L58-T61 PolarHBondContact O-N 2.95Å; L58-A62 WeakPolarHBondContact O-CB 3.35Å; L58-A62 PolarHBondContact O-N 3.5Å; L58-F123 HydrophobicContact CD1-CE2 4.37Å; L58-I323 HydrophobicContact CD2-CD1 4.33Å; L58-I323 HydrophobicContact CD2-CG2 3.86Å; L58-I323 HydrophobicContact CG-CD1 4.27Å
59	S	86.6	Confident	78.9	Confident	71 Å²	71	69.6 Å²	69.6	50%	0.497	35%	0.352	S	S	.	.	H	α-helix	trans	-66.8	-40.6	178.5	67.9	0	0	0	0	112.2	Q55 A56 T61 A62 A63	Q55-S59 WeakPolarHBondContact O-CB 3.35Å; Q55-S59 PolarHBondContact O-N 2.92Å; Q55-S59 PolarHBondContact O-OG 3.49Å; A56-S59 PolarHBondContact O-OG 3.48Å; S59-T61 VanDerWaalsContact C-N 3.3Å; S59-T61 PolarHBondContact O-N 3.44Å; S59-A62 PolarHBondContact O-N 2.87Å; S59-A63 WeakPolarHBondContact O-CB 3.34Å; S59-A63 PolarHBondContact O-N 3.32Å
60	R	85.8	Confident	77.1	Confident	135 Å²	135	69.6 Å²	69.6	51%	0.509	36%	0.357	S	S	.	.	H	α-helix	trans	-61.4	-38.6	172.4	-75	-174.9	-70.7	-153.6	3.9	112.1	A56 A64	A56-R60 WeakPolarHBondContact O-CG 3.47Å; A56-R60 PolarHBondContact O-N 3.47Å; A56-R60 VanDerWaalsContact O-N 3.16Å; A56-R60 PolarHBondContact O-NE 2.85Å; R60-A64 PolarHBondContact O-N 3.01Å; R60-A64 VanDerWaalsContact O-N 3.1Å
61	T	83.5	Confident	75	Confident	0 Å²	0	75.7 Å²	75.7	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-68.6	-45.9	177	-59	0	0	0	0	111.8	A57 L58 S59 A63 A64 L65 I323 R324 L327	A57-T61 WeakPolarHBondContact O-CB 3.35Å; A57-T61 PolarHBondContact O-N 3.02Å; A57-T61 PolarHBondContact O-OG1 3.3Å; L58-T61 PolarHBondContact O-N 2.95Å; S59-T61 VanDerWaalsContact C-N 3.3Å; S59-T61 PolarHBondContact O-N 3.44Å; T61-A63 VanDerWaalsContact C-N 3.32Å; T61-A63 PolarHBondContact O-N 2.91Å; T61-A64 PolarHBondContact O-N 3.49Å; T61-L65 HydrophobicContact CG2-CD1 4.14Å; T61-L65 WeakPolarHBondContact O-CG 3.21Å; T61-L65 PolarHBondContact O-N 3.31Å; T61-I323 HydrophobicContact CG2-CG2 4.13Å; T61-R324 HydrophobicContact CG2-CG 3.51Å; T61-L327 HydrophobicContact CG2-CD1 3.74Å
62	A	81.4	Confident	72.6	Confident	43 Å²	43	81.8 Å²	81.8	36%	0.355	41%	0.413	S	S	.	.	H	α-helix	trans	-61.1	-39.8	175.7	0	0	0	0	0	112.2	L58 S59 L65 S66 L91	L58-A62 WeakPolarHBondContact O-CB 3.35Å; L58-A62 PolarHBondContact O-N 3.5Å; S59-A62 PolarHBondContact O-N 2.87Å; A62-L65 PolarHBondContact O-N 3.3Å; A62-S66 WeakPolarHBondContact O-CB 3.42Å; A62-S66 PolarHBondContact O-N 3.44Å; A62-L91 HydrophobicContact CB-CD1 4.34Å
63	A	78	Confident	70.2	Confident	43 Å²	43	84.8 Å²	84.8	36%	0.355	42%	0.424	S	S	.	.	H	α-helix	trans	-63.4	-40.2	175.2	0	0	0	0	0	112.3	S59 T61 S66 R67	S59-A63 WeakPolarHBondContact O-CB 3.34Å; S59-A63 PolarHBondContact O-N 3.32Å; T61-A63 VanDerWaalsContact C-N 3.32Å; T61-A63 PolarHBondContact O-N 2.91Å; A63-S66 PolarHBondContact O-N 3.28Å; A63-S66 PolarHBondContact O-OG 3.43Å; A63-R67 PolarHBondContact O-N 2.95Å; A63-R67 VanDerWaalsContact O-N 3.14Å
64	A	72.4	Confident	67.5	Low	19 Å²	19	86.4 Å²	86.4	16%	0.157	44%	0.436	C	S	.	.	H	α-helix	trans	-66.1	-46.4	176	0	0	0	0	0	112.3	R60 T61 S66 R67 D68 R324	R60-A64 PolarHBondContact O-N 3.01Å; R60-A64 VanDerWaalsContact O-N 3.1Å; T61-A64 PolarHBondContact O-N 3.49Å; A64-S66 PolarHBondContact O-N 3.34Å; A64-R67 PolarHBondContact O-N 3.17Å; A64-D68 PolarHBondContact O-N 3.24Å; A64-R324 VanDerWaalsContact CB-CZ 3.4Å
65	L	70.4	Confident	65.2	Low	73 Å²	73	92 Å²	92	38%	0.382	47%	0.472	S	S	.	.	H	α-helix	trans	-59.4	-30	174.7	-69.9	169.1	0	0	0	112.6	T61 A62 L91 L327	T61-L65 HydrophobicContact CG2-CD1 4.14Å; T61-L65 WeakPolarHBondContact O-CG 3.21Å; T61-L65 PolarHBondContact O-N 3.31Å; A62-L65 PolarHBondContact O-N 3.3Å; L65-L91 HydrophobicContact CD1-CD1 4.41Å; L65-L327 HydrophobicContact CD1-CD1 4.13Å
66	S	64.9	Low	62.5	Low	74 Å²	74	92.1 Å²	92.1	52%	0.517	48%	0.476	S	S	.	.	H	α-helix	trans	-77.1	-29.3	175.8	77.8	0	0	0	0	114	A62 A63 A64 R69	A62-S66 WeakPolarHBondContact O-CB 3.42Å; A62-S66 PolarHBondContact O-N 3.44Å; A63-S66 PolarHBondContact O-N 3.28Å; A63-S66 PolarHBondContact O-OG 3.43Å; A64-S66 PolarHBondContact O-N 3.34Å; S66-R69 WeakPolarHBondContact O-CB 3.47Å; S66-R69 PolarHBondContact O-N 3.4Å
67	R	58.4	Low	60.1	Low	196 Å²	196	95.9 Å²	95.9	74%	0.74	50%	0.497	S	S	*	.	H	α-helix	trans	-72.9	-35.3	176.4	-78.1	-174.9	-160.9	173.1	5.4	112.1	A63 A64 R69 N70	A63-R67 PolarHBondContact O-N 2.95Å; A63-R67 VanDerWaalsContact O-N 3.14Å; A64-R67 PolarHBondContact O-N 3.17Å; R67-R69 PolarHBondContact O-N 3.27Å; R67-N70 PolarHBondContact O-N 3.35Å; R67-N70 VanDerWaalsContact O-N 3.16Å
68	D	52.6	Low	57.8	Low	77 Å²	77	104.1 Å²	104.1	41%	0.412	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-6.9	174.3	-78.8	-23.1	0	0	0	113.4	A64	A64-D68 PolarHBondContact O-N 3.24Å
69	R	49.7	Very low	56	Low	190 Å²	190	111 Å²	111	72%	0.717	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	-18.4	176.7	-152.2	178	179.6	-170.6	0.3	114.1	S66 R67	S66-R69 WeakPolarHBondContact O-CB 3.47Å; S66-R69 PolarHBondContact O-N 3.4Å; R67-R69 PolarHBondContact O-N 3.27Å
70	N	46.1	Very low	54.1	Low	146 Å²	146	112.1 Å²	112.1	78%	0.781	56%	0.564	S	S	*	*			trans	-107.6	93.3	-179.6	-94.8	5.9	0	0	0	110.2	R67	R67-N70 PolarHBondContact O-N 3.35Å; R67-N70 VanDerWaalsContact O-N 3.16Å
71	W	39.5	Very low	52.6	Low	136 Å²	136	110.1 Å²	110.1	52%	0.515	56%	0.563	S	S	.	*			trans	-137.1	121.3	164.8	-89.1	114.6	0	0	0	111.9	Q73 D74	W71-Q73 VanDerWaalsContact CE3-C 3.49Å; W71-Q73 HydrophobicContact CZ3-CB 4.42Å; W71-Q73 VanDerWaalsContact CZ3-O 3.24Å; W71-Q73 WeakPolarHBondContact CZ3-O 3.23Å; W71-D74 HydrophobicContact CE3-CB 4.34Å; W71-D74 HydrophobicContact CH2-CB 3.65Å; W71-D74 HydrophobicContact CZ2-CB 4.5Å; W71-D74 HydrophobicContact CZ3-CB 3.59Å; W71-D74 VanDerWaalsContact CZ3-N 3.32Å
72	D	37.5	Very low	51.8	Low	160 Å²	160	114.1 Å²	114.1	86%	0.856	58%	0.581	S	S	*	*	S	Bend	trans	-134.5	23.8	161.1	-137.6	3.7	0	0	0	110.7
73	Q	37.6	Very low	51.3	Low	168 Å²	168	112.7 Å²	112.7	79%	0.785	57%	0.567	S	S	*	*	S	Bend	trans	-164.9	37.8	-167.9	-122.6	161.8	72.2	0	0	119.1	W71	W71-Q73 VanDerWaalsContact CE3-C 3.49Å; W71-Q73 HydrophobicContact CZ3-CB 4.42Å; W71-Q73 VanDerWaalsContact CZ3-O 3.24Å; W71-Q73 WeakPolarHBondContact CZ3-O 3.23Å
74	D	31.8	Very low	50.7	Low	124 Å²	124	112.3 Å²	112.3	66%	0.663	56%	0.561	S	S	*	*			trans	-171.1	137.1	151.7	-103.4	-31.8	0	0	0	111.6	W71 D76	W71-D74 HydrophobicContact CE3-CB 4.34Å; W71-D74 HydrophobicContact CH2-CB 3.65Å; W71-D74 HydrophobicContact CZ2-CB 4.5Å; W71-D74 HydrophobicContact CZ3-CB 3.59Å; W71-D74 VanDerWaalsContact CZ3-N 3.32Å; D74-D76 PolarHBondContact O-N 3.24Å
75	P	39.9	Very low	50.5	Low	122 Å²	122	114.9 Å²	114.9	79%	0.792	57%	0.568	S	S	*	*			trans	-94	80.1	178.5	36.4	-28.5	0	0	0	110.2
76	D	33.7	Very low	50.5	Low	103 Å²	103	117.5 Å²	117.5	55%	0.551	58%	0.582	S	S	*	*			trans	-96	114.1	167	-133.9	2.8	0	0	0	108.4	D74 E78 R79	D74-D76 PolarHBondContact O-N 3.24Å; D76-E78 PolarHBondContact O-N 3.15Å; D76-R79 IonicContact OD2-NH2 3.26Å
77	P	36.4	Very low	51	Low	119 Å²	119	114.2 Å²	114.2	77%	0.773	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	5	-163.4	26.2	-33.4	0	0	0	116.3
78	E	39.4	Very low	52	Low	175 Å²	175	107 Å²	107	82%	0.818	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.2	0.8	-175.6	-67.7	-159.8	153.8	0	0	115.6	D76	D76-E78 PolarHBondContact O-N 3.15Å
79	R	50.1	Low	53.5	Low	156 Å²	156	105.5 Å²	105.5	59%	0.589	53%	0.531	S	S	*	.			trans	-113.1	91.7	-173.9	-61.4	-174.3	-165.7	178.9	11.2	111.8	D76	D76-R79 IonicContact OD2-NH2 3.26Å
80	V	47.2	Very low	55.1	Low	96 Å²	96	100.4 Å²	100.4	58%	0.582	52%	0.516	S	S	*	.			trans	-121.1	130.1	-178.7	-174.6	0	0	0	0	109.8	F82	V80-F82 WeakPolarHBondContact O-CD2 3.43Å; V80-F82 WeakPolarHBondContact O-CE2 3.44Å; V80-F82 WeakPolarHBondContact O-CG 3.42Å; V80-F82 PolarHBondContact O-N 3.27Å
81	N	55.1	Low	57	Low	92 Å²	92	95.4 Å²	95.4	49%	0.492	49%	0.489	S	S	.	.			trans	-53	104.9	163.2	-92.1	-21.8	0	0	0	108.7	L83	N81-L83 PolarHBondContact O-N 3.42Å; N81-L83 VanDerWaalsContact O-N 3.16Å
82	F	65.2	Low	59.2	Low	85 Å²	85	89.5 Å²	89.5	37%	0.373	47%	0.468	S	S	.	.			trans	-69.8	-12.5	-170.2	-60.9	-74.1	0	0	0	114	V80 Q328 R332 A335	V80-F82 WeakPolarHBondContact O-CD2 3.43Å; V80-F82 WeakPolarHBondContact O-CE2 3.44Å; V80-F82 WeakPolarHBondContact O-CG 3.42Å; V80-F82 PolarHBondContact O-N 3.27Å; F82-Q328 HydrophobicContact CD2-CG 4.42Å; F82-Q328 HydrophobicContact CE2-CG 4.29Å; F82-R332 HydrophobicContact CD1-CG 4.47Å; F82-A335 WeakPolarHBondContact O-CB 3.24Å
83	L	72.1	Confident	61.5	Low	13 Å²	13	84.4 Å²	84.4	7%	0.068	45%	0.445	C	S	.	.	S	Bend	trans	-90.7	135.2	179.6	-69.6	173	0	0	0	111.7	V38 N81 L87 V89 T331 V334	V38-L83 HydrophobicContact CB-CD1 4.18Å; V38-L83 HydrophobicContact CG2-CD1 3.92Å; V38-L83 HydrophobicContact CG2-CD2 4.45Å; N81-L83 PolarHBondContact O-N 3.42Å; N81-L83 VanDerWaalsContact O-N 3.16Å; L83-L87 HydrophobicContact CB-CB 4.09Å; L83-L87 HydrophobicContact CD1-CB 4.17Å; L83-V89 HydrophobicContact CD1-CG2 3.61Å; L83-T331 HydrophobicContact CD1-CG2 4.4Å; L83-T331 HydrophobicContact CG-CG2 4.4Å; L83-V334 HydrophobicContact CD2-CB 4.19Å; L83-V334 HydrophobicContact CD2-CG1 3.92Å
84	P	65.4	Low	63.7	Low	35 Å²	35	80.5 Å²	80.5	23%	0.227	42%	0.423	C	S	.	.	G	3₁₀ helix	trans	-67.8	160.4	174.6	27.3	-31.2	0	0	0	111.6	N86 L87 T338	P84-N86 VanDerWaalsContact C-N 3.33Å; P84-N86 PolarHBondContact O-N 2.92Å; P84-L87 WeakPolarHBondContact O-CD1 3.16Å; P84-L87 WeakPolarHBondContact O-CG 3.48Å; P84-T338 WeakPolarHBondContact CG-OG1 3.35Å
85	Y	68.3	Low	66.1	Low	73 Å²	73	79.6 Å²	79.6	29%	0.286	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	64.7	23.4	176.4	-43.2	-71	0	0	0	116.4	Q26 P27 L31 L87	Q26-Y85 HydrophobicContact CG-CE1 4.29Å; P27-Y85 HydrophobicContact CG-CE2 4.42Å; L31-Y85 HydrophobicContact CD1-CG 4.45Å; Y85-L87 PolarHBondContact O-N 2.65Å
86	N	69.8	Low	68.1	Low	128 Å²	128	74.5 Å²	74.5	68%	0.684	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	58.1	32.8	179.8	-156.1	17	0	0	0	113.1	P84	P84-N86 VanDerWaalsContact C-N 3.33Å; P84-N86 PolarHBondContact O-N 2.92Å
87	L	75.5	Confident	70.1	Confident	4 Å²	4	73.9 Å²	73.9	2%	0.021	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-71.7	134.8	174.4	-69.3	170.4	0	0	0	110.1	L31 I34 V38 L83 P84 Y85 L346	L31-L87 HydrophobicContact CD2-CD1 4.4Å; L31-L87 HydrophobicContact CD2-CD2 3.78Å; L31-L87 HydrophobicContact CD2-CG 4.3Å; I34-L87 HydrophobicContact CD1-CD2 4.25Å; V38-L87 HydrophobicContact CG2-CB 4.43Å; V38-L87 HydrophobicContact CG2-CD1 4.25Å; L83-L87 HydrophobicContact CB-CB 4.09Å; L83-L87 HydrophobicContact CD1-CB 4.17Å; P84-L87 WeakPolarHBondContact O-CD1 3.16Å; P84-L87 WeakPolarHBondContact O-CG 3.48Å; Y85-L87 PolarHBondContact O-N 2.65Å; L87-L346 HydrophobicContact CD1-CD1 4.12Å; L87-L346 HydrophobicContact CD1-CD2 3.75Å
88	S	79.9	Confident	72.1	Confident	46 Å²	46	70.3 Å²	70.3	32%	0.322	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	161.3	173.9	60.3	0	0	0	0	111.7	H36 A37 V38	H36-S88 PolarHBondContact O-N 3.14Å; H36-S88 PolarHBondContact O-OG 3.31Å; A37-S88 CarbonylContact C-O 3.59Å; A37-S88 WeakPolarHBondContact CA-O 3.41Å; A37-S88 WeakPolarHBondContact CB-OG 3.42Å; V38-S88 PolarHBondContact N-O 2.99Å
89	V	82.4	Confident	73.8	Confident	44 Å²	44	64.3 Å²	64.3	27%	0.267	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	125.6	172.7	-178.8	0	0	0	0	109	V38 V40 L83 T331	V38-V89 WeakPolarHBondContact O-CA 3.43Å; V40-V89 HydrophobicContact CG2-CG1 4.11Å; L83-V89 HydrophobicContact CD1-CG2 3.61Å; V89-T331 HydrophobicContact CG2-CG2 3.5Å
90	E	85.1	Confident	75.3	Confident	84 Å²	84	59.4 Å²	59.4	39%	0.393	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	119	175.9	-174.5	-176	-172.1	0	0	109.9	A37 V38 R39 V40	A37-E90 HydrophobicContact CB-CB 4.15Å; V38-E90 PolarHBondContact O-N 3.34Å; R39-E90 WeakPolarHBondContact CA-O 3.49Å; R39-E90 HydrophobicContact CG-CB 4.11Å; R39-E90 HydrophobicContact CG-CG 4.5Å; R39-E90 WeakPolarHBondContact CG-OE2 3.25Å; R39-E90 IonicContact CZ-OE2 3.63Å; R39-E90 IonicContact NE-OE2 3.92Å; R39-E90 PolarHBondContact NE-OE2 2.88Å; R39-E90 IonicContact NH2-OE2 3.26Å; V40-E90 PolarHBondContact N-O 3.4Å
91	L	86	Confident	77	Confident	41 Å²	41	58.2 Å²	58.2	22%	0.215	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	121.2	177.9	-78.8	162.2	0	0	0	111	V40 A62 L65 L327	V40-L91 HydrophobicContact CB-CD2 4.28Å; V40-L91 HydrophobicContact CG1-CD2 4.4Å; V40-L91 WeakPolarHBondContact O-CA 3.43Å; A62-L91 HydrophobicContact CB-CD1 4.34Å; L65-L91 HydrophobicContact CD1-CD1 4.41Å; L91-L327 HydrophobicContact CD1-CD1 4.09Å; L91-L327 HydrophobicContact CD2-CD1 4.16Å; L91-L327 HydrophobicContact CD2-CD2 3.81Å
92	V	85.7	Confident	78.4	Confident	11 Å²	11	59.2 Å²	59.2	7%	0.067	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	90	177.7	-174.1	0	0	0	0	109.5	R39 V40 G41 A42	R39-V92 HydrophobicContact CB-CG2 4.42Å; R39-V92 HydrophobicContact CG-CG2 4.43Å; V40-V92 PolarHBondContact O-N 3.36Å; G41-V92 CarbonylContact C-O 3.59Å; G41-V92 WeakPolarHBondContact CA-O 2.94Å; A42-V92 PolarHBondContact N-O 3.32Å
93	S	84.8	Confident	79.3	Confident	53 Å²	53	56 Å²	56	37%	0.371	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	139.2	177.1	61.6	0	0	0	0	112.5	A42	A42-S93 WeakPolarHBondContact O-CA 3.45Å
94	R	84.7	Confident	79.9	Confident	86 Å²	86	55.9 Å²	55.9	33%	0.325	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	137.9	177.4	-66.9	-66.2	177.1	-112.9	8.4	111.6	A42 L44 R111 V112	A42-R94 PolarHBondContact O-N 3.2Å; L44-R94 WeakPolarHBondContact CB-O 3.38Å; L44-R94 PolarHBondContact N-O 3.05Å; R94-R111 HydrophobicContact CG-CB 3.97Å; R94-R111 PolarHBondContact NE-O 3.12Å; R94-V112 HydrophobicContact CB-CG2 4.06Å; R94-V112 HydrophobicContact CG-CG2 3.87Å
95	Q	82.4	Confident	80.7	Confident	106 Å²	106	58.5 Å²	58.5	50%	0.495	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	133.7	-179.4	-175.7	175.7	-5.9	0	0	111.2
96	L	80.4	Confident	81.4	Confident	14 Å²	14	60.8 Å²	60.8	7%	0.073	34%	0.339	C	S	.	.			trans	-82.8	136.3	173.5	-160.2	64.7	0	0	0	111.3	L44 A46 R51 A98 S103 L104 C107	L44-L96 WeakPolarHBondContact O-CB 3.4Å; A46-L96 HydrophobicContact CB-CD2 4.27Å; R51-L96 PolarHBondContact NH2-O 2.71Å; R51-L96 VanDerWaalsContact NH2-O 3.09Å; L96-A98 VanDerWaalsContact CD2-O 3.31Å; L96-A98 WeakPolarHBondContact CD2-O 3.34Å; L96-A98 VanDerWaalsContact CG-O 3.27Å; L96-A98 WeakPolarHBondContact CG-O 3.44Å; L96-S103 WeakPolarHBondContact CD1-O 3.47Å; L96-L104 HydrophobicContact CD1-CB 4.19Å; L96-C107 HydrophobicContact CD1-CB 3.92Å
97	A	76.1	Confident	82.1	Confident	91 Å²	91	55 Å²	55	75%	0.752	31%	0.308	S	S	*	.	S	Bend	trans	-75.2	-43.8	-177.8	0	0	0	0	0	112.4
98	A	78.4	Confident	82.3	Confident	44 Å²	44	55 Å²	55	36%	0.364	31%	0.309	S	S	.	.	S	Bend	trans	-152.3	164.3	174.3	0	0	0	0	0	110.2	L96 D100 S103	L96-A98 VanDerWaalsContact CD2-O 3.31Å; L96-A98 WeakPolarHBondContact CD2-O 3.34Å; L96-A98 VanDerWaalsContact CG-O 3.27Å; L96-A98 WeakPolarHBondContact CG-O 3.44Å; A98-D100 WeakPolarHBondContact CB-OD1 3.28Å; A98-D100 PolarHBondContact O-N 3.03Å; A98-D100 VanDerWaalsContact O-N 3.1Å; A98-S103 WeakPolarHBondContact O-CB 3.18Å
99	A	75.3	Confident	82.3	Confident	48 Å²	48	53.9 Å²	53.9	40%	0.397	30%	0.3	S	S	.	.	S	Bend	trans	-77.8	21.2	-178.1	0	0	0	0	0	113.6	A46 E129	A46-A99 HydrophobicContact CB-CB 3.84Å; A99-E129 WeakPolarHBondContact CB-OE1 3.42Å
100	D	82.6	Confident	82	Confident	54 Å²	54	55.9 Å²	55.9	29%	0.289	31%	0.307	S	S	.	.	S	Bend	trans	-90.6	149.8	178.6	67.9	-77.7	0	0	0	111.3	A98 E102 S103 L104	A98-D100 WeakPolarHBondContact CB-OD1 3.28Å; A98-D100 PolarHBondContact O-N 3.03Å; A98-D100 VanDerWaalsContact O-N 3.1Å; D100-E102 PolarHBondContact O-N 2.98Å; D100-E102 WeakPolarHBondContact OD2-CB 3.39Å; D100-E102 PolarHBondContact OD2-N 3.32Å; D100-S103 VanDerWaalsContact CG-OG 3.27Å; D100-S103 PolarHBondContact O-N 2.9Å; D100-S103 WeakPolarHBondContact OD1-CB 3.29Å; D100-S103 PolarHBondContact OD1-OG 3.4Å; D100-S103 PolarHBondContact OD2-N 3.17Å; D100-S103 PolarHBondContact OD2-OG 3.25Å; D100-L104 PolarHBondContact O-N 3.07Å
101	P	82.3	Confident	81.4	Confident	70 Å²	70	58.3 Å²	58.3	46%	0.455	31%	0.313	S	S	.	.	H	α-helix	trans	-62.6	-29.7	-176.2	23.3	-33.6	0	0	0	113.1	L104 I105 Q132	P101-L104 PolarHBondContact O-N 2.87Å; P101-I105 WeakPolarHBondContact O-CD1 3.44Å; P101-I105 VanDerWaalsContact O-CG1 3.28Å; P101-I105 WeakPolarHBondContact O-CG1 3.35Å; P101-I105 PolarHBondContact O-N 3.37Å; P101-Q132 HydrophobicContact CB-CG 4.4Å
102	E	84.3	Confident	80.8	Confident	113 Å²	113	56.6 Å²	56.6	53%	0.528	30%	0.304	S	S	.	.	H	α-helix	trans	-67.9	-46.4	178.9	-172.1	-169.1	143.5	0	0	111	D100 L104 I105 R106	D100-E102 PolarHBondContact O-N 2.98Å; D100-E102 WeakPolarHBondContact OD2-CB 3.39Å; D100-E102 PolarHBondContact OD2-N 3.32Å; E102-L104 VanDerWaalsContact C-N 3.29Å; E102-L104 PolarHBondContact O-N 3.37Å; E102-I105 PolarHBondContact O-N 3.39Å; E102-R106 WeakPolarHBondContact O-CB 3.28Å; E102-R106 PolarHBondContact O-N 3.48Å; E102-R106 IonicContact OE1-CZ 2.61Å; E102-R106 IonicContact OE1-NH1 3.39Å; E102-R106 PolarHBondContact OE1-NH1 3.29Å; E102-R106 IonicContact OE1-NH2 2.64Å; E102-R106 PolarHBondContact OE1-NH2 3.49Å
103	S	84.8	Confident	80.2	Confident	17 Å²	17	56.6 Å²	56.6	12%	0.119	30%	0.303	C	S	.	.	H	α-helix	trans	-58.2	-40.3	173.3	-71.4	0	0	0	0	112.4	L96 A98 D100 C107	L96-S103 WeakPolarHBondContact CD1-O 3.47Å; A98-S103 WeakPolarHBondContact O-CB 3.18Å; D100-S103 VanDerWaalsContact CG-OG 3.27Å; D100-S103 PolarHBondContact O-N 2.9Å; D100-S103 WeakPolarHBondContact OD1-CB 3.29Å; D100-S103 PolarHBondContact OD1-OG 3.4Å; D100-S103 PolarHBondContact OD2-N 3.17Å; D100-S103 PolarHBondContact OD2-OG 3.25Å; S103-C107 WeakPolarHBondContact O-CB 3.49Å; S103-C107 PolarHBondContact O-N 2.95Å
104	L	83.6	Confident	79.6	Confident	12 Å²	12	61.1 Å²	61.1	6%	0.063	32%	0.319	C	S	.	.	H	α-helix	trans	-67.4	-48.1	180	-174.7	139.8	0	0	0	112.1	L96 D100 P101 E102 C107 A108 Q132 V133 L136	L96-L104 HydrophobicContact CD1-CB 4.19Å; D100-L104 PolarHBondContact O-N 3.07Å; P101-L104 PolarHBondContact O-N 2.87Å; E102-L104 VanDerWaalsContact C-N 3.29Å; E102-L104 PolarHBondContact O-N 3.37Å; L104-C107 PolarHBondContact O-N 2.94Å; L104-A108 WeakPolarHBondContact O-CB 3.47Å; L104-A108 PolarHBondContact O-N 2.85Å; L104-Q132 HydrophobicContact CD1-CB 4.36Å; L104-Q132 HydrophobicContact CD2-CB 4.45Å; L104-V133 HydrophobicContact CD1-CG2 4.1Å; L104-L136 HydrophobicContact CD2-CB 4.1Å; L104-L136 HydrophobicContact CD2-CD1 4.26Å; L104-L136 HydrophobicContact CD2-CD2 3.65Å; L104-L136 HydrophobicContact CD2-CG 4.19Å
105	I	82.2	Confident	79.1	Confident	90 Å²	90	63.4 Å²	63.4	46%	0.462	33%	0.327	S	S	.	.	H	α-helix	trans	-64.3	-46.2	176.9	-66.4	165	0	0	0	110.6	P101 E102 C107 A108 C109 L136	P101-I105 WeakPolarHBondContact O-CD1 3.44Å; P101-I105 VanDerWaalsContact O-CG1 3.28Å; P101-I105 WeakPolarHBondContact O-CG1 3.35Å; P101-I105 PolarHBondContact O-N 3.37Å; E102-I105 PolarHBondContact O-N 3.39Å; I105-C107 VanDerWaalsContact C-N 3.34Å; I105-C107 PolarHBondContact O-N 3.08Å; I105-A108 PolarHBondContact O-N 2.76Å; I105-C109 VanDerWaalsContact O-CB 3.27Å; I105-C109 WeakPolarHBondContact O-CB 2.99Å; I105-C109 PolarHBondContact O-N 2.88Å; I105-C109 PolarHBondContact O-SG 3.31Å; I105-L136 HydrophobicContact CG1-CD1 4.14Å
106	R	83.8	Confident	78.8	Confident	121 Å²	121	58.3 Å²	58.3	46%	0.457	30%	0.304	S	S	.	.	H	α-helix	trans	-60.2	-43.6	178.9	-173.7	-179	-76.7	130.2	-2.1	111.5	E102 Q110	E102-R106 WeakPolarHBondContact O-CB 3.28Å; E102-R106 PolarHBondContact O-N 3.48Å; E102-R106 IonicContact OE1-CZ 2.61Å; E102-R106 IonicContact OE1-NH1 3.39Å; E102-R106 PolarHBondContact OE1-NH1 3.29Å; E102-R106 IonicContact OE1-NH2 2.64Å; E102-R106 PolarHBondContact OE1-NH2 3.49Å; R106-Q110 VanDerWaalsContact CG-OE1 3.23Å; R106-Q110 WeakPolarHBondContact O-CB 3.3Å; R106-Q110 PolarHBondContact O-N 2.81Å
107	C	83.3	Confident	78.9	Confident	7 Å²	7	57.8 Å²	57.8	5%	0.047	30%	0.301	C	S	.	.	H	α-helix	trans	-66.4	-46.3	178	-168.8	0	0	0	0	111.9	L96 S103 L104 I105 R111 V112	L96-C107 HydrophobicContact CD1-CB 3.92Å; S103-C107 WeakPolarHBondContact O-CB 3.49Å; S103-C107 PolarHBondContact O-N 2.95Å; L104-C107 PolarHBondContact O-N 2.94Å; I105-C107 VanDerWaalsContact C-N 3.34Å; I105-C107 PolarHBondContact O-N 3.08Å; C107-R111 WeakPolarHBondContact O-CA 3.39Å; C107-R111 VanDerWaalsContact O-CB 3.31Å; C107-R111 WeakPolarHBondContact O-CB 3.33Å; C107-R111 PolarHBondContact O-N 2.03Å; C107-R111 VanDerWaalsContact O-N 3.08Å; C107-V112 PolarHBondContact O-N 2.88Å
108	A	80.4	Confident	79.2	Confident	4 Å²	4	54.1 Å²	54.1	3%	0.033	27%	0.269	C	S	.	.	I	π-helix	trans	-61.4	-48.8	178.4	0	0	0	0	0	111.8	L104 I105 V112 L113 L136 L140	L104-A108 WeakPolarHBondContact O-CB 3.47Å; L104-A108 PolarHBondContact O-N 2.85Å; I105-A108 PolarHBondContact O-N 2.76Å; A108-V112 WeakPolarHBondContact O-CB 3.21Å; A108-V112 PolarHBondContact O-N 3.41Å; A108-L113 WeakPolarHBondContact O-CG 3.13Å; A108-L113 PolarHBondContact O-N 2.94Å; A108-L136 HydrophobicContact CB-CD1 4.09Å; A108-L136 HydrophobicContact CB-CD2 3.61Å; A108-L136 HydrophobicContact CB-CG 4.4Å; A108-L140 HydrophobicContact CB-CD1 4.27Å
109	C	79.2	Confident	79.6	Confident	21 Å²	21	52.1 Å²	52.1	14%	0.142	25%	0.253	C	S	.	.	I	π-helix	trans	-71.9	-51.4	-176.2	-73.8	0	0	0	0	113.8	I105 C353	I105-C109 VanDerWaalsContact O-CB 3.27Å; I105-C109 WeakPolarHBondContact O-CB 2.99Å; I105-C109 PolarHBondContact O-N 2.88Å; I105-C109 PolarHBondContact O-SG 3.31Å; C109-C353 WeakPolarHBondContact CA-SG 3.21Å; C109-C353 HydrophobicContact CB-CB 3.74Å; C109-C353 WeakPolarHBondContact CB-SG 3.27Å; C109-C353 WeakPolarHBondContact SG-CB 2.93Å; C109-C353 CovalentContact SG-SG 2.03Å; C109-C353 PolarHBondContact SG-SG 3.47Å
110	Q	77.4	Confident	80.3	Confident	86 Å²	86	50.2 Å²	50.2	40%	0.402	24%	0.238	S	C	.	.	I	π-helix	trans	-88	-18.6	-171.9	-62.4	179.1	-19.1	0	0	113.5	R106 E114	R106-Q110 VanDerWaalsContact CG-OE1 3.23Å; R106-Q110 WeakPolarHBondContact O-CB 3.3Å; R106-Q110 PolarHBondContact O-N 2.81Å; Q110-E114 VanDerWaalsContact O-OE2 3.1Å
111	R	71.2	Confident	80.8	Confident	136 Å²	136	47.7 Å²	47.7	51%	0.513	22%	0.224	S	C	.	.	I	π-helix	trans	-121.8	-24.2	-171.2	-58.5	-175.9	174.8	176.4	-2.3	115.1	R94 C107	R94-R111 HydrophobicContact CG-CB 3.97Å; R94-R111 PolarHBondContact NE-O 3.12Å; C107-R111 WeakPolarHBondContact O-CA 3.39Å; C107-R111 VanDerWaalsContact O-CB 3.31Å; C107-R111 WeakPolarHBondContact O-CB 3.33Å; C107-R111 PolarHBondContact O-N 2.03Å; C107-R111 VanDerWaalsContact O-N 3.08Å
112	V	74.3	Confident	81.2	Confident	5 Å²	5	44.4 Å²	44.4	3%	0.03	20%	0.203	C	C	.	.	I	π-helix	trans	-105.3	-50.5	-179.3	-178.5	0	0	0	0	110.9	L43 R94 C107 A108 R115 V117	L43-V112 HydrophobicContact CD2-CG2 3.86Å; R94-V112 HydrophobicContact CB-CG2 4.06Å; R94-V112 HydrophobicContact CG-CG2 3.87Å; C107-V112 PolarHBondContact O-N 2.88Å; A108-V112 WeakPolarHBondContact O-CB 3.21Å; A108-V112 PolarHBondContact O-N 3.41Å; V112-R115 PolarHBondContact O-N 3.38Å; V112-V117 HydrophobicContact CG1-CB 4.46Å; V112-V117 HydrophobicContact CG1-CG2 4.03Å; V112-V117 VanDerWaalsContact O-CG2 3.23Å; V112-V117 WeakPolarHBondContact O-CG2 3.32Å
113	L	73.6	Confident	81.6	Confident	11 Å²	11	39.4 Å²	39.4	6%	0.058	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-72.4	-35.2	-177.2	-70.7	177.8	0	0	0	114.4	A108 R115 G116 L140 V142 C353	A108-L113 WeakPolarHBondContact O-CG 3.13Å; A108-L113 PolarHBondContact O-N 2.94Å; L113-R115 PolarHBondContact O-N 3.01Å; L113-G116 PolarHBondContact O-N 2.82Å; L113-L140 HydrophobicContact CD1-CB 4.48Å; L113-L140 HydrophobicContact CD1-CD1 3.61Å; L113-L140 HydrophobicContact CD1-CD2 3.73Å; L113-L140 HydrophobicContact CD1-CG 4.14Å; L113-L140 HydrophobicContact CG-CD1 4.47Å; L113-V142 HydrophobicContact CD2-CG2 3.85Å; L113-C353 VanDerWaalsContact CD1-SG 3.59Å
114	E	71.7	Confident	81.8	Confident	147 Å²	147	39 Å²	39	69%	0.687	18%	0.176	S	C	*	.	G	3₁₀ helix	trans	-56.4	-20.9	175	-73.8	-174.5	-172.8	0	0	113.4	Q110 G116	Q110-E114 VanDerWaalsContact O-OE2 3.1Å; E114-G116 VanDerWaalsContact C-N 3.35Å
115	R	73.8	Confident	81.9	Confident	134 Å²	134	40.5 Å²	40.5	51%	0.506	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-88.2	3	178.2	-69.3	-73.5	177.2	158.5	-3.4	113.9	R39 V112 L113	R39-R115 WeakPolarHBondContact CD-O 3.44Å; R39-R115 PolarHBondContact NH1-O 3.29Å; V112-R115 PolarHBondContact O-N 3.38Å; L113-R115 PolarHBondContact O-N 3.01Å
116	G	76.8	Confident	82	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.175	C	C	.	.			trans	71.2	50.9	174.9	0	0	0	0	0	113	L113 E114 Q348	L113-G116 PolarHBondContact O-N 2.82Å; E114-G116 VanDerWaalsContact C-N 3.35Å; G116-Q348 WeakPolarHBondContact O-CG 3.42Å
117	V	82.6	Confident	82	Confident	2 Å²	2	40.9 Å²	40.9	1%	0.012	19%	0.185	C	C	.	.			trans	-80.6	139.2	-176.7	169.1	0	0	0	0	111.6	R39 V112 A119	R39-V117 HydrophobicContact CB-CG2 4.29Å; R39-V117 WeakPolarHBondContact O-CA 3.3Å; V112-V117 HydrophobicContact CG1-CB 4.46Å; V112-V117 HydrophobicContact CG1-CG2 4.03Å; V112-V117 VanDerWaalsContact O-CG2 3.23Å; V112-V117 WeakPolarHBondContact O-CG2 3.32Å; V117-A119 WeakPolarHBondContact CG1-O 3.29Å
118	S	81.6	Confident	82.1	Confident	14 Å²	14	47.4 Å²	47.4	10%	0.098	22%	0.215	C	C	.	.	S	Bend	trans	-87.7	-31.9	179.7	-51.9	0	0	0	0	113.5	R39	R39-S118 PolarHBondContact O-N 2.72Å
119	A	88.1	Confident	82.4	Confident	3 Å²	3	48.3 Å²	48.3	3%	0.025	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	159.4	174.2	0	0	0	0	0	110	V40 G41 V117 P143 I330	V40-A119 WeakPolarHBondContact CA-O 3.42Å; V40-A119 WeakPolarHBondContact CG1-O 3.45Å; G41-A119 PolarHBondContact N-O 3.45Å; V117-A119 WeakPolarHBondContact CG1-O 3.29Å; A119-P143 CarbonylContact C-O 3.59Å; A119-P143 WeakPolarHBondContact CA-O 3.38Å; A119-P143 HydrophobicContact CB-CB 4.39Å; A119-I330 HydrophobicContact CB-CD1 4Å; A119-I330 HydrophobicContact CB-CG1 4.2Å; A119-I330 HydrophobicContact CB-CG2 3.86Å
120	A	89.5	Confident	82.8	Confident	8 Å²	8	47.3 Å²	47.3	7%	0.066	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	151	179.3	0	0	0	0	0	113.2	G41 P143 V144 V145	G41-A120 CarbonylContact O-C 3.57Å; G41-A120 VanDerWaalsContact O-CA 3.26Å; G41-A120 WeakPolarHBondContact O-CA 3.28Å; A120-P143 PolarHBondContact N-O 3.47Å; A120-V144 HydrophobicContact CB-CG2 4.34Å; A120-V144 CarbonylContact O-C 3.08Å; A120-V144 VanDerWaalsContact O-CA 3.24Å; A120-V144 WeakPolarHBondContact O-CA 3.25Å; A120-V145 PolarHBondContact O-N 2.97Å
121	L	92.8	Very high	83.4	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	139.2	167.9	-59.3	-178.4	0	0	0	109.6	V40 G41 A42 L43 F123 V145 L147 I323 A326 L327 I330	V40-L121 HydrophobicContact CG1-CG 4.36Å; G41-L121 PolarHBondContact O-N 2.87Å; A42-L121 CarbonylContact C-O 3.47Å; A42-L121 WeakPolarHBondContact CA-O 3.11Å; A42-L121 HydrophobicContact CB-CB 4.43Å; L43-L121 PolarHBondContact N-O 3.36Å; L121-F123 HydrophobicContact CB-CE2 4.15Å; L121-F123 HydrophobicContact CB-CZ 4.41Å; L121-V145 WeakPolarHBondContact CA-O 3.29Å; L121-V145 HydrophobicContact CD2-CB 3.88Å; L121-L147 HydrophobicContact CD2-CD1 4.36Å; L121-I323 HydrophobicContact CD1-CG2 4.25Å; L121-A326 HydrophobicContact CD2-CB 4Å; L121-L327 HydrophobicContact CD1-CD2 4.03Å; L121-L327 HydrophobicContact CD1-CG 4.23Å; L121-I330 HydrophobicContact CD2-CD1 3.88Å
122	A	91.3	Very high	84.2	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.008	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	149.3	174.6	0	0	0	0	0	110.9	P124 V133 V144 V145 S146 L147	A122-P124 VanDerWaalsContact C-CD 3.49Å; A122-P124 WeakPolarHBondContact O-CD 3.29Å; A122-V133 HydrophobicContact CB-CG1 3.82Å; A122-V133 HydrophobicContact CB-CG2 4.16Å; A122-V144 HydrophobicContact CB-CG1 3.8Å; A122-V145 PolarHBondContact N-O 3.18Å; A122-S146 CarbonylContact O-C 3.55Å; A122-S146 VanDerWaalsContact O-CA 3.29Å; A122-S146 WeakPolarHBondContact O-CA 3.21Å; A122-L147 PolarHBondContact O-N 3.48Å
123	F	91.4	Very high	84.9	Confident	9 Å²	9	42.9 Å²	42.9	4%	0.039	20%	0.199	C	C	.	.			trans	-128.5	66.5	-176.4	-59.8	-89.7	0	0	0	110.9	L43 P45 V54 L58 L121 Q125 L147 I323	L43-F123 WeakPolarHBondContact O-CD2 3.17Å; P45-F123 HydrophobicContact CG-CB 3.92Å; V54-F123 HydrophobicContact CG1-CD1 3.89Å; V54-F123 HydrophobicContact CG1-CD2 3.57Å; V54-F123 HydrophobicContact CG1-CE1 3.86Å; V54-F123 HydrophobicContact CG1-CE2 3.55Å; V54-F123 HydrophobicContact CG1-CG 3.75Å; V54-F123 HydrophobicContact CG1-CZ 3.7Å; V54-F123 HydrophobicContact CG2-CB 4.14Å; V54-F123 HydrophobicContact CG2-CD1 3.82Å; V54-F123 HydrophobicContact CG2-CE1 4.37Å; V54-F123 HydrophobicContact CG2-CG 3.93Å; L58-F123 HydrophobicContact CD1-CE2 4.37Å; L121-F123 HydrophobicContact CB-CE2 4.15Å; L121-F123 HydrophobicContact CB-CZ 4.41Å; F123-Q125 PolarHBondContact O-NE2 2.84Å; F123-L147 HydrophobicContact CD1-CB 3.98Å; F123-L147 HydrophobicContact CD1-CD1 4.47Å; F123-L147 HydrophobicContact CE1-CB 4.07Å; F123-L147 HydrophobicContact CE1-CD1 3.93Å; F123-L147 HydrophobicContact CE1-CD2 4.14Å; F123-L147 HydrophobicContact CE1-CG 4.27Å; F123-L147 HydrophobicContact CZ-CD1 4.25Å; F123-I323 HydrophobicContact CE1-CD1 3.86Å; F123-I323 HydrophobicContact CE1-CG1 3.93Å; F123-I323 HydrophobicContact CZ-CD1 3.9Å; F123-I323 HydrophobicContact CZ-CG1 4.04Å
124	P	89.4	Confident	85.7	Confident	7 Å²	7	43.6 Å²	43.6	5%	0.045	20%	0.203	C	C	.	.			trans	-66.2	137.3	-177.5	27.6	-32.4	0	0	0	111.3	A122 E129 L130 I148	A122-P124 VanDerWaalsContact C-CD 3.49Å; A122-P124 WeakPolarHBondContact O-CD 3.29Å; P124-E129 HydrophobicContact CB-CB 3.91Å; P124-L130 HydrophobicContact CB-CB 4.06Å; P124-L130 HydrophobicContact CB-CD1 4.39Å; P124-L130 HydrophobicContact CG-CB 4.21Å; P124-L130 HydrophobicContact CG-CD1 3.63Å; P124-L130 HydrophobicContact CG-CG 4.48Å; P124-I148 HydrophobicContact CG-CG1 4.49Å
125	Q	85.6	Confident	86.5	Confident	44 Å²	44	42.7 Å²	42.7	21%	0.206	20%	0.202	C	C	.	.			trans	-98.3	-23.2	179.3	-60.8	-57.6	-61.2	0	0	112.8	P45 A50 F123 E129	P45-Q125 HydrophobicContact CB-CG 4.14Å; A50-Q125 HydrophobicContact CB-CG 4.1Å; F123-Q125 PolarHBondContact O-NE2 2.84Å; Q125-E129 PolarHBondContact N-OE2 3.25Å
126	S	83.9	Confident	87.1	Confident	44 Å²	44	37 Å²	37	31%	0.308	18%	0.182	S	C	.	.	S	Bend	trans	-128.6	162.1	-179.3	76.6	0	0	0	0	111.4	E128 E129 L130	S126-E128 PolarHBondContact O-N 3.33Å; S126-E128 PolarHBondContact OG-N 3.5Å; S126-E129 PolarHBondContact O-N 2.86Å; S126-E129 PolarHBondContact OG-N 3.41Å; S126-L130 PolarHBondContact O-N 3.5Å
127	R	84.6	Confident	87.6	Confident	176 Å²	176	37 Å²	37	66%	0.664	18%	0.182	S	C	*	.	H	α-helix	trans	-60.3	-32.2	173.7	-173.5	176	178.6	-177	-0.1	112.3	L130 L131 L154	R127-L130 PolarHBondContact O-N 3.17Å; R127-L131 WeakPolarHBondContact O-CG 3.45Å; R127-L131 PolarHBondContact O-N 2.78Å; R127-L131 VanDerWaalsContact O-N 3.09Å; R127-L154 HydrophobicContact CG-CD2 4.35Å
128	E	85.1	Confident	87.8	Confident	144 Å²	144	39 Å²	39	67%	0.673	20%	0.199	S	C	*	.	H	α-helix	trans	-67.7	-45.2	177.1	-64	-177.6	177	0	0	111.5	S126 L130 L131 Q132	S126-E128 PolarHBondContact O-N 3.33Å; S126-E128 PolarHBondContact OG-N 3.5Å; E128-L130 VanDerWaalsContact C-N 3.3Å; E128-L130 PolarHBondContact O-N 3.49Å; E128-L131 PolarHBondContact O-N 2.78Å; E128-Q132 WeakPolarHBondContact O-CG 3.2Å; E128-Q132 PolarHBondContact O-N 3.01Å
129	E	85.8	Confident	87.9	Confident	23 Å²	23	42 Å²	42	11%	0.107	22%	0.224	C	C	.	.	H	α-helix	trans	-62.2	-39.3	175	-71.1	-179.1	-174	0	0	111.4	A99 P124 Q125 S126 L131 Q132 V133	A99-E129 WeakPolarHBondContact CB-OE1 3.42Å; P124-E129 HydrophobicContact CB-CB 3.91Å; Q125-E129 PolarHBondContact N-OE2 3.25Å; S126-E129 PolarHBondContact O-N 2.86Å; S126-E129 PolarHBondContact OG-N 3.41Å; E129-L131 PolarHBondContact O-N 3.3Å; E129-Q132 PolarHBondContact O-N 3.49Å; E129-V133 WeakPolarHBondContact O-CG2 3.25Å; E129-V133 PolarHBondContact O-N 3.01Å
130	L	88.7	Confident	87.4	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-63	-40.7	177.5	-174.2	61.6	0	0	0	112	P124 S126 R127 E128 V133 D134 I148 L154	P124-L130 HydrophobicContact CB-CB 4.06Å; P124-L130 HydrophobicContact CB-CD1 4.39Å; P124-L130 HydrophobicContact CG-CB 4.21Å; P124-L130 HydrophobicContact CG-CD1 3.63Å; P124-L130 HydrophobicContact CG-CG 4.48Å; S126-L130 PolarHBondContact O-N 3.5Å; R127-L130 PolarHBondContact O-N 3.17Å; E128-L130 VanDerWaalsContact C-N 3.3Å; E128-L130 PolarHBondContact O-N 3.49Å; L130-V133 PolarHBondContact O-N 3.44Å; L130-D134 PolarHBondContact O-N 3.19Å; L130-I148 HydrophobicContact CD1-CD1 3.86Å; L130-I148 HydrophobicContact CD1-CG1 4.15Å; L130-I148 HydrophobicContact CD2-CD1 3.78Å; L130-I148 HydrophobicContact CD2-CG1 4.49Å; L130-L154 HydrophobicContact CB-CD1 4.37Å; L130-L154 HydrophobicContact CD2-CD1 4.14Å; L130-L154 HydrophobicContact CD2-CD2 4.48Å; L130-L154 HydrophobicContact CD2-CG 3.69Å; L130-L154 HydrophobicContact CG-CD1 3.69Å; L130-L154 HydrophobicContact CG-CG 3.84Å
131	L	89.1	Confident	87.1	Confident	89 Å²	89	47.9 Å²	47.9	47%	0.466	25%	0.247	S	C	.	.	H	α-helix	trans	-65	-40	173.9	-75.4	167	0	0	0	112.3	R127 E128 E129 V133 D134 L135 L154	R127-L131 WeakPolarHBondContact O-CG 3.45Å; R127-L131 PolarHBondContact O-N 2.78Å; R127-L131 VanDerWaalsContact O-N 3.09Å; E128-L131 PolarHBondContact O-N 2.78Å; E129-L131 PolarHBondContact O-N 3.3Å; L131-V133 VanDerWaalsContact C-N 3.33Å; L131-D134 PolarHBondContact O-N 2.85Å; L131-L135 PolarHBondContact O-N 3.38Å; L131-L135 VanDerWaalsContact O-N 3.07Å; L131-L154 HydrophobicContact CD2-CD1 3.69Å; L131-L154 HydrophobicContact CD2-CD2 3.81Å; L131-L154 HydrophobicContact CD2-CG 4.42Å; L131-L154 HydrophobicContact CG-CD1 4.04Å; L131-L154 HydrophobicContact CG-CD2 4.09Å
132	Q	88.6	Confident	86.7	Confident	40 Å²	40	48.3 Å²	48.3	19%	0.187	25%	0.249	C	C	.	.	H	α-helix	trans	-63.1	-40.9	176.4	-68.7	173.5	19.5	0	0	111.5	P101 L104 E128 E129 L136	P101-Q132 HydrophobicContact CB-CG 4.4Å; L104-Q132 HydrophobicContact CD1-CB 4.36Å; L104-Q132 HydrophobicContact CD2-CB 4.45Å; E128-Q132 WeakPolarHBondContact O-CG 3.2Å; E128-Q132 PolarHBondContact O-N 3.01Å; E129-Q132 PolarHBondContact O-N 3.49Å; Q132-L136 VanDerWaalsContact O-CB 3.29Å; Q132-L136 WeakPolarHBondContact O-CB 2.99Å; Q132-L136 PolarHBondContact O-N 2.84Å
133	V	88.9	Confident	86.7	Confident	5 Å²	5	48.4 Å²	48.4	3%	0.03	25%	0.249	C	C	.	.	H	α-helix	trans	-67.8	-40.4	177	175.4	0	0	0	0	111.8	L104 A122 E129 L130 L131 L136 A137 V144 S146	L104-V133 HydrophobicContact CD1-CG2 4.1Å; A122-V133 HydrophobicContact CB-CG1 3.82Å; A122-V133 HydrophobicContact CB-CG2 4.16Å; E129-V133 WeakPolarHBondContact O-CG2 3.25Å; E129-V133 PolarHBondContact O-N 3.01Å; L130-V133 PolarHBondContact O-N 3.44Å; L131-V133 VanDerWaalsContact C-N 3.33Å; V133-L136 PolarHBondContact O-N 2.74Å; V133-A137 WeakPolarHBondContact O-CB 3.24Å; V133-A137 PolarHBondContact O-N 2.95Å; V133-V144 HydrophobicContact CG1-CG1 3.76Å; V133-S146 WeakPolarHBondContact CG1-OG 3.2Å
134	D	89.9	Confident	86.7	Confident	26 Å²	26	48.3 Å²	48.3	14%	0.139	25%	0.25	C	C	.	.	H	α-helix	trans	-59.5	-47.7	176	-173.9	40	0	0	0	111.1	L130 L131 L136 A137 A138 L154 T156 N158 H161	L130-D134 PolarHBondContact O-N 3.19Å; L131-D134 PolarHBondContact O-N 2.85Å; D134-L136 PolarHBondContact O-N 2.66Å; D134-A137 PolarHBondContact O-N 3.16Å; D134-A138 PolarHBondContact O-N 2.91Å; D134-A138 VanDerWaalsContact O-N 3.08Å; D134-L154 HydrophobicContact CB-CD1 4.25Å; D134-T156 PolarHBondContact OD2-OG1 3.04Å; D134-N158 PolarHBondContact O-ND2 3.32Å; D134-N158 WeakPolarHBondContact OD1-CB 3.43Å; D134-N158 PolarHBondContact OD1-ND2 3.24Å; D134-H161 VanDerWaalsContact OD1-CB 3.28Å; D134-H161 WeakPolarHBondContact OD1-CB 3.34Å; D134-H161 IonicContact OD1-CG 3.56Å; D134-H161 IonicContact OD1-ND1 3.32Å; D134-H161 PolarHBondContact OD1-ND1 3.47Å
135	L	88.5	Confident	86.9	Confident	128 Å²	128	48 Å²	48	67%	0.67	25%	0.248	S	C	*	.	H	α-helix	trans	-61.5	-44.3	175.8	-175.6	69.6	0	0	0	111.9	L131 A138 A139	L131-L135 PolarHBondContact O-N 3.38Å; L131-L135 VanDerWaalsContact O-N 3.07Å; L135-A138 PolarHBondContact O-N 3.32Å; L135-A139 WeakPolarHBondContact O-CB 3.28Å; L135-A139 PolarHBondContact O-N 3.45Å
136	L	86.6	Confident	87.3	Confident	13 Å²	13	46 Å²	46	7%	0.068	24%	0.238	C	C	.	.	H	α-helix	trans	-61	-46.3	178.7	-177.1	76.2	0	0	0	111.3	L43 L104 I105 A108 Q132 V133 D134 A138 A139 L140	L43-L136 HydrophobicContact CD1-CD2 4.25Å; L104-L136 HydrophobicContact CD2-CB 4.1Å; L104-L136 HydrophobicContact CD2-CD1 4.26Å; L104-L136 HydrophobicContact CD2-CD2 3.65Å; L104-L136 HydrophobicContact CD2-CG 4.19Å; I105-L136 HydrophobicContact CG1-CD1 4.14Å; A108-L136 HydrophobicContact CB-CD1 4.09Å; A108-L136 HydrophobicContact CB-CD2 3.61Å; A108-L136 HydrophobicContact CB-CG 4.4Å; Q132-L136 VanDerWaalsContact O-CB 3.29Å; Q132-L136 WeakPolarHBondContact O-CB 2.99Å; Q132-L136 PolarHBondContact O-N 2.84Å; V133-L136 PolarHBondContact O-N 2.74Å; D134-L136 PolarHBondContact O-N 2.66Å; L136-A138 VanDerWaalsContact C-N 3.33Å; L136-A138 PolarHBondContact O-N 3.3Å; L136-A139 PolarHBondContact O-N 3.13Å; L136-L140 HydrophobicContact CD1-CD1 3.54Å; L136-L140 HydrophobicContact CD1-CG 4.04Å; L136-L140 HydrophobicContact CD2-CD1 4.2Å; L136-L140 HydrophobicContact CG-CD1 3.65Å; L136-L140 HydrophobicContact CG-CG 4.29Å; L136-L140 WeakPolarHBondContact O-CB 3.28Å; L136-L140 WeakPolarHBondContact O-CG 3.4Å; L136-L140 PolarHBondContact O-N 3.48Å
137	A	87.9	Confident	87.6	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.008	23%	0.225	C	C	.	.	H	α-helix	trans	-62.1	-41.1	179.3	0	0	0	0	0	111.7	V133 D134 R141 V144 F160 H161	V133-A137 WeakPolarHBondContact O-CB 3.24Å; V133-A137 PolarHBondContact O-N 2.95Å; D134-A137 PolarHBondContact O-N 3.16Å; A137-R141 WeakPolarHBondContact O-CA 3.37Å; A137-R141 PolarHBondContact O-N 2.91Å; A137-V144 HydrophobicContact CB-CB 4Å; A137-V144 HydrophobicContact CB-CG2 3.68Å; A137-F160 HydrophobicContact CB-CB 4.19Å; A137-F160 WeakPolarHBondContact O-CB 3.21Å; A137-H161 HydrophobicContact CB-CB 4.04Å
138	A	86.4	Confident	87.8	Confident	45 Å²	45	35.8 Å²	35.8	37%	0.372	19%	0.193	S	C	.	.	H	α-helix	trans	-64.9	-44.6	175.3	0	0	0	0	0	112.5	D134 L135 L136	D134-A138 PolarHBondContact O-N 2.91Å; D134-A138 VanDerWaalsContact O-N 3.08Å; L135-A138 PolarHBondContact O-N 3.32Å; L136-A138 VanDerWaalsContact C-N 3.33Å; L136-A138 PolarHBondContact O-N 3.3Å
139	A	82.8	Confident	87.6	Confident	76 Å²	76	30.9 Å²	30.9	63%	0.628	17%	0.171	S	C	*	.	H	α-helix	trans	-67.7	-45.6	-178	0	0	0	0	0	112.3	L135 L136 R141	L135-A139 WeakPolarHBondContact O-CB 3.28Å; L135-A139 PolarHBondContact O-N 3.45Å; L136-A139 PolarHBondContact O-N 3.13Å; A139-R141 VanDerWaalsContact C-N 3.3Å; A139-R141 PolarHBondContact O-N 3.31Å
140	L	79.6	Confident	86.9	Confident	34 Å²	34	36.7 Å²	36.7	18%	0.178	20%	0.198	C	C	.	.	H	α-helix	trans	-78.9	-14.7	-178.9	-61.1	178.8	0	0	0	112.9	A108 L113 L136 V142 C353	A108-L140 HydrophobicContact CB-CD1 4.27Å; L113-L140 HydrophobicContact CD1-CB 4.48Å; L113-L140 HydrophobicContact CD1-CD1 3.61Å; L113-L140 HydrophobicContact CD1-CD2 3.73Å; L113-L140 HydrophobicContact CD1-CG 4.14Å; L113-L140 HydrophobicContact CG-CD1 4.47Å; L136-L140 HydrophobicContact CD1-CD1 3.54Å; L136-L140 HydrophobicContact CD1-CG 4.04Å; L136-L140 HydrophobicContact CD2-CD1 4.2Å; L136-L140 HydrophobicContact CG-CD1 3.65Å; L136-L140 HydrophobicContact CG-CG 4.29Å; L136-L140 WeakPolarHBondContact O-CB 3.28Å; L136-L140 WeakPolarHBondContact O-CG 3.4Å; L136-L140 PolarHBondContact O-N 3.48Å; L140-V142 HydrophobicContact CB-CB 4.42Å; L140-V142 HydrophobicContact CB-CG2 4.3Å; L140-V142 PolarHBondContact O-N 3.09Å; L140-V142 VanDerWaalsContact O-N 3.15Å; L140-C353 WeakPolarHBondContact CD2-SG 3.47Å
141	R	83.1	Confident	86.2	Confident	101 Å²	101	37.6 Å²	37.6	38%	0.381	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.8	31.4	-172.9	-56.8	179	179.7	158.3	1.9	112.6	A137 A139 F160 P357 G363	A137-R141 WeakPolarHBondContact O-CA 3.37Å; A137-R141 PolarHBondContact O-N 2.91Å; A139-R141 VanDerWaalsContact C-N 3.3Å; A139-R141 PolarHBondContact O-N 3.31Å; R141-F160 HydrophobicContact CB-CD1 4.46Å; R141-F160 HydrophobicContact CB-CE1 3.97Å; R141-F160 HydrophobicContact CB-CZ 4.02Å; R141-F160 HydrophobicContact CG-CE2 4.42Å; R141-F160 HydrophobicContact CG-CZ 4.23Å; R141-P357 PolarHBondContact NH1-O 3.44Å; R141-G363 WeakPolarHBondContact O-CA 3.41Å
142	V	84.5	Confident	85.6	Confident	8 Å²	8	36.1 Å²	36.1	5%	0.048	20%	0.196	C	C	.	.			trans	-105.9	128.7	175.7	174	0	0	0	0	107.7	L113 L140 V144	L113-V142 HydrophobicContact CD2-CG2 3.85Å; L140-V142 HydrophobicContact CB-CB 4.42Å; L140-V142 HydrophobicContact CB-CG2 4.3Å; L140-V142 PolarHBondContact O-N 3.09Å; L140-V142 VanDerWaalsContact O-N 3.15Å; V142-V144 PolarHBondContact O-N 3.34Å
143	P	90.2	Very high	85.5	Confident	3 Å²	3	35.6 Å²	35.6	2%	0.019	20%	0.196	C	C	.	.			trans	-62	125.7	176.6	-21.4	32.6	0	0	0	111.6	A119 A120 F160 L366 L370	A119-P143 CarbonylContact C-O 3.59Å; A119-P143 WeakPolarHBondContact CA-O 3.38Å; A119-P143 HydrophobicContact CB-CB 4.39Å; A120-P143 PolarHBondContact N-O 3.47Å; P143-F160 CarbonylContact C-O 3.6Å; P143-F160 VanDerWaalsContact CA-O 3.3Å; P143-F160 WeakPolarHBondContact CA-O 3.36Å; P143-L366 HydrophobicContact CG-CB 4.29Å; P143-L370 HydrophobicContact CB-CD1 3.36Å; P143-L370 HydrophobicContact CG-CD1 3.79Å
144	V	91.3	Very high	85.3	Confident	8 Å²	8	36.3 Å²	36.3	5%	0.048	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	125.2	176.3	-174.6	0	0	0	0	109.3	A120 A122 V133 A137 V142 F160 H161 L162	A120-V144 HydrophobicContact CB-CG2 4.34Å; A120-V144 CarbonylContact O-C 3.08Å; A120-V144 VanDerWaalsContact O-CA 3.24Å; A120-V144 WeakPolarHBondContact O-CA 3.25Å; A122-V144 HydrophobicContact CB-CG1 3.8Å; V133-V144 HydrophobicContact CG1-CG1 3.76Å; A137-V144 HydrophobicContact CB-CB 4Å; A137-V144 HydrophobicContact CB-CG2 3.68Å; V142-V144 PolarHBondContact O-N 3.34Å; V144-F160 PolarHBondContact N-O 2.78Å; V144-H161 WeakPolarHBondContact O-CA 3.33Å; V144-L162 PolarHBondContact O-N 2.9Å
145	V	93.7	Very high	85	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.006	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	114	171	-173.8	0	0	0	0	108.2	A120 L121 A122 L162 M164 A326 I330	A120-V145 PolarHBondContact O-N 2.97Å; L121-V145 WeakPolarHBondContact CA-O 3.29Å; L121-V145 HydrophobicContact CD2-CB 3.88Å; A122-V145 PolarHBondContact N-O 3.18Å; V145-L162 CarbonylContact C-O 3.49Å; V145-L162 WeakPolarHBondContact CA-O 3.29Å; V145-L162 HydrophobicContact CG2-CB 4.31Å; V145-M164 HydrophobicContact CG1-CB 4.38Å; V145-A326 HydrophobicContact CG1-CB 4.17Å; V145-I330 HydrophobicContact CG2-CD1 4.17Å; V145-I330 HydrophobicContact CG2-CG1 4.27Å
146	S	93.1	Very high	84.7	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	126.7	178.4	-61.9	0	0	0	0	110.6	A122 V133 H161 L162 M164	A122-S146 CarbonylContact O-C 3.55Å; A122-S146 VanDerWaalsContact O-CA 3.29Å; A122-S146 WeakPolarHBondContact O-CA 3.21Å; V133-S146 WeakPolarHBondContact CG1-OG 3.2Å; S146-H161 PolarHBondContact OG-CD2 2.81Å; S146-H161 PolarHBondContact OG-NE2 2.99Å; S146-L162 PolarHBondContact N-O 3.4Å; S146-M164 PolarHBondContact O-N 2.64Å
147	L	92.3	Very high	84.5	Confident	5 Å²	5	47.9 Å²	47.9	3%	0.026	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	119.4	173.2	-70.3	88	0	0	0	109.2	L121 A122 F123 M164 T166 L319 I323 A326	L121-L147 HydrophobicContact CD2-CD1 4.36Å; A122-L147 PolarHBondContact O-N 3.48Å; F123-L147 HydrophobicContact CD1-CB 3.98Å; F123-L147 HydrophobicContact CD1-CD1 4.47Å; F123-L147 HydrophobicContact CE1-CB 4.07Å; F123-L147 HydrophobicContact CE1-CD1 3.93Å; F123-L147 HydrophobicContact CE1-CD2 4.14Å; F123-L147 HydrophobicContact CE1-CG 4.27Å; F123-L147 HydrophobicContact CZ-CD1 4.25Å; L147-M164 CarbonylContact C-O 3.59Å; L147-M164 VanDerWaalsContact CA-O 3.32Å; L147-M164 WeakPolarHBondContact CA-O 3.24Å; L147-T166 HydrophobicContact CB-CG2 4.15Å; L147-T166 HydrophobicContact CD2-CG2 4.16Å; L147-L319 HydrophobicContact CD2-CD1 4.06Å; L147-I323 HydrophobicContact CD2-CG1 3.81Å; L147-A326 HydrophobicContact CD1-CB 4.43Å
148	I	88.5	Confident	84.4	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.005	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	118.3	-170.9	-51	171	0	0	0	110.1	P124 L130 A151 P153 Q163 M164 T166	P124-I148 HydrophobicContact CG-CG1 4.49Å; L130-I148 HydrophobicContact CD1-CD1 3.86Å; L130-I148 HydrophobicContact CD1-CG1 4.15Å; L130-I148 HydrophobicContact CD2-CD1 3.78Å; L130-I148 HydrophobicContact CD2-CG1 4.49Å; I148-A151 HydrophobicContact CG2-CB 3.83Å; I148-A151 WeakPolarHBondContact CG2-O 3.34Å; I148-P153 HydrophobicContact CD1-CB 4.33Å; I148-Q163 HydrophobicContact CD1-CB 3.83Å; I148-Q163 HydrophobicContact CD1-CG 4.05Å; I148-M164 PolarHBondContact N-O 2.91Å; I148-T166 PolarHBondContact O-N 3.05Å; I148-T166 PolarHBondContact O-OG1 3.29Å; I148-T166 VanDerWaalsContact O-OG1 3.1Å
149	E	79.8	Confident	84.4	Confident	42 Å²	42	55.3 Å²	55.3	20%	0.196	26%	0.26	C	S	.	.	S	Bend	trans	-99.4	-40.1	-176.3	-165.7	170.5	-176.5	0	0	113.8	T166	E149-T166 WeakPolarHBondContact CA-OG1 3.3Å
150	H	71.3	Confident	84.7	Confident	145 Å²	145	53 Å²	53	67%	0.671	24%	0.237	S	C	*	.	S	Bend	trans	-127	-3.8	-170.8	-58.5	-53.8	0	0	0	115
151	A	73.8	Confident	85.3	Confident	19 Å²	19	51.4 Å²	51.4	16%	0.157	23%	0.228	C	C	.	.	S	Bend	trans	-109.5	152	-177.1	0	0	0	0	0	112.1	I148	I148-A151 HydrophobicContact CG2-CB 3.83Å; I148-A151 WeakPolarHBondContact CG2-O 3.34Å
152	E	78	Confident	85.8	Confident	58 Å²	58	47.1 Å²	47.1	27%	0.271	21%	0.212	S	C	.	.	P	Polyproline II helix	trans	-66.1	137.7	168.6	-80.5	-71.6	152.4	0	0	110.8	P169 E170 S171	E152-P169 VanDerWaalsContact OE1-CB 3.32Å; E152-P169 WeakPolarHBondContact OE1-CB 3.35Å; E152-E170 WeakPolarHBondContact OE1-CA 3.32Å; E152-E170 WeakPolarHBondContact OE1-CB 3.36Å; E152-E170 PolarHBondContact OE1-N 2.77Å; E152-S171 PolarHBondContact OE1-N 2.87Å; E152-S171 PolarHBondContact OE1-OG 3.35Å; E152-S171 PolarHBondContact OE2-OG 3.45Å
153	P	84.6	Confident	86.1	Confident	29 Å²	29	46.7 Å²	46.7	19%	0.188	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-62.7	141.4	172.9	26.8	-34.1	0	0	0	111.1	I148 V165 L390	I148-P153 HydrophobicContact CD1-CB 4.33Å; P153-V165 HydrophobicContact CB-CG2 4.15Å; P153-V165 HydrophobicContact CG-CG2 4.14Å; P153-L390 HydrophobicContact CB-CD1 3.91Å; P153-L390 HydrophobicContact CG-CD1 4.25Å
154	L	85.4	Confident	86.2	Confident	19 Å²	19	46.7 Å²	46.7	10%	0.099	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-70	134.7	173.9	-64.9	174.2	0	0	0	110.2	R127 L130 L131 D134 T156 Q163	R127-L154 HydrophobicContact CG-CD2 4.35Å; L130-L154 HydrophobicContact CB-CD1 4.37Å; L130-L154 HydrophobicContact CD2-CD1 4.14Å; L130-L154 HydrophobicContact CD2-CD2 4.48Å; L130-L154 HydrophobicContact CD2-CG 3.69Å; L130-L154 HydrophobicContact CG-CD1 3.69Å; L130-L154 HydrophobicContact CG-CG 3.84Å; L131-L154 HydrophobicContact CD2-CD1 3.69Å; L131-L154 HydrophobicContact CD2-CD2 3.81Å; L131-L154 HydrophobicContact CD2-CG 4.42Å; L131-L154 HydrophobicContact CG-CD1 4.04Å; L131-L154 HydrophobicContact CG-CD2 4.09Å; D134-L154 HydrophobicContact CB-CD1 4.25Å; L154-T156 VanDerWaalsContact C-N 3.33Å; L154-T156 HydrophobicContact CB-CG2 4.43Å; L154-T156 PolarHBondContact O-N 3.4Å; L154-Q163 PolarHBondContact O-NE2 3.02Å
155	R	83.2	Confident	86	Confident	226 Å²	226	46.9 Å²	46.9	85%	0.853	21%	0.211	S	C	*	.			trans	-77.4	84.4	165.9	-66.1	-175.9	-179.1	-178.6	0	109.4
156	T	82.8	Confident	85.5	Confident	24 Å²	24	47.2 Å²	47.2	15%	0.147	21%	0.213	C	C	.	.			trans	-121.4	155.7	179.2	-174.6	0	0	0	0	110.8	D134 L154 N158 R388	D134-T156 PolarHBondContact OD2-OG1 3.04Å; L154-T156 VanDerWaalsContact C-N 3.33Å; L154-T156 HydrophobicContact CB-CG2 4.43Å; L154-T156 PolarHBondContact O-N 3.4Å; T156-N158 HydrophobicContact CG2-CB 4.37Å; T156-N158 WeakPolarHBondContact OG1-CB 3.44Å; T156-N158 PolarHBondContact OG1-N 3.43Å; T156-R388 CarbonylContact O-C 3.45Å
157	Q	82.1	Confident	84.8	Confident	160 Å²	160	47.5 Å²	47.5	75%	0.748	22%	0.216	S	C	*	.			trans	-107.9	15.9	171.8	-66.7	-176.2	-4.1	0	0	111.5	R159	Q157-R159 PolarHBondContact O-N 3.25Å
158	N	87	Confident	84.1	Confident	21 Å²	21	49 Å²	49	11%	0.112	23%	0.225	C	C	.	.			trans	-68.2	114.8	-179.8	-174.8	4.2	0	0	0	110.6	D134 T156 F160 H161 S389	D134-N158 PolarHBondContact O-ND2 3.32Å; D134-N158 WeakPolarHBondContact OD1-CB 3.43Å; D134-N158 PolarHBondContact OD1-ND2 3.24Å; T156-N158 HydrophobicContact CG2-CB 4.37Å; T156-N158 WeakPolarHBondContact OG1-CB 3.44Å; T156-N158 PolarHBondContact OG1-N 3.43Å; N158-F160 PolarHBondContact O-N 3.05Å; N158-F160 PolarHBondContact OD1-N 2.79Å; N158-H161 HydrophobicContact CB-CB 4.25Å; N158-H161 PolarHBondContact O-N 2.99Å; N158-H161 VanDerWaalsContact O-O 3.1Å; N158-S389 PolarHBondContact O-OG 3.02Å
159	R	86.1	Confident	83.5	Confident	181 Å²	181	49.6 Å²	49.6	68%	0.683	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-12.3	-179	-59.6	-176.9	-174.5	-173.7	0.6	113.7	Q157 S367	Q157-R159 PolarHBondContact O-N 3.25Å; R159-S367 WeakPolarHBondContact O-CB 3.5Å
160	F	88.8	Confident	83.4	Confident	29 Å²	29	50.4 Å²	50.4	13%	0.127	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-10.4	178.6	-58.9	-76.9	0	0	0	112.6	A137 R141 P143 V144 N158 R364	A137-F160 HydrophobicContact CB-CB 4.19Å; A137-F160 WeakPolarHBondContact O-CB 3.21Å; R141-F160 HydrophobicContact CB-CD1 4.46Å; R141-F160 HydrophobicContact CB-CE1 3.97Å; R141-F160 HydrophobicContact CB-CZ 4.02Å; R141-F160 HydrophobicContact CG-CE2 4.42Å; R141-F160 HydrophobicContact CG-CZ 4.23Å; P143-F160 CarbonylContact C-O 3.6Å; P143-F160 VanDerWaalsContact CA-O 3.3Å; P143-F160 WeakPolarHBondContact CA-O 3.36Å; V144-F160 PolarHBondContact N-O 2.78Å; N158-F160 PolarHBondContact O-N 3.05Å; N158-F160 PolarHBondContact OD1-N 2.79Å; F160-R364 HydrophobicContact CE1-CB 4.17Å; F160-R364 HydrophobicContact CZ-CB 4.13Å; F160-R364 HydrophobicContact CZ-CG 4.22Å
161	H	91.9	Very high	83.6	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	112.5	178.9	-178.5	-128.3	0	0	0	108.9	D134 A137 V144 S146 N158 Q163 S389	D134-H161 VanDerWaalsContact OD1-CB 3.28Å; D134-H161 WeakPolarHBondContact OD1-CB 3.34Å; D134-H161 IonicContact OD1-CG 3.56Å; D134-H161 IonicContact OD1-ND1 3.32Å; D134-H161 PolarHBondContact OD1-ND1 3.47Å; A137-H161 HydrophobicContact CB-CB 4.04Å; V144-H161 WeakPolarHBondContact O-CA 3.33Å; S146-H161 PolarHBondContact OG-CD2 2.81Å; S146-H161 PolarHBondContact OG-NE2 2.99Å; N158-H161 HydrophobicContact CB-CB 4.25Å; N158-H161 PolarHBondContact O-N 2.99Å; N158-H161 VanDerWaalsContact O-O 3.1Å; H161-Q163 VanDerWaalsContact CE1-CG 3.43Å; H161-Q163 WeakPolarHBondContact CE1-CG 3.33Å; H161-S389 WeakPolarHBondContact O-CB 3.31Å
162	L	93	Very high	83.9	Confident	10 Å²	10	45.4 Å²	45.4	5%	0.052	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	135.5	173.5	-65.7	-179.1	0	0	0	109.3	V144 V145 S146 L329 L370 V384 S389 V391	V144-L162 PolarHBondContact O-N 2.9Å; V145-L162 CarbonylContact C-O 3.49Å; V145-L162 WeakPolarHBondContact CA-O 3.29Å; V145-L162 HydrophobicContact CG2-CB 4.31Å; S146-L162 PolarHBondContact N-O 3.4Å; L162-L329 HydrophobicContact CD1-CD2 4.31Å; L162-L370 HydrophobicContact CD1-CB 4.04Å; L162-V384 HydrophobicContact CD1-CG1 4.32Å; L162-V384 HydrophobicContact CD1-CG2 4.45Å; L162-V384 HydrophobicContact CD2-CG1 3.64Å; L162-S389 WeakPolarHBondContact CA-O 3.35Å; L162-V391 HydrophobicContact CB-CG2 4.01Å
163	Q	91.8	Very high	84	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	117.6	-176.8	-66	176.9	79.2	0	0	109.4	I148 L154 H161 S389 L390 V391	I148-Q163 HydrophobicContact CD1-CB 3.83Å; I148-Q163 HydrophobicContact CD1-CG 4.05Å; L154-Q163 PolarHBondContact O-NE2 3.02Å; H161-Q163 VanDerWaalsContact CE1-CG 3.43Å; H161-Q163 WeakPolarHBondContact CE1-CG 3.33Å; Q163-S389 PolarHBondContact N-O 2.82Å; Q163-L390 HydrophobicContact CB-CD1 4.26Å; Q163-L390 CarbonylContact O-C 3.53Å; Q163-L390 WeakPolarHBondContact O-CA 3.5Å; Q163-L390 WeakPolarHBondContact O-CD1 3.14Å; Q163-V391 PolarHBondContact O-N 3.4Å
164	M	91.3	Very high	83.8	Confident	2 Å²	2	42.2 Å²	42.2	1%	0.01	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	115.4	175.7	-170.5	-179.8	-160.5	0	0	108.2	V145 S146 L147 I148 Y322 D325 A326 V391 T393	V145-M164 HydrophobicContact CG1-CB 4.38Å; S146-M164 PolarHBondContact O-N 2.64Å; L147-M164 CarbonylContact C-O 3.59Å; L147-M164 VanDerWaalsContact CA-O 3.32Å; L147-M164 WeakPolarHBondContact CA-O 3.24Å; I148-M164 PolarHBondContact N-O 2.91Å; M164-Y322 HydrophobicContact CE-CD1 3.8Å; M164-Y322 HydrophobicContact CG-CD1 4.45Å; M164-Y322 HydrophobicContact SD-CD1 4.27Å; M164-D325 HydrophobicContact CE-CB 4.03Å; M164-A326 HydrophobicContact SD-CB 4.16Å; M164-V391 HydrophobicContact CB-CB 3.96Å; M164-V391 HydrophobicContact CB-CG1 4.49Å; M164-V391 HydrophobicContact CB-CG2 4.24Å; M164-V391 HydrophobicContact CE-CG1 4.39Å; M164-V391 HydrophobicContact CG-CB 4.08Å; M164-V391 HydrophobicContact CG-CG1 4.14Å; M164-T393 HydrophobicContact CE-CG2 3.48Å; M164-T393 VanDerWaalsContact CE-CG2 3.48Å; M164-T393 HydrophobicContact CG-CG2 4.38Å
165	V	87.7	Confident	83.6	Confident	13 Å²	13	44.2 Å²	44.2	8%	0.079	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	127.4	-177.1	-171.5	0	0	0	0	108.4	P153 G167 P169 L390	P153-V165 HydrophobicContact CB-CG2 4.15Å; P153-V165 HydrophobicContact CG-CG2 4.14Å; V165-G167 VanDerWaalsContact CG1-O 3.26Å; V165-G167 WeakPolarHBondContact CG1-O 3.36Å; V165-P169 HydrophobicContact CG1-CG 4.41Å; V165-L390 HydrophobicContact CG2-CD1 3.82Å
166	T	83.9	Confident	83.8	Confident	7 Å²	7	33.4 Å²	33.4	4%	0.043	17%	0.165	C	C	.	.			trans	-104.5	-16.2	-179.1	65.9	0	0	0	0	112.7	L147 I148 E149 L319 Y322	L147-T166 HydrophobicContact CB-CG2 4.15Å; L147-T166 HydrophobicContact CD2-CG2 4.16Å; I148-T166 PolarHBondContact O-N 3.05Å; I148-T166 PolarHBondContact O-OG1 3.29Å; I148-T166 VanDerWaalsContact O-OG1 3.1Å; E149-T166 WeakPolarHBondContact CA-OG1 3.3Å; T166-L319 HydrophobicContact CG2-CD1 4.04Å; T166-Y322 HydrophobicContact CG2-CD1 3.77Å; T166-Y322 HydrophobicContact CG2-CD2 4.12Å; T166-Y322 HydrophobicContact CG2-CE1 4.34Å; T166-Y322 HydrophobicContact CG2-CG 3.67Å
167	G	77.8	Confident	83.9	Confident	7 Å²	7	32.3 Å²	32.3	7%	0.072	16%	0.158	C	C	.	.	S	Bend	trans	-104.4	-171.7	170.7	0	0	0	0	0	112.4	V165 Q395	V165-G167 VanDerWaalsContact CG1-O 3.26Å; V165-G167 WeakPolarHBondContact CG1-O 3.36Å; G167-Q395 PolarHBondContact O-NE2 2.77Å
168	V	77	Confident	83.9	Confident	36 Å²	36	25.7 Å²	25.7	22%	0.218	13%	0.128	C	C	.	.			trans	-101	114.9	174.2	-164.8	0	0	0	0	108.1	V172 L173 F397	V168-V172 HydrophobicContact CG1-CB 4.21Å; V168-V172 HydrophobicContact CG1-CG1 3.76Å; V168-L173 HydrophobicContact CB-CD2 4.32Å; V168-L173 HydrophobicContact CB-CG 4.28Å; V168-L173 HydrophobicContact CG1-CD1 4.36Å; V168-L173 HydrophobicContact CG1-CD2 3.64Å; V168-L173 HydrophobicContact CG1-CG 3.62Å; V168-F397 HydrophobicContact CB-CZ 4.11Å; V168-F397 HydrophobicContact CG1-CE1 4.24Å; V168-F397 HydrophobicContact CG1-CE2 4.3Å; V168-F397 HydrophobicContact CG1-CZ 3.47Å; V168-F397 VanDerWaalsContact CG1-CZ 3.47Å; V168-F397 HydrophobicContact CG2-CE1 4.02Å; V168-F397 HydrophobicContact CG2-CZ 3.5Å; V168-F397 VanDerWaalsContact CG2-CZ 3.5Å
169	P	76.9	Confident	83.7	Confident	14 Å²	14	25.6 Å²	25.6	9%	0.091	13%	0.13	C	C	.	.			trans	-68.2	148.3	176.3	26	-27.3	0	0	0	110.1	E152 V165 S171 V172 L173	E152-P169 VanDerWaalsContact OE1-CB 3.32Å; E152-P169 WeakPolarHBondContact OE1-CB 3.35Å; V165-P169 HydrophobicContact CG1-CG 4.41Å; P169-S171 PolarHBondContact O-N 2.96Å; P169-V172 HydrophobicContact CG-CB 3.82Å; P169-V172 HydrophobicContact CG-CG2 3.55Å; P169-V172 PolarHBondContact O-N 2.98Å; P169-V172 VanDerWaalsContact O-N 3.1Å; P169-L173 PolarHBondContact O-N 3.41Å; P169-L173 VanDerWaalsContact O-N 3.08Å
170	E	76.6	Confident	83.7	Confident	58 Å²	58	17.1 Å²	17.1	27%	0.271	10%	0.098	S	C	.	.	H	α-helix	trans	-56.5	-32.9	175.9	-62	-171.4	166.3	0	0	111.6	E152 L173 S174 G202 L203	E152-E170 WeakPolarHBondContact OE1-CA 3.32Å; E152-E170 WeakPolarHBondContact OE1-CB 3.36Å; E152-E170 PolarHBondContact OE1-N 2.77Å; E170-L173 PolarHBondContact O-N 2.99Å; E170-S174 PolarHBondContact O-N 2.77Å; E170-G202 WeakPolarHBondContact OE2-CA 3.09Å; E170-L203 HydrophobicContact CB-CB 4.41Å; E170-L203 HydrophobicContact CB-CD1 4.21Å; E170-L203 WeakPolarHBondContact O-CD1 3.34Å; E170-L203 PolarHBondContact OE2-N 3.35Å; E170-L203 VanDerWaalsContact OE2-N 3.12Å
171	S	75.9	Confident	83.3	Confident	26 Å²	26	15.8 Å²	15.8	18%	0.182	9%	0.093	C	C	.	.	H	α-helix	trans	-59.4	-47.1	174.4	51	0	0	0	0	112.7	E152 P169 S174 D175	E152-S171 PolarHBondContact OE1-N 2.87Å; E152-S171 PolarHBondContact OE1-OG 3.35Å; E152-S171 PolarHBondContact OE2-OG 3.45Å; P169-S171 PolarHBondContact O-N 2.96Å; S171-S174 PolarHBondContact O-N 3.25Å; S171-S174 PolarHBondContact O-OG 3.12Å; S171-D175 PolarHBondContact O-N 3.48Å; S171-D175 VanDerWaalsContact O-N 3.13Å
172	V	79.4	Confident	82.7	Confident	33 Å²	33	20.4 Å²	20.4	20%	0.2	11%	0.114	C	C	.	.	H	α-helix	trans	-65.8	-39.3	176.3	163.9	0	0	0	0	111.4	V168 P169 S174 D175 L176 W418	V168-V172 HydrophobicContact CG1-CB 4.21Å; V168-V172 HydrophobicContact CG1-CG1 3.76Å; P169-V172 HydrophobicContact CG-CB 3.82Å; P169-V172 HydrophobicContact CG-CG2 3.55Å; P169-V172 PolarHBondContact O-N 2.98Å; P169-V172 VanDerWaalsContact O-N 3.1Å; V172-S174 VanDerWaalsContact C-N 3.31Å; V172-S174 PolarHBondContact O-N 2.93Å; V172-D175 PolarHBondContact O-N 2.93Å; V172-L176 PolarHBondContact O-N 3.37Å; V172-W418 HydrophobicContact CG1-CH2 3.68Å; V172-W418 HydrophobicContact CG1-CZ3 3.81Å
173	L	81.7	Confident	82	Confident	18 Å²	18	26.6 Å²	26.6	9%	0.094	14%	0.137	C	C	.	.	H	α-helix	trans	-63.7	-36.7	174.4	-69.7	173.8	0	0	0	112.3	V168 P169 E170 L176 L177 L203 P293 Y311 F397	V168-L173 HydrophobicContact CB-CD2 4.32Å; V168-L173 HydrophobicContact CB-CG 4.28Å; V168-L173 HydrophobicContact CG1-CD1 4.36Å; V168-L173 HydrophobicContact CG1-CD2 3.64Å; V168-L173 HydrophobicContact CG1-CG 3.62Å; P169-L173 PolarHBondContact O-N 3.41Å; P169-L173 VanDerWaalsContact O-N 3.08Å; E170-L173 PolarHBondContact O-N 2.99Å; L173-L176 PolarHBondContact O-N 2.9Å; L173-L177 WeakPolarHBondContact O-CB 3.47Å; L173-L177 PolarHBondContact O-N 3.29Å; L173-L203 HydrophobicContact CB-CD1 3.93Å; L173-P293 HydrophobicContact CD1-CG 4.47Å; L173-P293 HydrophobicContact CD2-CG 4.01Å; L173-Y311 HydrophobicContact CD2-CE2 4.18Å; L173-F397 HydrophobicContact CD2-CE1 4.37Å
174	S	80.1	Confident	81.3	Confident	2 Å²	2	26.7 Å²	26.7	1%	0.014	14%	0.138	C	C	.	.	H	α-helix	trans	-65.8	-40.5	176.2	74.6	0	0	0	0	111.8	E170 S171 V172 L177 L178	E170-S174 PolarHBondContact O-N 2.77Å; S171-S174 PolarHBondContact O-N 3.25Å; S171-S174 PolarHBondContact O-OG 3.12Å; V172-S174 VanDerWaalsContact C-N 3.31Å; V172-S174 PolarHBondContact O-N 2.93Å; S174-L177 PolarHBondContact O-N 3.08Å; S174-L178 WeakPolarHBondContact O-CB 3.33Å; S174-L178 PolarHBondContact O-N 3.38Å
175	D	81.4	Confident	80.3	Confident	61 Å²	61	28.7 Å²	28.7	33%	0.326	16%	0.158	S	C	.	.	H	α-helix	trans	-66.5	-42.6	177.9	-68.6	-18.1	0	0	0	110.9	S171 V172 A179 Q210 W418	S171-D175 PolarHBondContact O-N 3.48Å; S171-D175 VanDerWaalsContact O-N 3.13Å; V172-D175 PolarHBondContact O-N 2.93Å; D175-A179 VanDerWaalsContact O-CB 3.3Å; D175-A179 WeakPolarHBondContact O-CB 3.42Å; D175-A179 PolarHBondContact O-N 2.89Å; D175-Q210 PolarHBondContact OD1-NE2 2.76Å; D175-W418 HydrophobicContact CB-CZ2 4.37Å
176	L	86.3	Confident	79.9	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-58.2	-52.9	173.5	174.2	71.5	0	0	0	111.2	V172 L173 L178 A179 V180 Y311 F397 W418	V172-L176 PolarHBondContact O-N 3.37Å; L173-L176 PolarHBondContact O-N 2.9Å; L176-L178 VanDerWaalsContact C-N 3.34Å; L176-L178 PolarHBondContact O-N 2.89Å; L176-A179 WeakPolarHBondContact O-CB 3.26Å; L176-A179 PolarHBondContact O-N 2.83Å; L176-V180 WeakPolarHBondContact O-CG2 3.49Å; L176-V180 PolarHBondContact O-N 2.94Å; L176-Y311 HydrophobicContact CD2-CD2 3.48Å; L176-Y311 VanDerWaalsContact CD2-CD2 3.48Å; L176-Y311 HydrophobicContact CD2-CE2 3.73Å; L176-Y311 HydrophobicContact CD2-CG 3.95Å; L176-F397 HydrophobicContact CD1-CB 4.33Å; L176-F397 HydrophobicContact CD2-CB 4.35Å; L176-F397 HydrophobicContact CD2-CD1 3.91Å; L176-F397 HydrophobicContact CD2-CE1 4.44Å; L176-F397 HydrophobicContact CD2-CG 4.05Å; L176-W418 HydrophobicContact CB-CD2 4.34Å; L176-W418 HydrophobicContact CD1-CB 3.33Å; L176-W418 HydrophobicContact CD1-CD2 3.56Å; L176-W418 HydrophobicContact CD1-CE3 4.06Å; L176-W418 HydrophobicContact CD1-CG 3.26Å
177	L	85.3	Confident	79.4	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-64.6	-40.9	-177.6	-170.9	69.6	0	0	0	111.2	L173 S174 A179 V180 L181 L207 L260 F262 V289 Y311	L173-L177 WeakPolarHBondContact O-CB 3.47Å; L173-L177 PolarHBondContact O-N 3.29Å; S174-L177 PolarHBondContact O-N 3.08Å; L177-A179 VanDerWaalsContact C-N 3.35Å; L177-A179 PolarHBondContact O-N 2.95Å; L177-V180 PolarHBondContact O-N 2.93Å; L177-L181 HydrophobicContact CG-CD1 4.19Å; L177-L181 VanDerWaalsContact O-CG 3.25Å; L177-L181 WeakPolarHBondContact O-CG 3.27Å; L177-L181 PolarHBondContact O-N 2.99Å; L177-L207 HydrophobicContact CB-CD2 4.42Å; L177-L207 HydrophobicContact CD2-CD1 3.75Å; L177-L207 HydrophobicContact CD2-CD2 4.19Å; L177-L260 HydrophobicContact CD1-CD2 4.01Å; L177-L260 HydrophobicContact CD2-CD1 3.97Å; L177-L260 HydrophobicContact CD2-CD2 4.2Å; L177-L260 HydrophobicContact CG-CD2 4.43Å; L177-F262 HydrophobicContact CD2-CZ 3.99Å; L177-V289 HydrophobicContact CD1-CG1 4.01Å; L177-Y311 HydrophobicContact CD1-CE1 3.91Å
178	L	81.8	Confident	79.4	Confident	22 Å²	22	40.4 Å²	40.4	12%	0.115	20%	0.203	C	C	.	.	H	α-helix	trans	-62	-42.4	175	-176	63.9	0	0	0	111.3	S174 L176 V180 L181 Q182 L207 Q210 W223	S174-L178 WeakPolarHBondContact O-CB 3.33Å; S174-L178 PolarHBondContact O-N 3.38Å; L176-L178 VanDerWaalsContact C-N 3.34Å; L176-L178 PolarHBondContact O-N 2.89Å; L178-V180 VanDerWaalsContact C-N 3.33Å; L178-V180 PolarHBondContact O-N 3.11Å; L178-L181 PolarHBondContact O-N 3.46Å; L178-Q182 HydrophobicContact CD1-CG 4.11Å; L178-Q182 HydrophobicContact CG-CG 4.25Å; L178-Q182 VanDerWaalsContact O-CB 3.29Å; L178-Q182 WeakPolarHBondContact O-CB 3.27Å; L178-Q182 VanDerWaalsContact O-CG 3.25Å; L178-Q182 WeakPolarHBondContact O-CG 3.26Å; L178-Q182 PolarHBondContact O-N 2.87Å; L178-L207 HydrophobicContact CB-CD2 4.5Å; L178-Q210 HydrophobicContact CD2-CB 4.42Å; L178-W223 HydrophobicContact CD1-CB 4.45Å
179	A	83.6	Confident	79.6	Confident	19 Å²	19	38.7 Å²	38.7	16%	0.157	19%	0.192	C	C	.	.	H	α-helix	trans	-61.4	-40.7	175.7	0	0	0	0	0	111.9	D175 L176 L177 R183	D175-A179 VanDerWaalsContact O-CB 3.3Å; D175-A179 WeakPolarHBondContact O-CB 3.42Å; D175-A179 PolarHBondContact O-N 2.89Å; L176-A179 WeakPolarHBondContact O-CB 3.26Å; L176-A179 PolarHBondContact O-N 2.83Å; L177-A179 VanDerWaalsContact C-N 3.35Å; L177-A179 PolarHBondContact O-N 2.95Å; A179-R183 WeakPolarHBondContact O-CB 3.25Å; A179-R183 PolarHBondContact O-N 3.39Å
180	V	85.1	Confident	80	Confident	2 Å²	2	38.2 Å²	38.2	1%	0.012	19%	0.189	C	C	.	.	H	α-helix	trans	-62.3	-49.8	174.8	170.8	0	0	0	0	110.9	L176 L177 L178 R183 S184 L309 I399 W431	L176-V180 WeakPolarHBondContact O-CG2 3.49Å; L176-V180 PolarHBondContact O-N 2.94Å; L177-V180 PolarHBondContact O-N 2.93Å; L178-V180 VanDerWaalsContact C-N 3.33Å; L178-V180 PolarHBondContact O-N 3.11Å; V180-R183 PolarHBondContact O-N 2.9Å; V180-S184 WeakPolarHBondContact O-CB 3.41Å; V180-S184 PolarHBondContact O-N 2.8Å; V180-S184 PolarHBondContact O-OG 2.79Å; V180-S184 VanDerWaalsContact O-OG 3.11Å; V180-L309 HydrophobicContact CG1-CD1 4.43Å; V180-I399 HydrophobicContact CG2-CD1 3.85Å; V180-I399 HydrophobicContact CG2-CG1 4.38Å; V180-W431 HydrophobicContact CB-CH2 4.39Å; V180-W431 HydrophobicContact CB-CZ3 4.22Å; V180-W431 HydrophobicContact CG1-CH2 4.04Å; V180-W431 HydrophobicContact CG1-CZ3 3.83Å; V180-W431 HydrophobicContact CG2-CH2 4.09Å; V180-W431 HydrophobicContact CG2-CZ3 4.4Å
181	L	81.7	Confident	80.4	Confident	2 Å²	2	35.5 Å²	35.5	1%	0.01	18%	0.176	C	C	.	.	H	α-helix	trans	-65.1	-41.3	-179.3	-67.7	172.4	0	0	0	112.9	L177 L178 S184 G185 W186 W223 L260	L177-L181 HydrophobicContact CG-CD1 4.19Å; L177-L181 VanDerWaalsContact O-CG 3.25Å; L177-L181 WeakPolarHBondContact O-CG 3.27Å; L177-L181 PolarHBondContact O-N 2.99Å; L178-L181 PolarHBondContact O-N 3.46Å; L181-S184 PolarHBondContact O-OG 2.69Å; L181-G185 PolarHBondContact O-N 3.32Å; L181-W186 HydrophobicContact CD2-CE3 3.7Å; L181-W186 HydrophobicContact CD2-CZ3 4.32Å; L181-W186 PolarHBondContact O-N 3.43Å; L181-W223 HydrophobicContact CD1-CD2 4.19Å; L181-W223 HydrophobicContact CD1-CG 4.16Å; L181-L260 HydrophobicContact CD1-CD1 4.29Å; L181-L260 HydrophobicContact CD2-CD2 4.14Å
182	Q	78.4	Confident	80.9	Confident	96 Å²	96	34.2 Å²	34.2	45%	0.449	17%	0.167	S	C	.	.	H	α-helix	trans	-67.2	-42.2	177.4	-75.7	177.7	-10.9	0	0	111.3	L178 G185	L178-Q182 HydrophobicContact CD1-CG 4.11Å; L178-Q182 HydrophobicContact CG-CG 4.25Å; L178-Q182 VanDerWaalsContact O-CB 3.29Å; L178-Q182 WeakPolarHBondContact O-CB 3.27Å; L178-Q182 VanDerWaalsContact O-CG 3.25Å; L178-Q182 WeakPolarHBondContact O-CG 3.26Å; L178-Q182 PolarHBondContact O-N 2.87Å; Q182-G185 PolarHBondContact O-N 3.27Å
183	R	79.1	Confident	81.1	Confident	140 Å²	140	33.3 Å²	33.3	53%	0.528	16%	0.161	S	C	.	.	H	α-helix	trans	-67.6	-36.2	179.9	-173.7	62.5	176.3	-168.2	-0.4	112.2	A179 V180 G185 L423 V425 W431	A179-R183 WeakPolarHBondContact O-CB 3.25Å; A179-R183 PolarHBondContact O-N 3.39Å; V180-R183 PolarHBondContact O-N 2.9Å; R183-G185 VanDerWaalsContact C-N 3.25Å; R183-G185 PolarHBondContact O-N 3.36Å; R183-L423 HydrophobicContact CB-CD2 3.75Å; R183-L423 HydrophobicContact CG-CD2 3.86Å; R183-V425 HydrophobicContact CG-CG2 4.43Å; R183-W431 HydrophobicContact CB-CE3 3.81Å; R183-W431 HydrophobicContact CB-CZ3 4.17Å; R183-W431 HydrophobicContact CG-CB 4.19Å; R183-W431 HydrophobicContact CG-CD2 3.91Å; R183-W431 HydrophobicContact CG-CE3 3.57Å; R183-W431 HydrophobicContact CG-CG 4.17Å; R183-W431 HydrophobicContact CG-CZ3 4.29Å
184	S	75.4	Confident	81	Confident	3 Å²	3	32.5 Å²	32.5	2%	0.021	16%	0.157	C	C	.	.	H	α-helix	trans	-76.7	-9.8	175.3	64.8	0	0	0	0	113.7	V180 L181 W186 G433	V180-S184 WeakPolarHBondContact O-CB 3.41Å; V180-S184 PolarHBondContact O-N 2.8Å; V180-S184 PolarHBondContact O-OG 2.79Å; V180-S184 VanDerWaalsContact O-OG 3.11Å; L181-S184 PolarHBondContact O-OG 2.69Å; S184-W186 VanDerWaalsContact C-N 3.26Å; S184-W186 PolarHBondContact O-N 3.16Å; S184-W186 WeakPolarHBondContact OG-CZ3 3.38Å; S184-G433 WeakPolarHBondContact O-CA 3.31Å
185	G	71.3	Confident	80.5	Confident	43 Å²	43	39.9 Å²	39.9	44%	0.443	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.1	12.1	178.6	0	0	0	0	0	114.4	L181 Q182 R183 R187	L181-G185 PolarHBondContact O-N 3.32Å; Q182-G185 PolarHBondContact O-N 3.27Å; R183-G185 VanDerWaalsContact C-N 3.25Å; R183-G185 PolarHBondContact O-N 3.36Å; G185-R187 PolarHBondContact O-N 2.96Å
186	W	79.1	Confident	79.7	Confident	8 Å²	8	39.6 Å²	39.6	3%	0.03	20%	0.196	C	C	.	.			trans	-76.9	108.3	175.6	-55.7	-32.6	0	0	0	109.3	L181 S184 W223 A257 A258 H287 V289 L309	L181-W186 HydrophobicContact CD2-CE3 3.7Å; L181-W186 HydrophobicContact CD2-CZ3 4.32Å; L181-W186 PolarHBondContact O-N 3.43Å; S184-W186 VanDerWaalsContact C-N 3.26Å; S184-W186 PolarHBondContact O-N 3.16Å; S184-W186 WeakPolarHBondContact OG-CZ3 3.38Å; W186-W223 VanDerWaalsContact O-CD1 3.27Å; W186-A257 HydrophobicContact CG-CB 4.3Å; W186-A258 HydrophobicContact CB-CB 3.98Å; W186-A258 HydrophobicContact CD2-CB 3.61Å; W186-A258 HydrophobicContact CE3-CB 3.47Å; W186-A258 VanDerWaalsContact CE3-CB 3.47Å; W186-A258 HydrophobicContact CG-CB 3.85Å; W186-A258 HydrophobicContact CZ3-CB 4.25Å; W186-H287 AromaticContact CE2-CD2 3.66Å; W186-H287 AromaticContact CE2-CG 3.77Å; W186-H287 HydrophobicContact CH2-CB 3.62Å; W186-H287 AromaticContact CH2-CG 3.86Å; W186-H287 HydrophobicContact CZ2-CB 3.42Å; W186-H287 VanDerWaalsContact CZ2-CB 3.42Å; W186-H287 AromaticContact CZ2-CD2 3.51Å; W186-H287 AromaticContact CZ2-CE1 3.9Å; W186-H287 AromaticContact CZ2-CG 3.19Å; W186-H287 AromaticContact CZ2-ND1 3.47Å; W186-H287 WeakPolarHBondContact CZ2-ND1 3.42Å; W186-H287 AromaticContact CZ2-NE2 3.94Å; W186-H287 HydrophobicContact CZ3-CB 4.32Å; W186-H287 AromaticContact NE1-CD2 3.54Å; W186-H287 AromaticContact NE1-NE2 3.95Å; W186-V289 HydrophobicContact CE3-CG2 4.42Å; W186-V289 HydrophobicContact CH2-CG2 4.16Å; W186-V289 HydrophobicContact CZ3-CG2 3.54Å; W186-L309 HydrophobicContact CH2-CD1 3.67Å; W186-L309 HydrophobicContact CZ3-CD1 4.14Å
187	R	74.2	Confident	78.7	Confident	170 Å²	170	40.3 Å²	40.3	64%	0.642	20%	0.198	S	C	*	.			trans	-89.8	-19	-178.2	-63.9	-176.6	-179.8	-172.3	-2.8	113.7	G185 V221 W223 H224	G185-R187 PolarHBondContact O-N 2.96Å; R187-V221 HydrophobicContact CG-CG1 4.22Å; R187-W223 CarbonylContact O-C 3.55Å; R187-W223 WeakPolarHBondContact O-CA 3.43Å; R187-H224 PolarHBondContact O-N 3.08Å
188	E	77.7	Confident	77.3	Confident	96 Å²	96	48 Å²	48	45%	0.449	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	145.2	179.6	65.2	-169.8	171.9	0	0	110	H224	E188-H224 VanDerWaalsContact CA-O 3.25Å; E188-H224 WeakPolarHBondContact CA-O 3.25Å
189	G	79.9	Confident	75.8	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	159.6	178.4	0	0	0	0	0	113.7	H224 Q226 A258	G189-H224 PolarHBondContact N-O 3.47Å; G189-H224 VanDerWaalsContact N-O 3.1Å; G189-Q226 PolarHBondContact O-N 3.23Å; G189-A258 WeakPolarHBondContact CA-O 2.89Å
190	T	85.3	Confident	74.2	Confident	4 Å²	4	56.1 Å²	56.1	3%	0.025	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	142.3	173.9	-71.4	0	0	0	0	109.5	A227 L229 P256 A258 V259 L260	T190-A227 WeakPolarHBondContact CA-O 3.09Å; T190-A227 HydrophobicContact CG2-CB 4.11Å; T190-A227 WeakPolarHBondContact CG2-O 3.31Å; T190-L229 HydrophobicContact CG2-CD1 3.8Å; T190-L229 HydrophobicContact CG2-CG 3.77Å; T190-P256 WeakPolarHBondContact OG1-CG 3.18Å; T190-A258 PolarHBondContact N-O 3.1Å; T190-A258 VanDerWaalsContact N-O 3.09Å; T190-V259 CarbonylContact O-C 3.51Å; T190-V259 VanDerWaalsContact O-CA 3.27Å; T190-V259 WeakPolarHBondContact O-CA 3.49Å; T190-L260 PolarHBondContact O-N 2.86Å
191	V	86.3	Confident	72.8	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	132.5	177.8	173.2	0	0	0	0	109.8	L193 L204 W223 L225 A227 L228 L229 L260 F262	V191-L193 HydrophobicContact CG1-CD2 3.68Å; V191-L193 HydrophobicContact CG1-CG 4.18Å; V191-L204 HydrophobicContact CG1-CD2 4.19Å; V191-L204 HydrophobicContact CG2-CD2 4.12Å; V191-W223 HydrophobicContact CG2-CH2 4.07Å; V191-L225 HydrophobicContact CB-CD1 3.92Å; V191-L225 HydrophobicContact CG2-CD1 3.38Å; V191-A227 PolarHBondContact N-O 3.2Å; V191-L228 HydrophobicContact CB-CD1 3.72Å; V191-L228 HydrophobicContact CG1-CD1 3.6Å; V191-L229 PolarHBondContact O-N 3.39Å; V191-L260 CarbonylContact C-O 3.52Å; V191-L260 WeakPolarHBondContact CA-O 3.23Å; V191-L260 HydrophobicContact CG2-CB 4.06Å; V191-L260 HydrophobicContact CG2-CD1 3.99Å; V191-F262 HydrophobicContact CG1-CD2 3.56Å; V191-F262 HydrophobicContact CG1-CE2 3.72Å; V191-F262 HydrophobicContact CG2-CE2 4.26Å
192	V	86.3	Confident	72	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	126	173	-172.6	0	0	0	0	109.3	L229 L231 V259 L260 L261 F262 V272 W288	V192-L229 CarbonylContact C-O 3.54Å; V192-L229 WeakPolarHBondContact CA-O 3.27Å; V192-L229 HydrophobicContact CG1-CB 4.49Å; V192-L229 HydrophobicContact CG2-CB 4.21Å; V192-L229 HydrophobicContact CG2-CD1 4.1Å; V192-L231 HydrophobicContact CG1-CD1 3.45Å; V192-L231 VanDerWaalsContact CG1-CD1 3.45Å; V192-L231 HydrophobicContact CG1-CG 4.14Å; V192-V259 HydrophobicContact CG2-CG1 3.69Å; V192-L260 PolarHBondContact N-O 2.97Å; V192-L261 HydrophobicContact CB-CD1 3.88Å; V192-L261 HydrophobicContact CG1-CD1 3.91Å; V192-F262 PolarHBondContact O-N 3.08Å; V192-V272 HydrophobicContact CG1-CG1 4.34Å; V192-W288 HydrophobicContact CG2-CZ3 4.4Å
193	L	84.1	Confident	71.6	Confident	14 Å²	14	54.2 Å²	54.2	7%	0.073	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	117.4	-178.3	-59.3	-176.4	0	0	0	111	V191 W197 L204 L228 L229 L231 F262	V191-L193 HydrophobicContact CG1-CD2 3.68Å; V191-L193 HydrophobicContact CG1-CG 4.18Å; L193-W197 HydrophobicContact CD2-CG 4.04Å; L193-L204 HydrophobicContact CD1-CD1 4.38Å; L193-L204 HydrophobicContact CD2-CD1 4.17Å; L193-L228 HydrophobicContact CD1-CD1 3.78Å; L193-L228 HydrophobicContact CD1-CD2 4.32Å; L193-L228 HydrophobicContact CD1-CG 4.24Å; L193-L228 HydrophobicContact CD2-CD1 4.48Å; L193-L228 HydrophobicContact CG-CD1 3.93Å; L193-L229 PolarHBondContact N-O 3.24Å; L193-L231 VanDerWaalsContact O-CB 3.29Å; L193-L231 WeakPolarHBondContact O-CB 3.03Å; L193-L231 PolarHBondContact O-N 3.11Å; L193-F262 HydrophobicContact CD2-CB 3.78Å; L193-F262 HydrophobicContact CD2-CD2 3.99Å; L193-F262 HydrophobicContact CD2-CG 4.2Å
194	C	79.1	Confident	71.2	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.26	C	S	.	.			trans	-82.2	163.2	166.7	-86.7	0	0	0	0	111.5	F262 C268	C194-F262 WeakPolarHBondContact CB-O 3.4Å; C194-F262 PolarHBondContact N-O 3.04Å; C194-C268 HydrophobicContact CB-CB 3.85Å; C194-C268 WeakPolarHBondContact CB-SG 3.08Å; C194-C268 WeakPolarHBondContact SG-CB 3.44Å; C194-C268 CovalentContact SG-SG 2.05Å; C194-C268 PolarHBondContact SG-SG 2.64Å
195	R	69.7	Low	70.9	Confident	158 Å²	158	58 Å²	58	60%	0.596	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	142.8	179.4	-169.6	176.6	178.3	178.2	-0.6	111.3
196	G	63.4	Low	70.7	Confident	54 Å²	54	58.6 Å²	58.6	56%	0.557	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.9	-3	-177.5	0	0	0	0	0	114.7
197	W	65.7	Low	70.2	Confident	15 Å²	15	58.5 Å²	58.5	6%	0.057	28%	0.284	C	S	.	.			trans	-88.3	-2.2	179	-167.5	-100	0	0	0	114.6	L193 E199 A200 L203 F262 Q292	L193-W197 HydrophobicContact CD2-CG 4.04Å; W197-E199 PolarHBondContact O-N 3.19Å; W197-E199 VanDerWaalsContact O-N 3.09Å; W197-A200 HydrophobicContact CD2-CB 3.75Å; W197-A200 HydrophobicContact CE3-CB 3.62Å; W197-A200 HydrophobicContact CG-CB 4.47Å; W197-A200 HydrophobicContact CH2-CB 3.72Å; W197-A200 HydrophobicContact CZ2-CB 3.88Å; W197-A200 WeakPolarHBondContact CZ2-O 3.46Å; W197-A200 HydrophobicContact CZ3-CB 3.57Å; W197-A200 PolarHBondContact O-N 3.43Å; W197-A200 VanDerWaalsContact O-N 3.08Å; W197-L203 HydrophobicContact CH2-CB 4.24Å; W197-L203 HydrophobicContact CH2-CD2 3.63Å; W197-L203 HydrophobicContact CZ2-CB 4.04Å; W197-L203 HydrophobicContact CZ2-CD2 3.95Å; W197-F262 HydrophobicContact CD2-CB 3.9Å; W197-F262 HydrophobicContact CD2-CG 4.45Å; W197-F262 HydrophobicContact CE3-CB 4Å; W197-F262 HydrophobicContact CE3-CD1 4.41Å; W197-F262 HydrophobicContact CG-CB 4.46Å; W197-F262 HydrophobicContact CH2-CB 4.44Å; W197-F262 AromaticContact CH2-CD1 3.38Å; W197-F262 HydrophobicContact CH2-CD1 3.38Å; W197-F262 AromaticContact CH2-CE1 3.97Å; W197-F262 HydrophobicContact CH2-CE1 3.97Å; W197-F262 HydrophobicContact CH2-CG 4.19Å; W197-F262 HydrophobicContact CZ2-CB 4.31Å; W197-F262 AromaticContact CZ2-CD1 3.48Å; W197-F262 HydrophobicContact CZ2-CD1 3.48Å; W197-F262 VanDerWaalsContact CZ2-CD1 3.48Å; W197-F262 AromaticContact CZ2-CE1 3.98Å; W197-F262 HydrophobicContact CZ2-CE1 3.98Å; W197-F262 AromaticContact CZ2-CG 3.97Å; W197-F262 HydrophobicContact CZ2-CG 3.97Å; W197-F262 HydrophobicContact CZ3-CB 4.29Å; W197-F262 AromaticContact CZ3-CD1 3.88Å; W197-F262 HydrophobicContact CZ3-CD1 3.88Å; W197-F262 HydrophobicContact CZ3-CG 4.49Å; W197-Q292 HydrophobicContact CH2-CG 4.22Å; W197-Q292 HydrophobicContact CZ3-CG 3.65Å
198	E	55.3	Low	69.8	Low	163 Å²	163	55.8 Å²	55.8	76%	0.762	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-18.5	-176.9	-67.6	-177	169.8	0	0	113.4
199	E	50.6	Low	69	Low	195 Å²	195	54.5 Å²	54.5	91%	0.911	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-16.2	176.9	-65.2	-178.5	168.8	0	0	114	W197	W197-E199 PolarHBondContact O-N 3.19Å; W197-E199 VanDerWaalsContact O-N 3.09Å
200	A	49.9	Very low	67.9	Low	15 Å²	15	58.3 Å²	58.3	12%	0.124	30%	0.301	C	S	.	.			trans	-103.9	24.3	-174	0	0	0	0	0	113.9	W197 G202 L203	W197-A200 HydrophobicContact CD2-CB 3.75Å; W197-A200 HydrophobicContact CE3-CB 3.62Å; W197-A200 HydrophobicContact CG-CB 4.47Å; W197-A200 HydrophobicContact CH2-CB 3.72Å; W197-A200 HydrophobicContact CZ2-CB 3.88Å; W197-A200 WeakPolarHBondContact CZ2-O 3.46Å; W197-A200 HydrophobicContact CZ3-CB 3.57Å; W197-A200 PolarHBondContact O-N 3.43Å; W197-A200 VanDerWaalsContact O-N 3.08Å; A200-G202 PolarHBondContact O-N 3.46Å; A200-L203 PolarHBondContact O-N 3.14Å
201	G	57.3	Low	66.3	Low	34 Å²	34	60.7 Å²	60.7	35%	0.351	32%	0.316	S	S	.	.	H	α-helix	trans	-62.6	-6	178.1	0	0	0	0	0	115	R205	G201-R205 WeakPolarHBondContact O-CG 3.17Å
202	G	64.8	Low	64.2	Low	22 Å²	22	65.6 Å²	65.6	23%	0.227	35%	0.35	C	S	.	.	H	α-helix	trans	-67	-46.7	175.9	0	0	0	0	0	112.7	E170 A200 L204 R205 F206	E170-G202 WeakPolarHBondContact OE2-CA 3.09Å; A200-G202 PolarHBondContact O-N 3.46Å; G202-L204 PolarHBondContact O-N 3.39Å; G202-R205 CarbonylContact O-C 3.51Å; G202-R205 WeakPolarHBondContact O-CA 3.48Å; G202-R205 WeakPolarHBondContact O-CB 3.44Å; G202-R205 PolarHBondContact O-N 3.46Å; G202-F206 WeakPolarHBondContact O-CD2 3.49Å; G202-F206 PolarHBondContact O-N 2.89Å
203	L	69.7	Low	62	Low	4 Å²	4	68.4 Å²	68.4	2%	0.021	38%	0.379	C	S	.	.	H	α-helix	trans	-58.6	-43.4	-177.8	-173.9	71.5	0	0	0	113.5	E170 L173 W197 A200 R205 F206 L207 F262	E170-L203 HydrophobicContact CB-CB 4.41Å; E170-L203 HydrophobicContact CB-CD1 4.21Å; E170-L203 WeakPolarHBondContact O-CD1 3.34Å; E170-L203 PolarHBondContact OE2-N 3.35Å; E170-L203 VanDerWaalsContact OE2-N 3.12Å; L173-L203 HydrophobicContact CB-CD1 3.93Å; W197-L203 HydrophobicContact CH2-CB 4.24Å; W197-L203 HydrophobicContact CH2-CD2 3.63Å; W197-L203 HydrophobicContact CZ2-CB 4.04Å; W197-L203 HydrophobicContact CZ2-CD2 3.95Å; A200-L203 PolarHBondContact O-N 3.14Å; L203-R205 VanDerWaalsContact C-N 3.32Å; L203-R205 PolarHBondContact O-N 2.93Å; L203-F206 PolarHBondContact O-N 3Å; L203-F206 VanDerWaalsContact O-N 3.16Å; L203-L207 HydrophobicContact CG-CD1 4.48Å; L203-L207 WeakPolarHBondContact O-CG 3.46Å; L203-L207 PolarHBondContact O-N 3.06Å; L203-F262 HydrophobicContact CD2-CD1 4.17Å; L203-F262 HydrophobicContact CD2-CE1 3.42Å; L203-F262 VanDerWaalsContact CD2-CE1 3.42Å; L203-F262 HydrophobicContact CD2-CZ 4.24Å
204	L	70.1	Confident	59.8	Low	32 Å²	32	73.6 Å²	73.6	17%	0.168	41%	0.414	C	S	.	.	H	α-helix	trans	-64.1	-37	175.6	-83.4	161.2	0	0	0	112.2	V191 L193 G202 F206 L207 D208 L228	V191-L204 HydrophobicContact CG1-CD2 4.19Å; V191-L204 HydrophobicContact CG2-CD2 4.12Å; L193-L204 HydrophobicContact CD1-CD1 4.38Å; L193-L204 HydrophobicContact CD2-CD1 4.17Å; G202-L204 PolarHBondContact O-N 3.39Å; L204-F206 VanDerWaalsContact C-N 3.33Å; L204-L207 PolarHBondContact O-N 2.87Å; L204-D208 WeakPolarHBondContact O-CB 3.43Å; L204-D208 PolarHBondContact O-N 3.35Å; L204-L228 HydrophobicContact CD1-CD1 4.44Å
205	R	69.6	Low	57.5	Low	191 Å²	191	85.4 Å²	85.4	72%	0.721	46%	0.458	S	S	*	.	H	α-helix	trans	-68	-33.3	173.6	-69.6	176.2	177.5	174.5	1.9	111.7	G201 G202 L203 S209	G201-R205 WeakPolarHBondContact O-CG 3.17Å; G202-R205 CarbonylContact O-C 3.51Å; G202-R205 WeakPolarHBondContact O-CA 3.48Å; G202-R205 WeakPolarHBondContact O-CB 3.44Å; G202-R205 PolarHBondContact O-N 3.46Å; L203-R205 VanDerWaalsContact C-N 3.32Å; L203-R205 PolarHBondContact O-N 2.93Å; R205-S209 WeakPolarHBondContact O-CB 3.24Å; R205-S209 PolarHBondContact O-N 3.49Å; R205-S209 PolarHBondContact O-OG 3.15Å
206	F	66.8	Low	55.7	Low	56 Å²	56	84.7 Å²	84.7	25%	0.246	47%	0.466	C	S	.	.	H	α-helix	trans	-68.8	-44.8	174.5	-72.8	-62.7	0	0	0	111.7	G202 L203 L204 D208 S209 Q210	G202-F206 WeakPolarHBondContact O-CD2 3.49Å; G202-F206 PolarHBondContact O-N 2.89Å; L203-F206 PolarHBondContact O-N 3Å; L203-F206 VanDerWaalsContact O-N 3.16Å; L204-F206 VanDerWaalsContact C-N 3.33Å; F206-D208 VanDerWaalsContact C-N 3.29Å; F206-D208 PolarHBondContact O-N 3.38Å; F206-S209 WeakPolarHBondContact CA-OG 3.42Å; F206-S209 PolarHBondContact O-N 3.45Å; F206-S209 PolarHBondContact O-OG 3.27Å; F206-Q210 VanDerWaalsContact O-CB 3.28Å; F206-Q210 WeakPolarHBondContact O-CB 3.44Å; F206-Q210 VanDerWaalsContact O-CG 3.28Å; F206-Q210 WeakPolarHBondContact O-CG 3.41Å; F206-Q210 PolarHBondContact O-N 3.1Å
207	L	69	Low	54.5	Low	6 Å²	6	86.6 Å²	86.6	3%	0.031	49%	0.486	C	S	.	.	H	α-helix	trans	-60.4	-38.5	174.7	-70.3	165.7	0	0	0	112.4	L177 L178 L203 L204 F262	L177-L207 HydrophobicContact CB-CD2 4.42Å; L177-L207 HydrophobicContact CD2-CD1 3.75Å; L177-L207 HydrophobicContact CD2-CD2 4.19Å; L178-L207 HydrophobicContact CB-CD2 4.5Å; L203-L207 HydrophobicContact CG-CD1 4.48Å; L203-L207 WeakPolarHBondContact O-CG 3.46Å; L203-L207 PolarHBondContact O-N 3.06Å; L204-L207 PolarHBondContact O-N 2.87Å; L207-F262 HydrophobicContact CD1-CZ 4.31Å
208	D	66.3	Low	53.2	Low	113 Å²	113	90.8 Å²	90.8	60%	0.604	52%	0.518	S	S	*	.	H	α-helix	trans	-74.7	-38.4	177.2	-164.9	41.8	0	0	0	112.3	L204 F206 T211	L204-D208 WeakPolarHBondContact O-CB 3.43Å; L204-D208 PolarHBondContact O-N 3.35Å; F206-D208 VanDerWaalsContact C-N 3.29Å; F206-D208 PolarHBondContact O-N 3.38Å; D208-T211 WeakPolarHBondContact O-CG2 3.47Å; D208-T211 PolarHBondContact O-OG1 3.39Å
209	S	59.4	Low	52.4	Low	69 Å²	69	86.4 Å²	86.4	48%	0.483	52%	0.516	S	S	.	.	H	α-helix	trans	-82.3	-25	-177.8	62.7	0	0	0	0	115.3	R205 F206 T211	R205-S209 WeakPolarHBondContact O-CB 3.24Å; R205-S209 PolarHBondContact O-N 3.49Å; R205-S209 PolarHBondContact O-OG 3.15Å; F206-S209 WeakPolarHBondContact CA-OG 3.42Å; F206-S209 PolarHBondContact O-N 3.45Å; F206-S209 PolarHBondContact O-OG 3.27Å; S209-T211 PolarHBondContact O-N 3.13Å
210	Q	56.6	Low	52	Low	80 Å²	80	81.3 Å²	81.3	37%	0.374	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	2.5	175.6	-71.1	-127.9	37.5	0	0	113.3	D175 L178 F206 S212	D175-Q210 PolarHBondContact OD1-NE2 2.76Å; L178-Q210 HydrophobicContact CD2-CB 4.42Å; F206-Q210 VanDerWaalsContact O-CB 3.28Å; F206-Q210 WeakPolarHBondContact O-CB 3.44Å; F206-Q210 VanDerWaalsContact O-CG 3.28Å; F206-Q210 WeakPolarHBondContact O-CG 3.41Å; F206-Q210 PolarHBondContact O-N 3.1Å; Q210-S212 PolarHBondContact O-N 3.01Å; Q210-S212 VanDerWaalsContact O-N 3.14Å
211	T	52.3	Low	52.2	Low	53 Å²	53	83.7 Å²	83.7	33%	0.325	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-3.3	173.5	56.2	0	0	0	0	114.2	D208 S209	D208-T211 WeakPolarHBondContact O-CG2 3.47Å; D208-T211 PolarHBondContact O-OG1 3.39Å; S209-T211 PolarHBondContact O-N 3.13Å
212	S	42.2	Very low	52.3	Low	103 Å²	103	85.9 Å²	85.9	72%	0.72	53%	0.528	S	S	*	.	S	Bend	trans	-132.5	82.9	177.3	63.9	0	0	0	0	112.6	Q210	Q210-S212 PolarHBondContact O-N 3.01Å; Q210-S212 VanDerWaalsContact O-N 3.14Å
213	G	40.3	Very low	52.8	Low	59 Å²	59	86 Å²	86	61%	0.608	52%	0.521	S	S	*	.			trans	-147.6	129.8	173.4	0	0	0	0	0	112.2
214	P	37.8	Very low	53	Low	124 Å²	124	91.8 Å²	91.8	81%	0.805	55%	0.548	S	S	*	.			trans	-99.4	121.6	-173.2	33.3	-27	0	0	0	112.7
215	W	29.9	Very low	53.4	Low	247 Å²	247	93.1 Å²	93.1	94%	0.936	56%	0.555	S	S	*	*			trans	-138.4	125.3	155.5	-99.8	67.8	0	0	0	111
216	D	33.2	Very low	53.7	Low	143 Å²	143	86.7 Å²	86.7	77%	0.765	53%	0.533	S	S	*	.	S	Bend	trans	39.2	98.1	168.4	-79.8	-14.6	0	0	0	120.9	S218	D216-S218 VanDerWaalsContact C-N 3.3Å; D216-S218 PolarHBondContact O-N 3.4Å
217	G	37.6	Very low	54.2	Low	95 Å²	95	85 Å²	85	98%	0.979	53%	0.529	S	S	*	.	S	Bend	trans	75.7	-15.6	130.4	0	0	0	0	0	119.8
218	S	38.6	Very low	54.8	Low	102 Å²	102	89 Å²	89	71%	0.713	55%	0.55	S	S	*	*	S	Bend	trans	-123.9	125.4	171.7	68	0	0	0	0	109.5	D216	D216-S218 VanDerWaalsContact C-N 3.3Å; D216-S218 PolarHBondContact O-N 3.4Å
219	G	38.7	Very low	55.5	Low	71 Å²	71	83.8 Å²	83.8	73%	0.732	52%	0.522	S	S	*	.			trans	-41.4	133.8	-164.7	0	0	0	0	0	115.8	V221	G219-V221 PolarHBondContact O-N 3.23Å
220	A	42.2	Very low	56.6	Low	89 Å²	89	84 Å²	84	74%	0.736	52%	0.518	S	S	*	.			trans	-53.9	118.7	178.7	0	0	0	0	0	111.2
221	V	52.8	Low	57.6	Low	64 Å²	64	80.4 Å²	80.4	39%	0.388	50%	0.501	S	S	.	.			trans	-90.4	103.7	174.4	-179	0	0	0	0	107.8	R187 G219	R187-V221 HydrophobicContact CG-CG1 4.22Å; G219-V221 PolarHBondContact O-N 3.23Å
222	T	61.3	Low	58.3	Low	81 Å²	81	79.1 Å²	79.1	50%	0.497	49%	0.493	S	S	.	.			trans	-85.8	129.9	175.5	54.3	0	0	0	0	110.3
223	W	73.4	Confident	59.2	Low	23 Å²	23	83.3 Å²	83.3	9%	0.087	50%	0.501	C	S	.	.			trans	-83	136.4	167.5	-175.3	84.8	0	0	0	110	L178 L181 W186 R187 V191 L225 L260	L178-W223 HydrophobicContact CD1-CB 4.45Å; L181-W223 HydrophobicContact CD1-CD2 4.19Å; L181-W223 HydrophobicContact CD1-CG 4.16Å; W186-W223 VanDerWaalsContact O-CD1 3.27Å; R187-W223 CarbonylContact O-C 3.55Å; R187-W223 WeakPolarHBondContact O-CA 3.43Å; V191-W223 HydrophobicContact CG2-CH2 4.07Å; W223-L225 HydrophobicContact CH2-CB 4.12Å; W223-L225 HydrophobicContact CH2-CD1 3.73Å; W223-L225 HydrophobicContact CZ3-CB 3.83Å; W223-L225 HydrophobicContact CZ3-CD1 4.2Å; W223-L260 HydrophobicContact CH2-CD1 3.85Å; W223-L260 HydrophobicContact CZ2-CD1 3.77Å; W223-L260 HydrophobicContact CZ2-CG 4.45Å
224	H	74.8	Confident	60.1	Low	127 Å²	127	81.4 Å²	81.4	59%	0.588	48%	0.479	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.5	123.9	-176.6	-171.1	62.8	0	0	0	111.6	R187 E188 G189 Q226	R187-H224 PolarHBondContact O-N 3.08Å; E188-H224 VanDerWaalsContact CA-O 3.25Å; E188-H224 WeakPolarHBondContact CA-O 3.25Å; G189-H224 PolarHBondContact N-O 3.47Å; G189-H224 VanDerWaalsContact N-O 3.1Å; H224-Q226 PolarHBondContact O-N 3.2Å
225	L	77.6	Confident	60.9	Low	60 Å²	60	77.5 Å²	77.5	31%	0.314	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	111.4	174.5	179.6	65.8	0	0	0	110.2	V191 W223 A227	V191-L225 HydrophobicContact CB-CD1 3.92Å; V191-L225 HydrophobicContact CG2-CD1 3.38Å; W223-L225 HydrophobicContact CH2-CB 4.12Å; W223-L225 HydrophobicContact CH2-CD1 3.73Å; W223-L225 HydrophobicContact CZ3-CB 3.83Å; W223-L225 HydrophobicContact CZ3-CD1 4.2Å; L225-A227 WeakPolarHBondContact CD1-O 3.48Å
226	Q	76	Confident	62.2	Low	56 Å²	56	74 Å²	74	26%	0.262	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	-43.6	-179.1	-173.7	-179.7	-8.7	0	0	112.2	G189 H224	G189-Q226 PolarHBondContact O-N 3.23Å; H224-Q226 PolarHBondContact O-N 3.2Å
227	A	77.9	Confident	63.8	Low	20 Å²	20	70.9 Å²	70.9	17%	0.165	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	149.8	179.8	0	0	0	0	0	111.7	T190 V191 L225	T190-A227 WeakPolarHBondContact CA-O 3.09Å; T190-A227 HydrophobicContact CG2-CB 4.11Å; T190-A227 WeakPolarHBondContact CG2-O 3.31Å; V191-A227 PolarHBondContact N-O 3.2Å; L225-A227 WeakPolarHBondContact CD1-O 3.48Å
228	L	80.9	Confident	65.3	Low	91 Å²	91	69.4 Å²	69.4	48%	0.476	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	115.9	172.7	-175.2	70	0	0	0	109.4	V191 L193 L204	V191-L228 HydrophobicContact CB-CD1 3.72Å; V191-L228 HydrophobicContact CG1-CD1 3.6Å; L193-L228 HydrophobicContact CD1-CD1 3.78Å; L193-L228 HydrophobicContact CD1-CD2 4.32Å; L193-L228 HydrophobicContact CD1-CG 4.24Å; L193-L228 HydrophobicContact CD2-CD1 4.48Å; L193-L228 HydrophobicContact CG-CD1 3.93Å; L204-L228 HydrophobicContact CD1-CD1 4.44Å
229	L	82.8	Confident	67.1	Low	2 Å²	2	68.5 Å²	68.5	1%	0.01	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	105.5	-177.9	-56.8	-170.1	0	0	0	109.9	T190 V191 V192 L193 F244 H248 F249	T190-L229 HydrophobicContact CG2-CD1 3.8Å; T190-L229 HydrophobicContact CG2-CG 3.77Å; V191-L229 PolarHBondContact O-N 3.39Å; V192-L229 CarbonylContact C-O 3.54Å; V192-L229 WeakPolarHBondContact CA-O 3.27Å; V192-L229 HydrophobicContact CG1-CB 4.49Å; V192-L229 HydrophobicContact CG2-CB 4.21Å; V192-L229 HydrophobicContact CG2-CD1 4.1Å; L193-L229 PolarHBondContact N-O 3.24Å; L229-F244 HydrophobicContact CB-CE1 4.12Å; L229-H248 HydrophobicContact CD1-CB 4.4Å; L229-H248 HydrophobicContact CD2-CB 4.26Å; L229-H248 VanDerWaalsContact CD2-CD2 3.4Å; L229-H248 WeakPolarHBondContact CD2-CD2 3.04Å; L229-H248 WeakPolarHBondContact CD2-CE1 3.33Å; L229-H248 VanDerWaalsContact CD2-ND1 3.31Å; L229-H248 WeakPolarHBondContact CD2-ND1 3.39Å; L229-H248 VanDerWaalsContact CD2-NE2 3.33Å; L229-H248 WeakPolarHBondContact CD2-NE2 3.48Å; L229-F249 HydrophobicContact CD1-CE2 3.92Å; L229-F249 HydrophobicContact CD1-CZ 4.34Å
230	N	81.6	Confident	69	Low	73 Å²	73	69.7 Å²	69.7	39%	0.39	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	114.7	-179.3	-166.1	-4.9	0	0	0	111.3	T232	N230-T232 PolarHBondContact ND2-OG1 3.46Å; N230-T232 WeakPolarHBondContact OD1-CB 3.46Å; N230-T232 WeakPolarHBondContact OD1-CG2 3.33Å; N230-T232 PolarHBondContact OD1-N 2.98Å; N230-T232 VanDerWaalsContact OD1-N 3.11Å; N230-T232 PolarHBondContact OD1-OG1 3.05Å
231	L	77.1	Confident	70.8	Confident	5 Å²	5	65.9 Å²	65.9	3%	0.026	35%	0.348	C	S	.	.			trans	-93.9	5.4	179	-65.9	166.6	0	0	0	113.2	V192 L193 Q233 S234 F244 V272	V192-L231 HydrophobicContact CG1-CD1 3.45Å; V192-L231 VanDerWaalsContact CG1-CD1 3.45Å; V192-L231 HydrophobicContact CG1-CG 4.14Å; L193-L231 VanDerWaalsContact O-CB 3.29Å; L193-L231 WeakPolarHBondContact O-CB 3.03Å; L193-L231 PolarHBondContact O-N 3.11Å; L231-Q233 PolarHBondContact O-N 3.36Å; L231-S234 PolarHBondContact O-N 2.99Å; L231-S234 VanDerWaalsContact O-N 3.11Å; L231-S234 PolarHBondContact O-OG 3.43Å; L231-F244 HydrophobicContact CD2-CB 4.43Å; L231-F244 HydrophobicContact CD2-CD1 3.31Å; L231-F244 HydrophobicContact CD2-CE1 3.54Å; L231-F244 HydrophobicContact CD2-CG 3.89Å; L231-F244 HydrophobicContact CD2-CZ 4.29Å; L231-F244 HydrophobicContact CG-CD1 4.43Å; L231-F244 HydrophobicContact CG-CE1 4.26Å; L231-V272 HydrophobicContact CD1-CG2 3.44Å; L231-V272 VanDerWaalsContact CD1-CG2 3.44Å
232	T	67.2	Low	72.2	Confident	26 Å²	26	65.4 Å²	65.4	16%	0.16	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-21	-176.1	56.2	0	0	0	0	114.4	N230	N230-T232 PolarHBondContact ND2-OG1 3.46Å; N230-T232 WeakPolarHBondContact OD1-CB 3.46Å; N230-T232 WeakPolarHBondContact OD1-CG2 3.33Å; N230-T232 PolarHBondContact OD1-N 2.98Å; N230-T232 VanDerWaalsContact OD1-N 3.11Å; N230-T232 PolarHBondContact OD1-OG1 3.05Å
233	Q	60.4	Low	73.2	Confident	191 Å²	191	65.9 Å²	65.9	89%	0.893	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-12.4	-179.1	-62.4	-176.1	8.1	0	0	114.7	L231	L231-Q233 PolarHBondContact O-N 3.36Å
234	S	61	Low	73.6	Confident	20 Å²	20	67 Å²	67	14%	0.14	35%	0.346	C	S	.	.	S	Bend	trans	-123	79.2	-173.7	55.9	0	0	0	0	110.1	L231	L231-S234 PolarHBondContact O-N 2.99Å; L231-S234 VanDerWaalsContact O-N 3.11Å; L231-S234 PolarHBondContact O-OG 3.43Å
235	A	53.8	Low	74	Confident	41 Å²	41	61 Å²	61	34%	0.339	32%	0.318	S	S	.	.			trans	-128.3	105.5	-171	0	0	0	0	0	110.9
236	H	57.5	Low	74.2	Confident	175 Å²	175	59 Å²	59	81%	0.81	31%	0.309	S	S	*	.	S	Bend	trans	158.4	-14.3	140.5	-76.8	-26.3	0	0	0	112.7
237	D	67.3	Low	74.4	Confident	77 Å²	77	64.1 Å²	64.1	41%	0.412	33%	0.326	S	S	.	.			trans	-111.5	119.8	-175.5	-155.7	-25	0	0	0	110.4	T239 Q240 I241	D237-T239 PolarHBondContact O-N 3.01Å; D237-T239 VanDerWaalsContact O-N 3.08Å; D237-T239 PolarHBondContact OD1-N 3.02Å; D237-T239 PolarHBondContact OD1-OG1 2.99Å; D237-T239 PolarHBondContact OD2-OG1 2.94Å; D237-Q240 HydrophobicContact CB-CB 4.37Å; D237-Q240 HydrophobicContact CB-CG 3.99Å; D237-Q240 PolarHBondContact O-N 3.26Å; D237-I241 PolarHBondContact O-N 2.99Å
238	D	68.7	Low	74.3	Confident	63 Å²	63	67.3 Å²	67.3	34%	0.337	34%	0.338	S	S	.	.	H	α-helix	trans	-50.7	-33	176	-75.1	-15.9	0	0	0	110.4	I241 H242 A271 R274	D238-I241 PolarHBondContact O-N 3.49Å; D238-H242 WeakPolarHBondContact O-CB 3.46Å; D238-H242 PolarHBondContact O-N 3.22Å; D238-A271 WeakPolarHBondContact OD1-CB 3.32Å; D238-R274 IonicContact OD1-CZ 2.81Å; D238-R274 IonicContact OD1-NH1 3.74Å; D238-R274 IonicContact OD1-NH2 3.78Å; D238-R274 PolarHBondContact OD1-NH2 3.25Å; D238-R274 IonicContact OD2-CZ 3.56Å; D238-R274 IonicContact OD2-NH1 3.43Å; D238-R274 PolarHBondContact OD2-NH1 2.82Å; D238-R274 IonicContact OD2-NH2 3.92Å; D238-R274 PolarHBondContact OD2-NH2 3.43Å; D238-R274 VanDerWaalsContact OD2-NH2 3.17Å
239	T	75	Confident	74	Confident	84 Å²	84	64.4 Å²	64.4	52%	0.515	32%	0.321	S	S	.	.	H	α-helix	trans	-66.6	-38.3	177.8	61.2	0	0	0	0	113.4	D237 H242 D243	D237-T239 PolarHBondContact O-N 3.01Å; D237-T239 VanDerWaalsContact O-N 3.08Å; D237-T239 PolarHBondContact OD1-N 3.02Å; D237-T239 PolarHBondContact OD1-OG1 2.99Å; D237-T239 PolarHBondContact OD2-OG1 2.94Å; T239-H242 PolarHBondContact O-N 3.42Å; T239-D243 WeakPolarHBondContact O-CB 3.46Å; T239-D243 PolarHBondContact O-N 2.89Å
240	Q	79.5	Confident	73.2	Confident	95 Å²	95	74.2 Å²	74.2	44%	0.444	36%	0.358	S	S	.	.	H	α-helix	trans	-71.6	-36.6	178.6	-68.5	178.2	21.3	0	0	111.7	D237 F244	D237-Q240 HydrophobicContact CB-CB 4.37Å; D237-Q240 HydrophobicContact CB-CG 3.99Å; D237-Q240 PolarHBondContact O-N 3.26Å; Q240-F244 VanDerWaalsContact O-CB 3.29Å; Q240-F244 WeakPolarHBondContact O-CB 3.25Å; Q240-F244 PolarHBondContact O-N 3.44Å
241	I	80.8	Confident	71.9	Confident	9 Å²	9	80.6 Å²	80.6	5%	0.046	38%	0.377	C	S	.	.	H	α-helix	trans	-66.5	-46.3	175	-63.3	172	0	0	0	109.5	D237 D238 D243 F244 L245 A271 V272	D237-I241 PolarHBondContact O-N 2.99Å; D238-I241 PolarHBondContact O-N 3.49Å; I241-D243 PolarHBondContact O-N 3.46Å; I241-F244 PolarHBondContact O-N 2.96Å; I241-L245 HydrophobicContact CG2-CD1 4.07Å; I241-L245 HydrophobicContact CG2-CG 4.45Å; I241-L245 WeakPolarHBondContact O-CG 3.07Å; I241-L245 PolarHBondContact O-N 3.24Å; I241-A271 HydrophobicContact CD1-CB 3.83Å; I241-V272 HydrophobicContact CG2-CG2 3.91Å
242	H	82.1	Confident	70.4	Confident	55 Å²	55	88.6 Å²	88.6	26%	0.255	42%	0.419	S	S	.	.	H	α-helix	trans	-56.7	-47.5	174.9	-174.5	94.3	0	0	0	112.1	D238 T239 F244 L245 S246 L279	D238-H242 WeakPolarHBondContact O-CB 3.46Å; D238-H242 PolarHBondContact O-N 3.22Å; T239-H242 PolarHBondContact O-N 3.42Å; H242-F244 VanDerWaalsContact C-N 3.33Å; H242-F244 PolarHBondContact O-N 3.45Å; H242-L245 PolarHBondContact O-N 2.87Å; H242-S246 VanDerWaalsContact O-CB 3.28Å; H242-S246 WeakPolarHBondContact O-CB 3.33Å; H242-S246 PolarHBondContact O-N 3.49Å; H242-S246 PolarHBondContact O-OG 3.12Å; H242-L279 WeakPolarHBondContact CE1-CD2 3.48Å; H242-L279 VanDerWaalsContact CE1-CG 3.46Å; H242-L279 WeakPolarHBondContact CE1-CG 3.42Å; H242-L279 WeakPolarHBondContact NE2-CD2 3.4Å
243	D	81.3	Confident	69.8	Low	90 Å²	90	93.3 Å²	93.3	48%	0.481	44%	0.44	S	S	.	.	H	α-helix	trans	-66.3	-32.5	177.5	-87	-6.4	0	0	0	113.5	T239 I241 S246 R247	T239-D243 WeakPolarHBondContact O-CB 3.46Å; T239-D243 PolarHBondContact O-N 2.89Å; I241-D243 PolarHBondContact O-N 3.46Å; D243-S246 WeakPolarHBondContact CA-OG 3.43Å; D243-S246 PolarHBondContact O-OG 2.88Å; D243-R247 WeakPolarHBondContact O-CB 3.16Å; D243-R247 VanDerWaalsContact O-CG 3.31Å; D243-R247 WeakPolarHBondContact O-CG 3.43Å; D243-R247 PolarHBondContact O-N 3.08Å; D243-R247 PolarHBondContact O-NE 2.98Å
244	F	83.3	Confident	69.7	Low	48 Å²	48	89 Å²	89	21%	0.211	43%	0.428	C	S	.	.	H	α-helix	trans	-69.9	-47.5	176.6	-179.4	-89.6	0	0	0	111.3	L229 L231 Q240 I241 H242 R247 H248	L229-F244 HydrophobicContact CB-CE1 4.12Å; L231-F244 HydrophobicContact CD2-CB 4.43Å; L231-F244 HydrophobicContact CD2-CD1 3.31Å; L231-F244 HydrophobicContact CD2-CE1 3.54Å; L231-F244 HydrophobicContact CD2-CG 3.89Å; L231-F244 HydrophobicContact CD2-CZ 4.29Å; L231-F244 HydrophobicContact CG-CD1 4.43Å; L231-F244 HydrophobicContact CG-CE1 4.26Å; Q240-F244 VanDerWaalsContact O-CB 3.29Å; Q240-F244 WeakPolarHBondContact O-CB 3.25Å; Q240-F244 PolarHBondContact O-N 3.44Å; I241-F244 PolarHBondContact O-N 2.96Å; H242-F244 VanDerWaalsContact C-N 3.33Å; H242-F244 PolarHBondContact O-N 3.45Å; F244-R247 PolarHBondContact O-N 3.2Å; F244-H248 PolarHBondContact O-N 3.08Å
245	L	82.6	Confident	69.8	Low	0 Å²	0	90.6 Å²	90.6	0%	0	44%	0.438	C	S	.	.	H	α-helix	trans	-63.8	-44.8	176.8	-66.8	174.6	0	0	0	111.1	I241 H242 R247 H248 F249 V272 L279	I241-L245 HydrophobicContact CG2-CD1 4.07Å; I241-L245 HydrophobicContact CG2-CG 4.45Å; I241-L245 WeakPolarHBondContact O-CG 3.07Å; I241-L245 PolarHBondContact O-N 3.24Å; H242-L245 PolarHBondContact O-N 2.87Å; L245-R247 VanDerWaalsContact C-N 3.34Å; L245-R247 PolarHBondContact O-N 3.2Å; L245-H248 PolarHBondContact O-N 3.1Å; L245-H248 VanDerWaalsContact O-N 3.16Å; L245-F249 HydrophobicContact CB-CD2 4.49Å; L245-F249 HydrophobicContact CD2-CE2 4.09Å; L245-F249 WeakPolarHBondContact O-CD2 3.47Å; L245-F249 PolarHBondContact O-N 3.22Å; L245-V272 HydrophobicContact CD1-CG1 4.27Å; L245-L279 HydrophobicContact CB-CD1 3.65Å
246	S	80.9	Confident	70.5	Confident	18 Å²	18	88.8 Å²	88.8	13%	0.126	42%	0.423	C	S	.	.	H	α-helix	trans	-61.5	-40.6	-179.3	76.8	0	0	0	0	112.3	H242 D243 H248 R250	H242-S246 VanDerWaalsContact O-CB 3.28Å; H242-S246 WeakPolarHBondContact O-CB 3.33Å; H242-S246 PolarHBondContact O-N 3.49Å; H242-S246 PolarHBondContact O-OG 3.12Å; D243-S246 WeakPolarHBondContact CA-OG 3.43Å; D243-S246 PolarHBondContact O-OG 2.88Å; S246-H248 VanDerWaalsContact C-N 3.34Å; S246-H248 PolarHBondContact O-N 3.33Å; S246-R250 WeakPolarHBondContact O-CB 3.34Å; S246-R250 WeakPolarHBondContact O-CG 3.32Å; S246-R250 PolarHBondContact O-N 2.93Å
247	R	79.9	Confident	71	Confident	164 Å²	164	81.9 Å²	81.9	62%	0.619	40%	0.396	S	S	*	.	H	α-helix	trans	-63.3	-37.2	175.8	-82	179.7	-78.6	150.8	-9.3	112.9	D243 F244 L245	D243-R247 WeakPolarHBondContact O-CB 3.16Å; D243-R247 VanDerWaalsContact O-CG 3.31Å; D243-R247 WeakPolarHBondContact O-CG 3.43Å; D243-R247 PolarHBondContact O-N 3.08Å; D243-R247 PolarHBondContact O-NE 2.98Å; F244-R247 PolarHBondContact O-N 3.2Å; L245-R247 VanDerWaalsContact C-N 3.34Å; L245-R247 PolarHBondContact O-N 3.2Å
248	H	75.8	Confident	71.8	Confident	86 Å²	86	78.2 Å²	78.2	40%	0.398	38%	0.377	S	S	.	.	H	α-helix	trans	-81.2	-42.2	-176.3	-148.7	96.9	0	0	0	112.4	L229 F244 L245 S246	L229-H248 HydrophobicContact CD1-CB 4.4Å; L229-H248 HydrophobicContact CD2-CB 4.26Å; L229-H248 VanDerWaalsContact CD2-CD2 3.4Å; L229-H248 WeakPolarHBondContact CD2-CD2 3.04Å; L229-H248 WeakPolarHBondContact CD2-CE1 3.33Å; L229-H248 VanDerWaalsContact CD2-ND1 3.31Å; L229-H248 WeakPolarHBondContact CD2-ND1 3.39Å; L229-H248 VanDerWaalsContact CD2-NE2 3.33Å; L229-H248 WeakPolarHBondContact CD2-NE2 3.48Å; F244-H248 PolarHBondContact O-N 3.08Å; L245-H248 PolarHBondContact O-N 3.1Å; L245-H248 VanDerWaalsContact O-N 3.16Å; S246-H248 VanDerWaalsContact C-N 3.34Å; S246-H248 PolarHBondContact O-N 3.33Å
249	F	74.9	Confident	72.6	Confident	31 Å²	31	75.2 Å²	75.2	14%	0.136	36%	0.361	C	S	.	.	H	α-helix	trans	-81.9	-17.2	-179.1	-74	-83.1	0	0	0	114.2	L229 L245 R251 P255 V259 L281	L229-F249 HydrophobicContact CD1-CE2 3.92Å; L229-F249 HydrophobicContact CD1-CZ 4.34Å; L245-F249 HydrophobicContact CB-CD2 4.49Å; L245-F249 HydrophobicContact CD2-CE2 4.09Å; L245-F249 WeakPolarHBondContact O-CD2 3.47Å; L245-F249 PolarHBondContact O-N 3.22Å; F249-R251 VanDerWaalsContact C-N 3.34Å; F249-P255 HydrophobicContact CD1-CB 4.27Å; F249-V259 HydrophobicContact CE1-CG2 4.31Å; F249-V259 HydrophobicContact CZ-CG2 4.04Å; F249-L281 HydrophobicContact CB-CD1 4.02Å; F249-L281 HydrophobicContact CB-CD2 4.02Å; F249-L281 HydrophobicContact CD1-CD1 4.36Å; F249-L281 HydrophobicContact CD1-CD2 4.09Å; F249-L281 HydrophobicContact CD2-CD1 3.59Å; F249-L281 HydrophobicContact CE2-CD1 4.12Å; F249-L281 HydrophobicContact CG-CD1 3.74Å; F249-L281 HydrophobicContact CG-CD2 4.05Å
250	R	66.1	Low	73.2	Confident	208 Å²	208	71.3 Å²	71.3	79%	0.785	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-11.6	172.8	-78.7	-176.3	-179.3	-162.6	3.6	114.6	S246 N252	S246-R250 WeakPolarHBondContact O-CB 3.34Å; S246-R250 WeakPolarHBondContact O-CG 3.32Å; S246-R250 PolarHBondContact O-N 2.93Å; R250-N252 PolarHBondContact O-N 2.68Å
251	R	55.6	Low	73.5	Confident	206 Å²	206	67 Å²	67	78%	0.777	32%	0.316	S	S	*	.	S	Bend	trans	-83.8	71.9	-167.6	-157.6	178.5	-166.7	-177.7	3.9	112.5	F249 Q253	F249-R251 VanDerWaalsContact C-N 3.34Å; R251-Q253 PolarHBondContact O-N 3.19Å
252	N	43.7	Very low	73.6	Confident	173 Å²	173	66.5 Å²	66.5	93%	0.925	31%	0.314	S	S	*	.	S	Bend	trans	45.4	7.1	166.4	-85.9	0.3	0	0	0	119.2	R250	R250-N252 PolarHBondContact O-N 2.68Å
253	Q	55.5	Low	73.2	Confident	125 Å²	125	64.1 Å²	64.1	58%	0.584	30%	0.304	S	S	*	.	S	Bend	trans	-103.9	136.5	173.4	-68.7	-174.6	3	0	0	108.2	R251	R251-Q253 PolarHBondContact O-N 3.19Å
254	P	58.9	Low	72.4	Confident	100 Å²	100	62.9 Å²	62.9	65%	0.649	31%	0.307	S	S	*	.	P	Polyproline II helix	trans	-58	137.7	172.9	25.5	-32.4	0	0	0	109.2
255	P	62.8	Low	72	Confident	55 Å²	55	63.8 Å²	63.8	36%	0.357	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-60.8	139.6	174.7	25.7	-32.7	0	0	0	109.5	F249 V286	F249-P255 HydrophobicContact CD1-CB 4.27Å; P255-V286 HydrophobicContact CB-CG2 3.81Å; P255-V286 HydrophobicContact CG-CG2 4.47Å
256	P	68.4	Low	71.7	Confident	3 Å²	3	66 Å²	66	2%	0.019	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-61.8	157.1	178.2	26.8	-36.8	0	0	0	111.4	T190 A258 V259	T190-P256 WeakPolarHBondContact OG1-CG 3.18Å; P256-A258 PolarHBondContact O-N 2.87Å; P256-V259 HydrophobicContact CG-CG2 3.97Å
257	A	68.8	Low	71.6	Confident	30 Å²	30	72.4 Å²	72.4	25%	0.248	36%	0.356	C	S	.	.	S	Bend	trans	-62.2	-29.3	175.2	0	0	0	0	0	112.9	W186 H287	W186-A257 HydrophobicContact CG-CB 4.3Å; A257-H287 PolarHBondContact O-CD2 2.91Å; A257-H287 PolarHBondContact O-N 2.77Å; A257-H287 VanDerWaalsContact O-N 3.15Å
258	A	83.1	Confident	71.6	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	144.4	180	0	0	0	0	0	113.1	W186 G189 T190 P256 H287	W186-A258 HydrophobicContact CB-CB 3.98Å; W186-A258 HydrophobicContact CD2-CB 3.61Å; W186-A258 HydrophobicContact CE3-CB 3.47Å; W186-A258 VanDerWaalsContact CE3-CB 3.47Å; W186-A258 HydrophobicContact CG-CB 3.85Å; W186-A258 HydrophobicContact CZ3-CB 4.25Å; G189-A258 WeakPolarHBondContact CA-O 2.89Å; T190-A258 PolarHBondContact N-O 3.1Å; T190-A258 VanDerWaalsContact N-O 3.09Å; P256-A258 PolarHBondContact O-N 2.87Å; A258-H287 CarbonylContact C-O 3.56Å; A258-H287 WeakPolarHBondContact CA-O 3.45Å
259	V	86.2	Confident	71.9	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	123	172	177.6	0	0	0	0	109.4	T190 V192 F249 P256 V286 H287 W288 V289	T190-V259 CarbonylContact O-C 3.51Å; T190-V259 VanDerWaalsContact O-CA 3.27Å; T190-V259 WeakPolarHBondContact O-CA 3.49Å; V192-V259 HydrophobicContact CG2-CG1 3.69Å; F249-V259 HydrophobicContact CE1-CG2 4.31Å; F249-V259 HydrophobicContact CZ-CG2 4.04Å; P256-V259 HydrophobicContact CG-CG2 3.97Å; V259-V286 HydrophobicContact CB-CG1 3.99Å; V259-V286 HydrophobicContact CG2-CG1 3.41Å; V259-V286 VanDerWaalsContact CG2-CG1 3.41Å; V259-H287 PolarHBondContact N-O 2.95Å; V259-W288 HydrophobicContact CB-CD2 4.24Å; V259-W288 HydrophobicContact CB-CE3 4.19Å; V259-W288 HydrophobicContact CB-CH2 4.5Å; V259-W288 HydrophobicContact CB-CZ3 4.33Å; V259-W288 HydrophobicContact CG1-CD2 4.31Å; V259-W288 HydrophobicContact CG1-CE3 3.81Å; V259-W288 HydrophobicContact CG1-CH2 3.76Å; V259-W288 HydrophobicContact CG1-CZ2 4.23Å; V259-W288 HydrophobicContact CG1-CZ3 3.52Å; V259-V289 PolarHBondContact O-N 2.94Å
260	L	87.1	Confident	72.2	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.005	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	124.6	176.5	-62.2	177.8	0	0	0	109.5	L177 L181 T190 V191 V192 W223 F262 V289	L177-L260 HydrophobicContact CD1-CD2 4.01Å; L177-L260 HydrophobicContact CD2-CD1 3.97Å; L177-L260 HydrophobicContact CD2-CD2 4.2Å; L177-L260 HydrophobicContact CG-CD2 4.43Å; L181-L260 HydrophobicContact CD1-CD1 4.29Å; L181-L260 HydrophobicContact CD2-CD2 4.14Å; T190-L260 PolarHBondContact O-N 2.86Å; V191-L260 CarbonylContact C-O 3.52Å; V191-L260 WeakPolarHBondContact CA-O 3.23Å; V191-L260 HydrophobicContact CG2-CB 4.06Å; V191-L260 HydrophobicContact CG2-CD1 3.99Å; V192-L260 PolarHBondContact N-O 2.97Å; W223-L260 HydrophobicContact CH2-CD1 3.85Å; W223-L260 HydrophobicContact CZ2-CD1 3.77Å; W223-L260 HydrophobicContact CZ2-CG 4.45Å; L260-F262 HydrophobicContact CB-CD2 4.44Å; L260-F262 HydrophobicContact CB-CE2 3.8Å; L260-F262 HydrophobicContact CD1-CE2 4.25Å; L260-F262 HydrophobicContact CD1-CZ 4.46Å; L260-V289 WeakPolarHBondContact CA-O 3.46Å; L260-V289 HydrophobicContact CD2-CB 3.81Å; L260-V289 HydrophobicContact CD2-CG1 4.24Å; L260-V289 HydrophobicContact CD2-CG2 4.35Å
261	L	86.6	Confident	72.9	Confident	4 Å²	4	52 Å²	52	2%	0.021	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	113.8	177.6	179.6	61.7	0	0	0	110.4	V192 A269 V272 L273 W288 V289 L290 G291	V192-L261 HydrophobicContact CB-CD1 3.88Å; V192-L261 HydrophobicContact CG1-CD1 3.91Å; L261-A269 HydrophobicContact CD2-CB 3.92Å; L261-V272 HydrophobicContact CD1-CB 4.32Å; L261-V272 HydrophobicContact CD1-CG1 3.96Å; L261-V272 HydrophobicContact CD1-CG2 4.49Å; L261-V272 HydrophobicContact CD2-CB 4.49Å; L261-V272 HydrophobicContact CD2-CG1 4.39Å; L261-L273 HydrophobicContact CD2-CD1 4Å; L261-L273 HydrophobicContact CD2-CD2 4.14Å; L261-L273 HydrophobicContact CD2-CG 3.82Å; L261-W288 HydrophobicContact CB-CE3 4.31Å; L261-W288 HydrophobicContact CB-CZ3 4.39Å; L261-V289 PolarHBondContact N-O 3.35Å; L261-L290 HydrophobicContact CB-CD2 4.4Å; L261-L290 HydrophobicContact CD2-CD2 4.06Å; L261-G291 PolarHBondContact O-N 3.28Å
262	F	82.4	Confident	74.4	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	130.9	173.4	-64.4	-89.1	0	0	0	110.2	L177 V191 V192 L193 C194 W197 L203 L207 L260 G291 Q292	L177-F262 HydrophobicContact CD2-CZ 3.99Å; V191-F262 HydrophobicContact CG1-CD2 3.56Å; V191-F262 HydrophobicContact CG1-CE2 3.72Å; V191-F262 HydrophobicContact CG2-CE2 4.26Å; V192-F262 PolarHBondContact O-N 3.08Å; L193-F262 HydrophobicContact CD2-CB 3.78Å; L193-F262 HydrophobicContact CD2-CD2 3.99Å; L193-F262 HydrophobicContact CD2-CG 4.2Å; C194-F262 WeakPolarHBondContact CB-O 3.4Å; C194-F262 PolarHBondContact N-O 3.04Å; W197-F262 HydrophobicContact CD2-CB 3.9Å; W197-F262 HydrophobicContact CD2-CG 4.45Å; W197-F262 HydrophobicContact CE3-CB 4Å; W197-F262 HydrophobicContact CE3-CD1 4.41Å; W197-F262 HydrophobicContact CG-CB 4.46Å; W197-F262 HydrophobicContact CH2-CB 4.44Å; W197-F262 AromaticContact CH2-CD1 3.38Å; W197-F262 HydrophobicContact CH2-CD1 3.38Å; W197-F262 AromaticContact CH2-CE1 3.97Å; W197-F262 HydrophobicContact CH2-CE1 3.97Å; W197-F262 HydrophobicContact CH2-CG 4.19Å; W197-F262 HydrophobicContact CZ2-CB 4.31Å; W197-F262 AromaticContact CZ2-CD1 3.48Å; W197-F262 HydrophobicContact CZ2-CD1 3.48Å; W197-F262 VanDerWaalsContact CZ2-CD1 3.48Å; W197-F262 AromaticContact CZ2-CE1 3.98Å; W197-F262 HydrophobicContact CZ2-CE1 3.98Å; W197-F262 AromaticContact CZ2-CG 3.97Å; W197-F262 HydrophobicContact CZ2-CG 3.97Å; W197-F262 HydrophobicContact CZ3-CB 4.29Å; W197-F262 AromaticContact CZ3-CD1 3.88Å; W197-F262 HydrophobicContact CZ3-CD1 3.88Å; W197-F262 HydrophobicContact CZ3-CG 4.49Å; L203-F262 HydrophobicContact CD2-CD1 4.17Å; L203-F262 HydrophobicContact CD2-CE1 3.42Å; L203-F262 VanDerWaalsContact CD2-CE1 3.42Å; L203-F262 HydrophobicContact CD2-CZ 4.24Å; L207-F262 HydrophobicContact CD1-CZ 4.31Å; L260-F262 HydrophobicContact CB-CD2 4.44Å; L260-F262 HydrophobicContact CB-CE2 3.8Å; L260-F262 HydrophobicContact CD1-CE2 4.25Å; L260-F262 HydrophobicContact CD1-CZ 4.46Å; F262-G291 WeakPolarHBondContact CD1-O 3.26Å; F262-G291 WeakPolarHBondContact CE1-O 3.08Å; F262-Q292 HydrophobicContact CD1-CG 4.32Å
263	G	73.5	Confident	76.4	Confident	5 Å²	5	34 Å²	34	5%	0.052	21%	0.205	C	C	.	.			trans	-178.2	122.3	179.2	0	0	0	0	0	111.5	Q292	G263-Q292 PolarHBondContact O-OE1 2.99Å
264	A	64.3	Low	77.8	Confident	64 Å²	64	32.6 Å²	32.6	53%	0.529	19%	0.194	S	C	.	.	S	Bend	trans	-74.5	-20.4	174.2	0	0	0	0	0	112.1	P266 Q292	A264-P266 WeakPolarHBondContact O-CD 3.37Å; A264-Q292 VanDerWaalsContact N-OE1 3.12Å
265	D	74.8	Confident	79	Confident	66 Å²	66	28 Å²	28	35%	0.353	17%	0.165	S	C	.	.			trans	-89.8	112.2	177.5	179.6	15.5	0	0	0	111	E267 C268 A269	D265-E267 PolarHBondContact O-N 2.82Å; D265-E267 PolarHBondContact OD1-N 3.1Å; D265-E267 VanDerWaalsContact OD1-N 3.1Å; D265-C268 HydrophobicContact CB-CB 4.19Å; D265-C268 PolarHBondContact O-N 3.19Å; D265-A269 PolarHBondContact O-N 3.28Å
266	P	76.3	Confident	80	Confident	46 Å²	46	25.4 Å²	25.4	30%	0.299	15%	0.148	S	C	.	.	H	α-helix	trans	-65.3	-26.7	-180	27.7	-34.7	0	0	0	112.6	A264 A269 A270 V298	A264-P266 WeakPolarHBondContact O-CD 3.37Å; P266-A269 PolarHBondContact O-N 3.3Å; P266-A270 WeakPolarHBondContact O-CB 3.16Å; P266-A270 PolarHBondContact O-N 2.84Å; P266-V298 HydrophobicContact CB-CG1 4.15Å; P266-V298 HydrophobicContact CG-CG1 4.33Å
267	E	78.6	Confident	80.6	Confident	153 Å²	153	29.6 Å²	29.6	72%	0.715	17%	0.167	S	C	*	.	H	α-helix	trans	-69.3	-43.4	179.3	-63.4	-170.6	172	0	0	111.2	D265 A270 A271	D265-E267 PolarHBondContact O-N 2.82Å; D265-E267 PolarHBondContact OD1-N 3.1Å; D265-E267 VanDerWaalsContact OD1-N 3.1Å; E267-A270 PolarHBondContact O-N 2.88Å; E267-A271 WeakPolarHBondContact O-CB 3.5Å; E267-A271 PolarHBondContact O-N 3.1Å
268	C	80.9	Confident	81.2	Confident	22 Å²	22	34.1 Å²	34.1	15%	0.149	19%	0.187	C	C	.	.	H	α-helix	trans	-61.1	-45.6	173.7	-175.7	0	0	0	0	111.7	C194 D265 A270 A271 V272	C194-C268 HydrophobicContact CB-CB 3.85Å; C194-C268 WeakPolarHBondContact CB-SG 3.08Å; C194-C268 WeakPolarHBondContact SG-CB 3.44Å; C194-C268 CovalentContact SG-SG 2.05Å; C194-C268 PolarHBondContact SG-SG 2.64Å; D265-C268 HydrophobicContact CB-CB 4.19Å; D265-C268 PolarHBondContact O-N 3.19Å; C268-A270 PolarHBondContact O-N 3.18Å; C268-A271 PolarHBondContact O-N 2.84Å; C268-V272 WeakPolarHBondContact O-CG2 3.31Å; C268-V272 PolarHBondContact O-N 2.97Å
269	A	80.9	Confident	81	Confident	2 Å²	2	36.2 Å²	36.2	2%	0.017	20%	0.198	C	C	.	.	H	α-helix	trans	-61.7	-43.8	179.7	0	0	0	0	0	111.8	L261 D265 P266 V272 L273	L261-A269 HydrophobicContact CD2-CB 3.92Å; D265-A269 PolarHBondContact O-N 3.28Å; P266-A269 PolarHBondContact O-N 3.3Å; A269-V272 PolarHBondContact O-N 3.16Å; A269-L273 WeakPolarHBondContact O-CB 3.27Å; A269-L273 WeakPolarHBondContact O-CD1 3.44Å; A269-L273 VanDerWaalsContact O-CG 3.25Å; A269-L273 WeakPolarHBondContact O-CG 3.39Å; A269-L273 PolarHBondContact O-N 2.56Å; A269-L273 VanDerWaalsContact O-N 3.09Å
270	A	81.5	Confident	80.4	Confident	30 Å²	30	37.9 Å²	37.9	25%	0.248	22%	0.215	C	C	.	.	H	α-helix	trans	-64.5	-40.1	176.1	0	0	0	0	0	112.6	P266 E267 C268 L273 R274	P266-A270 WeakPolarHBondContact O-CB 3.16Å; P266-A270 PolarHBondContact O-N 2.84Å; E267-A270 PolarHBondContact O-N 2.88Å; C268-A270 PolarHBondContact O-N 3.18Å; A270-L273 PolarHBondContact O-N 2.9Å; A270-R274 WeakPolarHBondContact O-CB 3.2Å; A270-R274 WeakPolarHBondContact O-CG 3.42Å; A270-R274 PolarHBondContact O-N 2.83Å
271	A	82.1	Confident	79.8	Confident	7 Å²	7	38.8 Å²	38.8	6%	0.058	22%	0.22	C	C	.	.	H	α-helix	trans	-64.1	-41.2	177.3	0	0	0	0	0	112.9	D238 I241 E267 C268 S275	D238-A271 WeakPolarHBondContact OD1-CB 3.32Å; I241-A271 HydrophobicContact CD1-CB 3.83Å; E267-A271 WeakPolarHBondContact O-CB 3.5Å; E267-A271 PolarHBondContact O-N 3.1Å; C268-A271 PolarHBondContact O-N 2.84Å; A271-S275 WeakPolarHBondContact O-CB 3.34Å; A271-S275 PolarHBondContact O-N 2.78Å; A271-S275 PolarHBondContact O-OG 2.91Å
272	V	85.2	Confident	79.3	Confident	0 Å²	0	40 Å²	40	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-63.1	-45.5	175.1	171.6	0	0	0	0	111.1	V192 L231 I241 L245 L261 C268 A269 S275 A276 W288	V192-V272 HydrophobicContact CG1-CG1 4.34Å; L231-V272 HydrophobicContact CD1-CG2 3.44Å; L231-V272 VanDerWaalsContact CD1-CG2 3.44Å; I241-V272 HydrophobicContact CG2-CG2 3.91Å; L245-V272 HydrophobicContact CD1-CG1 4.27Å; L261-V272 HydrophobicContact CD1-CB 4.32Å; L261-V272 HydrophobicContact CD1-CG1 3.96Å; L261-V272 HydrophobicContact CD1-CG2 4.49Å; L261-V272 HydrophobicContact CD2-CB 4.49Å; L261-V272 HydrophobicContact CD2-CG1 4.39Å; C268-V272 WeakPolarHBondContact O-CG2 3.31Å; C268-V272 PolarHBondContact O-N 2.97Å; A269-V272 PolarHBondContact O-N 3.16Å; V272-S275 PolarHBondContact O-N 3.05Å; V272-A276 WeakPolarHBondContact O-CB 3.29Å; V272-A276 PolarHBondContact O-N 2.88Å; V272-W288 HydrophobicContact CG1-CH2 3.9Å; V272-W288 HydrophobicContact CG1-CZ3 3.84Å
273	L	86.3	Confident	78.2	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-68.9	-38.7	-178.4	-69.8	169.7	0	0	0	112.5	L261 A269 A270 A276 Q277 W288 L290 L304 P305 L308	L261-L273 HydrophobicContact CD2-CD1 4Å; L261-L273 HydrophobicContact CD2-CD2 4.14Å; L261-L273 HydrophobicContact CD2-CG 3.82Å; A269-L273 WeakPolarHBondContact O-CB 3.27Å; A269-L273 WeakPolarHBondContact O-CD1 3.44Å; A269-L273 VanDerWaalsContact O-CG 3.25Å; A269-L273 WeakPolarHBondContact O-CG 3.39Å; A269-L273 PolarHBondContact O-N 2.56Å; A269-L273 VanDerWaalsContact O-N 3.09Å; A270-L273 PolarHBondContact O-N 2.9Å; L273-A276 PolarHBondContact O-N 3.46Å; L273-Q277 PolarHBondContact O-N 2.8Å; L273-W288 HydrophobicContact CD2-CB 4.05Å; L273-W288 HydrophobicContact CD2-CD2 3.64Å; L273-W288 HydrophobicContact CD2-CE3 3.51Å; L273-W288 HydrophobicContact CD2-CG 3.88Å; L273-W288 HydrophobicContact CD2-CZ3 4.2Å; L273-L290 HydrophobicContact CD1-CD2 4.39Å; L273-L304 HydrophobicContact CB-CD2 4.04Å; L273-L304 HydrophobicContact CD1-CD2 3.74Å; L273-P305 HydrophobicContact CB-CG 4.34Å; L273-P305 HydrophobicContact CD2-CG 3.9Å; L273-L308 HydrophobicContact CD1-CD1 4.2Å; L273-L308 HydrophobicContact CD1-CD2 3.83Å; L273-L308 HydrophobicContact CD2-CD1 4.1Å
274	R	84.8	Confident	77.6	Confident	97 Å²	97	48.5 Å²	48.5	37%	0.366	28%	0.277	S	S	.	.	H	α-helix	trans	-60.8	-48.6	171	-75.8	-175.5	-65.4	126	2.9	111.3	D238 A270 A276 Q277 D278 G303	D238-R274 IonicContact OD1-CZ 2.81Å; D238-R274 IonicContact OD1-NH1 3.74Å; D238-R274 IonicContact OD1-NH2 3.78Å; D238-R274 PolarHBondContact OD1-NH2 3.25Å; D238-R274 IonicContact OD2-CZ 3.56Å; D238-R274 IonicContact OD2-NH1 3.43Å; D238-R274 PolarHBondContact OD2-NH1 2.82Å; D238-R274 IonicContact OD2-NH2 3.92Å; D238-R274 PolarHBondContact OD2-NH2 3.43Å; D238-R274 VanDerWaalsContact OD2-NH2 3.17Å; A270-R274 WeakPolarHBondContact O-CB 3.2Å; A270-R274 WeakPolarHBondContact O-CG 3.42Å; A270-R274 PolarHBondContact O-N 2.83Å; R274-A276 VanDerWaalsContact C-N 3.29Å; R274-A276 PolarHBondContact O-N 3.16Å; R274-Q277 WeakPolarHBondContact O-CB 3.38Å; R274-Q277 PolarHBondContact O-N 3.41Å; R274-Q277 VanDerWaalsContact O-N 3.13Å; R274-D278 PolarHBondContact O-N 3.4Å; R274-G303 WeakPolarHBondContact CG-O 3.46Å
275	S	85.1	Confident	77.6	Confident	3 Å²	3	50.6 Å²	50.6	2%	0.021	28%	0.279	C	S	.	.	H	α-helix	trans	-61.8	-36.5	177.6	-60.3	0	0	0	0	112.6	A271 V272 D278 L279	A271-S275 WeakPolarHBondContact O-CB 3.34Å; A271-S275 PolarHBondContact O-N 2.78Å; A271-S275 PolarHBondContact O-OG 2.91Å; V272-S275 PolarHBondContact O-N 3.05Å; S275-D278 PolarHBondContact O-N 2.99Å; S275-L279 WeakPolarHBondContact O-CG 3.31Å; S275-L279 PolarHBondContact O-N 3.49Å; S275-L279 VanDerWaalsContact O-N 3.17Å
276	A	82.4	Confident	77.7	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-67.2	-37.4	175.3	0	0	0	0	0	112.5	V272 L273 R274 L279 G280 L281 W288	V272-A276 WeakPolarHBondContact O-CB 3.29Å; V272-A276 PolarHBondContact O-N 2.88Å; L273-A276 PolarHBondContact O-N 3.46Å; R274-A276 VanDerWaalsContact C-N 3.29Å; R274-A276 PolarHBondContact O-N 3.16Å; A276-L279 PolarHBondContact O-N 2.98Å; A276-G280 PolarHBondContact O-N 2.93Å; A276-L281 HydrophobicContact CB-CB 4.29Å; A276-L281 PolarHBondContact O-N 2.9Å; A276-W288 HydrophobicContact CB-CH2 4.01Å; A276-W288 HydrophobicContact CB-CZ2 3.33Å
277	Q	82.6	Confident	78	Confident	92 Å²	92	47.5 Å²	47.5	43%	0.43	26%	0.258	S	S	.	.	H	α-helix	trans	-62.9	-44.7	173.6	-174	174	9	0	0	111.6	L273 R274 L279 G280 T282	L273-Q277 PolarHBondContact O-N 2.8Å; R274-Q277 WeakPolarHBondContact O-CB 3.38Å; R274-Q277 PolarHBondContact O-N 3.41Å; R274-Q277 VanDerWaalsContact O-N 3.13Å; Q277-L279 PolarHBondContact O-N 3.21Å; Q277-G280 PolarHBondContact O-N 2.86Å; Q277-T282 HydrophobicContact CB-CG2 4.14Å; Q277-T282 HydrophobicContact CG-CG2 4.5Å
278	D	81.4	Confident	78.5	Confident	124 Å²	124	40.4 Å²	40.4	66%	0.663	23%	0.225	S	C	*	.	H	α-helix	trans	-62.8	-30.4	176.7	-66.8	-23.2	0	0	0	112.7	R274 S275 G280	R274-D278 PolarHBondContact O-N 3.4Å; S275-D278 PolarHBondContact O-N 2.99Å; D278-G280 VanDerWaalsContact C-N 3.33Å
279	L	78.9	Confident	78.8	Confident	45 Å²	45	39.4 Å²	39.4	24%	0.236	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-2.6	176.8	-70.2	171	0	0	0	113.9	H242 L245 S275 A276 Q277 L281	H242-L279 WeakPolarHBondContact CE1-CD2 3.48Å; H242-L279 VanDerWaalsContact CE1-CG 3.46Å; H242-L279 WeakPolarHBondContact CE1-CG 3.42Å; H242-L279 WeakPolarHBondContact NE2-CD2 3.4Å; L245-L279 HydrophobicContact CB-CD1 3.65Å; S275-L279 WeakPolarHBondContact O-CG 3.31Å; S275-L279 PolarHBondContact O-N 3.49Å; S275-L279 VanDerWaalsContact O-N 3.17Å; A276-L279 PolarHBondContact O-N 2.98Å; Q277-L279 PolarHBondContact O-N 3.21Å; L279-L281 HydrophobicContact CB-CD1 3.95Å; L279-L281 HydrophobicContact CB-CG 3.9Å; L279-L281 HydrophobicContact CD1-CD1 4.06Å; L279-L281 PolarHBondContact O-N 2.76Å
280	G	73.3	Confident	79.1	Confident	35 Å²	35	39.5 Å²	39.5	36%	0.361	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.6	22.1	-174.8	0	0	0	0	0	113.7	A276 Q277 D278 T282 L285	A276-G280 PolarHBondContact O-N 2.93Å; Q277-G280 PolarHBondContact O-N 2.86Å; D278-G280 VanDerWaalsContact C-N 3.33Å; G280-T282 PolarHBondContact O-N 2.79Å; G280-T282 VanDerWaalsContact O-N 3.17Å; G280-L285 VanDerWaalsContact O-CD1 3.27Å; G280-L285 WeakPolarHBondContact O-CD1 3.45Å
281	L	74.5	Confident	79	Confident	20 Å²	20	38 Å²	38	11%	0.105	21%	0.206	C	C	.	.			trans	-85.6	38.1	177.7	-63.5	173.1	0	0	0	111.4	F249 A276 L279 W288	F249-L281 HydrophobicContact CB-CD1 4.02Å; F249-L281 HydrophobicContact CB-CD2 4.02Å; F249-L281 HydrophobicContact CD1-CD1 4.36Å; F249-L281 HydrophobicContact CD1-CD2 4.09Å; F249-L281 HydrophobicContact CD2-CD1 3.59Å; F249-L281 HydrophobicContact CE2-CD1 4.12Å; F249-L281 HydrophobicContact CG-CD1 3.74Å; F249-L281 HydrophobicContact CG-CD2 4.05Å; A276-L281 HydrophobicContact CB-CB 4.29Å; A276-L281 PolarHBondContact O-N 2.9Å; L279-L281 HydrophobicContact CB-CD1 3.95Å; L279-L281 HydrophobicContact CB-CG 3.9Å; L279-L281 HydrophobicContact CD1-CD1 4.06Å; L279-L281 PolarHBondContact O-N 2.76Å; L281-W288 PolarHBondContact O-NE1 2.83Å
282	T	75.1	Confident	78.8	Confident	29 Å²	29	40 Å²	40	18%	0.178	21%	0.214	C	C	.	.	S	Bend	trans	-118.5	-172.6	-177.4	57.2	0	0	0	0	109.7	Q277 G280 L285 V286 P305	Q277-T282 HydrophobicContact CB-CG2 4.14Å; Q277-T282 HydrophobicContact CG-CG2 4.5Å; G280-T282 PolarHBondContact O-N 2.79Å; G280-T282 VanDerWaalsContact O-N 3.17Å; T282-L285 WeakPolarHBondContact O-CB 3.45Å; T282-L285 PolarHBondContact O-N 3.49Å; T282-V286 CarbonylContact C-O 3.46Å; T282-V286 PolarHBondContact O-N 2.9Å; T282-P305 HydrophobicContact CG2-CB 3.49Å; T282-P305 VanDerWaalsContact CG2-CB 3.49Å; T282-P305 HydrophobicContact CG2-CG 4.41Å
283	L	60.6	Low	78.5	Confident	75 Å²	75	42.1 Å²	42.1	39%	0.393	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	139	176.6	-76	179.1	0	0	0	111.8	H287 L306	L283-H287 VanDerWaalsContact CD2-CE1 3.4Å; L283-H287 WeakPolarHBondContact CD2-CE1 3.36Å; L283-L306 WeakPolarHBondContact CD1-O 3.31Å
284	P	60.6	Low	77.9	Confident	108 Å²	108	43.3 Å²	43.3	70%	0.701	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	cis	-91.7	6.8	7	36.5	-36.2	0	0	0	114.7
285	L	63.8	Low	77.1	Confident	108 Å²	108	41.2 Å²	41.2	57%	0.565	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-43.1	-171.6	-76.2	155.7	0	0	0	113.2	G280 T282	G280-L285 VanDerWaalsContact O-CD1 3.27Å; G280-L285 WeakPolarHBondContact O-CD1 3.45Å; T282-L285 WeakPolarHBondContact O-CB 3.45Å; T282-L285 PolarHBondContact O-N 3.49Å
286	V	77.1	Confident	76.2	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.006	24%	0.244	C	C	.	.			trans	-142.8	133.6	-174.2	-179.5	0	0	0	0	110.4	P255 V259 T282	P255-V286 HydrophobicContact CB-CG2 3.81Å; P255-V286 HydrophobicContact CG-CG2 4.47Å; V259-V286 HydrophobicContact CB-CG1 3.99Å; V259-V286 HydrophobicContact CG2-CG1 3.41Å; V259-V286 VanDerWaalsContact CG2-CG1 3.41Å; T282-V286 CarbonylContact C-O 3.46Å; T282-V286 PolarHBondContact O-N 2.9Å
287	H	83.3	Confident	75.5	Confident	47 Å²	47	49.7 Å²	49.7	22%	0.218	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	128.2	169	-67.8	-91.5	0	0	0	110.9	W186 A257 A258 V259 L283	W186-H287 AromaticContact CE2-CD2 3.66Å; W186-H287 AromaticContact CE2-CG 3.77Å; W186-H287 HydrophobicContact CH2-CB 3.62Å; W186-H287 AromaticContact CH2-CG 3.86Å; W186-H287 HydrophobicContact CZ2-CB 3.42Å; W186-H287 VanDerWaalsContact CZ2-CB 3.42Å; W186-H287 AromaticContact CZ2-CD2 3.51Å; W186-H287 AromaticContact CZ2-CE1 3.9Å; W186-H287 AromaticContact CZ2-CG 3.19Å; W186-H287 AromaticContact CZ2-ND1 3.47Å; W186-H287 WeakPolarHBondContact CZ2-ND1 3.42Å; W186-H287 AromaticContact CZ2-NE2 3.94Å; W186-H287 HydrophobicContact CZ3-CB 4.32Å; W186-H287 AromaticContact NE1-CD2 3.54Å; W186-H287 AromaticContact NE1-NE2 3.95Å; A257-H287 PolarHBondContact O-CD2 2.91Å; A257-H287 PolarHBondContact O-N 2.77Å; A257-H287 VanDerWaalsContact O-N 3.15Å; A258-H287 CarbonylContact C-O 3.56Å; A258-H287 WeakPolarHBondContact CA-O 3.45Å; V259-H287 PolarHBondContact N-O 2.95Å; L283-H287 VanDerWaalsContact CD2-CE1 3.4Å; L283-H287 WeakPolarHBondContact CD2-CE1 3.36Å
288	W	87.4	Confident	74.9	Confident	4 Å²	4	48.6 Å²	48.6	2%	0.015	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	132.5	173.7	-73	80.4	0	0	0	110.4	V192 V259 L261 V272 L273 A276 L281 L308 L309	V192-W288 HydrophobicContact CG2-CZ3 4.4Å; V259-W288 HydrophobicContact CB-CD2 4.24Å; V259-W288 HydrophobicContact CB-CE3 4.19Å; V259-W288 HydrophobicContact CB-CH2 4.5Å; V259-W288 HydrophobicContact CB-CZ3 4.33Å; V259-W288 HydrophobicContact CG1-CD2 4.31Å; V259-W288 HydrophobicContact CG1-CE3 3.81Å; V259-W288 HydrophobicContact CG1-CH2 3.76Å; V259-W288 HydrophobicContact CG1-CZ2 4.23Å; V259-W288 HydrophobicContact CG1-CZ3 3.52Å; L261-W288 HydrophobicContact CB-CE3 4.31Å; L261-W288 HydrophobicContact CB-CZ3 4.39Å; V272-W288 HydrophobicContact CG1-CH2 3.9Å; V272-W288 HydrophobicContact CG1-CZ3 3.84Å; L273-W288 HydrophobicContact CD2-CB 4.05Å; L273-W288 HydrophobicContact CD2-CD2 3.64Å; L273-W288 HydrophobicContact CD2-CE3 3.51Å; L273-W288 HydrophobicContact CD2-CG 3.88Å; L273-W288 HydrophobicContact CD2-CZ3 4.2Å; A276-W288 HydrophobicContact CB-CH2 4.01Å; A276-W288 HydrophobicContact CB-CZ2 3.33Å; L281-W288 PolarHBondContact O-NE1 2.83Å; W288-L308 HydrophobicContact CB-CD1 3.66Å; W288-L309 PolarHBondContact O-N 2.88Å
289	V	88.9	Confident	74.3	Confident	0 Å²	0	43 Å²	43	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	130.9	176.2	-170.5	0	0	0	0	108.7	L177 W186 V259 L260 L261 L309	L177-V289 HydrophobicContact CD1-CG1 4.01Å; W186-V289 HydrophobicContact CE3-CG2 4.42Å; W186-V289 HydrophobicContact CH2-CG2 4.16Å; W186-V289 HydrophobicContact CZ3-CG2 3.54Å; V259-V289 PolarHBondContact O-N 2.94Å; L260-V289 WeakPolarHBondContact CA-O 3.46Å; L260-V289 HydrophobicContact CD2-CB 3.81Å; L260-V289 HydrophobicContact CD2-CG1 4.24Å; L260-V289 HydrophobicContact CD2-CG2 4.35Å; L261-V289 PolarHBondContact N-O 3.35Å; V289-L309 WeakPolarHBondContact CA-O 3.48Å; V289-L309 HydrophobicContact CB-CB 4.46Å; V289-L309 HydrophobicContact CG1-CB 4.15Å; V289-L309 HydrophobicContact CG2-CB 4.25Å; V289-L309 HydrophobicContact CG2-CD1 4.31Å
290	L	87.1	Confident	73.8	Confident	4 Å²	4	48.2 Å²	48.2	2%	0.021	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	127.2	171	-60.9	178.5	0	0	0	109.3	L261 L273 Q292 L294 L299 L308 L309 A310 Y311	L261-L290 HydrophobicContact CB-CD2 4.4Å; L261-L290 HydrophobicContact CD2-CD2 4.06Å; L273-L290 HydrophobicContact CD1-CD2 4.39Å; L290-Q292 VanDerWaalsContact C-N 3.32Å; L290-L294 HydrophobicContact CD1-CD1 4.3Å; L290-L299 HydrophobicContact CD1-CD1 3.31Å; L290-L308 HydrophobicContact CD2-CD1 4.28Å; L290-L308 HydrophobicContact CG-CD1 4.17Å; L290-L309 PolarHBondContact N-O 3.04Å; L290-A310 HydrophobicContact CD1-CB 3.75Å; L290-Y311 WeakPolarHBondContact O-CE1 3.49Å
291	G	78.1	Confident	73.4	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.267	C	S	.	.	S	Bend	trans	-84.8	-2.3	-179.1	0	0	0	0	0	114.4	L261 F262 Y311	L261-G291 PolarHBondContact O-N 3.28Å; F262-G291 WeakPolarHBondContact CD1-O 3.26Å; F262-G291 WeakPolarHBondContact CE1-O 3.08Å; G291-Y311 PolarHBondContact O-OH 3.21Å
292	Q	78.2	Confident	72.7	Confident	47 Å²	47	55.4 Å²	55.4	22%	0.22	30%	0.298	C	S	.	.	S	Bend	trans	-126.9	148.2	175.4	-72.1	-172.9	-79	0	0	111	W197 F262 G263 A264 L290 L294	W197-Q292 HydrophobicContact CH2-CG 4.22Å; W197-Q292 HydrophobicContact CZ3-CG 3.65Å; F262-Q292 HydrophobicContact CD1-CG 4.32Å; G263-Q292 PolarHBondContact O-OE1 2.99Å; A264-Q292 VanDerWaalsContact N-OE1 3.12Å; L290-Q292 VanDerWaalsContact C-N 3.32Å; Q292-L294 PolarHBondContact O-N 2.76Å; Q292-L294 VanDerWaalsContact O-N 3.09Å
293	P	79.4	Confident	72.2	Confident	45 Å²	45	55.8 Å²	55.8	29%	0.292	31%	0.307	S	S	.	.			trans	-70.2	108.6	176.7	29.4	-33	0	0	0	109.7	L173 Y311	L173-P293 HydrophobicContact CD1-CG 4.47Å; L173-P293 HydrophobicContact CD2-CG 4.01Å; P293-Y311 WeakPolarHBondContact CA-O 3.46Å; P293-Y311 HydrophobicContact CB-CD2 3.99Å; P293-Y311 HydrophobicContact CB-CE2 4.03Å
294	L	73.3	Confident	73.1	Confident	26 Å²	26	52.9 Å²	52.9	14%	0.136	29%	0.292	C	S	.	.			trans	-114.5	132.1	174.2	-72.8	171.7	0	0	0	108	L290 Q292 L299 Y311	L290-L294 HydrophobicContact CD1-CD1 4.3Å; Q292-L294 PolarHBondContact O-N 2.76Å; Q292-L294 VanDerWaalsContact O-N 3.09Å; L294-L299 HydrophobicContact CB-CD1 3.74Å; L294-L299 HydrophobicContact CB-CG 4.29Å; L294-L299 HydrophobicContact CD1-CD1 4.02Å; L294-L299 HydrophobicContact CD1-CD2 4.18Å; L294-L299 HydrophobicContact CD1-CG 4.29Å; L294-Y311 PolarHBondContact N-O 3.42Å
295	S	68.3	Low	74.1	Confident	52 Å²	52	48 Å²	48	36%	0.364	26%	0.26	S	S	.	.			trans	-69.2	145.9	175.7	59.1	0	0	0	0	110	D297 V298	S295-D297 PolarHBondContact O-N 3.49Å; S295-D297 VanDerWaalsContact O-N 3.11Å; S295-V298 PolarHBondContact O-N 3.44Å; S295-V298 VanDerWaalsContact OG-CG2 3.27Å; S295-V298 WeakPolarHBondContact OG-CG2 3.37Å
296	P	65.2	Low	74.8	Confident	35 Å²	35	46.2 Å²	46.2	23%	0.227	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-30.8	177.9	-26.6	35.7	0	0	0	113	V298 L299 W400 W412	P296-V298 VanDerWaalsContact C-N 3.27Å; P296-V298 PolarHBondContact O-N 3.27Å; P296-L299 PolarHBondContact O-N 2.92Å; P296-L299 VanDerWaalsContact O-O 3.07Å; P296-W400 HydrophobicContact CG-CD2 3.81Å; P296-W400 HydrophobicContact CG-CE3 3.75Å; P296-W400 HydrophobicContact CG-CH2 3.87Å; P296-W400 HydrophobicContact CG-CZ2 3.92Å; P296-W400 HydrophobicContact CG-CZ3 3.76Å; P296-W412 HydrophobicContact CB-CB 4.45Å; P296-W412 HydrophobicContact CB-CG 4.05Å
297	D	68.8	Low	74.9	Confident	147 Å²	147	46.9 Å²	46.9	79%	0.786	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-26.4	179.9	-58.6	-33.7	0	0	0	113.4	S295	S295-D297 PolarHBondContact O-N 3.49Å; S295-D297 VanDerWaalsContact O-N 3.11Å
298	V	70.8	Confident	75.1	Confident	69 Å²	69	44.7 Å²	44.7	42%	0.418	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-25.7	-179.8	175.9	0	0	0	0	111.2	P266 S295 P296	P266-V298 HydrophobicContact CB-CG1 4.15Å; P266-V298 HydrophobicContact CG-CG1 4.33Å; S295-V298 PolarHBondContact O-N 3.44Å; S295-V298 VanDerWaalsContact OG-CG2 3.27Å; S295-V298 WeakPolarHBondContact OG-CG2 3.37Å; P296-V298 VanDerWaalsContact C-N 3.27Å; P296-V298 PolarHBondContact O-N 3.27Å
299	L	67.4	Low	75.2	Confident	7 Å²	7	44.7 Å²	44.7	4%	0.037	25%	0.248	C	C	.	.	S	Bend	trans	-100.8	94.6	178.9	-69.7	165.6	0	0	0	110.2	L290 L294 P296 T301 L304 W412	L290-L299 HydrophobicContact CD1-CD1 3.31Å; L294-L299 HydrophobicContact CB-CD1 3.74Å; L294-L299 HydrophobicContact CB-CG 4.29Å; L294-L299 HydrophobicContact CD1-CD1 4.02Å; L294-L299 HydrophobicContact CD1-CD2 4.18Å; L294-L299 HydrophobicContact CD1-CG 4.29Å; P296-L299 PolarHBondContact O-N 2.92Å; P296-L299 VanDerWaalsContact O-O 3.07Å; L299-T301 PolarHBondContact O-N 2.94Å; L299-L304 HydrophobicContact CB-CD1 4.42Å; L299-W412 HydrophobicContact CB-CZ2 4.03Å; L299-W412 HydrophobicContact CD1-CZ2 4.19Å
300	H	68.7	Low	75.1	Confident	153 Å²	153	44.8 Å²	44.8	71%	0.708	25%	0.249	S	C	*	.			trans	-53.3	133.8	170.5	-67.9	-58.5	0	0	0	110.7	F302 L304	H300-F302 PolarHBondContact O-N 3.44Å; H300-L304 WeakPolarHBondContact O-CD1 3.29Å
301	T	66	Low	75.1	Confident	34 Å²	34	44.6 Å²	44.6	21%	0.209	25%	0.248	C	C	.	.	S	Bend	trans	-74.2	-12	-174	55.9	0	0	0	0	113.8	L299 L402 P410	L299-T301 PolarHBondContact O-N 2.94Å; T301-L402 HydrophobicContact CG2-CD1 3.95Å; T301-P410 VanDerWaalsContact CB-O 3.22Å; T301-P410 WeakPolarHBondContact CB-O 3.37Å; T301-P410 WeakPolarHBondContact CG2-O 3.25Å; T301-P410 WeakPolarHBondContact O-CG 3.47Å; T301-P410 PolarHBondContact OG1-O 3.24Å
302	F	58	Low	75.5	Confident	172 Å²	172	44.8 Å²	44.8	75%	0.754	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.3	125.4	-178.7	-71.3	-79.4	0	0	0	112.1	H300	H300-F302 PolarHBondContact O-N 3.44Å
303	G	64.4	Low	75.7	Confident	37 Å²	37	44.7 Å²	44.7	38%	0.381	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.6	12.7	175.6	0	0	0	0	0	115.1	R274	R274-G303 WeakPolarHBondContact CG-O 3.46Å
304	L	80.2	Confident	75.7	Confident	14 Å²	14	44.2 Å²	44.2	7%	0.073	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-99.2	148	175.2	-63.5	-178.7	0	0	0	111.5	L273 L299 H300 L308 L402 W412	L273-L304 HydrophobicContact CB-CD2 4.04Å; L273-L304 HydrophobicContact CD1-CD2 3.74Å; L299-L304 HydrophobicContact CB-CD1 4.42Å; H300-L304 WeakPolarHBondContact O-CD1 3.29Å; L304-L308 HydrophobicContact CB-CD2 4.33Å; L304-L308 HydrophobicContact CD1-CD2 4.11Å; L304-L402 HydrophobicContact CB-CD2 3.56Å; L304-W412 HydrophobicContact CD1-CZ2 4.27Å
305	P	81.8	Confident	75.8	Confident	5 Å²	5	48.9 Å²	48.9	3%	0.032	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-70.5	138.1	179.9	28.3	-34.4	0	0	0	111.9	L273 T282 L308	L273-P305 HydrophobicContact CB-CG 4.34Å; L273-P305 HydrophobicContact CD2-CG 3.9Å; T282-P305 HydrophobicContact CG2-CB 3.49Å; T282-P305 VanDerWaalsContact CG2-CB 3.49Å; T282-P305 HydrophobicContact CG2-CG 4.41Å; P305-L308 HydrophobicContact CG-CB 4.44Å; P305-L308 VanDerWaalsContact O-CB 3.28Å; P305-L308 WeakPolarHBondContact O-CB 3.33Å; P305-L308 PolarHBondContact O-N 2.67Å
306	L	79.4	Confident	76.3	Confident	72 Å²	72	53 Å²	53	38%	0.377	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	141.8	173.2	-64.3	171.7	0	0	0	110.1	L283 L308 R404	L283-L306 WeakPolarHBondContact CD1-O 3.31Å; L306-L308 VanDerWaalsContact C-N 3.3Å; L306-R404 HydrophobicContact CD1-CG 4.37Å; L306-R404 HydrophobicContact CD2-CG 4.11Å
307	G	79.1	Confident	77.3	Confident	14 Å²	14	54.8 Å²	54.8	14%	0.144	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.2	7.7	-175.2	0	0	0	0	0	115.1	L309 L402	G307-L309 PolarHBondContact O-N 3.13Å; G307-L402 PolarHBondContact N-O 3.36Å
308	L	87.1	Confident	78.1	Confident	1 Å²	1	51 Å²	51	1%	0.005	27%	0.265	C	S	.	.			trans	-58.1	125.3	166.9	177.5	64.5	0	0	0	109.7	L273 W288 L290 L304 P305 L306 S401 L402 W412	L273-L308 HydrophobicContact CD1-CD1 4.2Å; L273-L308 HydrophobicContact CD1-CD2 3.83Å; L273-L308 HydrophobicContact CD2-CD1 4.1Å; W288-L308 HydrophobicContact CB-CD1 3.66Å; L290-L308 HydrophobicContact CD2-CD1 4.28Å; L290-L308 HydrophobicContact CG-CD1 4.17Å; L304-L308 HydrophobicContact CB-CD2 4.33Å; L304-L308 HydrophobicContact CD1-CD2 4.11Å; P305-L308 HydrophobicContact CG-CB 4.44Å; P305-L308 VanDerWaalsContact O-CB 3.28Å; P305-L308 WeakPolarHBondContact O-CB 3.33Å; P305-L308 PolarHBondContact O-N 2.67Å; L306-L308 VanDerWaalsContact C-N 3.3Å; L308-S401 WeakPolarHBondContact O-CA 3.33Å; L308-L402 HydrophobicContact CB-CB 4.26Å; L308-L402 PolarHBondContact O-N 3.26Å; L308-W412 HydrophobicContact CD2-CH2 3.8Å; L308-W412 HydrophobicContact CG-CH2 4.13Å
309	L	88.4	Confident	78.9	Confident	5 Å²	5	48.7 Å²	48.7	3%	0.026	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	126	173.2	-64.5	-175.8	0	0	0	110.4	V180 W186 W288 V289 L290 G307 W400 V415 V430	V180-L309 HydrophobicContact CG1-CD1 4.43Å; W186-L309 HydrophobicContact CH2-CD1 3.67Å; W186-L309 HydrophobicContact CZ3-CD1 4.14Å; W288-L309 PolarHBondContact O-N 2.88Å; V289-L309 WeakPolarHBondContact CA-O 3.48Å; V289-L309 HydrophobicContact CB-CB 4.46Å; V289-L309 HydrophobicContact CG1-CB 4.15Å; V289-L309 HydrophobicContact CG2-CB 4.25Å; V289-L309 HydrophobicContact CG2-CD1 4.31Å; L290-L309 PolarHBondContact N-O 3.04Å; G307-L309 PolarHBondContact O-N 3.13Å; L309-W400 WeakPolarHBondContact CA-O 3.19Å; L309-V415 HydrophobicContact CD2-CG2 4.38Å; L309-V430 HydrophobicContact CD2-CG1 3.91Å
310	A	87.6	Confident	79.9	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.008	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	158.8	171.4	0	0	0	0	0	108.9	L290 I399 W400 W412	L290-A310 HydrophobicContact CD1-CB 3.75Å; A310-I399 CarbonylContact O-C 3.6Å; A310-I399 WeakPolarHBondContact O-CA 3.43Å; A310-W400 HydrophobicContact CB-CE3 4.4Å; A310-W400 PolarHBondContact N-O 3.25Å; A310-W400 PolarHBondContact O-N 2.89Å; A310-W412 HydrophobicContact CB-CE3 4.33Å; A310-W412 HydrophobicContact CB-CH2 3.66Å; A310-W412 HydrophobicContact CB-CZ3 3.53Å
311	Y	87.5	Confident	80.8	Confident	1 Å²	1	44.6 Å²	44.6	0%	0.004	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	158.2	170	53.5	-96.4	0	0	0	109.8	L173 L176 L177 L290 G291 P293 L294 H398 W400	L173-Y311 HydrophobicContact CD2-CE2 4.18Å; L176-Y311 HydrophobicContact CD2-CD2 3.48Å; L176-Y311 VanDerWaalsContact CD2-CD2 3.48Å; L176-Y311 HydrophobicContact CD2-CE2 3.73Å; L176-Y311 HydrophobicContact CD2-CG 3.95Å; L177-Y311 HydrophobicContact CD1-CE1 3.91Å; L290-Y311 WeakPolarHBondContact O-CE1 3.49Å; G291-Y311 PolarHBondContact O-OH 3.21Å; P293-Y311 WeakPolarHBondContact CA-O 3.46Å; P293-Y311 HydrophobicContact CB-CD2 3.99Å; P293-Y311 HydrophobicContact CB-CE2 4.03Å; L294-Y311 PolarHBondContact N-O 3.42Å; Y311-H398 CarbonylContact C-O 3.46Å; Y311-H398 VanDerWaalsContact CA-O 3.22Å; Y311-H398 WeakPolarHBondContact CA-O 3.35Å; Y311-W400 VanDerWaalsContact C-CZ3 3.41Å
312	G	85.7	Confident	82	Confident	3 Å²	3	43.3 Å²	43.3	3%	0.031	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162	152.4	179.8	0	0	0	0	0	111.7	F397 H398 W400	G312-F397 WeakPolarHBondContact O-CA 3.46Å; G312-H398 PolarHBondContact N-O 3.49Å; G312-H398 PolarHBondContact O-N 2.67Å; G312-W400 VanDerWaalsContact CA-CZ3 3.43Å
313	E	83.5	Confident	83.6	Confident	45 Å²	45	35.1 Å²	35.1	21%	0.21	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	136.2	175.5	-170.2	-176.5	-176.2	0	0	109.7	R316 F397	E313-R316 HydrophobicContact CG-CB 4.39Å; E313-R316 WeakPolarHBondContact OE2-CD 3.49Å; E313-F397 HydrophobicContact CB-CD1 4.27Å; E313-F397 HydrophobicContact CB-CE1 3.85Å; E313-F397 HydrophobicContact CB-CZ 4.24Å; E313-F397 HydrophobicContact CG-CE1 4.47Å; E313-F397 HydrophobicContact CG-CZ 4.39Å
314	V	79.7	Confident	84.7	Confident	36 Å²	36	37 Å²	37	22%	0.218	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	137.6	-175.9	-177.1	0	0	0	0	107.6	R316 R396 H398	V314-R316 VanDerWaalsContact C-N 3.3Å; V314-R316 PolarHBondContact O-N 2.88Å; V314-R396 PolarHBondContact N-O 2.82Å; V314-H398 HydrophobicContact CG2-CB 3.61Å; V314-H398 WeakPolarHBondContact CG2-CD2 3.43Å
315	D	74.3	Confident	85.2	Confident	123 Å²	123	36.3 Å²	36.3	66%	0.658	18%	0.179	S	C	*	.	S	Bend	trans	59.8	31	177.7	-65.4	-42.5	0	0	0	115.7	K317	D315-K317 WeakPolarHBondContact O-CD 3.48Å; D315-K317 WeakPolarHBondContact O-CE 3.44Å; D315-K317 PolarHBondContact O-N 2.96Å
316	R	78.6	Confident	85.6	Confident	139 Å²	139	36.1 Å²	36.1	53%	0.525	18%	0.177	S	C	.	.			trans	-50.4	113.8	175.8	-173.6	178.5	-179.8	-163.9	-2.3	110.8	E313 V314	E313-R316 HydrophobicContact CG-CB 4.39Å; E313-R316 WeakPolarHBondContact OE2-CD 3.49Å; V314-R316 VanDerWaalsContact C-N 3.3Å; V314-R316 PolarHBondContact O-N 2.88Å
317	K	85.6	Confident	86.1	Confident	73 Å²	73	33 Å²	33	32%	0.317	16%	0.161	S	C	.	.			trans	-79.3	147.1	-179	-56.8	-55.8	179.9	-161.7	0	111	D315 F321 Y322 T379	D315-K317 WeakPolarHBondContact O-CD 3.48Å; D315-K317 WeakPolarHBondContact O-CE 3.44Å; D315-K317 PolarHBondContact O-N 2.96Å; K317-F321 HydrophobicContact CB-CB 3.91Å; K317-F321 HydrophobicContact CB-CD1 4.16Å; K317-F321 HydrophobicContact CB-CG 4.12Å; K317-F321 HydrophobicContact CD-CD1 4.08Å; K317-F321 HydrophobicContact CD-CE1 4.36Å; K317-F321 HydrophobicContact CG-CD1 4.18Å; K317-Y322 HydrophobicContact CB-CE2 4.09Å; K317-Y322 WeakPolarHBondContact O-CE2 3.49Å; K317-T379 HydrophobicContact CB-CG2 4.39Å; K317-T379 HydrophobicContact CG-CG2 4.46Å
318	P	87.1	Confident	86.6	Confident	66 Å²	66	33.9 Å²	33.9	43%	0.429	16%	0.161	S	C	.	.			trans	-70.2	158.4	174.4	30.9	-34.8	0	0	0	111	D320 F321	P318-D320 VanDerWaalsContact CB-OD1 3.26Å; P318-D320 WeakPolarHBondContact CB-OD1 3.47Å; P318-D320 VanDerWaalsContact CG-OD1 3.24Å; P318-D320 WeakPolarHBondContact CG-OD1 3.36Å; P318-D320 PolarHBondContact O-N 3.12Å; P318-F321 HydrophobicContact CG-CD2 3.58Å; P318-F321 HydrophobicContact CG-CE2 3.76Å; P318-F321 HydrophobicContact CG-CG 4.39Å; P318-F321 WeakPolarHBondContact O-CB 3.27Å; P318-F321 PolarHBondContact O-N 3.42Å
319	L	87.3	Confident	86.8	Confident	22 Å²	22	33.9 Å²	33.9	12%	0.115	16%	0.161	C	C	.	.	H	α-helix	trans	-53.4	-30.9	-174.1	-178.7	63.7	0	0	0	114.3	V54 A57 L147 T166 F321 Y322 I323	V54-L319 HydrophobicContact CG2-CD2 4.05Å; A57-L319 HydrophobicContact CB-CD2 4.29Å; A57-L319 HydrophobicContact CB-CG 4.37Å; L147-L319 HydrophobicContact CD2-CD1 4.06Å; T166-L319 HydrophobicContact CG2-CD1 4.04Å; L319-F321 PolarHBondContact O-N 3.29Å; L319-Y322 PolarHBondContact O-N 2.95Å; L319-I323 HydrophobicContact CG-CD1 4.1Å; L319-I323 HydrophobicContact CG-CG1 4.42Å; L319-I323 WeakPolarHBondContact O-CG1 3.4Å; L319-I323 PolarHBondContact O-N 2.77Å; L319-I323 VanDerWaalsContact O-N 3.07Å
320	D	87.6	Confident	86.8	Confident	15 Å²	15	33.7 Å²	33.7	8%	0.08	16%	0.161	C	C	.	.	H	α-helix	trans	-64.9	-25	179.2	57.8	-60.8	0	0	0	113.6	A57 P318 R324	A57-D320 HydrophobicContact CB-CB 4.13Å; P318-D320 VanDerWaalsContact CB-OD1 3.26Å; P318-D320 WeakPolarHBondContact CB-OD1 3.47Å; P318-D320 VanDerWaalsContact CG-OD1 3.24Å; P318-D320 WeakPolarHBondContact CG-OD1 3.36Å; P318-D320 PolarHBondContact O-N 3.12Å; D320-R324 WeakPolarHBondContact O-CG 3.27Å; D320-R324 PolarHBondContact O-N 3.11Å; D320-R324 VanDerWaalsContact O-N 3.1Å
321	F	89.1	Confident	86.8	Confident	58 Å²	58	34.3 Å²	34.3	25%	0.254	16%	0.164	S	C	.	.	H	α-helix	trans	-72	-44.6	176.1	-77.1	-130.4	0	0	0	110.2	K317 P318 L319 I323 R324 D325 L378 T379	K317-F321 HydrophobicContact CB-CB 3.91Å; K317-F321 HydrophobicContact CB-CD1 4.16Å; K317-F321 HydrophobicContact CB-CG 4.12Å; K317-F321 HydrophobicContact CD-CD1 4.08Å; K317-F321 HydrophobicContact CD-CE1 4.36Å; K317-F321 HydrophobicContact CG-CD1 4.18Å; P318-F321 HydrophobicContact CG-CD2 3.58Å; P318-F321 HydrophobicContact CG-CE2 3.76Å; P318-F321 HydrophobicContact CG-CG 4.39Å; P318-F321 WeakPolarHBondContact O-CB 3.27Å; P318-F321 PolarHBondContact O-N 3.42Å; L319-F321 PolarHBondContact O-N 3.29Å; F321-I323 VanDerWaalsContact C-N 3.33Å; F321-I323 PolarHBondContact O-N 3.26Å; F321-R324 PolarHBondContact O-N 2.8Å; F321-D325 PolarHBondContact O-N 2.97Å; F321-L378 HydrophobicContact CB-CB 4.33Å; F321-L378 HydrophobicContact CD1-CB 3.58Å; F321-L378 HydrophobicContact CD1-CD1 4.22Å; F321-L378 HydrophobicContact CD1-CG 4.45Å; F321-L378 HydrophobicContact CE1-CB 4.22Å; F321-L378 HydrophobicContact CG-CB 4.26Å; F321-L378 HydrophobicContact CG-CD1 4.48Å; F321-T379 HydrophobicContact CB-CG2 4.01Å
322	Y	90.3	Very high	86.9	Confident	7 Å²	7	37.9 Å²	37.9	3%	0.027	18%	0.178	C	C	.	.	H	α-helix	trans	-61.7	-39.9	174.4	-68	-89.4	0	0	0	112.1	M164 T166 K317 L319 R324 D325 A326 T379 T393	M164-Y322 HydrophobicContact CE-CD1 3.8Å; M164-Y322 HydrophobicContact CG-CD1 4.45Å; M164-Y322 HydrophobicContact SD-CD1 4.27Å; T166-Y322 HydrophobicContact CG2-CD1 3.77Å; T166-Y322 HydrophobicContact CG2-CD2 4.12Å; T166-Y322 HydrophobicContact CG2-CE1 4.34Å; T166-Y322 HydrophobicContact CG2-CG 3.67Å; K317-Y322 HydrophobicContact CB-CE2 4.09Å; K317-Y322 WeakPolarHBondContact O-CE2 3.49Å; L319-Y322 PolarHBondContact O-N 2.95Å; Y322-R324 PolarHBondContact O-N 2.91Å; Y322-D325 PolarHBondContact O-N 2.78Å; Y322-A326 WeakPolarHBondContact O-CB 3.43Å; Y322-A326 PolarHBondContact O-N 2.78Å; Y322-T379 HydrophobicContact CD1-CG2 3.81Å; Y322-T379 HydrophobicContact CD2-CG2 4.08Å; Y322-T379 HydrophobicContact CE1-CG2 3.88Å; Y322-T379 HydrophobicContact CE2-CG2 4.18Å; Y322-T379 HydrophobicContact CG-CG2 3.89Å; Y322-T393 HydrophobicContact CE1-CG2 4.28Å
323	I	90.6	Very high	87	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-63.1	-41.8	175.7	-66.8	173	0	0	0	110.9	A57 L58 T61 L121 F123 L147 L319 F321 A326 L327	A57-I323 HydrophobicContact CB-CD1 3.64Å; L58-I323 HydrophobicContact CD2-CD1 4.33Å; L58-I323 HydrophobicContact CD2-CG2 3.86Å; L58-I323 HydrophobicContact CG-CD1 4.27Å; T61-I323 HydrophobicContact CG2-CG2 4.13Å; L121-I323 HydrophobicContact CD1-CG2 4.25Å; F123-I323 HydrophobicContact CE1-CD1 3.86Å; F123-I323 HydrophobicContact CE1-CG1 3.93Å; F123-I323 HydrophobicContact CZ-CD1 3.9Å; F123-I323 HydrophobicContact CZ-CG1 4.04Å; L147-I323 HydrophobicContact CD2-CG1 3.81Å; L319-I323 HydrophobicContact CG-CD1 4.1Å; L319-I323 HydrophobicContact CG-CG1 4.42Å; L319-I323 WeakPolarHBondContact O-CG1 3.4Å; L319-I323 PolarHBondContact O-N 2.77Å; L319-I323 VanDerWaalsContact O-N 3.07Å; F321-I323 VanDerWaalsContact C-N 3.33Å; F321-I323 PolarHBondContact O-N 3.26Å; I323-A326 PolarHBondContact O-N 3.33Å; I323-L327 HydrophobicContact CG2-CD1 4.14Å; I323-L327 VanDerWaalsContact O-CG 3.29Å; I323-L327 WeakPolarHBondContact O-CG 3.47Å; I323-L327 PolarHBondContact O-N 3.18Å
324	R	88.4	Confident	87.2	Confident	76 Å²	76	35.8 Å²	35.8	29%	0.287	17%	0.167	S	C	.	.	H	α-helix	trans	-63.8	-44.5	176.7	-77.9	178.8	-165.3	-171.8	11.9	112.2	T61 A64 D320 F321 Y322 L327 Q328 L378	T61-R324 HydrophobicContact CG2-CG 3.51Å; A64-R324 VanDerWaalsContact CB-CZ 3.4Å; D320-R324 WeakPolarHBondContact O-CG 3.27Å; D320-R324 PolarHBondContact O-N 3.11Å; D320-R324 VanDerWaalsContact O-N 3.1Å; F321-R324 PolarHBondContact O-N 2.8Å; Y322-R324 PolarHBondContact O-N 2.91Å; R324-L327 CarbonylContact O-C 3.37Å; R324-L327 PolarHBondContact O-N 3.26Å; R324-Q328 WeakPolarHBondContact O-CB 3.37Å; R324-Q328 PolarHBondContact O-N 3.08Å; R324-L378 HydrophobicContact CB-CD1 4.19Å
325	D	90.6	Very high	87.5	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-67.1	-38.7	178.6	-73.9	-3.6	0	0	0	111.1	M164 F321 Y322 L327 Q328 L329 F375 L378 T379 V382	M164-D325 HydrophobicContact CE-CB 4.03Å; F321-D325 PolarHBondContact O-N 2.97Å; Y322-D325 PolarHBondContact O-N 2.78Å; D325-L327 VanDerWaalsContact C-N 3.32Å; D325-L327 PolarHBondContact O-N 2.87Å; D325-Q328 PolarHBondContact O-N 3.45Å; D325-Q328 VanDerWaalsContact O-N 3.16Å; D325-L329 WeakPolarHBondContact O-CB 3.33Å; D325-L329 PolarHBondContact O-N 3.15Å; D325-F375 HydrophobicContact CB-CE2 4.49Å; D325-F375 HydrophobicContact CB-CZ 4.34Å; D325-F375 WeakPolarHBondContact O-CZ 3.36Å; D325-L378 PolarHBondContact OD1-N 2.85Å; D325-L378 PolarHBondContact OD2-N 2.81Å; D325-T379 VanDerWaalsContact OD2-CB 3.27Å; D325-T379 WeakPolarHBondContact OD2-CB 3.44Å; D325-T379 WeakPolarHBondContact OD2-CG2 3.32Å; D325-T379 PolarHBondContact OD2-N 3.09Å; D325-T379 PolarHBondContact OD2-OG1 3.29Å; D325-V382 HydrophobicContact CB-CG2 4.27Å
326	A	91.2	Very high	88.1	Confident	1 Å²	1	31 Å²	31	1%	0.008	15%	0.148	C	C	.	.	H	α-helix	trans	-60.7	-40.4	171.8	0	0	0	0	0	112.2	L121 V145 L147 M164 Y322 I323 L329 I330	L121-A326 HydrophobicContact CD2-CB 4Å; V145-A326 HydrophobicContact CG1-CB 4.17Å; L147-A326 HydrophobicContact CD1-CB 4.43Å; M164-A326 HydrophobicContact SD-CB 4.16Å; Y322-A326 WeakPolarHBondContact O-CB 3.43Å; Y322-A326 PolarHBondContact O-N 2.78Å; I323-A326 PolarHBondContact O-N 3.33Å; A326-L329 WeakPolarHBondContact O-CB 3.43Å; A326-L329 PolarHBondContact O-N 2.89Å; A326-I330 WeakPolarHBondContact O-CG1 2.95Å; A326-I330 PolarHBondContact O-N 2.93Å; A326-I330 VanDerWaalsContact O-N 3.12Å
327	L	89.8	Confident	88.5	Confident	6 Å²	6	24.3 Å²	24.3	3%	0.031	12%	0.123	C	C	.	.	H	α-helix	trans	-68.5	-36.3	173.8	-70.4	170.4	0	0	0	112.2	V40 T61 L65 L91 L121 I323 R324 D325 I330 T331	V40-L327 HydrophobicContact CB-CD2 4.23Å; V40-L327 HydrophobicContact CG1-CD2 3.82Å; V40-L327 HydrophobicContact CG2-CD2 4.35Å; T61-L327 HydrophobicContact CG2-CD1 3.74Å; L65-L327 HydrophobicContact CD1-CD1 4.13Å; L91-L327 HydrophobicContact CD1-CD1 4.09Å; L91-L327 HydrophobicContact CD2-CD1 4.16Å; L91-L327 HydrophobicContact CD2-CD2 3.81Å; L121-L327 HydrophobicContact CD1-CD2 4.03Å; L121-L327 HydrophobicContact CD1-CG 4.23Å; I323-L327 HydrophobicContact CG2-CD1 4.14Å; I323-L327 VanDerWaalsContact O-CG 3.29Å; I323-L327 WeakPolarHBondContact O-CG 3.47Å; I323-L327 PolarHBondContact O-N 3.18Å; R324-L327 CarbonylContact O-C 3.37Å; R324-L327 PolarHBondContact O-N 3.26Å; D325-L327 VanDerWaalsContact C-N 3.32Å; D325-L327 PolarHBondContact O-N 2.87Å; L327-I330 PolarHBondContact O-N 3.1Å; L327-T331 WeakPolarHBondContact O-CB 3.43Å; L327-T331 VanDerWaalsContact O-CG2 3.25Å; L327-T331 WeakPolarHBondContact O-CG2 3.14Å; L327-T331 PolarHBondContact O-N 3.5Å; L327-T331 PolarHBondContact O-OG1 3.42Å
328	Q	88.8	Confident	88.4	Confident	33 Å²	33	21 Å²	21	15%	0.154	11%	0.109	C	C	.	.	H	α-helix	trans	-67	-39.4	175.9	-167.3	171.7	16.5	0	0	111.5	F82 R324 D325 T331 R332 F375	F82-Q328 HydrophobicContact CD2-CG 4.42Å; F82-Q328 HydrophobicContact CE2-CG 4.29Å; R324-Q328 WeakPolarHBondContact O-CB 3.37Å; R324-Q328 PolarHBondContact O-N 3.08Å; D325-Q328 PolarHBondContact O-N 3.45Å; D325-Q328 VanDerWaalsContact O-N 3.16Å; Q328-T331 VanDerWaalsContact CA-OG1 3.31Å; Q328-T331 WeakPolarHBondContact CA-OG1 3.48Å; Q328-T331 PolarHBondContact O-N 3.09Å; Q328-T331 PolarHBondContact O-OG1 2.81Å; Q328-T331 VanDerWaalsContact O-OG1 3.11Å; Q328-R332 HydrophobicContact CG-CG 4.29Å; Q328-R332 VanDerWaalsContact O-CB 3.27Å; Q328-R332 WeakPolarHBondContact O-CB 3.19Å; Q328-R332 VanDerWaalsContact O-CG 3.27Å; Q328-R332 WeakPolarHBondContact O-CG 3.49Å; Q328-R332 PolarHBondContact O-N 2.78Å; Q328-F375 HydrophobicContact CB-CE2 3.89Å; Q328-F375 HydrophobicContact CB-CZ 3.88Å; Q328-F375 HydrophobicContact CG-CD2 4.16Å; Q328-F375 HydrophobicContact CG-CE2 3.77Å; Q328-F375 HydrophobicContact CG-CZ 4.1Å
329	L	90.6	Very high	88.2	Confident	1 Å²	1	22.6 Å²	22.6	1%	0.005	12%	0.117	C	C	.	.	H	α-helix	trans	-57.6	-49.6	172.1	-174.2	72.4	0	0	0	110.8	L162 D325 A326 A333 L370 T373 F375 V384 V391	L162-L329 HydrophobicContact CD1-CD2 4.31Å; D325-L329 WeakPolarHBondContact O-CB 3.33Å; D325-L329 PolarHBondContact O-N 3.15Å; A326-L329 WeakPolarHBondContact O-CB 3.43Å; A326-L329 PolarHBondContact O-N 2.89Å; L329-A333 VanDerWaalsContact O-CB 3.29Å; L329-A333 WeakPolarHBondContact O-CB 3.37Å; L329-A333 PolarHBondContact O-N 2.93Å; L329-L370 HydrophobicContact CG-CD2 4.23Å; L329-T373 WeakPolarHBondContact CD1-OG1 3.4Å; L329-F375 HydrophobicContact CB-CE1 3.83Å; L329-F375 HydrophobicContact CB-CZ 4.26Å; L329-F375 HydrophobicContact CD1-CD1 4.43Å; L329-F375 HydrophobicContact CD1-CE1 3.78Å; L329-F375 HydrophobicContact CG-CE1 4.44Å; L329-V384 HydrophobicContact CD1-CG2 4.02Å; L329-V384 HydrophobicContact CD2-CG2 4.17Å; L329-V391 HydrophobicContact CD2-CG1 4.45Å; L329-V391 HydrophobicContact CD2-CG2 4.15Å
330	I	89.9	Confident	88	Confident	2 Å²	2	25.7 Å²	25.7	1%	0.01	14%	0.137	C	C	.	.	H	α-helix	trans	-62.8	-50	178.7	-66.9	166	0	0	0	111.2	V40 A119 L121 V145 A326 L327 A333 V334 L370	V40-I330 HydrophobicContact CG1-CD1 4.13Å; V40-I330 HydrophobicContact CG2-CG2 4.19Å; A119-I330 HydrophobicContact CB-CD1 4Å; A119-I330 HydrophobicContact CB-CG1 4.2Å; A119-I330 HydrophobicContact CB-CG2 3.86Å; L121-I330 HydrophobicContact CD2-CD1 3.88Å; V145-I330 HydrophobicContact CG2-CD1 4.17Å; V145-I330 HydrophobicContact CG2-CG1 4.27Å; A326-I330 WeakPolarHBondContact O-CG1 2.95Å; A326-I330 PolarHBondContact O-N 2.93Å; A326-I330 VanDerWaalsContact O-N 3.12Å; L327-I330 PolarHBondContact O-N 3.1Å; I330-A333 PolarHBondContact O-N 3.13Å; I330-V334 HydrophobicContact CG2-CG2 4.36Å; I330-V334 VanDerWaalsContact O-CG2 3.26Å; I330-V334 WeakPolarHBondContact O-CG2 3.27Å; I330-V334 PolarHBondContact O-N 3.35Å; I330-L370 HydrophobicContact CG1-CD2 4.28Å
331	T	87.5	Confident	87.7	Confident	13 Å²	13	30.2 Å²	30.2	8%	0.08	15%	0.153	C	C	.	.	H	α-helix	trans	-66.8	-39.5	-176.2	50.8	0	0	0	0	112.5	L83 V89 L327 Q328 V334 A335	L83-T331 HydrophobicContact CD1-CG2 4.4Å; L83-T331 HydrophobicContact CG-CG2 4.4Å; V89-T331 HydrophobicContact CG2-CG2 3.5Å; L327-T331 WeakPolarHBondContact O-CB 3.43Å; L327-T331 VanDerWaalsContact O-CG2 3.25Å; L327-T331 WeakPolarHBondContact O-CG2 3.14Å; L327-T331 PolarHBondContact O-N 3.5Å; L327-T331 PolarHBondContact O-OG1 3.42Å; Q328-T331 VanDerWaalsContact CA-OG1 3.31Å; Q328-T331 WeakPolarHBondContact CA-OG1 3.48Å; Q328-T331 PolarHBondContact O-N 3.09Å; Q328-T331 PolarHBondContact O-OG1 2.81Å; Q328-T331 VanDerWaalsContact O-OG1 3.11Å; T331-V334 PolarHBondContact O-N 3.04Å; T331-A335 VanDerWaalsContact O-CB 3.28Å; T331-A335 WeakPolarHBondContact O-CB 3.21Å; T331-A335 PolarHBondContact O-N 3.2Å
332	R	88.9	Confident	87.2	Confident	77 Å²	77	28.7 Å²	28.7	29%	0.291	15%	0.149	S	C	.	.	H	α-helix	trans	-65.7	-39.9	173.3	-72.9	-176.7	-178.5	-143.5	10	112	F82 Q328 A335 A336 F375	F82-R332 HydrophobicContact CD1-CG 4.47Å; Q328-R332 HydrophobicContact CG-CG 4.29Å; Q328-R332 VanDerWaalsContact O-CB 3.27Å; Q328-R332 WeakPolarHBondContact O-CB 3.19Å; Q328-R332 VanDerWaalsContact O-CG 3.27Å; Q328-R332 WeakPolarHBondContact O-CG 3.49Å; Q328-R332 PolarHBondContact O-N 2.78Å; R332-A335 PolarHBondContact O-N 3.07Å; R332-A336 WeakPolarHBondContact O-CB 3.38Å; R332-A336 PolarHBondContact O-N 3.2Å; R332-F375 VanDerWaalsContact CZ-CB 3.45Å
333	A	88.6	Confident	86.5	Confident	1 Å²	1	31.9 Å²	31.9	1%	0.008	17%	0.166	C	C	.	.	H	α-helix	trans	-64.6	-42.6	175.3	0	0	0	0	0	111.9	L329 I330 A336 A337 F369 L370 T373	L329-A333 VanDerWaalsContact O-CB 3.29Å; L329-A333 WeakPolarHBondContact O-CB 3.37Å; L329-A333 PolarHBondContact O-N 2.93Å; I330-A333 PolarHBondContact O-N 3.13Å; A333-A336 PolarHBondContact O-N 3.11Å; A333-A337 VanDerWaalsContact O-CB 3.23Å; A333-A337 WeakPolarHBondContact O-CB 3.44Å; A333-A337 PolarHBondContact O-N 3.19Å; A333-F369 HydrophobicContact CB-CB 4.08Å; A333-L370 HydrophobicContact CB-CB 4.44Å; A333-L370 HydrophobicContact CB-CD2 3.53Å; A333-L370 HydrophobicContact CB-CG 3.72Å; A333-T373 HydrophobicContact CB-CG2 3.98Å
334	V	87.6	Confident	85.9	Confident	3 Å²	3	33.4 Å²	33.4	2%	0.018	17%	0.174	C	C	.	.	H	α-helix	trans	-63.6	-42.8	174.2	172.5	0	0	0	0	110.7	L83 I330 T331 A337 T338 L346 L366	L83-V334 HydrophobicContact CD2-CB 4.19Å; L83-V334 HydrophobicContact CD2-CG1 3.92Å; I330-V334 HydrophobicContact CG2-CG2 4.36Å; I330-V334 VanDerWaalsContact O-CG2 3.26Å; I330-V334 WeakPolarHBondContact O-CG2 3.27Å; I330-V334 PolarHBondContact O-N 3.35Å; T331-V334 PolarHBondContact O-N 3.04Å; V334-A337 PolarHBondContact O-N 3.3Å; V334-T338 HydrophobicContact CG1-CG2 4.29Å; V334-T338 WeakPolarHBondContact O-CB 2.95Å; V334-T338 VanDerWaalsContact O-CG2 3.25Å; V334-T338 WeakPolarHBondContact O-CG2 3.3Å; V334-T338 PolarHBondContact O-N 3.42Å; V334-T338 PolarHBondContact O-OG1 3.49Å; V334-L346 HydrophobicContact CG1-CD2 4.34Å; V334-L366 HydrophobicContact CB-CD2 4.46Å; V334-L366 HydrophobicContact CG2-CD1 4.47Å; V334-L366 HydrophobicContact CG2-CD2 3.86Å
335	A	86.1	Confident	85.3	Confident	15 Å²	15	29.9 Å²	29.9	12%	0.124	16%	0.161	C	C	.	.	H	α-helix	trans	-61.7	-45.1	176.3	0	0	0	0	0	112.4	F82 T331 R332 A337 T338 V339	F82-A335 WeakPolarHBondContact O-CB 3.24Å; T331-A335 VanDerWaalsContact O-CB 3.28Å; T331-A335 WeakPolarHBondContact O-CB 3.21Å; T331-A335 PolarHBondContact O-N 3.2Å; R332-A335 PolarHBondContact O-N 3.07Å; A335-A337 PolarHBondContact O-N 3.02Å; A335-T338 VanDerWaalsContact CA-OG1 3.29Å; A335-T338 WeakPolarHBondContact CA-OG1 3.33Å; A335-T338 PolarHBondContact O-N 2.72Å; A335-T338 PolarHBondContact O-OG1 2.82Å; A335-V339 WeakPolarHBondContact O-CG2 3.36Å; A335-V339 PolarHBondContact O-N 3.04Å
336	A	86.9	Confident	84.5	Confident	42 Å²	42	30.1 Å²	30.1	35%	0.347	16%	0.162	S	C	.	.	H	α-helix	trans	-64.6	-41	175.6	0	0	0	0	0	111.8	R332 A333 T338 F369	R332-A336 WeakPolarHBondContact O-CB 3.38Å; R332-A336 PolarHBondContact O-N 3.2Å; A333-A336 PolarHBondContact O-N 3.11Å; A336-T338 PolarHBondContact O-N 2.75Å; A336-F369 HydrophobicContact CB-CD1 3.89Å; A336-F369 HydrophobicContact CB-CE1 4.43Å
337	A	86.4	Confident	83.5	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-66.5	-36.8	179	0	0	0	0	0	112.8	A333 V334 A335 V340 R341 A345 Y365 L366 F369	A333-A337 VanDerWaalsContact O-CB 3.23Å; A333-A337 WeakPolarHBondContact O-CB 3.44Å; A333-A337 PolarHBondContact O-N 3.19Å; V334-A337 PolarHBondContact O-N 3.3Å; A335-A337 PolarHBondContact O-N 3.02Å; A337-V340 PolarHBondContact O-N 3.2Å; A337-R341 CarbonylContact O-C 3.49Å; A337-R341 PolarHBondContact O-N 3.48Å; A337-A345 HydrophobicContact CB-CB 3.69Å; A337-Y365 HydrophobicContact CB-CD1 4.34Å; A337-Y365 HydrophobicContact CB-CE1 3.87Å; A337-Y365 PolarHBondContact O-OH 2.98Å; A337-L366 HydrophobicContact CB-CD2 3.76Å; A337-F369 HydrophobicContact CB-CD1 4.25Å; A337-F369 HydrophobicContact CB-CD2 3.6Å; A337-F369 HydrophobicContact CB-CE1 4.39Å; A337-F369 HydrophobicContact CB-CE2 3.79Å; A337-F369 HydrophobicContact CB-CG 3.86Å; A337-F369 HydrophobicContact CB-CZ 4.19Å
338	T	83.9	Confident	82.2	Confident	2 Å²	2	35 Å²	35	1%	0.012	19%	0.19	C	C	.	.	H	α-helix	trans	-69.9	-33.5	179.8	42.7	0	0	0	0	113.7	P84 V334 A335 A336 V340 P342 A345 L346	P84-T338 WeakPolarHBondContact CG-OG1 3.35Å; V334-T338 HydrophobicContact CG1-CG2 4.29Å; V334-T338 WeakPolarHBondContact O-CB 2.95Å; V334-T338 VanDerWaalsContact O-CG2 3.25Å; V334-T338 WeakPolarHBondContact O-CG2 3.3Å; V334-T338 PolarHBondContact O-N 3.42Å; V334-T338 PolarHBondContact O-OG1 3.49Å; A335-T338 VanDerWaalsContact CA-OG1 3.29Å; A335-T338 WeakPolarHBondContact CA-OG1 3.33Å; A335-T338 PolarHBondContact O-N 2.72Å; A335-T338 PolarHBondContact O-OG1 2.82Å; A336-T338 PolarHBondContact O-N 2.75Å; T338-V340 VanDerWaalsContact C-N 3.26Å; T338-V340 PolarHBondContact O-N 3.42Å; T338-P342 VanDerWaalsContact O-CD 3.3Å; T338-P342 WeakPolarHBondContact O-CD 3.43Å; T338-A345 HydrophobicContact CG2-CB 3.53Å; T338-L346 HydrophobicContact CG2-CD1 3.81Å; T338-L346 HydrophobicContact CG2-CD2 3.7Å; T338-L346 HydrophobicContact CG2-CG 3.46Å; T338-L346 VanDerWaalsContact CG2-CG 3.46Å
339	V	82.4	Confident	80.8	Confident	101 Å²	101	34.3 Å²	34.3	61%	0.612	19%	0.187	S	C	*	.	H	α-helix	trans	-63	-36.2	173.8	172	0	0	0	0	111.2	A335	A335-V339 WeakPolarHBondContact O-CG2 3.36Å; A335-V339 PolarHBondContact O-N 3.04Å
340	V	83.8	Confident	79.3	Confident	86 Å²	86	39.5 Å²	39.5	52%	0.521	22%	0.218	S	C	.	.	H	α-helix	trans	-82.4	-50.2	-177.9	-179.4	0	0	0	0	111.7	A337 T338 Y365 F369	A337-V340 PolarHBondContact O-N 3.2Å; T338-V340 VanDerWaalsContact C-N 3.26Å; T338-V340 PolarHBondContact O-N 3.42Å; V340-Y365 WeakPolarHBondContact CB-OH 3.31Å; V340-Y365 WeakPolarHBondContact CG1-OH 3.44Å; V340-F369 HydrophobicContact CB-CZ 4.35Å; V340-F369 HydrophobicContact CG2-CE1 4.22Å; V340-F369 HydrophobicContact CG2-CZ 4.24Å
341	R	80.8	Confident	77.9	Confident	110 Å²	110	41.3 Å²	41.3	42%	0.415	23%	0.23	S	C	.	.			trans	-148.4	93.5	178.5	-78.6	-154.2	-68.4	176.1	-0.4	111.1	A337 D343 L344 A345 Y365	A337-R341 CarbonylContact O-C 3.49Å; A337-R341 PolarHBondContact O-N 3.48Å; R341-D343 VanDerWaalsContact C-OD1 3.31Å; R341-D343 WeakPolarHBondContact CA-OD1 3.37Å; R341-D343 VanDerWaalsContact CB-OD1 3.25Å; R341-D343 WeakPolarHBondContact CB-OD1 3.27Å; R341-D343 PolarHBondContact O-N 3.45Å; R341-L344 PolarHBondContact O-N 3.11Å; R341-A345 WeakPolarHBondContact O-CB 3.47Å; R341-A345 PolarHBondContact O-N 3.29Å; R341-Y365 HydrophobicContact CB-CE1 4.24Å; R341-Y365 WeakPolarHBondContact CB-OH 3.4Å
342	P	78.1	Confident	76.6	Confident	26 Å²	26	43 Å²	43	17%	0.169	24%	0.242	C	C	.	.	H	α-helix	trans	-67.1	-27.1	-177.8	26.8	-32.9	0	0	0	112.5	P27 T338 L344 L346	P27-P342 HydrophobicContact CG-CB 4.3Å; P27-P342 HydrophobicContact CG-CG 4.48Å; T338-P342 VanDerWaalsContact O-CD 3.3Å; T338-P342 WeakPolarHBondContact O-CD 3.43Å; P342-L344 VanDerWaalsContact C-N 3.28Å; P342-L344 PolarHBondContact O-N 3.3Å; P342-L346 PolarHBondContact O-N 2.97Å
343	D	75.1	Confident	75.8	Confident	75 Å²	75	41.7 Å²	41.7	40%	0.401	24%	0.244	S	C	.	.	H	α-helix	trans	-64.6	-23	177.8	59.5	-52.2	0	0	0	114.3	L30 R341 V347	L30-D343 HydrophobicContact CD1-CB 4.37Å; R341-D343 VanDerWaalsContact C-OD1 3.31Å; R341-D343 WeakPolarHBondContact CA-OD1 3.37Å; R341-D343 VanDerWaalsContact CB-OD1 3.25Å; R341-D343 WeakPolarHBondContact CB-OD1 3.27Å; R341-D343 PolarHBondContact O-N 3.45Å; D343-V347 WeakPolarHBondContact O-CG2 3.39Å
344	L	78.3	Confident	75	Confident	32 Å²	32	50.9 Å²	50.9	17%	0.168	28%	0.28	C	S	.	.	H	α-helix	trans	-110.6	-20.4	175.8	-71.2	173.9	0	0	0	113.7	R341 P342 A362 Y365	R341-L344 PolarHBondContact O-N 3.11Å; P342-L344 VanDerWaalsContact C-N 3.28Å; P342-L344 PolarHBondContact O-N 3.3Å; L344-A362 WeakPolarHBondContact O-CA 3.31Å; L344-A362 WeakPolarHBondContact O-CB 3.4Å; L344-Y365 HydrophobicContact CB-CD1 3.86Å; L344-Y365 HydrophobicContact CB-CE1 4.23Å; L344-Y365 HydrophobicContact CB-CG 4.26Å
345	A	76.4	Confident	73.9	Confident	1 Å²	1	56 Å²	56	1%	0.008	31%	0.307	C	S	.	.	H	α-helix	trans	-83.4	-31.5	-179	0	0	0	0	0	113.2	A337 T338 R341 Y365 L366	A337-A345 HydrophobicContact CB-CB 3.69Å; T338-A345 HydrophobicContact CG2-CB 3.53Å; R341-A345 WeakPolarHBondContact O-CB 3.47Å; R341-A345 PolarHBondContact O-N 3.29Å; A345-Y365 HydrophobicContact CB-CD1 4.49Å; A345-Y365 HydrophobicContact CB-CE1 4.24Å; A345-L366 HydrophobicContact CB-CD2 4.5Å
346	L	74.3	Confident	72.6	Confident	5 Å²	5	61.4 Å²	61.4	3%	0.026	34%	0.339	C	S	.	.	S	Bend	trans	-104.7	-9.9	-176.7	-66.5	171.1	0	0	0	114.2	L30 I34 V38 L87 V334 T338 P342 Q348	L30-L346 HydrophobicContact CD2-CB 3.79Å; I34-L346 HydrophobicContact CD1-CB 4.19Å; I34-L346 HydrophobicContact CD1-CD1 4.26Å; I34-L346 VanDerWaalsContact CG2-O 3.24Å; I34-L346 WeakPolarHBondContact CG2-O 3.38Å; V38-L346 HydrophobicContact CG2-CD2 4.09Å; L87-L346 HydrophobicContact CD1-CD1 4.12Å; L87-L346 HydrophobicContact CD1-CD2 3.75Å; V334-L346 HydrophobicContact CG1-CD2 4.34Å; T338-L346 HydrophobicContact CG2-CD1 3.81Å; T338-L346 HydrophobicContact CG2-CD2 3.7Å; T338-L346 HydrophobicContact CG2-CG 3.46Å; T338-L346 VanDerWaalsContact CG2-CG 3.46Å; P342-L346 PolarHBondContact O-N 2.97Å; L346-Q348 PolarHBondContact O-N 3Å
347	V	69.1	Low	71.3	Confident	67 Å²	67	61.4 Å²	61.4	41%	0.406	34%	0.335	S	S	.	.	S	Bend	trans	-65.5	120.5	177	168.7	0	0	0	0	109.2	L30 D343 N349	L30-V347 HydrophobicContact CD2-CG2 4.3Å; D343-V347 WeakPolarHBondContact O-CG2 3.39Å; V347-N349 PolarHBondContact O-N 3.22Å
348	Q	62.9	Low	69.7	Low	44 Å²	44	71.2 Å²	71.2	21%	0.206	38%	0.381	C	S	.	.			trans	-62.7	124.1	175.3	-70	-179.8	-5.9	0	0	108.5	I34 G116 L346 T350	I34-Q348 HydrophobicContact CG2-CG 3.7Å; I34-Q348 PolarHBondContact O-NE2 2.9Å; G116-Q348 WeakPolarHBondContact O-CG 3.42Å; L346-Q348 PolarHBondContact O-N 3Å; Q348-T350 HydrophobicContact CB-CG2 4.45Å; Q348-T350 PolarHBondContact O-N 3.02Å
349	N	60.1	Low	68.5	Low	17 Å²	17	74.3 Å²	74.3	9%	0.091	41%	0.407	C	S	.	.			trans	-71.9	80.1	174.5	-124.5	23.8	0	0	0	107.7	V347 V351	V347-N349 PolarHBondContact O-N 3.22Å; N349-V351 HydrophobicContact CB-CG2 4.13Å; N349-V351 PolarHBondContact O-N 2.94Å
350	T	59.2	Low	67.4	Low	110 Å²	110	73.5 Å²	73.5	68%	0.675	40%	0.404	S	S	*	.			trans	-78.7	55.5	167.7	58.4	0	0	0	0	108.7	Q348 S352	Q348-T350 HydrophobicContact CB-CG2 4.45Å; Q348-T350 PolarHBondContact O-N 3.02Å; T350-S352 PolarHBondContact O-N 3.11Å
351	V	59.5	Low	66.8	Low	40 Å²	40	69.9 Å²	69.9	24%	0.242	38%	0.382	C	S	.	.			trans	-84.2	113.1	178.8	-176.1	0	0	0	0	106.7	N349 C353 P357	N349-V351 HydrophobicContact CB-CG2 4.13Å; N349-V351 PolarHBondContact O-N 2.94Å; V351-C353 PolarHBondContact O-N 3.22Å; V351-P357 HydrophobicContact CG1-CG 4.42Å
352	S	61.1	Low	66.5	Low	50 Å²	50	65.1 Å²	65.1	35%	0.35	37%	0.366	S	S	.	.			trans	-57.6	125.9	163	162.8	0	0	0	0	107.9	T350 Y354 D355	T350-S352 PolarHBondContact O-N 3.11Å; S352-Y354 PolarHBondContact O-N 3.09Å; S352-Y354 PolarHBondContact OG-N 3.07Å; S352-D355 WeakPolarHBondContact CB-OD2 3.45Å; S352-D355 PolarHBondContact O-N 3.29Å; S352-D355 PolarHBondContact OG-OD2 2.91Å
353	C	71.1	Confident	66.6	Low	48 Å²	48	64 Å²	64	32%	0.324	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-8.8	176.4	-77.7	0	0	0	0	113.9	C109 L113 L140 V351	C109-C353 WeakPolarHBondContact CA-SG 3.21Å; C109-C353 HydrophobicContact CB-CB 3.74Å; C109-C353 WeakPolarHBondContact CB-SG 3.27Å; C109-C353 WeakPolarHBondContact SG-CB 2.93Å; C109-C353 CovalentContact SG-SG 2.03Å; C109-C353 PolarHBondContact SG-SG 3.47Å; L113-C353 VanDerWaalsContact CD1-SG 3.59Å; L140-C353 WeakPolarHBondContact CD2-SG 3.47Å; V351-C353 PolarHBondContact O-N 3.22Å
354	Y	71.7	Confident	67	Low	195 Å²	195	67 Å²	67	77%	0.765	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-11.6	178.7	-56.8	-76.3	0	0	0	113.2	S352	S352-Y354 PolarHBondContact O-N 3.09Å; S352-Y354 PolarHBondContact OG-N 3.07Å
355	D	65.1	Low	67.4	Low	110 Å²	110	66.5 Å²	66.5	59%	0.588	36%	0.361	S	S	*	.			trans	-114.9	129.1	-176.9	-62.7	-48.9	0	0	0	111.7	S352 P357	S352-D355 WeakPolarHBondContact CB-OD2 3.45Å; S352-D355 PolarHBondContact O-N 3.29Å; S352-D355 PolarHBondContact OG-OD2 2.91Å; D355-P357 WeakPolarHBondContact O-CD 3.25Å
356	T	59.3	Low	67.9	Low	128 Å²	128	66.6 Å²	66.6	79%	0.785	36%	0.361	S	S	*	.			trans	-87.7	116.6	173.9	51.2	0	0	0	0	110.7	E358	T356-E358 PolarHBondContact O-N 3.3Å
357	P	57.9	Low	68.6	Low	43 Å²	43	66.7 Å²	66.7	28%	0.279	36%	0.362	S	S	.	.			trans	-75.2	129.3	-179.2	26.2	-30.9	0	0	0	112.1	R141 V351 D355 T361	R141-P357 PolarHBondContact NH1-O 3.44Å; V351-P357 HydrophobicContact CG1-CG 4.42Å; D355-P357 WeakPolarHBondContact O-CD 3.25Å; P357-T361 HydrophobicContact CB-CG2 3.82Å; P357-T361 HydrophobicContact CG-CG2 3.4Å; P357-T361 VanDerWaalsContact CG-CG2 3.4Å
358	E	53.5	Low	69.5	Low	205 Å²	205	70.8 Å²	70.8	96%	0.958	37%	0.37	S	S	*	.			trans	-81.8	-18.6	176	-66.5	-174.5	156.9	0	0	113.4	T356	T356-E358 PolarHBondContact O-N 3.3Å
359	A	58.8	Low	70.8	Confident	68 Å²	68	70.7 Å²	70.7	56%	0.562	37%	0.37	S	S	*	.	S	Bend	trans	-89.2	160.6	179.8	0	0	0	0	0	113.1	T361	A359-T361 PolarHBondContact O-N 3.03Å
360	P	60.4	Low	72.2	Confident	83 Å²	83	70.2 Å²	70.2	54%	0.539	37%	0.367	S	S	.	.			trans	-62.6	104.3	171.2	25.9	-33.1	0	0	0	110.2
361	T	69.9	Low	73.5	Confident	11 Å²	11	66 Å²	66	7%	0.067	34%	0.343	C	S	.	.			trans	-63.6	147.5	177.3	34.4	0	0	0	0	112	P357 A359 G363 R364 Y365	P357-T361 HydrophobicContact CB-CG2 3.82Å; P357-T361 HydrophobicContact CG-CG2 3.4Å; P357-T361 VanDerWaalsContact CG-CG2 3.4Å; A359-T361 PolarHBondContact O-N 3.03Å; T361-G363 PolarHBondContact O-N 3.2Å; T361-G363 VanDerWaalsContact O-N 3.15Å; T361-R364 PolarHBondContact O-N 2.99Å; T361-Y365 PolarHBondContact O-N 3.35Å
362	A	75.6	Confident	74.9	Confident	10 Å²	10	70.4 Å²	70.4	8%	0.083	37%	0.365	C	S	.	.	H	α-helix	trans	-50	-39	174.3	0	0	0	0	0	111.8	L344 R364 Y365 L366	L344-A362 WeakPolarHBondContact O-CA 3.31Å; L344-A362 WeakPolarHBondContact O-CB 3.4Å; A362-R364 PolarHBondContact O-N 3Å; A362-Y365 WeakPolarHBondContact O-CB 3.01Å; A362-Y365 PolarHBondContact O-N 3.03Å; A362-L366 WeakPolarHBondContact O-CB 3.27Å; A362-L366 WeakPolarHBondContact O-CG 3.24Å; A362-L366 PolarHBondContact O-N 3.18Å
363	G	78.8	Confident	76.2	Confident	2 Å²	2	68.9 Å²	68.9	2%	0.021	35%	0.354	C	S	.	.	H	α-helix	trans	-64.5	-37.8	176.5	0	0	0	0	0	114.9	R141 T361 Y365 L366 S367	R141-G363 WeakPolarHBondContact O-CA 3.41Å; T361-G363 PolarHBondContact O-N 3.2Å; T361-G363 VanDerWaalsContact O-N 3.15Å; G363-Y365 VanDerWaalsContact C-N 3.3Å; G363-Y365 PolarHBondContact O-N 3.1Å; G363-L366 PolarHBondContact O-N 3.44Å; G363-S367 WeakPolarHBondContact O-CB 3.45Å; G363-S367 PolarHBondContact O-N 3.41Å; G363-S367 PolarHBondContact O-OG 3.01Å
364	R	84.1	Confident	77.2	Confident	139 Å²	139	71.1 Å²	71.1	53%	0.525	37%	0.37	S	S	.	.	H	α-helix	trans	-68.1	-34.4	174.5	-169.8	178.7	-172.9	-173.9	2.4	111.2	F160 T361 A362 S367	F160-R364 HydrophobicContact CE1-CB 4.17Å; F160-R364 HydrophobicContact CZ-CB 4.13Å; F160-R364 HydrophobicContact CZ-CG 4.22Å; T361-R364 PolarHBondContact O-N 2.99Å; A362-R364 PolarHBondContact O-N 3Å; R364-S367 PolarHBondContact O-OG 3.4Å
365	Y	86.1	Confident	78	Confident	20 Å²	20	62.5 Å²	62.5	8%	0.078	34%	0.336	C	S	.	.	H	α-helix	trans	-67.4	-52	174.3	-173.5	-116.7	0	0	0	111	A337 V340 R341 L344 A345 T361 A362 G363 S367 R368 F369	A337-Y365 HydrophobicContact CB-CD1 4.34Å; A337-Y365 HydrophobicContact CB-CE1 3.87Å; A337-Y365 PolarHBondContact O-OH 2.98Å; V340-Y365 WeakPolarHBondContact CB-OH 3.31Å; V340-Y365 WeakPolarHBondContact CG1-OH 3.44Å; R341-Y365 HydrophobicContact CB-CE1 4.24Å; R341-Y365 WeakPolarHBondContact CB-OH 3.4Å; L344-Y365 HydrophobicContact CB-CD1 3.86Å; L344-Y365 HydrophobicContact CB-CE1 4.23Å; L344-Y365 HydrophobicContact CB-CG 4.26Å; A345-Y365 HydrophobicContact CB-CD1 4.49Å; A345-Y365 HydrophobicContact CB-CE1 4.24Å; T361-Y365 PolarHBondContact O-N 3.35Å; A362-Y365 WeakPolarHBondContact O-CB 3.01Å; A362-Y365 PolarHBondContact O-N 3.03Å; G363-Y365 VanDerWaalsContact C-N 3.3Å; G363-Y365 PolarHBondContact O-N 3.1Å; Y365-S367 PolarHBondContact O-N 3.4Å; Y365-R368 PolarHBondContact O-N 3.22Å; Y365-F369 HydrophobicContact CD1-CE2 4.24Å; Y365-F369 HydrophobicContact CD2-CE2 4.14Å; Y365-F369 AromaticContact CE1-CE2 3.78Å; Y365-F369 HydrophobicContact CE1-CE2 3.78Å; Y365-F369 HydrophobicContact CE1-CZ 4.42Å; Y365-F369 AromaticContact CE2-CE2 3.65Å; Y365-F369 HydrophobicContact CE2-CE2 3.65Å; Y365-F369 HydrophobicContact CE2-CZ 4.22Å; Y365-F369 HydrophobicContact CG-CE2 4.4Å; Y365-F369 AromaticContact CZ-CE2 3.44Å; Y365-F369 VanDerWaalsContact CZ-CE2 3.44Å; Y365-F369 AromaticContact CZ-CZ 3.84Å; Y365-F369 WeakPolarHBondContact O-CD2 3.07Å
366	L	87.8	Confident	79.1	Confident	4 Å²	4	62 Å²	62	2%	0.021	34%	0.342	C	S	.	.	H	α-helix	trans	-61.8	-37.1	179.7	-71.7	171.8	0	0	0	113.5	P143 V334 A337 A345 A362 G363 R368 F369 L370	P143-L366 HydrophobicContact CG-CB 4.29Å; V334-L366 HydrophobicContact CB-CD2 4.46Å; V334-L366 HydrophobicContact CG2-CD1 4.47Å; V334-L366 HydrophobicContact CG2-CD2 3.86Å; A337-L366 HydrophobicContact CB-CD2 3.76Å; A345-L366 HydrophobicContact CB-CD2 4.5Å; A362-L366 WeakPolarHBondContact O-CB 3.27Å; A362-L366 WeakPolarHBondContact O-CG 3.24Å; A362-L366 PolarHBondContact O-N 3.18Å; G363-L366 PolarHBondContact O-N 3.44Å; L366-R368 PolarHBondContact O-N 3.37Å; L366-R368 VanDerWaalsContact O-N 3.14Å; L366-F369 PolarHBondContact O-N 2.95Å; L366-L370 PolarHBondContact O-N 2.98Å
367	S	88.3	Confident	80.4	Confident	6 Å²	6	56.8 Å²	56.8	4%	0.042	31%	0.314	C	S	.	.	H	α-helix	trans	-55.9	-31.4	178.2	66.8	0	0	0	0	113.8	R159 G363 R364 Y365 A371	R159-S367 WeakPolarHBondContact O-CB 3.5Å; G363-S367 WeakPolarHBondContact O-CB 3.45Å; G363-S367 PolarHBondContact O-N 3.41Å; G363-S367 PolarHBondContact O-OG 3.01Å; R364-S367 PolarHBondContact O-OG 3.4Å; Y365-S367 PolarHBondContact O-N 3.4Å; S367-A371 WeakPolarHBondContact O-CB 3.42Å; S367-A371 PolarHBondContact O-N 3.04Å; S367-A371 VanDerWaalsContact O-N 3.1Å
368	R	88.6	Confident	81.7	Confident	153 Å²	153	58.5 Å²	58.5	58%	0.577	32%	0.32	S	S	*	.	H	α-helix	trans	-71.3	-35.3	177.4	-63.9	179.1	-177.3	174.8	-1.3	112.4	Y365 L366	Y365-R368 PolarHBondContact O-N 3.22Å; L366-R368 PolarHBondContact O-N 3.37Å; L366-R368 VanDerWaalsContact O-N 3.14Å
369	F	89.8	Confident	83.2	Confident	43 Å²	43	49.3 Å²	49.3	19%	0.189	28%	0.278	C	S	.	.	H	α-helix	trans	-75.2	-43.1	177.1	-68.7	-89.5	0	0	0	110.3	A333 A336 A337 V340 Y365 L366 A371 N372 T373	A333-F369 HydrophobicContact CB-CB 4.08Å; A336-F369 HydrophobicContact CB-CD1 3.89Å; A336-F369 HydrophobicContact CB-CE1 4.43Å; A337-F369 HydrophobicContact CB-CD1 4.25Å; A337-F369 HydrophobicContact CB-CD2 3.6Å; A337-F369 HydrophobicContact CB-CE1 4.39Å; A337-F369 HydrophobicContact CB-CE2 3.79Å; A337-F369 HydrophobicContact CB-CG 3.86Å; A337-F369 HydrophobicContact CB-CZ 4.19Å; V340-F369 HydrophobicContact CB-CZ 4.35Å; V340-F369 HydrophobicContact CG2-CE1 4.22Å; V340-F369 HydrophobicContact CG2-CZ 4.24Å; Y365-F369 HydrophobicContact CD1-CE2 4.24Å; Y365-F369 HydrophobicContact CD2-CE2 4.14Å; Y365-F369 AromaticContact CE1-CE2 3.78Å; Y365-F369 HydrophobicContact CE1-CE2 3.78Å; Y365-F369 HydrophobicContact CE1-CZ 4.42Å; Y365-F369 AromaticContact CE2-CE2 3.65Å; Y365-F369 HydrophobicContact CE2-CE2 3.65Å; Y365-F369 HydrophobicContact CE2-CZ 4.22Å; Y365-F369 HydrophobicContact CG-CE2 4.4Å; Y365-F369 AromaticContact CZ-CE2 3.44Å; Y365-F369 VanDerWaalsContact CZ-CE2 3.44Å; Y365-F369 AromaticContact CZ-CZ 3.84Å; Y365-F369 WeakPolarHBondContact O-CD2 3.07Å; L366-F369 PolarHBondContact O-N 2.95Å; F369-A371 VanDerWaalsContact C-N 3.27Å; F369-A371 PolarHBondContact O-N 2.89Å; F369-N372 CarbonylContact O-C 3.6Å; F369-N372 PolarHBondContact O-N 3.05Å; F369-T373 WeakPolarHBondContact O-CG2 3.42Å; F369-T373 PolarHBondContact O-N 3.08Å; F369-T373 VanDerWaalsContact O-N 3.12Å; F369-T373 PolarHBondContact O-OG1 2.65Å
370	L	89.9	Confident	84.5	Confident	6 Å²	6	47.2 Å²	47.2	3%	0.031	26%	0.263	C	S	.	.	H	α-helix	trans	-56.5	-40.4	174.8	-74.5	166.5	0	0	0	112.5	P143 L162 L329 I330 A333 L366 N372 T373 V384	P143-L370 HydrophobicContact CB-CD1 3.36Å; P143-L370 HydrophobicContact CG-CD1 3.79Å; L162-L370 HydrophobicContact CD1-CB 4.04Å; L329-L370 HydrophobicContact CG-CD2 4.23Å; I330-L370 HydrophobicContact CG1-CD2 4.28Å; A333-L370 HydrophobicContact CB-CB 4.44Å; A333-L370 HydrophobicContact CB-CD2 3.53Å; A333-L370 HydrophobicContact CB-CG 3.72Å; L366-L370 PolarHBondContact O-N 2.98Å; L370-N372 PolarHBondContact O-N 3.31Å; L370-T373 PolarHBondContact O-OG1 2.95Å; L370-V384 WeakPolarHBondContact O-CG2 3.36Å
371	A	87.4	Confident	85.8	Confident	21 Å²	21	47 Å²	47	17%	0.174	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-14	177.2	0	0	0	0	0	114.4	S367 F369 Q386	S367-A371 WeakPolarHBondContact O-CB 3.42Å; S367-A371 PolarHBondContact O-N 3.04Å; S367-A371 VanDerWaalsContact O-N 3.1Å; F369-A371 VanDerWaalsContact C-N 3.27Å; F369-A371 PolarHBondContact O-N 2.89Å; A371-Q386 HydrophobicContact CB-CG 4.07Å; A371-Q386 WeakPolarHBondContact O-CG 3.5Å; A371-Q386 PolarHBondContact O-NE2 2.77Å
372	N	88.8	Confident	86.7	Confident	133 Å²	133	46.7 Å²	46.7	71%	0.711	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120	12.8	-176.3	-164.8	30.7	0	0	0	112.9	F369 L370	F369-N372 CarbonylContact O-C 3.6Å; F369-N372 PolarHBondContact O-N 3.05Å; L370-N372 PolarHBondContact O-N 3.31Å
373	T	88.5	Confident	87.4	Confident	19 Å²	19	47 Å²	47	12%	0.117	26%	0.263	C	S	.	.			trans	-93	130.4	176	38.3	0	0	0	0	110.8	L329 A333 F369 L370	L329-T373 WeakPolarHBondContact CD1-OG1 3.4Å; A333-T373 HydrophobicContact CB-CG2 3.98Å; F369-T373 WeakPolarHBondContact O-CG2 3.42Å; F369-T373 PolarHBondContact O-N 3.08Å; F369-T373 VanDerWaalsContact O-N 3.12Å; F369-T373 PolarHBondContact O-OG1 2.65Å; L370-T373 PolarHBondContact O-OG1 2.95Å
374	S	91.3	Very high	87.9	Confident	94 Å²	94	48 Å²	48	66%	0.657	27%	0.269	S	S	*	.			trans	-133.9	146.4	166.2	57.7	0	0	0	0	109.9	V382	S374-V382 CarbonylContact C-O 3.59Å; S374-V382 WeakPolarHBondContact CA-O 3.44Å
375	F	89.4	Confident	88	Confident	14 Å²	14	43.4 Å²	43.4	6%	0.061	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.9	160.7	177.9	63.7	-81.8	0	0	0	111.9	D325 Q328 L329 R332 V382	D325-F375 HydrophobicContact CB-CE2 4.49Å; D325-F375 HydrophobicContact CB-CZ 4.34Å; D325-F375 WeakPolarHBondContact O-CZ 3.36Å; Q328-F375 HydrophobicContact CB-CE2 3.89Å; Q328-F375 HydrophobicContact CB-CZ 3.88Å; Q328-F375 HydrophobicContact CG-CD2 4.16Å; Q328-F375 HydrophobicContact CG-CE2 3.77Å; Q328-F375 HydrophobicContact CG-CZ 4.1Å; L329-F375 HydrophobicContact CB-CE1 3.83Å; L329-F375 HydrophobicContact CB-CZ 4.26Å; L329-F375 HydrophobicContact CD1-CD1 4.43Å; L329-F375 HydrophobicContact CD1-CE1 3.78Å; L329-F375 HydrophobicContact CG-CE1 4.44Å; R332-F375 VanDerWaalsContact CZ-CB 3.45Å; F375-V382 HydrophobicContact CD1-CB 4.35Å; F375-V382 HydrophobicContact CE1-CB 3.95Å; F375-V382 HydrophobicContact CE1-CG1 3.91Å; F375-V382 HydrophobicContact CE2-CB 4.23Å; F375-V382 HydrophobicContact CE2-CG2 4.19Å; F375-V382 HydrophobicContact CZ-CB 3.87Å; F375-V382 HydrophobicContact CZ-CG1 3.98Å; F375-V382 HydrophobicContact CZ-CG2 4.1Å; F375-V382 PolarHBondContact N-O 2.89Å; F375-V382 PolarHBondContact O-N 2.97Å
376	S	87.8	Confident	87.7	Confident	100 Å²	100	47.9 Å²	47.9	70%	0.699	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.5	112.3	167.8	-51.4	0	0	0	0	109.4
377	G	84.9	Confident	87.4	Confident	19 Å²	19	53.6 Å²	53.6	20%	0.196	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	-171.2	177.6	0	0	0	0	0	112.6	T379 G380	G377-T379 PolarHBondContact O-N 3.16Å; G377-G380 PolarHBondContact N-O 2.86Å; G377-G380 PolarHBondContact O-N 3.44Å
378	L	85.6	Confident	87	Confident	79 Å²	79	60.8 Å²	60.8	41%	0.414	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-21	178.3	-61.2	175.9	0	0	0	113	F321 R324 D325	F321-L378 HydrophobicContact CB-CB 4.33Å; F321-L378 HydrophobicContact CD1-CB 3.58Å; F321-L378 HydrophobicContact CD1-CD1 4.22Å; F321-L378 HydrophobicContact CD1-CG 4.45Å; F321-L378 HydrophobicContact CE1-CB 4.22Å; F321-L378 HydrophobicContact CG-CB 4.26Å; F321-L378 HydrophobicContact CG-CD1 4.48Å; R324-L378 HydrophobicContact CB-CD1 4.19Å; D325-L378 PolarHBondContact OD1-N 2.85Å; D325-L378 PolarHBondContact OD2-N 2.81Å
379	T	86.1	Confident	87	Confident	11 Å²	11	53.7 Å²	53.7	7%	0.067	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93	7.7	174.4	61.9	0	0	0	0	113	K317 F321 Y322 D325 G377	K317-T379 HydrophobicContact CB-CG2 4.39Å; K317-T379 HydrophobicContact CG-CG2 4.46Å; F321-T379 HydrophobicContact CB-CG2 4.01Å; Y322-T379 HydrophobicContact CD1-CG2 3.81Å; Y322-T379 HydrophobicContact CD2-CG2 4.08Å; Y322-T379 HydrophobicContact CE1-CG2 3.88Å; Y322-T379 HydrophobicContact CE2-CG2 4.18Å; Y322-T379 HydrophobicContact CG-CG2 3.89Å; D325-T379 VanDerWaalsContact OD2-CB 3.27Å; D325-T379 WeakPolarHBondContact OD2-CB 3.44Å; D325-T379 WeakPolarHBondContact OD2-CG2 3.32Å; D325-T379 PolarHBondContact OD2-N 3.09Å; D325-T379 PolarHBondContact OD2-OG1 3.29Å; G377-T379 PolarHBondContact O-N 3.16Å
380	G	85.1	Confident	86.9	Confident	24 Å²	24	53.1 Å²	53.1	25%	0.247	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	102.1	-158.6	-177.6	0	0	0	0	0	112.6	G377 V382	G377-G380 PolarHBondContact N-O 2.86Å; G377-G380 PolarHBondContact O-N 3.44Å; G380-V382 PolarHBondContact O-N 3.43Å
381	P	87.8	Confident	86.9	Confident	80 Å²	80	53 Å²	53	52%	0.519	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	119.5	173.8	27.3	-34.3	0	0	0	110.3
382	V	89.4	Confident	86.7	Confident	3 Å²	3	56.3 Å²	56.3	2%	0.018	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	125.1	176.5	-176.8	0	0	0	0	108.8	D325 S374 F375 G380 V391 L392	D325-V382 HydrophobicContact CB-CG2 4.27Å; S374-V382 CarbonylContact C-O 3.59Å; S374-V382 WeakPolarHBondContact CA-O 3.44Å; F375-V382 HydrophobicContact CD1-CB 4.35Å; F375-V382 HydrophobicContact CE1-CB 3.95Å; F375-V382 HydrophobicContact CE1-CG1 3.91Å; F375-V382 HydrophobicContact CE2-CB 4.23Å; F375-V382 HydrophobicContact CE2-CG2 4.19Å; F375-V382 HydrophobicContact CZ-CB 3.87Å; F375-V382 HydrophobicContact CZ-CG1 3.98Å; F375-V382 HydrophobicContact CZ-CG2 4.1Å; F375-V382 PolarHBondContact N-O 2.89Å; F375-V382 PolarHBondContact O-N 2.97Å; G380-V382 PolarHBondContact O-N 3.43Å; V382-V391 HydrophobicContact CG1-CG1 3.59Å; V382-L392 WeakPolarHBondContact CA-O 3.4Å
383	G	89.4	Confident	86.5	Confident	16 Å²	16	51 Å²	51	17%	0.165	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	168.6	175.6	0	0	0	0	0	111.6	V391 L392	G383-V391 CarbonylContact O-C 3.54Å; G383-V391 WeakPolarHBondContact O-CA 3.48Å; G383-L392 PolarHBondContact N-O 3.02Å; G383-L392 PolarHBondContact O-N 2.88Å
384	V	89.5	Confident	86	Confident	23 Å²	23	51.5 Å²	51.5	14%	0.139	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	119.9	178.9	-176.6	0	0	0	0	110.2	L162 L329 L370 Q386 V391	L162-V384 HydrophobicContact CD1-CG1 4.32Å; L162-V384 HydrophobicContact CD1-CG2 4.45Å; L162-V384 HydrophobicContact CD2-CG1 3.64Å; L329-V384 HydrophobicContact CD1-CG2 4.02Å; L329-V384 HydrophobicContact CD2-CG2 4.17Å; L370-V384 WeakPolarHBondContact O-CG2 3.36Å; V384-Q386 PolarHBondContact O-N 3.26Å; V384-V391 HydrophobicContact CG2-CG2 4.34Å
385	D	85.8	Confident	85.3	Confident	44 Å²	44	48.1 Å²	48.1	24%	0.235	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	110.4	168.3	-179.7	2.4	0	0	0	109.6	N387 R388 S389 L390 L392	D385-N387 VanDerWaalsContact C-N 3.27Å; D385-N387 PolarHBondContact O-N 3.34Å; D385-N387 PolarHBondContact OD1-N 3.04Å; D385-R388 WeakPolarHBondContact OD2-CD 3.32Å; D385-R388 WeakPolarHBondContact OD2-CG 3.41Å; D385-S389 WeakPolarHBondContact O-CA 3.46Å; D385-S389 PolarHBondContact O-N 2.9Å; D385-L390 PolarHBondContact N-O 2.98Å; D385-L390 PolarHBondContact O-N 3.38Å; D385-L392 HydrophobicContact CB-CD1 4.3Å; D385-L392 HydrophobicContact CB-CG 4.4Å
386	Q	80.2	Confident	85.1	Confident	114 Å²	114	51.8 Å²	51.8	53%	0.533	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-25.5	-176.7	-54.6	-170.7	-3.9	0	0	113.5	A371 V384	A371-Q386 HydrophobicContact CB-CG 4.07Å; A371-Q386 WeakPolarHBondContact O-CG 3.5Å; A371-Q386 PolarHBondContact O-NE2 2.77Å; V384-Q386 PolarHBondContact O-N 3.26Å
387	N	82.2	Confident	85	Confident	123 Å²	123	47 Å²	47	66%	0.658	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-27.8	-174.9	-72.3	-25.9	0	0	0	112.6	D385	D385-N387 VanDerWaalsContact C-N 3.27Å; D385-N387 PolarHBondContact O-N 3.34Å; D385-N387 PolarHBondContact OD1-N 3.04Å
388	R	80.1	Confident	85.3	Confident	158 Å²	158	47.8 Å²	47.8	60%	0.596	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108.8	-1.5	-179.8	-62.4	-177.7	177.6	-173.3	1.6	113	T156 D385 L390	T156-R388 CarbonylContact O-C 3.45Å; D385-R388 WeakPolarHBondContact OD2-CD 3.32Å; D385-R388 WeakPolarHBondContact OD2-CG 3.41Å; R388-L390 HydrophobicContact CB-CB 4.06Å; R388-L390 PolarHBondContact O-N 3.11Å; R388-L390 VanDerWaalsContact O-N 3.17Å
389	S	87.9	Confident	85.4	Confident	3 Å²	3	44 Å²	44	2%	0.021	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.9	38	-170.5	-63.6	0	0	0	0	112.8	N158 H161 L162 Q163 D385	N158-S389 PolarHBondContact O-OG 3.02Å; H161-S389 WeakPolarHBondContact O-CB 3.31Å; L162-S389 WeakPolarHBondContact CA-O 3.35Å; Q163-S389 PolarHBondContact N-O 2.82Å; D385-S389 WeakPolarHBondContact O-CA 3.46Å; D385-S389 PolarHBondContact O-N 2.9Å
390	L	88.6	Confident	85.5	Confident	31 Å²	31	45 Å²	45	16%	0.162	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	131.4	-173.5	-170.8	75.4	0	0	0	109.4	P153 Q163 V165 D385 R388 L392	P153-L390 HydrophobicContact CB-CD1 3.91Å; P153-L390 HydrophobicContact CG-CD1 4.25Å; Q163-L390 HydrophobicContact CB-CD1 4.26Å; Q163-L390 CarbonylContact O-C 3.53Å; Q163-L390 WeakPolarHBondContact O-CA 3.5Å; Q163-L390 WeakPolarHBondContact O-CD1 3.14Å; V165-L390 HydrophobicContact CG2-CD1 3.82Å; D385-L390 PolarHBondContact N-O 2.98Å; D385-L390 PolarHBondContact O-N 3.38Å; R388-L390 HydrophobicContact CB-CB 4.06Å; R388-L390 PolarHBondContact O-N 3.11Å; R388-L390 VanDerWaalsContact O-N 3.17Å; L390-L392 HydrophobicContact CD2-CD2 3.9Å; L390-L392 HydrophobicContact CG-CD2 4.49Å; L390-L392 PolarHBondContact O-N 3.4Å
391	V	88.3	Confident	85.7	Confident	4 Å²	4	44 Å²	44	2%	0.024	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	111.3	169.4	-175.1	0	0	0	0	107.1	L162 Q163 M164 L329 V382 G383 V384	L162-V391 HydrophobicContact CB-CG2 4.01Å; Q163-V391 PolarHBondContact O-N 3.4Å; M164-V391 HydrophobicContact CB-CB 3.96Å; M164-V391 HydrophobicContact CB-CG1 4.49Å; M164-V391 HydrophobicContact CB-CG2 4.24Å; M164-V391 HydrophobicContact CE-CG1 4.39Å; M164-V391 HydrophobicContact CG-CB 4.08Å; M164-V391 HydrophobicContact CG-CG1 4.14Å; L329-V391 HydrophobicContact CD2-CG1 4.45Å; L329-V391 HydrophobicContact CD2-CG2 4.15Å; V382-V391 HydrophobicContact CG1-CG1 3.59Å; G383-V391 CarbonylContact O-C 3.54Å; G383-V391 WeakPolarHBondContact O-CA 3.48Å; V384-V391 HydrophobicContact CG2-CG2 4.34Å
392	L	85.2	Confident	85.6	Confident	91 Å²	91	40.2 Å²	40.2	48%	0.476	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	127.2	177.1	-60.6	175	0	0	0	108.9	V382 G383 D385 L390	V382-L392 WeakPolarHBondContact CA-O 3.4Å; G383-L392 PolarHBondContact N-O 3.02Å; G383-L392 PolarHBondContact O-N 2.88Å; D385-L392 HydrophobicContact CB-CD1 4.3Å; D385-L392 HydrophobicContact CB-CG 4.4Å; L390-L392 HydrophobicContact CD2-CD2 3.9Å; L390-L392 HydrophobicContact CG-CD2 4.49Å; L390-L392 PolarHBondContact O-N 3.4Å
393	T	83.4	Confident	85.3	Confident	20 Å²	20	43 Å²	43	12%	0.123	21%	0.206	C	C	.	.			trans	-122	146.1	170.7	53.2	0	0	0	0	108.1	M164 Y322 Q395	M164-T393 HydrophobicContact CE-CG2 3.48Å; M164-T393 VanDerWaalsContact CE-CG2 3.48Å; M164-T393 HydrophobicContact CG-CG2 4.38Å; Y322-T393 HydrophobicContact CE1-CG2 4.28Å; T393-Q395 PolarHBondContact O-N 2.84Å
394	S	77.4	Confident	84.8	Confident	30 Å²	30	50.1 Å²	50.1	21%	0.21	23%	0.228	C	C	.	.			trans	-67	124.5	174.5	171.8	0	0	0	0	109.8	E419	S394-E419 PolarHBondContact OG-OE1 2.92Å
395	Q	77.6	Confident	84.1	Confident	23 Å²	23	51.8 Å²	51.8	11%	0.107	24%	0.236	C	C	.	.			trans	-121.4	120.4	170.6	-68.4	-175.8	-17.7	0	0	107.6	G167 T393 F397	G167-Q395 PolarHBondContact O-NE2 2.77Å; T393-Q395 PolarHBondContact O-N 2.84Å; Q395-F397 HydrophobicContact CB-CE2 4.11Å
396	R	84.3	Confident	83.2	Confident	92 Å²	92	55.1 Å²	55.1	35%	0.347	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	128.4	-180	-174.8	173.8	176.4	155.8	3.1	109.9	V314	V314-R396 PolarHBondContact N-O 2.82Å
397	F	87.1	Confident	82.6	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	137.3	174.3	-68.8	-99.1	0	0	0	109.8	V168 L173 L176 G312 E313 Q395 S417 W418	V168-F397 HydrophobicContact CB-CZ 4.11Å; V168-F397 HydrophobicContact CG1-CE1 4.24Å; V168-F397 HydrophobicContact CG1-CE2 4.3Å; V168-F397 HydrophobicContact CG1-CZ 3.47Å; V168-F397 VanDerWaalsContact CG1-CZ 3.47Å; V168-F397 HydrophobicContact CG2-CE1 4.02Å; V168-F397 HydrophobicContact CG2-CZ 3.5Å; V168-F397 VanDerWaalsContact CG2-CZ 3.5Å; L173-F397 HydrophobicContact CD2-CE1 4.37Å; L176-F397 HydrophobicContact CD1-CB 4.33Å; L176-F397 HydrophobicContact CD2-CB 4.35Å; L176-F397 HydrophobicContact CD2-CD1 3.91Å; L176-F397 HydrophobicContact CD2-CE1 4.44Å; L176-F397 HydrophobicContact CD2-CG 4.05Å; G312-F397 WeakPolarHBondContact O-CA 3.46Å; E313-F397 HydrophobicContact CB-CD1 4.27Å; E313-F397 HydrophobicContact CB-CE1 3.85Å; E313-F397 HydrophobicContact CB-CZ 4.24Å; E313-F397 HydrophobicContact CG-CE1 4.47Å; E313-F397 HydrophobicContact CG-CZ 4.39Å; Q395-F397 HydrophobicContact CB-CE2 4.11Å; F397-S417 CarbonylContact O-C 3.59Å; F397-S417 WeakPolarHBondContact O-CA 3.43Å; F397-W418 HydrophobicContact CB-CB 4.31Å; F397-W418 AromaticContact CD2-CE3 3.62Å; F397-W418 HydrophobicContact CD2-CE3 3.62Å; F397-W418 AromaticContact CD2-CZ3 3.98Å; F397-W418 HydrophobicContact CD2-CZ3 3.98Å; F397-W418 HydrophobicContact CE2-CE3 4.19Å; F397-W418 HydrophobicContact CE2-CZ3 4.08Å; F397-W418 HydrophobicContact CG-CE3 4.44Å; F397-W418 PolarHBondContact N-O 3.12Å; F397-W418 PolarHBondContact O-N 3.4Å
398	H	89.4	Confident	82	Confident	34 Å²	34	52.2 Å²	52.2	16%	0.157	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	139.2	164.1	-83	-51	0	0	0	109.4	Y311 G312 V314 W400 T414 E426	Y311-H398 CarbonylContact C-O 3.46Å; Y311-H398 VanDerWaalsContact CA-O 3.22Å; Y311-H398 WeakPolarHBondContact CA-O 3.35Å; G312-H398 PolarHBondContact N-O 3.49Å; G312-H398 PolarHBondContact O-N 2.67Å; V314-H398 HydrophobicContact CG2-CB 3.61Å; V314-H398 WeakPolarHBondContact CG2-CD2 3.43Å; H398-W400 HydrophobicContact CB-CH2 4.46Å; H398-W400 HydrophobicContact CB-CZ2 3.66Å; H398-T414 HydrophobicContact CB-CG2 4.12Å; H398-T414 VanDerWaalsContact ND1-CG2 3.31Å; H398-T414 WeakPolarHBondContact ND1-CG2 3.25Å; H398-E426 IonicContact CE1-OE1 3.83Å
399	I	89.8	Confident	81.6	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.005	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	125.4	172.9	-61.4	146.8	0	0	0	106.2	V180 A310 T414 V415 G416 L423 W431	V180-I399 HydrophobicContact CG2-CD1 3.85Å; V180-I399 HydrophobicContact CG2-CG1 4.38Å; A310-I399 CarbonylContact O-C 3.6Å; A310-I399 WeakPolarHBondContact O-CA 3.43Å; I399-T414 CarbonylContact O-C 3.57Å; I399-T414 WeakPolarHBondContact O-CA 3.08Å; I399-V415 HydrophobicContact CB-CG2 4.17Å; I399-V415 HydrophobicContact CG2-CG2 3.68Å; I399-V415 WeakPolarHBondContact O-CG2 3.43Å; I399-V415 PolarHBondContact O-N 2.81Å; I399-G416 PolarHBondContact N-O 3.17Å; I399-L423 HydrophobicContact CD1-CD1 3.18Å; I399-W431 HydrophobicContact CD1-CH2 4.1Å; I399-W431 HydrophobicContact CD1-CZ2 4.28Å; I399-W431 HydrophobicContact CG2-CH2 4.22Å; I399-W431 HydrophobicContact CG2-CZ2 4.31Å
400	W	87.9	Confident	81.2	Confident	31 Å²	31	51.7 Å²	51.7	12%	0.117	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	145.2	-179.3	-54.6	-72	0	0	0	110.8	P296 L309 A310 Y311 G312 H398 W412 V413 T414	P296-W400 HydrophobicContact CG-CD2 3.81Å; P296-W400 HydrophobicContact CG-CE3 3.75Å; P296-W400 HydrophobicContact CG-CH2 3.87Å; P296-W400 HydrophobicContact CG-CZ2 3.92Å; P296-W400 HydrophobicContact CG-CZ3 3.76Å; L309-W400 WeakPolarHBondContact CA-O 3.19Å; A310-W400 HydrophobicContact CB-CE3 4.4Å; A310-W400 PolarHBondContact N-O 3.25Å; A310-W400 PolarHBondContact O-N 2.89Å; Y311-W400 VanDerWaalsContact C-CZ3 3.41Å; G312-W400 VanDerWaalsContact CA-CZ3 3.43Å; H398-W400 HydrophobicContact CB-CH2 4.46Å; H398-W400 HydrophobicContact CB-CZ2 3.66Å; W400-W412 HydrophobicContact CB-CB 4.31Å; W400-W412 HydrophobicContact CB-CD2 4.42Å; W400-W412 HydrophobicContact CB-CE3 3.69Å; W400-W412 HydrophobicContact CB-CZ3 4.38Å; W400-V413 CarbonylContact C-O 3.52Å; W400-V413 VanDerWaalsContact CA-O 3.25Å; W400-V413 WeakPolarHBondContact CA-O 3.36Å; W400-T414 PolarHBondContact NE1-OG1 2.95Å
401	S	88.4	Confident	81	Confident	3 Å²	3	51.6 Å²	51.6	2%	0.021	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	132.4	168.6	177.9	0	0	0	0	108.5	L308 R403 V413 V415	L308-S401 WeakPolarHBondContact O-CA 3.33Å; S401-R403 PolarHBondContact O-N 2.78Å; S401-V413 PolarHBondContact N-O 2.96Å; S401-V413 PolarHBondContact O-N 2.89Å; S401-V415 VanDerWaalsContact CB-CG1 3.44Å
402	L	85.9	Confident	80.9	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.005	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	115.3	172.8	-168.2	68.8	0	0	0	109.8	T301 L304 G307 L308 P410 W412	T301-L402 HydrophobicContact CG2-CD1 3.95Å; L304-L402 HydrophobicContact CB-CD2 3.56Å; G307-L402 PolarHBondContact N-O 3.36Å; L308-L402 HydrophobicContact CB-CB 4.26Å; L308-L402 PolarHBondContact O-N 3.26Å; L402-P410 HydrophobicContact CD1-CB 4.18Å; L402-P410 HydrophobicContact CG-CB 4.37Å; L402-W412 HydrophobicContact CB-CE3 4.08Å; L402-W412 HydrophobicContact CB-CH2 4.27Å; L402-W412 HydrophobicContact CB-CZ3 3.9Å; L402-W412 HydrophobicContact CD1-CD2 3.94Å; L402-W412 HydrophobicContact CD1-CE3 4.26Å; L402-W412 HydrophobicContact CD1-CG 4.33Å; L402-W412 HydrophobicContact CD1-CZ2 4.3Å
403	R	82.8	Confident	81	Confident	60 Å²	60	51.9 Å²	51.9	23%	0.226	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	172.4	-179.2	-61.3	-168.5	-173.8	176.5	14.1	110.8	S401 P410 A411 V413 V415 D427	S401-R403 PolarHBondContact O-N 2.78Å; R403-P410 CarbonylContact O-C 3.54Å; R403-P410 WeakPolarHBondContact O-CA 3.19Å; R403-A411 PolarHBondContact N-O 2.83Å; R403-A411 PolarHBondContact O-N 2.87Å; R403-A411 VanDerWaalsContact O-O 3.1Å; R403-V413 HydrophobicContact CB-CG2 4.18Å; R403-V415 VanDerWaalsContact NH2-CG1 3.33Å; R403-D427 IonicContact CZ-OD2 3.53Å; R403-D427 IonicContact NH1-OD2 3.92Å; R403-D427 PolarHBondContact NH1-OD2 3.29Å; R403-D427 IonicContact NH2-OD2 3.98Å; R403-D427 PolarHBondContact NH2-OD2 2.93Å
404	R	79	Confident	81.2	Confident	167 Å²	167	53 Å²	53	63%	0.63	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.1	131.3	170.4	-67	-178.6	-178	-98.3	5.6	109.3	L306 G408 Q409	L306-R404 HydrophobicContact CD1-CG 4.37Å; L306-R404 HydrophobicContact CD2-CG 4.11Å; R404-G408 PolarHBondContact NH1-O 2.79Å; R404-Q409 CarbonylContact C-O 3.6Å; R404-Q409 WeakPolarHBondContact CA-O 3.42Å
405	D	74.6	Confident	81.6	Confident	58 Å²	58	51.5 Å²	51.5	31%	0.31	27%	0.273	S	S	.	.			trans	-72.9	178.4	170.7	70.8	6.2	0	0	0	111.4	L407 G408 Q409 A411	D405-L407 PolarHBondContact O-N 3.29Å; D405-L407 VanDerWaalsContact OD1-C 3.27Å; D405-L407 WeakPolarHBondContact OD1-CA 3.43Å; D405-L407 WeakPolarHBondContact OD1-CB 3.4Å; D405-L407 PolarHBondContact OD1-N 3.16Å; D405-G408 PolarHBondContact O-N 3.3Å; D405-G408 PolarHBondContact OD1-N 2.93Å; D405-Q409 PolarHBondContact N-O 3.39Å; D405-Q409 PolarHBondContact OD1-N 2.89Å; D405-A411 HydrophobicContact CB-CB 3.99Å
406	A	68.1	Low	82.1	Confident	113 Å²	113	50.4 Å²	50.4	93%	0.934	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-14.8	178.7	0	0	0	0	0	114.1
407	L	66.1	Low	82.4	Confident	145 Å²	145	46 Å²	46	76%	0.759	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	2.5	176.8	-62.3	170.4	0	0	0	112.1	D405	D405-L407 PolarHBondContact O-N 3.29Å; D405-L407 VanDerWaalsContact OD1-C 3.27Å; D405-L407 WeakPolarHBondContact OD1-CA 3.43Å; D405-L407 WeakPolarHBondContact OD1-CB 3.4Å; D405-L407 PolarHBondContact OD1-N 3.16Å
408	G	69.8	Low	82.5	Confident	32 Å²	32	46.7 Å²	46.7	33%	0.33	25%	0.254	S	S	.	.	S	Bend	trans	81.7	4.9	179.4	0	0	0	0	0	115.3	R404 D405	R404-G408 PolarHBondContact NH1-O 2.79Å; D405-G408 PolarHBondContact O-N 3.3Å; D405-G408 PolarHBondContact OD1-N 2.93Å
409	Q	72	Confident	82.2	Confident	115 Å²	115	47.6 Å²	47.6	54%	0.537	26%	0.258	S	S	.	.			trans	-86.2	145.6	179.2	-60.1	-168.5	0.3	0	0	111.4	R404 D405 A411	R404-Q409 CarbonylContact C-O 3.6Å; R404-Q409 WeakPolarHBondContact CA-O 3.42Å; D405-Q409 PolarHBondContact N-O 3.39Å; D405-Q409 PolarHBondContact OD1-N 2.89Å; Q409-A411 PolarHBondContact O-N 3.34Å
410	P	80.4	Confident	81.4	Confident	34 Å²	34	53.6 Å²	53.6	22%	0.221	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	119.9	177.6	28.7	-33.4	0	0	0	110.5	T301 L402 R403	T301-P410 VanDerWaalsContact CB-O 3.22Å; T301-P410 WeakPolarHBondContact CB-O 3.37Å; T301-P410 WeakPolarHBondContact CG2-O 3.25Å; T301-P410 WeakPolarHBondContact O-CG 3.47Å; T301-P410 PolarHBondContact OG1-O 3.24Å; L402-P410 HydrophobicContact CD1-CB 4.18Å; L402-P410 HydrophobicContact CG-CB 4.37Å; R403-P410 CarbonylContact O-C 3.54Å; R403-P410 WeakPolarHBondContact O-CA 3.19Å
411	A	83.7	Confident	80.7	Confident	30 Å²	30	54.5 Å²	54.5	25%	0.248	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	145.8	-179.9	0	0	0	0	0	111	R403 D405 Q409	R403-A411 PolarHBondContact N-O 2.83Å; R403-A411 PolarHBondContact O-N 2.87Å; R403-A411 VanDerWaalsContact O-O 3.1Å; D405-A411 HydrophobicContact CB-CB 3.99Å; Q409-A411 PolarHBondContact O-N 3.34Å
412	W	85.9	Confident	80.3	Confident	43 Å²	43	61.1 Å²	61.1	16%	0.163	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	122.5	176.3	-68.5	108.6	0	0	0	110.3	P296 L299 L304 L308 A310 W400 L402	P296-W412 HydrophobicContact CB-CB 4.45Å; P296-W412 HydrophobicContact CB-CG 4.05Å; L299-W412 HydrophobicContact CB-CZ2 4.03Å; L299-W412 HydrophobicContact CD1-CZ2 4.19Å; L304-W412 HydrophobicContact CD1-CZ2 4.27Å; L308-W412 HydrophobicContact CD2-CH2 3.8Å; L308-W412 HydrophobicContact CG-CH2 4.13Å; A310-W412 HydrophobicContact CB-CE3 4.33Å; A310-W412 HydrophobicContact CB-CH2 3.66Å; A310-W412 HydrophobicContact CB-CZ3 3.53Å; W400-W412 HydrophobicContact CB-CB 4.31Å; W400-W412 HydrophobicContact CB-CD2 4.42Å; W400-W412 HydrophobicContact CB-CE3 3.69Å; W400-W412 HydrophobicContact CB-CZ3 4.38Å; L402-W412 HydrophobicContact CB-CE3 4.08Å; L402-W412 HydrophobicContact CB-CH2 4.27Å; L402-W412 HydrophobicContact CB-CZ3 3.9Å; L402-W412 HydrophobicContact CD1-CD2 3.94Å; L402-W412 HydrophobicContact CD1-CE3 4.26Å; L402-W412 HydrophobicContact CD1-CG 4.33Å; L402-W412 HydrophobicContact CD1-CZ2 4.3Å
413	V	86.6	Confident	80.2	Confident	57 Å²	57	62.7 Å²	62.7	35%	0.345	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	131.2	178.1	-179.1	0	0	0	0	109.2	W400 S401 R403 V415	W400-V413 CarbonylContact C-O 3.52Å; W400-V413 VanDerWaalsContact CA-O 3.25Å; W400-V413 WeakPolarHBondContact CA-O 3.36Å; S401-V413 PolarHBondContact N-O 2.96Å; S401-V413 PolarHBondContact O-N 2.89Å; R403-V413 HydrophobicContact CB-CG2 4.18Å; V413-V415 PolarHBondContact O-N 3.16Å
414	T	87.8	Confident	80.2	Confident	43 Å²	43	64.6 Å²	64.6	26%	0.264	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	125.3	175.6	-50.5	0	0	0	0	110.3	H398 I399 W400 E426	H398-T414 HydrophobicContact CB-CG2 4.12Å; H398-T414 VanDerWaalsContact ND1-CG2 3.31Å; H398-T414 WeakPolarHBondContact ND1-CG2 3.25Å; I399-T414 CarbonylContact O-C 3.57Å; I399-T414 WeakPolarHBondContact O-CA 3.08Å; W400-T414 PolarHBondContact NE1-OG1 2.95Å; T414-E426 VanDerWaalsContact CG2-OE2 3.26Å; T414-E426 WeakPolarHBondContact CG2-OE2 3.37Å
415	V	87.2	Confident	80.2	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	-13.9	-179.2	-63.9	0	0	0	0	113.2	L309 I399 S401 R403 V413 E426 D427 V430 W431	L309-V415 HydrophobicContact CD2-CG2 4.38Å; I399-V415 HydrophobicContact CB-CG2 4.17Å; I399-V415 HydrophobicContact CG2-CG2 3.68Å; I399-V415 WeakPolarHBondContact O-CG2 3.43Å; I399-V415 PolarHBondContact O-N 2.81Å; S401-V415 VanDerWaalsContact CB-CG1 3.44Å; R403-V415 VanDerWaalsContact NH2-CG1 3.33Å; V413-V415 PolarHBondContact O-N 3.16Å; V415-E426 PolarHBondContact O-N 3.35Å; V415-D427 PolarHBondContact O-N 2.82Å; V415-V430 HydrophobicContact CB-CB 4.46Å; V415-V430 HydrophobicContact CB-CG1 4.43Å; V415-V430 HydrophobicContact CG1-CB 4.34Å; V415-V430 HydrophobicContact CG1-CG1 4.49Å; V415-V430 HydrophobicContact CG1-CG2 4.11Å; V415-V430 HydrophobicContact CG2-CG1 4.32Å; V415-W431 HydrophobicContact CG2-CZ2 4.11Å; V415-W431 PolarHBondContact O-NE1 3.43Å; V415-W431 VanDerWaalsContact O-NE1 3.11Å
416	G	88.4	Confident	80.3	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.5	165.8	175.1	0	0	0	0	0	112.4	I399 Q424	I399-G416 PolarHBondContact N-O 3.17Å; G416-Q424 CarbonylContact C-O 3.52Å; G416-Q424 WeakPolarHBondContact CA-O 3.49Å
417	S	89.9	Confident	80	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	137.1	171.9	59.7	0	0	0	0	110.5	F397 Q424	F397-S417 CarbonylContact O-C 3.59Å; F397-S417 WeakPolarHBondContact O-CA 3.43Å; S417-Q424 PolarHBondContact N-O 2.96Å; S417-Q424 WeakPolarHBondContact O-CA 3.18Å; S417-Q424 WeakPolarHBondContact O-CB 3.21Å; S417-Q424 PolarHBondContact O-N 2.71Å
418	W	87.8	Confident	79.6	Confident	14 Å²	14	57.1 Å²	57.1	5%	0.053	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	126.1	176.8	-175.8	92.8	0	0	0	109.8	V172 D175 L176 F397 G421 Q422 L423	V172-W418 HydrophobicContact CG1-CH2 3.68Å; V172-W418 HydrophobicContact CG1-CZ3 3.81Å; D175-W418 HydrophobicContact CB-CZ2 4.37Å; L176-W418 HydrophobicContact CB-CD2 4.34Å; L176-W418 HydrophobicContact CD1-CB 3.33Å; L176-W418 HydrophobicContact CD1-CD2 3.56Å; L176-W418 HydrophobicContact CD1-CE3 4.06Å; L176-W418 HydrophobicContact CD1-CG 3.26Å; F397-W418 HydrophobicContact CB-CB 4.31Å; F397-W418 AromaticContact CD2-CE3 3.62Å; F397-W418 HydrophobicContact CD2-CE3 3.62Å; F397-W418 AromaticContact CD2-CZ3 3.98Å; F397-W418 HydrophobicContact CD2-CZ3 3.98Å; F397-W418 HydrophobicContact CE2-CE3 4.19Å; F397-W418 HydrophobicContact CE2-CZ3 4.08Å; F397-W418 HydrophobicContact CG-CE3 4.44Å; F397-W418 PolarHBondContact N-O 3.12Å; F397-W418 PolarHBondContact O-N 3.4Å; W418-G421 VanDerWaalsContact CZ2-CA 3.47Å; W418-Q422 WeakPolarHBondContact CA-O 3.22Å; W418-L423 HydrophobicContact CB-CD1 4.29Å
419	E	84.6	Confident	79.2	Confident	52 Å²	52	62.4 Å²	62.4	24%	0.243	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	134.2	-179.3	-172.4	170.2	-164	0	0	108.3	S394 G421 Q422	S394-E419 PolarHBondContact OG-OE1 2.92Å; E419-G421 VanDerWaalsContact C-N 3.3Å; E419-G421 PolarHBondContact O-N 2.91Å; E419-Q422 PolarHBondContact N-O 2.84Å; E419-Q422 VanDerWaalsContact N-O 3.1Å; E419-Q422 PolarHBondContact O-N 3.09Å
420	D	73.1	Confident	78.6	Confident	127 Å²	127	58.5 Å²	58.5	68%	0.679	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	40.8	176.4	-62.1	-31	0	0	0	115.4	Q422	D420-Q422 PolarHBondContact O-N 3.17Å
421	G	73.2	Confident	77.5	Confident	50 Å²	50	57.6 Å²	57.6	52%	0.515	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	80	-0.9	179.2	0	0	0	0	0	114.7	W418 E419	W418-G421 VanDerWaalsContact CZ2-CA 3.47Å; E419-G421 VanDerWaalsContact C-N 3.3Å; E419-G421 PolarHBondContact O-N 2.91Å
422	Q	78.9	Confident	76	Confident	142 Å²	142	62.5 Å²	62.5	66%	0.664	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.3	130	178.4	-64.9	-165	-15.4	0	0	111.8	W418 E419 D420	W418-Q422 WeakPolarHBondContact CA-O 3.22Å; E419-Q422 PolarHBondContact N-O 2.84Å; E419-Q422 VanDerWaalsContact N-O 3.1Å; E419-Q422 PolarHBondContact O-N 3.09Å; D420-Q422 PolarHBondContact O-N 3.17Å
423	L	83.9	Confident	74	Confident	34 Å²	34	61.9 Å²	61.9	18%	0.178	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	108.2	172.8	179.9	61.5	0	0	0	110.1	R183 I399 W418 W431	R183-L423 HydrophobicContact CB-CD2 3.75Å; R183-L423 HydrophobicContact CG-CD2 3.86Å; I399-L423 HydrophobicContact CD1-CD1 3.18Å; W418-L423 HydrophobicContact CB-CD1 4.29Å; L423-W431 HydrophobicContact CD1-CH2 4.39Å; L423-W431 HydrophobicContact CD1-CZ2 4.4Å; L423-W431 HydrophobicContact CD2-CE3 4.29Å; L423-W431 HydrophobicContact CD2-CH2 3.71Å; L423-W431 HydrophobicContact CD2-CZ2 4.13Å; L423-W431 HydrophobicContact CD2-CZ3 3.79Å
424	Q	83.3	Confident	71.8	Confident	100 Å²	100	63.3 Å²	63.3	47%	0.467	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	125.6	170.3	-59.4	-177.7	18.2	0	0	109.5	G416 S417	G416-Q424 CarbonylContact C-O 3.52Å; G416-Q424 WeakPolarHBondContact CA-O 3.49Å; S417-Q424 PolarHBondContact N-O 2.96Å; S417-Q424 WeakPolarHBondContact O-CA 3.18Å; S417-Q424 WeakPolarHBondContact O-CB 3.21Å; S417-Q424 PolarHBondContact O-N 2.71Å
425	V	79.7	Confident	69.1	Low	40 Å²	40	68.8 Å²	68.8	24%	0.242	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	117.1	-179	172.9	0	0	0	0	109	R183 D427 Q428 W431	R183-V425 HydrophobicContact CG-CG2 4.43Å; V425-D427 WeakPolarHBondContact CG1-O 3.26Å; V425-Q428 HydrophobicContact CG1-CG 4.12Å; V425-W431 HydrophobicContact CG1-CG 4.25Å; V425-W431 HydrophobicContact CG2-CD2 4.43Å; V425-W431 HydrophobicContact CG2-CG 4.14Å
426	E	75.7	Confident	66.4	Low	106 Å²	106	74.8 Å²	74.8	50%	0.495	40%	0.397	S	S	.	.	S	Bend	trans	-87.8	-34.2	174.9	-69	-177.7	177.3	0	0	111.1	H398 T414 V415	H398-E426 IonicContact CE1-OE1 3.83Å; T414-E426 VanDerWaalsContact CG2-OE2 3.26Å; T414-E426 WeakPolarHBondContact CG2-OE2 3.37Å; V415-E426 PolarHBondContact O-N 3.35Å
427	D	62.6	Low	63.7	Low	37 Å²	37	86.1 Å²	86.1	20%	0.198	44%	0.44	C	S	.	.			trans	-127.5	116.8	177.2	-176.5	-4	0	0	0	111	R403 V415 V425 E429 W431	R403-D427 IonicContact CZ-OD2 3.53Å; R403-D427 IonicContact NH1-OD2 3.92Å; R403-D427 PolarHBondContact NH1-OD2 3.29Å; R403-D427 IonicContact NH2-OD2 3.98Å; R403-D427 PolarHBondContact NH2-OD2 2.93Å; V415-D427 PolarHBondContact O-N 2.82Å; V425-D427 WeakPolarHBondContact CG1-O 3.26Å; D427-E429 VanDerWaalsContact C-N 3.32Å; D427-E429 PolarHBondContact O-N 2.75Å; D427-E429 PolarHBondContact OD1-N 2.68Å; D427-W431 PolarHBondContact O-NE1 2.82Å
428	Q	57.8	Low	60.7	Low	143 Å²	143	97.7 Å²	97.7	67%	0.668	48%	0.483	S	S	*	.	S	Bend	trans	-74.4	-15.5	-175.8	-69.6	-175.7	1.3	0	0	114.2	V425	V425-Q428 HydrophobicContact CG1-CG 4.12Å
429	E	59.7	Low	57.8	Low	143 Å²	143	108.6 Å²	108.6	67%	0.668	52%	0.524	S	S	*	.	S	Bend	trans	-70.4	-35.1	-172.8	-66.1	-176.2	169.4	0	0	113.2	D427	D427-E429 VanDerWaalsContact C-N 3.32Å; D427-E429 PolarHBondContact O-N 2.75Å; D427-E429 PolarHBondContact OD1-N 2.68Å
430	V	61	Low	55.1	Low	34 Å²	34	110.8 Å²	110.8	21%	0.206	55%	0.551	C	S	.	*	T	Hydrogen-bonded Turn	trans	-77	-23	-178.3	159.6	0	0	0	0	113.6	L309 V415	L309-V430 HydrophobicContact CD2-CG1 3.91Å; V415-V430 HydrophobicContact CB-CB 4.46Å; V415-V430 HydrophobicContact CB-CG1 4.43Å; V415-V430 HydrophobicContact CG1-CB 4.34Å; V415-V430 HydrophobicContact CG1-CG1 4.49Å; V415-V430 HydrophobicContact CG1-CG2 4.11Å; V415-V430 HydrophobicContact CG2-CG1 4.32Å
431	W	57.2	Low	53	Low	14 Å²	14	113.5 Å²	113.5	5%	0.053	56%	0.56	C	S	.	*	T	Hydrogen-bonded Turn	trans	-93.3	-1.1	-175.2	-55.9	100	0	0	0	113.8	V180 R183 I399 V415 L423 V425 D427 G433	V180-W431 HydrophobicContact CB-CH2 4.39Å; V180-W431 HydrophobicContact CB-CZ3 4.22Å; V180-W431 HydrophobicContact CG1-CH2 4.04Å; V180-W431 HydrophobicContact CG1-CZ3 3.83Å; V180-W431 HydrophobicContact CG2-CH2 4.09Å; V180-W431 HydrophobicContact CG2-CZ3 4.4Å; R183-W431 HydrophobicContact CB-CE3 3.81Å; R183-W431 HydrophobicContact CB-CZ3 4.17Å; R183-W431 HydrophobicContact CG-CB 4.19Å; R183-W431 HydrophobicContact CG-CD2 3.91Å; R183-W431 HydrophobicContact CG-CE3 3.57Å; R183-W431 HydrophobicContact CG-CG 4.17Å; R183-W431 HydrophobicContact CG-CZ3 4.29Å; I399-W431 HydrophobicContact CD1-CH2 4.1Å; I399-W431 HydrophobicContact CD1-CZ2 4.28Å; I399-W431 HydrophobicContact CG2-CH2 4.22Å; I399-W431 HydrophobicContact CG2-CZ2 4.31Å; V415-W431 HydrophobicContact CG2-CZ2 4.11Å; V415-W431 PolarHBondContact O-NE1 3.43Å; V415-W431 VanDerWaalsContact O-NE1 3.11Å; L423-W431 HydrophobicContact CD1-CH2 4.39Å; L423-W431 HydrophobicContact CD1-CZ2 4.4Å; L423-W431 HydrophobicContact CD2-CE3 4.29Å; L423-W431 HydrophobicContact CD2-CH2 3.71Å; L423-W431 HydrophobicContact CD2-CZ2 4.13Å; L423-W431 HydrophobicContact CD2-CZ3 3.79Å; V425-W431 HydrophobicContact CG1-CG 4.25Å; V425-W431 HydrophobicContact CG2-CD2 4.43Å; V425-W431 HydrophobicContact CG2-CG 4.14Å; D427-W431 PolarHBondContact O-NE1 2.82Å; W431-G433 PolarHBondContact O-N 2.82Å; W431-G433 VanDerWaalsContact O-N 3.08Å
432	Q	51.2	Low	50.9	Low	134 Å²	134	114.7 Å²	114.7	63%	0.626	57%	0.572	S	S	*	*			trans	-79.9	91.8	174.7	-65.5	-166.8	25.3	0	0	109.9
433	G	44.4	Very low	48.5	Very low	30 Å²	30	114 Å²	114	31%	0.309	58%	0.583	S	S	.	*	P	Polyproline II helix	trans	-56	156.5	175.2	0	0	0	0	0	113.6	S184 W431 K435	S184-G433 WeakPolarHBondContact O-CA 3.31Å; W431-G433 PolarHBondContact O-N 2.82Å; W431-G433 VanDerWaalsContact O-N 3.08Å; G433-K435 PolarHBondContact O-N 2.76Å; G433-K435 VanDerWaalsContact O-N 3.15Å
434	P	40.3	Very low	45.9	Very low	87 Å²	87	116 Å²	116	57%	0.565	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-60.8	120.2	174.3	23.5	-30.3	0	0	0	109.8
435	K	31.4	Very low	43.6	Very low	157 Å²	157	115.1 Å²	115.1	68%	0.683	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-55.1	135.2	170.4	-72	176.7	-177.4	165.3	0	108.5	G433 R437	G433-K435 PolarHBondContact O-N 2.76Å; G433-K435 VanDerWaalsContact O-N 3.15Å; K435-R437 PolarHBondContact O-N 3.01Å
436	P	31.2	Very low	41.5	Very low	126 Å²	126	125.1 Å²	125.1	82%	0.818	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-58.5	118.7	-174.7	20.6	-30.3	0	0	0	110.3	R438	P436-R438 PolarHBondContact O-N 3.25Å
437	R	30.1	Very low	39.9	Very low	238 Å²	238	124 Å²	124	90%	0.898	67%	0.667	S	S	*	*			trans	-57.6	106.6	167.7	-83.8	-179.4	169.7	162.5	-0.7	107.8	K435 R439	K435-R437 PolarHBondContact O-N 3.01Å; R437-R439 PolarHBondContact O-N 3.16Å
438	R	27.8	Very low	39.4	Very low	243 Å²	243	123.6 Å²	123.6	92%	0.917	67%	0.671	S	S	*	*			trans	-60.9	118.8	156.9	-87	-173.3	176.3	-177.1	-0.7	106.6	P436 A440	P436-R438 PolarHBondContact O-N 3.25Å; R438-A440 PolarHBondContact O-N 2.88Å
439	R	27.4	Very low	39.6	Very low	243 Å²	243	119.5 Å²	119.5	92%	0.917	67%	0.667	S	S	*	*			trans	-46.7	107.3	164.4	-93.3	177.9	171	164.1	-1.9	108	R437 E441	R437-R439 PolarHBondContact O-N 3.16Å; R439-E441 PolarHBondContact O-N 3.08Å
440	A	28	Very low	40.3	Very low	98 Å²	98	117.2 Å²	117.2	81%	0.81	65%	0.652	S	S	*	*			trans	-80.2	104.6	153.9	0	0	0	0	0	105.4	R438	R438-A440 PolarHBondContact O-N 2.88Å
441	E	28	Very low	41.2	Very low	185 Å²	185	116 Å²	116	86%	0.864	64%	0.644	S	S	*	*			trans	-53	140.6	161.2	-83	172.4	141.3	0	0	110	R439	R439-E441 PolarHBondContact O-N 3.08Å
442	G	28.8	Very low	41.8	Very low	75 Å²	75	124.2 Å²	124.2	77%	0.773	68%	0.675	S	S	*	*	S	Bend	trans	21.7	129.8	156.6	0	0	0	0	0	120.9
443	S	29.3	Very low	42	Very low	127 Å²	127	122.8 Å²	122.8	89%	0.888	68%	0.678	S	S	*	*			trans	102.9	101.1	148.5	-172.4	0	0	0	0	117.5
444	G	29.5	Very low	42.6	Very low	77 Å²	77	123.3 Å²	123.3	79%	0.794	68%	0.683	S	S	*	*	S	Bend	trans	92.1	114.5	141.9	0	0	0	0	0	118.1
445	G	34.6	Very low	43.5	Very low	80 Å²	80	121.5 Å²	121.5	83%	0.825	67%	0.67	S	S	*	*			trans	65.5	90.3	154.8	0	0	0	0	0	117.5	S447	G445-S447 PolarHBondContact O-N 2.95Å; G445-S447 VanDerWaalsContact O-N 3.13Å
446	R	35.9	Very low	45.3	Very low	251 Å²	251	118.8 Å²	118.8	95%	0.947	67%	0.669	S	S	*	*			trans	-71.2	103.1	175.1	-83.3	177.9	163	170.3	-4.9	111.6
447	S	42.3	Very low	47.4	Very low	83 Å²	83	113.6 Å²	113.6	58%	0.58	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-96.4	120.8	151.7	177.8	0	0	0	0	108.3	G445	G445-S447 PolarHBondContact O-N 2.95Å; G445-S447 VanDerWaalsContact O-N 3.13Å
448	G	52.7	Low	49.7	Very low	27 Å²	27	108 Å²	108	28%	0.278	62%	0.619	S	S	.	*	P	Polyproline II helix	trans	-58	139.3	169.6	0	0	0	0	0	110.8	R461	G448-R461 WeakPolarHBondContact O-CD 3.37Å; G448-R461 WeakPolarHBondContact O-CG 3.49Å
449	G	61.5	Low	51.8	Low	57 Å²	57	98.2 Å²	98.2	59%	0.588	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-69.9	161.9	177.1	0	0	0	0	0	112.4	W451 R461	G449-W451 PolarHBondContact O-N 3.07Å; G449-R461 PolarHBondContact O-N 3.49Å; G449-R461 VanDerWaalsContact O-N 3.12Å
450	R	74.8	Confident	54.4	Low	96 Å²	96	87.8 Å²	87.8	36%	0.362	56%	0.557	S	S	.	*	B	Isolated β-bridge	trans	-55.2	133.1	174.1	-176.5	-178.7	172.9	-159.3	-4.5	110.4	R461 E502 G571 D574	R450-R461 CarbonylContact C-O 3.48Å; R450-R461 WeakPolarHBondContact CA-O 3.38Å; R450-E502 IonicContact NH1-OE1 2.64Å; R450-E502 PolarHBondContact NH1-OE1 2.95Å; R450-G571 PolarHBondContact NH2-O 3.03Å; R450-D574 IonicContact CZ-OD1 2.91Å; R450-D574 IonicContact CZ-OD2 2.75Å; R450-D574 IonicContact NE-OD1 3.49Å; R450-D574 IonicContact NE-OD2 3.36Å; R450-D574 PolarHBondContact NE-OD2 3.06Å; R450-D574 IonicContact NH2-OD1 2.89Å; R450-D574 PolarHBondContact NH2-OD1 3.29Å; R450-D574 IonicContact NH2-OD2 3.2Å
451	W	78.6	Confident	57.1	Low	8 Å²	8	86.2 Å²	86.2	3%	0.03	53%	0.53	C	S	.	.	P	Polyproline II helix	trans	-58.6	145.8	177.6	-179.7	77.4	0	0	0	111.4	G449 P453 T455 V457 T460 R461 V462 D574 P830 L831	G449-W451 PolarHBondContact O-N 3.07Å; W451-P453 HydrophobicContact CZ3-CG 4.46Å; W451-T455 PolarHBondContact NE1-O 2.97Å; W451-V457 HydrophobicContact CZ2-CG2 4.35Å; W451-V457 VanDerWaalsContact NE1-CG2 3.3Å; W451-T460 VanDerWaalsContact CD1-OG1 3.3Å; W451-R461 PolarHBondContact N-O 3.37Å; W451-V462 HydrophobicContact CB-CG2 3.97Å; W451-V462 HydrophobicContact CG-CG2 4.24Å; W451-D574 HydrophobicContact CE3-CB 4.08Å; W451-D574 HydrophobicContact CZ3-CB 4.29Å; W451-P830 HydrophobicContact CH2-CG 4.17Å; W451-P830 HydrophobicContact CZ2-CG 3.96Å; W451-L831 HydrophobicContact CD2-CD1 4.44Å; W451-L831 HydrophobicContact CE3-CD1 4.33Å; W451-L831 HydrophobicContact CH2-CD1 3.56Å; W451-L831 HydrophobicContact CH2-CG 4.03Å; W451-L831 HydrophobicContact CZ2-CD1 3.7Å; W451-L831 HydrophobicContact CZ2-CG 3.87Å; W451-L831 HydrophobicContact CZ3-CD1 3.91Å
452	R	70.4	Confident	60.1	Low	186 Å²	186	77.4 Å²	77.4	70%	0.702	49%	0.489	S	S	*	.			trans	-129.8	147.3	175.9	-66.1	-174.5	-178.6	-175.9	-0.6	110	G454 T455	R452-G454 PolarHBondContact O-N 2.96Å; R452-T455 PolarHBondContact O-N 3.48Å; R452-T455 PolarHBondContact O-OG1 3.25Å
453	P	55.7	Low	63	Low	105 Å²	105	74.4 Å²	74.4	68%	0.682	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	129	173.8	-25.5	34.2	0	0	0	111.4	W451	W451-P453 HydrophobicContact CZ3-CG 4.46Å
454	G	57.3	Low	66.2	Low	41 Å²	41	68.3 Å²	68.3	42%	0.423	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.5	15.8	-179.3	0	0	0	0	0	115.8	R452	R452-G454 PolarHBondContact O-N 2.96Å
455	T	58.9	Low	69.3	Low	48 Å²	48	64.7 Å²	64.7	29%	0.294	37%	0.374	S	S	.	.	S	Bend	trans	-114.9	146.3	163.1	51.9	0	0	0	0	110.6	W451 R452	W451-T455 PolarHBondContact NE1-O 2.97Å; R452-T455 PolarHBondContact O-N 3.48Å; R452-T455 PolarHBondContact O-OG1 3.25Å
456	P	68.9	Low	72.2	Confident	100 Å²	100	60.9 Å²	60.9	65%	0.649	34%	0.335	S	S	*	.			trans	-57.5	147.9	172.6	25.1	-32.8	0	0	0	110.1	T460	P456-T460 WeakPolarHBondContact O-CG2 3.18Å
457	V	75	Confident	74.9	Confident	18 Å²	18	49.3 Å²	49.3	11%	0.109	29%	0.292	C	S	.	.			trans	-85.4	-23.5	-170.5	176.2	0	0	0	0	110.8	W451 G459 T460 V462 F541 L831	W451-V457 HydrophobicContact CZ2-CG2 4.35Å; W451-V457 VanDerWaalsContact NE1-CG2 3.3Å; V457-G459 PolarHBondContact O-N 3.43Å; V457-T460 WeakPolarHBondContact CA-OG1 3.45Å; V457-T460 WeakPolarHBondContact O-CB 3.29Å; V457-T460 PolarHBondContact O-N 2.99Å; V457-T460 PolarHBondContact O-OG1 3.5Å; V457-V462 HydrophobicContact CG1-CG2 4.15Å; V457-F541 HydrophobicContact CG1-CB 3.51Å; V457-F541 HydrophobicContact CG1-CD1 3.68Å; V457-F541 HydrophobicContact CG1-CG 3.69Å; V457-F541 WeakPolarHBondContact O-CB 3.14Å; V457-L831 HydrophobicContact CB-CD2 4.29Å; V457-L831 HydrophobicContact CG1-CD2 4.27Å; V457-L831 HydrophobicContact CG2-CD1 4.39Å; V457-L831 HydrophobicContact CG2-CD2 3.32Å; V457-L831 HydrophobicContact CG2-CG 4.02Å
458	E	77.6	Confident	77.3	Confident	120 Å²	120	47.6 Å²	47.6	56%	0.561	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	123.2	174	-171.4	176.9	-176.8	0	0	112	T460 D540	E458-T460 PolarHBondContact O-N 3.04Å; E458-D540 CarbonylContact C-O 3.6Å; E458-D540 WeakPolarHBondContact CA-O 3.5Å; E458-D540 HydrophobicContact CG-CB 4.14Å
459	G	72.3	Confident	79.1	Confident	37 Å²	37	46.9 Å²	46.9	38%	0.381	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.5	8.9	-179.4	0	0	0	0	0	115.8	V457 D540	V457-G459 PolarHBondContact O-N 3.43Å; G459-D540 PolarHBondContact N-O 2.73Å
460	T	82.5	Confident	80.5	Confident	24 Å²	24	46.9 Å²	46.9	15%	0.147	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-100.6	162	178.5	69.1	0	0	0	0	112.7	W451 P456 V457 E458 H542	W451-T460 VanDerWaalsContact CD1-OG1 3.3Å; P456-T460 WeakPolarHBondContact O-CG2 3.18Å; V457-T460 WeakPolarHBondContact CA-OG1 3.45Å; V457-T460 WeakPolarHBondContact O-CB 3.29Å; V457-T460 PolarHBondContact O-N 2.99Å; V457-T460 PolarHBondContact O-OG1 3.5Å; E458-T460 PolarHBondContact O-N 3.04Å; T460-H542 PolarHBondContact O-N 2.99Å
461	R	85.5	Confident	81.3	Confident	65 Å²	65	42.3 Å²	42.3	25%	0.245	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	117.3	174.3	-70.5	-173.8	84	96.6	-0.3	111.7	G448 G449 R450 W451 H542 D544	G448-R461 WeakPolarHBondContact O-CD 3.37Å; G448-R461 WeakPolarHBondContact O-CG 3.49Å; G449-R461 PolarHBondContact O-N 3.49Å; G449-R461 VanDerWaalsContact O-N 3.12Å; R450-R461 CarbonylContact C-O 3.48Å; R450-R461 WeakPolarHBondContact CA-O 3.38Å; W451-R461 PolarHBondContact N-O 3.37Å; R461-H542 CarbonylContact C-O 3.46Å; R461-H542 VanDerWaalsContact CA-O 3.24Å; R461-H542 WeakPolarHBondContact CA-O 3.34Å; R461-H542 HydrophobicContact CG-CB 4.03Å; R461-D544 IonicContact CZ-OD1 3.76Å; R461-D544 IonicContact CZ-OD2 3.77Å; R461-D544 IonicContact NE-OD1 3.05Å; R461-D544 PolarHBondContact NE-OD1 2.93Å; R461-D544 IonicContact NE-OD2 3.17Å; R461-D544 PolarHBondContact NE-OD2 3.46Å; R461-D544 IonicContact NH2-OD1 3.56Å; R461-D544 PolarHBondContact NH2-OD1 2.89Å; R461-D544 IonicContact NH2-OD2 3.87Å
462	V	90.3	Very high	82.1	Confident	0 Å²	0	42 Å²	42	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	132.4	178.4	-178.2	0	0	0	0	110	W451 V457 V464 F541 H542 F543 D544 D574 M575	W451-V462 HydrophobicContact CB-CG2 3.97Å; W451-V462 HydrophobicContact CG-CG2 4.24Å; V457-V462 HydrophobicContact CG1-CG2 4.15Å; V462-V464 HydrophobicContact CG1-CG2 4.28Å; V462-F541 HydrophobicContact CB-CD2 4.14Å; V462-F541 HydrophobicContact CB-CE2 4.41Å; V462-F541 HydrophobicContact CG2-CD2 3.83Å; V462-F541 HydrophobicContact CG2-CE2 4.41Å; V462-F541 HydrophobicContact CG2-CG 4.29Å; V462-H542 PolarHBondContact N-O 2.88Å; V462-F543 CarbonylContact O-C 3.55Å; V462-F543 WeakPolarHBondContact O-CA 3.15Å; V462-D544 PolarHBondContact O-N 2.91Å; V462-D574 HydrophobicContact CG1-CB 3.89Å; V462-M575 HydrophobicContact CG1-CB 4.36Å; V462-M575 HydrophobicContact CG1-CE 4.46Å
463	R	90.6	Very high	83.2	Confident	12 Å²	12	33.1 Å²	33.1	5%	0.045	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	120.7	174.4	-160.2	179.9	-59.7	145.9	-1.6	111.2	E502 F505 D544 Y546 L572 D574 M575	R463-E502 IonicContact NH2-OE1 3.1Å; R463-E502 PolarHBondContact NH2-OE1 3.15Å; R463-F505 HydrophobicContact CG-CE2 4.26Å; R463-D544 HydrophobicContact CG-CB 4.3Å; R463-Y546 HydrophobicContact CG-CD1 3.88Å; R463-Y546 HydrophobicContact CG-CE1 3.77Å; R463-L572 VanDerWaalsContact CD-O 3.27Å; R463-L572 WeakPolarHBondContact CD-O 3.12Å; R463-L572 PolarHBondContact NH1-O 2.79Å; R463-D574 PolarHBondContact N-OD2 3.24Å; R463-D574 VanDerWaalsContact N-OD2 3.11Å; R463-D574 PolarHBondContact O-N 2.73Å; R463-M575 PolarHBondContact O-N 3.31Å
464	V	94.9	Very high	84.9	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	125	-176.3	-175.1	0	0	0	0	109.9	V462 L532 F543 D544 L545 Y546 M575 V577	V462-V464 HydrophobicContact CG1-CG2 4.28Å; V464-L532 HydrophobicContact CB-CD2 4.31Å; V464-L532 HydrophobicContact CG1-CD2 3.92Å; V464-L532 HydrophobicContact CG2-CD1 4.3Å; V464-L532 HydrophobicContact CG2-CD2 4.23Å; V464-F543 HydrophobicContact CG2-CB 3.84Å; V464-D544 PolarHBondContact N-O 3.29Å; V464-L545 HydrophobicContact CB-CD1 4.1Å; V464-L545 HydrophobicContact CG1-CD1 3.95Å; V464-L545 WeakPolarHBondContact O-CA 3.45Å; V464-Y546 WeakPolarHBondContact O-CD1 3.43Å; V464-Y546 PolarHBondContact O-N 3.36Å; V464-M575 CarbonylContact C-O 3.56Å; V464-M575 VanDerWaalsContact CA-O 3.32Å; V464-M575 WeakPolarHBondContact CA-O 3.24Å; V464-M575 HydrophobicContact CG2-CB 4.33Å; V464-M575 HydrophobicContact CG2-SD 4.47Å; V464-V577 HydrophobicContact CG1-CB 4.05Å; V464-V577 HydrophobicContact CG1-CG2 3.69Å
465	V	95.1	Very high	86.6	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	140.6	170.8	65.9	0	0	0	0	110.4	Y546 V548 L564 A573 M575 A576 V577	V465-Y546 WeakPolarHBondContact CA-O 3.46Å; V465-Y546 HydrophobicContact CB-CD1 4.42Å; V465-Y546 HydrophobicContact CB-CE1 3.74Å; V465-Y546 HydrophobicContact CB-CE2 4.08Å; V465-Y546 HydrophobicContact CG2-CD2 4.21Å; V465-Y546 HydrophobicContact CG2-CE1 4.19Å; V465-Y546 HydrophobicContact CG2-CE2 3.59Å; V465-V548 HydrophobicContact CG2-CB 3.87Å; V465-V548 HydrophobicContact CG2-CG2 4.43Å; V465-L564 HydrophobicContact CB-CD2 4.43Å; V465-L564 HydrophobicContact CG1-CD2 3.97Å; V465-L564 HydrophobicContact CG2-CD2 3.73Å; V465-A573 HydrophobicContact CB-CB 3.73Å; V465-A573 HydrophobicContact CG1-CB 3.53Å; V465-M575 PolarHBondContact N-O 3.32Å; V465-A576 HydrophobicContact CG1-CB 3.54Å; V465-A576 WeakPolarHBondContact O-CA 3.43Å; V465-V577 PolarHBondContact O-N 3.46Å
466	T	95.3	Very high	88	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	167.6	176.4	-161.5	0	0	0	0	112.1	V473 L545 Y546 I547 V548 V577	T466-V473 HydrophobicContact CG2-CG1 4.28Å; T466-V473 WeakPolarHBondContact OG1-CG2 3.21Å; T466-L545 HydrophobicContact CG2-CD1 3.8Å; T466-L545 HydrophobicContact CG2-CG 4.25Å; T466-Y546 PolarHBondContact N-O 3.31Å; T466-I547 HydrophobicContact CG2-CG1 4.21Å; T466-I547 WeakPolarHBondContact O-CA 3.35Å; T466-V548 PolarHBondContact O-N 3.01Å; T466-V577 WeakPolarHBondContact CB-O 3.26Å; T466-V577 PolarHBondContact OG1-O 3.48Å
467	L	93.9	Very high	88.9	Confident	9 Å²	9	32 Å²	32	5%	0.047	17%	0.165	C	C	.	.			trans	-129.8	136.9	175.4	179.4	72	0	0	0	108.2	E469 V473 V548 G551 Y553 L564 T578	L467-E469 HydrophobicContact CD2-CG 4.07Å; L467-E469 HydrophobicContact CG-CG 4.21Å; L467-E469 PolarHBondContact O-N 2.99Å; L467-V473 WeakPolarHBondContact O-CB 3.41Å; L467-V548 HydrophobicContact CB-CG1 4.21Å; L467-V548 HydrophobicContact CD1-CG1 3.45Å; L467-V548 VanDerWaalsContact CD1-CG1 3.45Å; L467-V548 HydrophobicContact CG-CG1 4.43Å; L467-G551 VanDerWaalsContact CD1-C 3.47Å; L467-Y553 HydrophobicContact CD2-CD1 3.73Å; L467-Y553 HydrophobicContact CD2-CD2 3.94Å; L467-Y553 HydrophobicContact CD2-CE1 3.54Å; L467-Y553 HydrophobicContact CD2-CE2 3.71Å; L467-Y553 HydrophobicContact CD2-CG 3.94Å; L467-L564 HydrophobicContact CB-CD1 4.23Å; L467-L564 HydrophobicContact CB-CD2 4.4Å; L467-T578 HydrophobicContact CB-CG2 4.09Å; L467-T578 PolarHBondContact O-OG1 3.36Å
468	V	92.3	Very high	89.4	Confident	47 Å²	47	32.3 Å²	32.3	29%	0.285	17%	0.166	S	C	.	.			trans	-77.4	108.3	-178.1	-173.7	0	0	0	0	110.2	T475 I547	V468-T475 HydrophobicContact CB-CG2 4.35Å; V468-T475 HydrophobicContact CG1-CG2 3.95Å; V468-T475 HydrophobicContact CG2-CG2 3.44Å; V468-T475 VanDerWaalsContact CG2-CG2 3.44Å; V468-I547 HydrophobicContact CG2-CD1 3.79Å; V468-I547 HydrophobicContact CG2-CG1 4.25Å; V468-I547 HydrophobicContact CG2-CG2 3.92Å
469	E	90.4	Very high	89.5	Confident	11 Å²	11	29.7 Å²	29.7	5%	0.051	16%	0.156	C	C	.	.	B	Isolated β-bridge	trans	-150.5	122	-179	-75.2	-75.7	-171.3	0	0	110	L467 F472 V473 Y553 T773	L467-E469 HydrophobicContact CD2-CG 4.07Å; L467-E469 HydrophobicContact CG-CG 4.21Å; L467-E469 PolarHBondContact O-N 2.99Å; E469-F472 WeakPolarHBondContact O-CA 3.45Å; E469-F472 PolarHBondContact O-N 3.21Å; E469-V473 CarbonylContact C-O 3.53Å; E469-V473 PolarHBondContact N-O 3.03Å; E469-V473 PolarHBondContact O-N 3.36Å; E469-Y553 WeakPolarHBondContact CG-OH 3.34Å; E469-Y553 PolarHBondContact OE1-OH 3.44Å; E469-T773 PolarHBondContact OE2-OG1 2.72Å
470	H	90.4	Very high	89.5	Confident	58 Å²	58	36.2 Å²	36.2	27%	0.269	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	135.7	-178.3	-49.6	123.1	0	0	0	110.9	F474 L796 Y799	H470-F474 HydrophobicContact CB-CE1 3.87Å; H470-F474 HydrophobicContact CB-CZ 4.07Å; H470-F474 AromaticContact CD2-CD1 3.02Å; H470-F474 WeakPolarHBondContact CD2-CD1 3.43Å; H470-F474 AromaticContact CD2-CE1 3.23Å; H470-F474 WeakPolarHBondContact CD2-CE1 3.39Å; H470-F474 AromaticContact CD2-CG 3.67Å; H470-F474 AromaticContact CG-CD1 3.95Å; H470-F474 AromaticContact CG-CE1 3.7Å; H470-F474 AromaticContact NE2-CD1 3.57Å; H470-L796 VanDerWaalsContact O-CD2 3.25Å; H470-L796 WeakPolarHBondContact O-CD2 3.47Å; H470-Y799 HydrophobicContact CB-CD1 4.01Å; H470-Y799 HydrophobicContact CB-CE1 3.52Å
471	P	91.9	Very high	88.6	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	cis	-97.3	13.9	6	37.4	-34.2	0	0	0	115	F474 Y527 Y799 Y856	P471-F474 HydrophobicContact CB-CE2 4.02Å; P471-F474 HydrophobicContact CB-CZ 3.95Å; P471-F474 WeakPolarHBondContact O-CE2 3.48Å; P471-Y527 PolarHBondContact O-N 2.84Å; P471-Y799 HydrophobicContact CB-CD1 4.31Å; P471-Y799 HydrophobicContact CB-CD2 3.66Å; P471-Y799 HydrophobicContact CB-CE1 4.31Å; P471-Y799 HydrophobicContact CB-CE2 3.66Å; P471-Y799 HydrophobicContact CB-CG 4Å; P471-Y799 HydrophobicContact CG-CD1 4.41Å; P471-Y799 HydrophobicContact CG-CD2 3.75Å; P471-Y799 HydrophobicContact CG-CE2 4.28Å; P471-Y799 HydrophobicContact CG-CG 3.82Å; P471-Y856 HydrophobicContact CG-CD2 4.19Å; P471-Y856 HydrophobicContact CG-CE1 4.17Å; P471-Y856 HydrophobicContact CG-CE2 3.54Å
472	F	94.1	Very high	87.7	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-40.5	-173.3	-67.9	-81.7	0	0	0	112.7	E469 G526 Y527 C528 F596 F597 A795 L796 Y821 Y856	E469-F472 WeakPolarHBondContact O-CA 3.45Å; E469-F472 PolarHBondContact O-N 3.21Å; F472-G526 CarbonylContact O-C 3.5Å; F472-G526 VanDerWaalsContact O-C 3.3Å; F472-G526 WeakPolarHBondContact O-CA 3.29Å; F472-Y527 AromaticContact CD1-CD1 3.9Å; F472-Y527 HydrophobicContact CD1-CD1 3.9Å; F472-Y527 HydrophobicContact CD1-CG 4.07Å; F472-Y527 HydrophobicContact CE1-CD1 4.05Å; F472-Y527 HydrophobicContact CE1-CG 4.23Å; F472-Y527 PolarHBondContact O-N 2.86Å; F472-Y527 VanDerWaalsContact O-N 3.1Å; F472-C528 HydrophobicContact CB-CB 4.49Å; F472-C528 WeakPolarHBondContact O-CB 3.41Å; F472-C528 PolarHBondContact O-N 3.45Å; F472-F596 HydrophobicContact CE1-CE2 4.41Å; F472-F597 HydrophobicContact CE1-CD2 4.03Å; F472-F597 HydrophobicContact CE1-CE2 4.32Å; F472-F597 HydrophobicContact CE1-CG 4.2Å; F472-F597 HydrophobicContact CZ-CD1 4.25Å; F472-F597 HydrophobicContact CZ-CD2 4.21Å; F472-F597 HydrophobicContact CZ-CE1 4.28Å; F472-F597 HydrophobicContact CZ-CE2 4.19Å; F472-F597 HydrophobicContact CZ-CG 4.23Å; F472-F597 HydrophobicContact CZ-CZ 4.23Å; F472-A795 HydrophobicContact CE2-CB 4.36Å; F472-A795 HydrophobicContact CZ-CB 4.35Å; F472-L796 HydrophobicContact CD2-CD2 3.77Å; F472-L796 HydrophobicContact CE2-CD2 3.86Å; F472-Y821 AromaticContact CE1-CD2 3.99Å; F472-Y821 HydrophobicContact CE1-CD2 3.99Å; F472-Y821 HydrophobicContact CE1-CE2 4.11Å; F472-Y821 HydrophobicContact CE2-CD2 4.37Å; F472-Y821 AromaticContact CE2-CE2 3.68Å; F472-Y821 HydrophobicContact CE2-CE2 3.68Å; F472-Y821 AromaticContact CZ-CD2 3.79Å; F472-Y821 HydrophobicContact CZ-CD2 3.79Å; F472-Y821 AromaticContact CZ-CE2 3.44Å; F472-Y821 HydrophobicContact CZ-CE2 3.44Å; F472-Y821 VanDerWaalsContact CZ-CE2 3.44Å; F472-Y856 VanDerWaalsContact CE2-OH 3.29Å; F472-Y856 WeakPolarHBondContact CE2-OH 3.46Å; F472-Y856 HydrophobicContact CZ-CE2 4.48Å; F472-Y856 WeakPolarHBondContact CZ-OH 3.48Å
473	V	94.6	Very high	87	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.237	C	C	.	.	B	Isolated β-bridge	trans	-145.1	116.9	178.9	-175.2	0	0	0	0	108.9	T466 L467 E469 Y525 C528 I529	T466-V473 HydrophobicContact CG2-CG1 4.28Å; T466-V473 WeakPolarHBondContact OG1-CG2 3.21Å; L467-V473 WeakPolarHBondContact O-CB 3.41Å; E469-V473 CarbonylContact C-O 3.53Å; E469-V473 PolarHBondContact N-O 3.03Å; E469-V473 PolarHBondContact O-N 3.36Å; V473-Y525 CarbonylContact C-O 3.54Å; V473-C528 HydrophobicContact CG2-CB 3.97Å; V473-I529 HydrophobicContact CG1-CD1 4.39Å; V473-I529 HydrophobicContact CG1-CG1 4.47Å; V473-I529 HydrophobicContact CG2-CD1 4.34Å
474	F	91.4	Very high	86.6	Confident	26 Å²	26	44.9 Å²	44.9	11%	0.114	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	157.3	169.1	-62.3	-95.5	0	0	0	109.4	H470 P471 C524 Y525 Y799 W855	H470-F474 HydrophobicContact CB-CE1 3.87Å; H470-F474 HydrophobicContact CB-CZ 4.07Å; H470-F474 AromaticContact CD2-CD1 3.02Å; H470-F474 WeakPolarHBondContact CD2-CD1 3.43Å; H470-F474 AromaticContact CD2-CE1 3.23Å; H470-F474 WeakPolarHBondContact CD2-CE1 3.39Å; H470-F474 AromaticContact CD2-CG 3.67Å; H470-F474 AromaticContact CG-CD1 3.95Å; H470-F474 AromaticContact CG-CE1 3.7Å; H470-F474 AromaticContact NE2-CD1 3.57Å; P471-F474 HydrophobicContact CB-CE2 4.02Å; P471-F474 HydrophobicContact CB-CZ 3.95Å; P471-F474 WeakPolarHBondContact O-CE2 3.48Å; F474-C524 WeakPolarHBondContact O-CA 3.41Å; F474-Y525 HydrophobicContact CB-CD1 4.17Å; F474-Y525 HydrophobicContact CB-CD2 3.69Å; F474-Y525 HydrophobicContact CB-CE1 3.79Å; F474-Y525 HydrophobicContact CB-CE2 3.3Å; F474-Y525 HydrophobicContact CB-CG 4.14Å; F474-Y525 HydrophobicContact CD1-CE2 4.19Å; F474-Y525 AromaticContact CD2-CD2 3.85Å; F474-Y525 HydrophobicContact CD2-CD2 3.85Å; F474-Y525 AromaticContact CD2-CE2 3.67Å; F474-Y525 HydrophobicContact CD2-CE2 3.67Å; F474-Y525 AromaticContact CG-CD2 4Å; F474-Y525 HydrophobicContact CG-CD2 4Å; F474-Y525 AromaticContact CG-CE2 3.46Å; F474-Y525 HydrophobicContact CG-CE2 3.46Å; F474-Y525 VanDerWaalsContact CG-CE2 3.46Å; F474-Y525 AromaticContact CG-CZ 3.9Å; F474-Y525 PolarHBondContact N-O 3.47Å; F474-Y525 PolarHBondContact O-N 2.99Å; F474-Y525 VanDerWaalsContact O-N 3.15Å; F474-Y799 AromaticContact CZ-CZ 3.97Å; F474-Y799 WeakPolarHBondContact CZ-OH 3.24Å; F474-W855 HydrophobicContact CD2-CE3 4.41Å; F474-W855 AromaticContact CD2-CZ3 3.98Å; F474-W855 HydrophobicContact CD2-CZ3 3.98Å; F474-W855 AromaticContact CE2-CE3 3.78Å; F474-W855 HydrophobicContact CE2-CE3 3.78Å; F474-W855 AromaticContact CE2-CZ3 3.75Å; F474-W855 HydrophobicContact CE2-CZ3 3.75Å
475	T	91.8	Very high	85.7	Confident	50 Å²	50	49.5 Å²	49.5	31%	0.307	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	145.9	171.5	56	0	0	0	0	110.6	V468 C523 I547	V468-T475 HydrophobicContact CB-CG2 4.35Å; V468-T475 HydrophobicContact CG1-CG2 3.95Å; V468-T475 HydrophobicContact CG2-CG2 3.44Å; V468-T475 VanDerWaalsContact CG2-CG2 3.44Å; T475-C523 CarbonylContact C-O 3.57Å; T475-C523 WeakPolarHBondContact CA-O 3.2Å; T475-I547 HydrophobicContact CG2-CD1 3.69Å
476	R	89.6	Confident	84.7	Confident	96 Å²	96	52.2 Å²	52.2	36%	0.362	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	152.4	171.3	-166.6	-179.6	75.7	171.8	10.2	109.2	D479 K522 C523 Y525	R476-D479 IonicContact CZ-OD1 2.68Å; R476-D479 IonicContact NH2-OD1 2.71Å; R476-D479 PolarHBondContact NH2-OD1 3.2Å; R476-D479 IonicContact NH2-OD2 3.23Å; R476-D479 PolarHBondContact NH2-OD2 3.41Å; R476-D479 VanDerWaalsContact NH2-OD2 3.1Å; R476-K522 CarbonylContact O-C 3.54Å; R476-K522 WeakPolarHBondContact O-CA 3.47Å; R476-C523 PolarHBondContact N-O 3.4Å; R476-C523 PolarHBondContact O-N 2.86Å; R476-Y525 HydrophobicContact CB-CE1 4.14Å
477	D	88	Confident	84.1	Confident	100 Å²	100	53.4 Å²	53.4	54%	0.535	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	152.1	168.1	-61	-48.8	0	0	0	110.8	K522	D477-K522 IonicContact OD1-NZ 3.36Å; D477-K522 PolarHBondContact OD1-NZ 2.98Å
478	V	84.8	Confident	83.9	Confident	23 Å²	23	56.3 Å²	56.3	14%	0.139	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-75.3	143	177.4	-168	0	0	0	0	109.4	S482 S483 R521	V478-S482 VanDerWaalsContact CG1-CA 3.41Å; V478-S483 WeakPolarHBondContact CG1-O 3.44Å; V478-R521 HydrophobicContact CG2-CB 3.74Å; V478-R521 WeakPolarHBondContact CG2-O 3.25Å
479	D	79.2	Confident	83.7	Confident	65 Å²	65	56.6 Å²	56.6	35%	0.348	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-66.2	165.4	177.6	-61.3	-32.7	0	0	0	111	R476 D481 S482 P485	R476-D479 IonicContact CZ-OD1 2.68Å; R476-D479 IonicContact NH2-OD1 2.71Å; R476-D479 PolarHBondContact NH2-OD1 3.2Å; R476-D479 IonicContact NH2-OD2 3.23Å; R476-D479 PolarHBondContact NH2-OD2 3.41Å; R476-D479 VanDerWaalsContact NH2-OD2 3.1Å; D479-D481 PolarHBondContact O-N 3.28Å; D479-D481 VanDerWaalsContact O-N 3.09Å; D479-S482 WeakPolarHBondContact O-CA 3.43Å; D479-S482 PolarHBondContact O-N 2.93Å; D479-P485 WeakPolarHBondContact OD2-CD 3.31Å; D479-P485 WeakPolarHBondContact OD2-CG 3.16Å
480	D	72.3	Confident	83.7	Confident	174 Å²	174	56.1 Å²	56.1	93%	0.93	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-30.2	-175.5	-68	-41.4	0	0	0	113.7	S482	D480-S482 PolarHBondContact O-N 3.45Å
481	D	65.1	Low	83.7	Confident	140 Å²	140	53.3 Å²	53.3	75%	0.749	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	3.3	175.1	-66.4	-34.3	0	0	0	113.3	D479 S483	D479-D481 PolarHBondContact O-N 3.28Å; D479-D481 VanDerWaalsContact O-N 3.09Å; D481-S483 PolarHBondContact O-N 3.1Å
482	S	66.6	Low	83.6	Confident	53 Å²	53	55.9 Å²	55.9	37%	0.371	32%	0.318	S	S	.	.	S	Bend	trans	63.3	23.1	176.7	93.4	0	0	0	0	113.8	V478 D479 D480 R521	V478-S482 VanDerWaalsContact CG1-CA 3.41Å; D479-S482 WeakPolarHBondContact O-CA 3.43Å; D479-S482 PolarHBondContact O-N 2.93Å; D480-S482 PolarHBondContact O-N 3.45Å; S482-R521 PolarHBondContact O-NH2 3.38Å; S482-R521 PolarHBondContact OG-NH2 3.24Å; S482-R521 VanDerWaalsContact OG-NH2 3.13Å
483	S	75.3	Confident	82.8	Confident	60 Å²	60	56.1 Å²	56.1	42%	0.42	32%	0.321	S	S	.	.			trans	-110.3	154.5	179.2	71.3	0	0	0	0	112.1	V478 D481 P485	V478-S483 WeakPolarHBondContact CG1-O 3.44Å; D481-S483 PolarHBondContact O-N 3.1Å; S483-P485 WeakPolarHBondContact O-CD 3.29Å
484	C	81.9	Confident	82.2	Confident	31 Å²	31	59.7 Å²	59.7	21%	0.209	35%	0.345	C	S	.	.			trans	-109.7	92.9	174.7	-65.7	0	0	0	0	108.9	A486 C523	C484-A486 PolarHBondContact O-N 3.06Å; C484-C523 VanDerWaalsContact CA-SG 3.52Å; C484-C523 HydrophobicContact CB-CB 3.85Å; C484-C523 WeakPolarHBondContact CB-SG 3.25Å; C484-C523 VanDerWaalsContact SG-CA 3.56Å; C484-C523 WeakPolarHBondContact SG-CB 3.49Å; C484-C523 CovalentContact SG-SG 2.04Å; C484-C523 PolarHBondContact SG-SG 2.88Å
485	P	75.4	Confident	81.5	Confident	97 Å²	97	60.2 Å²	60.2	63%	0.63	35%	0.351	S	S	*	.	S	Bend	trans	-70.9	-22.1	179.8	27.5	-34.4	0	0	0	112.8	D479 S483	D479-P485 WeakPolarHBondContact OD2-CD 3.31Å; D479-P485 WeakPolarHBondContact OD2-CG 3.16Å; S483-P485 WeakPolarHBondContact O-CD 3.29Å
486	A	74.8	Confident	80.7	Confident	56 Å²	56	62.8 Å²	62.8	46%	0.463	36%	0.363	S	S	.	.	S	Bend	trans	-131.7	123.7	173.5	0	0	0	0	0	109.3	C484	C484-A486 PolarHBondContact O-N 3.06Å
487	G	83.5	Confident	80.3	Confident	25 Å²	25	60.3 Å²	60.3	26%	0.258	36%	0.36	S	S	.	.	S	Bend	trans	88.3	-173.2	-174.6	0	0	0	0	0	113.7	C524	G487-C524 CarbonylContact C-O 3.59Å; G487-C524 WeakPolarHBondContact CA-O 3.41Å
488	Q	89.4	Confident	79.7	Confident	70 Å²	70	58.1 Å²	58.1	33%	0.327	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	148.4	-176.6	-66.5	-63.9	-20.1	0	0	111.6	C490 C523 C524 I529 E533 F543	Q488-C490 PolarHBondContact O-N 3.34Å; Q488-C523 CarbonylContact O-C 3.57Å; Q488-C523 WeakPolarHBondContact O-CA 3.28Å; Q488-C524 PolarHBondContact N-O 3.11Å; Q488-C524 PolarHBondContact O-N 2.65Å; Q488-I529 HydrophobicContact CB-CG2 4.23Å; Q488-I529 HydrophobicContact CG-CG2 3.96Å; Q488-E533 HydrophobicContact CG-CG 4.12Å; Q488-E533 WeakPolarHBondContact CG-OE1 3.37Å; Q488-E533 PolarHBondContact NE2-OE1 3.22Å; Q488-F543 HydrophobicContact CB-CE2 4.34Å; Q488-F543 HydrophobicContact CG-CE2 4.14Å; Q488-F543 HydrophobicContact CG-CZ 3.91Å
489	F	88.1	Confident	79.4	Confident	54 Å²	54	63.6 Å²	63.6	24%	0.237	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	129.6	171.7	179.6	-97.1	0	0	0	110.2	V508 R521	F489-V508 HydrophobicContact CD1-CG1 4.46Å; F489-V508 HydrophobicContact CE1-CG1 3.94Å; F489-V508 HydrophobicContact CE1-CG2 4.17Å; F489-V508 HydrophobicContact CZ-CG1 4.43Å; F489-V508 HydrophobicContact CZ-CG2 4.26Å; F489-R521 HydrophobicContact CE2-CB 3.92Å; F489-R521 HydrophobicContact CE2-CG 4.06Å; F489-R521 HydrophobicContact CZ-CB 4.37Å; F489-R521 HydrophobicContact CZ-CG 4.1Å
490	C	90.2	Very high	79.6	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	148.8	175.5	61.4	0	0	0	0	111.7	Q488 K522 C524 L545	Q488-C490 PolarHBondContact O-N 3.34Å; C490-K522 PolarHBondContact N-O 2.87Å; C490-K522 PolarHBondContact O-N 2.97Å; C490-K522 PolarHBondContact SG-O 2.98Å; C490-C524 HydrophobicContact CB-CB 3.74Å; C490-C524 WeakPolarHBondContact CB-SG 3.4Å; C490-C524 WeakPolarHBondContact SG-CB 3.06Å; C490-C524 PolarHBondContact SG-N 3.02Å; C490-C524 CovalentContact SG-SG 2.03Å; C490-C524 PolarHBondContact SG-SG 3.46Å; C490-L545 WeakPolarHBondContact CA-O 3.29Å; C490-L545 HydrophobicContact CB-CB 4.14Å; C490-L545 HydrophobicContact CB-CD2 3.8Å; C490-L545 HydrophobicContact CB-CG 3.78Å
491	L	89.8	Confident	80.1	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	126.8	-177.2	-165.6	89.2	0	0	0	110.8	A493 L501 Y504 F505 L516 Y520 L545 Y546 I547	L491-A493 HydrophobicContact CD2-CB 3.67Å; L491-A493 HydrophobicContact CG-CB 4.18Å; L491-L501 HydrophobicContact CD2-CD2 3.75Å; L491-Y504 HydrophobicContact CD2-CD2 3.94Å; L491-Y504 HydrophobicContact CD2-CG 4.38Å; L491-F505 HydrophobicContact CB-CZ 4.44Å; L491-L516 HydrophobicContact CD1-CD2 4.37Å; L491-Y520 WeakPolarHBondContact CA-O 3.33Å; L491-L545 PolarHBondContact N-O 3.14Å; L491-L545 VanDerWaalsContact N-O 3.08Å; L491-Y546 CarbonylContact O-C 3.52Å; L491-Y546 VanDerWaalsContact O-CA 3.27Å; L491-Y546 WeakPolarHBondContact O-CA 2.99Å; L491-Y546 WeakPolarHBondContact O-CB 3.35Å; L491-I547 PolarHBondContact O-N 2.71Å
492	D	88.9	Confident	80.9	Confident	53 Å²	53	49.4 Å²	49.4	28%	0.283	30%	0.3	S	S	.	.			trans	-103.3	72.7	171.6	-169.8	2.8	0	0	0	110.1	S494 Y520 K522 I547	D492-S494 VanDerWaalsContact C-N 3.32Å; D492-S494 PolarHBondContact O-N 3.16Å; D492-Y520 PolarHBondContact N-O 3.31Å; D492-Y520 WeakPolarHBondContact O-CD1 3.34Å; D492-K522 HydrophobicContact CB-CG 4.14Å; D492-I547 HydrophobicContact CB-CD1 4.1Å
493	A	78.4	Confident	81.6	Confident	6 Å²	6	52.5 Å²	52.5	5%	0.05	30%	0.303	C	S	.	.			trans	-80.8	-9.8	-170.7	0	0	0	0	0	114.4	L491 T495 L501 Y504	L491-A493 HydrophobicContact CD2-CB 3.67Å; L491-A493 HydrophobicContact CG-CB 4.18Å; A493-T495 HydrophobicContact CB-CG2 3.64Å; A493-T495 PolarHBondContact O-N 3.13Å; A493-L501 HydrophobicContact CB-CD2 3.55Å; A493-Y504 HydrophobicContact CB-CD2 3.98Å; A493-Y504 HydrophobicContact CB-CE2 4.01Å
494	S	80.8	Confident	82	Confident	75 Å²	75	51.9 Å²	51.9	52%	0.524	29%	0.292	S	S	.	.			trans	46.4	24.1	-176.1	66.5	0	0	0	0	115	D492	D492-S494 VanDerWaalsContact C-N 3.32Å; D492-S494 PolarHBondContact O-N 3.16Å
495	T	78.7	Confident	82	Confident	36 Å²	36	51.2 Å²	51.2	22%	0.221	29%	0.286	C	S	.	.			trans	-123.3	140.1	-171.3	-172.6	0	0	0	0	111.3	A493 S497 T500 L501	A493-T495 HydrophobicContact CB-CG2 3.64Å; A493-T495 PolarHBondContact O-N 3.13Å; T495-S497 PolarHBondContact OG1-N 2.96Å; T495-T500 HydrophobicContact CG2-CG2 4.34Å; T495-L501 HydrophobicContact CG2-CD2 4.18Å; T495-L501 HydrophobicContact CG2-CG 3.91Å
496	N	74.7	Confident	82.1	Confident	105 Å²	105	54.4 Å²	54.4	56%	0.561	29%	0.285	S	S	*	.			trans	-98.3	14.2	178	-61.1	-15.1	0	0	0	111.9
497	S	80.4	Confident	82.2	Confident	43 Å²	43	54.4 Å²	54.4	30%	0.301	28%	0.276	S	S	.	.			trans	-101.8	121	-177.9	172.3	0	0	0	0	112.1	T495 E499 T500 L501	T495-S497 PolarHBondContact OG1-N 2.96Å; S497-E499 PolarHBondContact O-N 3.46Å; S497-T500 PolarHBondContact O-N 2.89Å; S497-T500 PolarHBondContact OG-OG1 3.37Å; S497-L501 PolarHBondContact O-N 3.5Å
498	S	75.8	Confident	81.9	Confident	54 Å²	54	55.3 Å²	55.3	38%	0.378	28%	0.276	S	S	.	.	H	α-helix	trans	-59.9	-43.8	178.2	55.6	0	0	0	0	112.8	T500 L501 E502	S498-T500 VanDerWaalsContact C-N 3.28Å; S498-T500 PolarHBondContact O-N 3.15Å; S498-L501 PolarHBondContact O-N 3.22Å; S498-E502 WeakPolarHBondContact O-CB 3.27Å; S498-E502 WeakPolarHBondContact O-CG 3.45Å; S498-E502 PolarHBondContact O-N 2.9Å
499	E	79.3	Confident	81	Confident	138 Å²	138	55.4 Å²	55.4	65%	0.645	29%	0.289	S	S	*	.	H	α-helix	trans	-65.6	-34.1	-176.8	-64.3	-179.1	178.7	0	0	112	S497 R503	S497-E499 PolarHBondContact O-N 3.46Å; E499-R503 WeakPolarHBondContact O-CB 3.45Å; E499-R503 PolarHBondContact O-N 3.48Å; E499-R503 VanDerWaalsContact O-N 3.08Å
500	T	83.1	Confident	80	Confident	28 Å²	28	56.1 Å²	56.1	17%	0.172	31%	0.305	C	S	.	.	H	α-helix	trans	-75	-44.6	179.7	-52	0	0	0	0	110.7	T495 S497 S498 E502 R503 Y504	T495-T500 HydrophobicContact CG2-CG2 4.34Å; S497-T500 PolarHBondContact O-N 2.89Å; S497-T500 PolarHBondContact OG-OG1 3.37Å; S498-T500 VanDerWaalsContact C-N 3.28Å; S498-T500 PolarHBondContact O-N 3.15Å; T500-E502 VanDerWaalsContact C-N 3.34Å; T500-E502 PolarHBondContact O-N 2.97Å; T500-R503 WeakPolarHBondContact O-CB 3.41Å; T500-R503 PolarHBondContact O-N 2.86Å; T500-Y504 HydrophobicContact CG2-CD2 4.23Å; T500-Y504 HydrophobicContact CG2-CE1 4.23Å; T500-Y504 HydrophobicContact CG2-CE2 3.6Å; T500-Y504 WeakPolarHBondContact O-CD2 3.19Å; T500-Y504 VanDerWaalsContact O-CG 3.28Å; T500-Y504 PolarHBondContact O-N 3.32Å
501	L	82.8	Confident	78.8	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.005	34%	0.336	C	S	.	.	H	α-helix	trans	-59.8	-43.3	173	-78	168.8	0	0	0	112	L491 A493 T495 S497 S498 R503 Y504 F505 Y546 L572	L491-L501 HydrophobicContact CD2-CD2 3.75Å; A493-L501 HydrophobicContact CB-CD2 3.55Å; T495-L501 HydrophobicContact CG2-CD2 4.18Å; T495-L501 HydrophobicContact CG2-CG 3.91Å; S497-L501 PolarHBondContact O-N 3.5Å; S498-L501 PolarHBondContact O-N 3.22Å; L501-R503 VanDerWaalsContact C-N 3.31Å; L501-R503 PolarHBondContact O-N 3.08Å; L501-Y504 PolarHBondContact O-N 2.03Å; L501-F505 WeakPolarHBondContact O-CD2 3.35Å; L501-F505 PolarHBondContact O-N 3.39Å; L501-Y546 HydrophobicContact CD1-CD2 4.32Å; L501-Y546 HydrophobicContact CD1-CE2 4.04Å; L501-Y546 HydrophobicContact CD2-CD2 4.27Å; L501-Y546 HydrophobicContact CD2-CG 4.48Å; L501-L572 HydrophobicContact CD1-CD2 4.42Å
502	E	80.6	Confident	77.5	Confident	53 Å²	53	64.1 Å²	64.1	25%	0.248	36%	0.362	C	S	.	.	H	α-helix	trans	-62.7	-37.9	176.2	-84.1	-172.2	-172.2	0	0	113.2	R450 R463 S498 T500 R506	R450-E502 IonicContact NH1-OE1 2.64Å; R450-E502 PolarHBondContact NH1-OE1 2.95Å; R463-E502 IonicContact NH2-OE1 3.1Å; R463-E502 PolarHBondContact NH2-OE1 3.15Å; S498-E502 WeakPolarHBondContact O-CB 3.27Å; S498-E502 WeakPolarHBondContact O-CG 3.45Å; S498-E502 PolarHBondContact O-N 2.9Å; T500-E502 VanDerWaalsContact C-N 3.34Å; T500-E502 PolarHBondContact O-N 2.97Å; E502-R506 WeakPolarHBondContact O-CB 3.38Å; E502-R506 VanDerWaalsContact O-CG 3.24Å; E502-R506 WeakPolarHBondContact O-CG 3.29Å; E502-R506 PolarHBondContact O-N 3.45Å; E502-R506 IonicContact OE2-NH2 3.18Å; E502-R506 PolarHBondContact OE2-NH2 3.38Å
503	R	81.8	Confident	75.9	Confident	117 Å²	117	62 Å²	62	44%	0.442	35%	0.354	S	S	.	.	H	α-helix	trans	-61.3	-48.2	174.2	-169.5	-173	-55.8	123	6.2	110.4	E499 T500 L501 F505 R506 E507	E499-R503 WeakPolarHBondContact O-CB 3.45Å; E499-R503 PolarHBondContact O-N 3.48Å; E499-R503 VanDerWaalsContact O-N 3.08Å; T500-R503 WeakPolarHBondContact O-CB 3.41Å; T500-R503 PolarHBondContact O-N 2.86Å; L501-R503 VanDerWaalsContact C-N 3.31Å; L501-R503 PolarHBondContact O-N 3.08Å; R503-F505 PolarHBondContact O-N 2.91Å; R503-R506 PolarHBondContact O-N 3.17Å; R503-E507 WeakPolarHBondContact CG-OE1 3.43Å; R503-E507 WeakPolarHBondContact O-CG 3.11Å; R503-E507 PolarHBondContact O-N 3.04Å
504	Y	83.7	Confident	74.9	Confident	47 Å²	47	67 Å²	67	18%	0.184	39%	0.388	C	S	.	.	H	α-helix	trans	-61.3	-45.7	179.6	-63.2	-26	0	0	0	112.6	L491 A493 T500 L501 R506 E507 V508 L516	L491-Y504 HydrophobicContact CD2-CD2 3.94Å; L491-Y504 HydrophobicContact CD2-CG 4.38Å; A493-Y504 HydrophobicContact CB-CD2 3.98Å; A493-Y504 HydrophobicContact CB-CE2 4.01Å; T500-Y504 HydrophobicContact CG2-CD2 4.23Å; T500-Y504 HydrophobicContact CG2-CE1 4.23Å; T500-Y504 HydrophobicContact CG2-CE2 3.6Å; T500-Y504 WeakPolarHBondContact O-CD2 3.19Å; T500-Y504 VanDerWaalsContact O-CG 3.28Å; T500-Y504 PolarHBondContact O-N 3.32Å; L501-Y504 PolarHBondContact O-N 2.03Å; Y504-R506 VanDerWaalsContact C-N 3.34Å; Y504-R506 PolarHBondContact O-N 3.49Å; Y504-E507 PolarHBondContact O-N 2.98Å; Y504-V508 WeakPolarHBondContact O-CG2 3.25Å; Y504-V508 PolarHBondContact O-N 2.69Å; Y504-L516 HydrophobicContact CD1-CD2 3.48Å; Y504-L516 VanDerWaalsContact CD1-CD2 3.48Å; Y504-L516 HydrophobicContact CD1-CG 4.28Å; Y504-L516 HydrophobicContact CD2-CD2 4.26Å; Y504-L516 HydrophobicContact CE1-CD2 3.83Å; Y504-L516 HydrophobicContact CG-CD2 3.7Å
505	F	81	Confident	73.9	Confident	18 Å²	18	67 Å²	67	8%	0.079	39%	0.388	C	S	.	.	H	α-helix	trans	-64.2	-36.8	176	-77	-61.7	0	0	0	113	R463 L491 L501 R503 A509 D544 Y546	R463-F505 HydrophobicContact CG-CE2 4.26Å; L491-F505 HydrophobicContact CB-CZ 4.44Å; L501-F505 WeakPolarHBondContact O-CD2 3.35Å; L501-F505 PolarHBondContact O-N 3.39Å; R503-F505 PolarHBondContact O-N 2.91Å; F505-A509 VanDerWaalsContact O-CB 3.29Å; F505-A509 WeakPolarHBondContact O-CB 3.36Å; F505-A509 PolarHBondContact O-N 2.89Å; F505-D544 HydrophobicContact CD1-CB 3.92Å; F505-D544 HydrophobicContact CE1-CB 3.63Å; F505-D544 HydrophobicContact CE2-CB 4.41Å; F505-D544 HydrophobicContact CG-CB 4.43Å; F505-D544 HydrophobicContact CZ-CB 3.88Å; F505-Y546 HydrophobicContact CE2-CD1 4.36Å; F505-Y546 HydrophobicContact CZ-CD1 4.35Å
506	R	78.8	Confident	73.5	Confident	163 Å²	163	65.6 Å²	65.6	62%	0.615	38%	0.379	S	S	*	.	H	α-helix	trans	-66.6	-39.4	174.8	-73.7	179.9	-134.7	162.5	2.2	112.1	E502 R503 Y504 A509 A510	E502-R506 WeakPolarHBondContact O-CB 3.38Å; E502-R506 VanDerWaalsContact O-CG 3.24Å; E502-R506 WeakPolarHBondContact O-CG 3.29Å; E502-R506 PolarHBondContact O-N 3.45Å; E502-R506 IonicContact OE2-NH2 3.18Å; E502-R506 PolarHBondContact OE2-NH2 3.38Å; R503-R506 PolarHBondContact O-N 3.17Å; Y504-R506 VanDerWaalsContact C-N 3.34Å; Y504-R506 PolarHBondContact O-N 3.49Å; R506-A509 PolarHBondContact O-N 3.11Å; R506-A510 VanDerWaalsContact O-CB 3.25Å; R506-A510 WeakPolarHBondContact O-CB 3.01Å; R506-A510 PolarHBondContact O-N 3Å
507	E	76.8	Confident	73.4	Confident	57 Å²	57	63.8 Å²	63.8	27%	0.266	37%	0.373	S	S	.	.	H	α-helix	trans	-66.2	-41.5	177.6	-75.4	169.1	178.9	0	0	111.9	R503 Y504 A510 N512 G513 L516	R503-E507 WeakPolarHBondContact CG-OE1 3.43Å; R503-E507 WeakPolarHBondContact O-CG 3.11Å; R503-E507 PolarHBondContact O-N 3.04Å; Y504-E507 PolarHBondContact O-N 2.98Å; E507-A510 PolarHBondContact O-N 2.75Å; E507-N512 CarbonylContact O-C 3.3Å; E507-N512 PolarHBondContact O-N 2.91Å; E507-G513 PolarHBondContact O-N 2.05Å; E507-L516 HydrophobicContact CB-CD1 4.42Å
508	V	76.3	Confident	73	Confident	44 Å²	44	67.7 Å²	67.7	27%	0.267	39%	0.39	S	S	.	.	H	α-helix	trans	-63.4	-47.1	173.3	174.7	0	0	0	0	110.8	F489 Y504 A510 G511 L516	F489-V508 HydrophobicContact CD1-CG1 4.46Å; F489-V508 HydrophobicContact CE1-CG1 3.94Å; F489-V508 HydrophobicContact CE1-CG2 4.17Å; F489-V508 HydrophobicContact CZ-CG1 4.43Å; F489-V508 HydrophobicContact CZ-CG2 4.26Å; Y504-V508 WeakPolarHBondContact O-CG2 3.25Å; Y504-V508 PolarHBondContact O-N 2.69Å; V508-A510 VanDerWaalsContact C-N 3.28Å; V508-A510 PolarHBondContact O-N 3.31Å; V508-G511 PolarHBondContact O-N 2.98Å; V508-L516 HydrophobicContact CG2-CD1 3.46Å; V508-L516 VanDerWaalsContact CG2-CD1 3.46Å
509	A	71	Confident	73	Confident	71 Å²	71	72.2 Å²	72.2	59%	0.587	41%	0.405	S	S	*	.	H	α-helix	trans	-65.5	-29.4	179.5	0	0	0	0	0	113.4	F505 R506 G511	F505-A509 VanDerWaalsContact O-CB 3.29Å; F505-A509 WeakPolarHBondContact O-CB 3.36Å; F505-A509 PolarHBondContact O-N 2.89Å; R506-A509 PolarHBondContact O-N 3.11Å; A509-G511 PolarHBondContact O-N 3.4Å
510	A	67.9	Low	73.2	Confident	70 Å²	70	68.9 Å²	68.9	58%	0.579	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	0.1	178.3	0	0	0	0	0	114	R506 E507 V508 N512	R506-A510 VanDerWaalsContact O-CB 3.25Å; R506-A510 WeakPolarHBondContact O-CB 3.01Å; R506-A510 PolarHBondContact O-N 3Å; E507-A510 PolarHBondContact O-N 2.75Å; V508-A510 VanDerWaalsContact C-N 3.28Å; V508-A510 PolarHBondContact O-N 3.31Å; A510-N512 PolarHBondContact O-N 3.26Å
511	G	64.8	Low	73.2	Confident	63 Å²	63	68.7 Å²	68.7	65%	0.649	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.8	2.8	-176.8	0	0	0	0	0	114.4	V508 A509 G513	V508-G511 PolarHBondContact O-N 2.98Å; A509-G511 PolarHBondContact O-N 3.4Å; G511-G513 VanDerWaalsContact C-N 3.25Å; G511-G513 PolarHBondContact O-N 3.34Å
512	N	61.1	Low	73.5	Confident	104 Å²	104	70.5 Å²	70.5	56%	0.556	39%	0.391	S	S	*	.			trans	-92.2	27.1	175.3	-73.2	-12.8	0	0	0	112.1	E507 A510 S514 S515	E507-N512 CarbonylContact O-C 3.3Å; E507-N512 PolarHBondContact O-N 2.91Å; A510-N512 PolarHBondContact O-N 3.26Å; N512-S514 PolarHBondContact O-N 3.46Å; N512-S515 PolarHBondContact O-N 2.93Å; N512-S515 PolarHBondContact O-OG 3.46Å
513	G	56.5	Low	74	Confident	10 Å²	10	68 Å²	68	10%	0.103	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-62.7	-6.6	-179.5	0	0	0	0	0	114.8	E507 G511 S515 R521	E507-G513 PolarHBondContact O-N 2.05Å; G511-G513 VanDerWaalsContact C-N 3.25Å; G511-G513 PolarHBondContact O-N 3.34Å; G513-S515 VanDerWaalsContact C-N 3.29Å; G513-R521 PolarHBondContact O-NH1 3.01Å
514	S	57.4	Low	74.6	Confident	109 Å²	109	62.4 Å²	62.4	76%	0.762	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-74.6	-12.9	170.5	49.2	0	0	0	0	114.2	N512	N512-S514 PolarHBondContact O-N 3.46Å
515	S	59.4	Low	75	Confident	76 Å²	76	63.6 Å²	63.6	53%	0.531	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-81.2	-18.5	175.8	60.6	0	0	0	0	113.8	N512 G513	N512-S515 PolarHBondContact O-N 2.93Å; N512-S515 PolarHBondContact O-OG 3.46Å; G513-S515 VanDerWaalsContact C-N 3.29Å
516	L	70.8	Confident	75.6	Confident	7 Å²	7	62.7 Å²	62.7	4%	0.037	36%	0.359	C	S	.	.	S	Bend	trans	-82.5	130.4	174.2	-85.9	147	0	0	0	110.3	L491 Y504 E507 V508 L518 Y520	L491-L516 HydrophobicContact CD1-CD2 4.37Å; Y504-L516 HydrophobicContact CD1-CD2 3.48Å; Y504-L516 VanDerWaalsContact CD1-CD2 3.48Å; Y504-L516 HydrophobicContact CD1-CG 4.28Å; Y504-L516 HydrophobicContact CD2-CD2 4.26Å; Y504-L516 HydrophobicContact CE1-CD2 3.83Å; Y504-L516 HydrophobicContact CG-CD2 3.7Å; E507-L516 HydrophobicContact CB-CD1 4.42Å; V508-L516 HydrophobicContact CG2-CD1 3.46Å; V508-L516 VanDerWaalsContact CG2-CD1 3.46Å; L516-L518 PolarHBondContact O-N 3.17Å; L516-Y520 HydrophobicContact CD2-CD2 4.48Å
517	P	72.2	Confident	76.4	Confident	66 Å²	66	55.1 Å²	55.1	43%	0.429	33%	0.33	S	S	.	.			trans	-49.8	135.4	170.7	-28.1	34.1	0	0	0	111.8	E519 Y520	P517-E519 PolarHBondContact O-N 3.16Å; P517-E519 VanDerWaalsContact O-N 3.08Å; P517-Y520 HydrophobicContact CB-CD2 3.93Å; P517-Y520 HydrophobicContact CB-CE2 4.11Å; P517-Y520 HydrophobicContact CG-CD2 3.88Å; P517-Y520 HydrophobicContact CG-CE2 3.78Å; P517-Y520 PolarHBondContact O-N 3.37Å
518	L	72.9	Confident	77.3	Confident	125 Å²	125	52.4 Å²	52.4	65%	0.654	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-55.1	-27.7	178.7	-74.8	165.4	0	0	0	112.4	L516 Y520 R521	L516-L518 PolarHBondContact O-N 3.17Å; L518-Y520 VanDerWaalsContact C-N 3.26Å; L518-Y520 PolarHBondContact O-N 2.96Å; L518-R521 PolarHBondContact O-N 3.02Å; L518-R521 VanDerWaalsContact O-N 3.15Å
519	E	74.5	Confident	78.2	Confident	149 Å²	149	50.3 Å²	50.3	70%	0.696	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-62.4	-29	178.3	-64.6	-179.1	174.2	0	0	113.8	P517 R521 K522	P517-E519 PolarHBondContact O-N 3.16Å; P517-E519 VanDerWaalsContact O-N 3.08Å; E519-R521 VanDerWaalsContact C-N 3.34Å; E519-K522 VanDerWaalsContact O-CE 3.29Å; E519-K522 WeakPolarHBondContact O-CE 3.36Å
520	Y	82.9	Confident	79.3	Confident	68 Å²	68	47.9 Å²	47.9	27%	0.267	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-88.1	-6	179.3	-58.3	-38.7	0	0	0	113.4	L491 D492 L516 P517 L518	L491-Y520 WeakPolarHBondContact CA-O 3.33Å; D492-Y520 PolarHBondContact N-O 3.31Å; D492-Y520 WeakPolarHBondContact O-CD1 3.34Å; L516-Y520 HydrophobicContact CD2-CD2 4.48Å; P517-Y520 HydrophobicContact CB-CD2 3.93Å; P517-Y520 HydrophobicContact CB-CE2 4.11Å; P517-Y520 HydrophobicContact CG-CD2 3.88Å; P517-Y520 HydrophobicContact CG-CE2 3.78Å; P517-Y520 PolarHBondContact O-N 3.37Å; L518-Y520 VanDerWaalsContact C-N 3.26Å; L518-Y520 PolarHBondContact O-N 2.96Å
521	R	84.9	Confident	80.6	Confident	24 Å²	24	44.5 Å²	44.5	9%	0.091	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	119.8	-179.3	-62.9	-178.5	65.4	178.5	-4	107.7	V478 S482 F489 G513 L518 E519	V478-R521 HydrophobicContact CG2-CB 3.74Å; V478-R521 WeakPolarHBondContact CG2-O 3.25Å; S482-R521 PolarHBondContact O-NH2 3.38Å; S482-R521 PolarHBondContact OG-NH2 3.24Å; S482-R521 VanDerWaalsContact OG-NH2 3.13Å; F489-R521 HydrophobicContact CE2-CB 3.92Å; F489-R521 HydrophobicContact CE2-CG 4.06Å; F489-R521 HydrophobicContact CZ-CB 4.37Å; F489-R521 HydrophobicContact CZ-CG 4.1Å; G513-R521 PolarHBondContact O-NH1 3.01Å; L518-R521 PolarHBondContact O-N 3.02Å; L518-R521 VanDerWaalsContact O-N 3.15Å; E519-R521 VanDerWaalsContact C-N 3.34Å
522	K	88.7	Confident	82.1	Confident	40 Å²	40	41.5 Å²	41.5	17%	0.174	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	157.6	178.4	-60.2	-68.6	178	174.2	0	110.3	R476 D477 C490 D492 E519	R476-K522 CarbonylContact O-C 3.54Å; R476-K522 WeakPolarHBondContact O-CA 3.47Å; D477-K522 IonicContact OD1-NZ 3.36Å; D477-K522 PolarHBondContact OD1-NZ 2.98Å; C490-K522 PolarHBondContact N-O 2.87Å; C490-K522 PolarHBondContact O-N 2.97Å; C490-K522 PolarHBondContact SG-O 2.98Å; D492-K522 HydrophobicContact CB-CG 4.14Å; E519-K522 VanDerWaalsContact O-CE 3.29Å; E519-K522 WeakPolarHBondContact O-CE 3.36Å
523	C	90.9	Very high	83.7	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	118.4	166.7	-57.4	0	0	0	0	108.4	T475 R476 C484 Q488	T475-C523 CarbonylContact C-O 3.57Å; T475-C523 WeakPolarHBondContact CA-O 3.2Å; R476-C523 PolarHBondContact N-O 3.4Å; R476-C523 PolarHBondContact O-N 2.86Å; C484-C523 VanDerWaalsContact CA-SG 3.52Å; C484-C523 HydrophobicContact CB-CB 3.85Å; C484-C523 WeakPolarHBondContact CB-SG 3.25Å; C484-C523 VanDerWaalsContact SG-CA 3.56Å; C484-C523 WeakPolarHBondContact SG-CB 3.49Å; C484-C523 CovalentContact SG-SG 2.04Å; C484-C523 PolarHBondContact SG-SG 2.88Å; Q488-C523 CarbonylContact O-C 3.57Å; Q488-C523 WeakPolarHBondContact O-CA 3.28Å
524	C	93.4	Very high	85.5	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	134.2	178.2	-72.8	0	0	0	0	110.2	F474 G487 Q488 C490 I529 L545	F474-C524 WeakPolarHBondContact O-CA 3.41Å; G487-C524 CarbonylContact C-O 3.59Å; G487-C524 WeakPolarHBondContact CA-O 3.41Å; Q488-C524 PolarHBondContact N-O 3.11Å; Q488-C524 PolarHBondContact O-N 2.65Å; C490-C524 HydrophobicContact CB-CB 3.74Å; C490-C524 WeakPolarHBondContact CB-SG 3.4Å; C490-C524 WeakPolarHBondContact SG-CB 3.06Å; C490-C524 PolarHBondContact SG-N 3.02Å; C490-C524 CovalentContact SG-SG 2.03Å; C490-C524 PolarHBondContact SG-SG 3.46Å; C524-I529 HydrophobicContact CB-CD1 4.32Å; C524-I529 HydrophobicContact CB-CG1 4.36Å; C524-L545 HydrophobicContact CB-CD2 3.75Å
525	Y	93.7	Very high	87.2	Confident	71 Å²	71	35.8 Å²	35.8	28%	0.278	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	161.7	176	60.4	-90.6	0	0	0	110	V473 F474 R476 W855	V473-Y525 CarbonylContact C-O 3.54Å; F474-Y525 HydrophobicContact CB-CD1 4.17Å; F474-Y525 HydrophobicContact CB-CD2 3.69Å; F474-Y525 HydrophobicContact CB-CE1 3.79Å; F474-Y525 HydrophobicContact CB-CE2 3.3Å; F474-Y525 HydrophobicContact CB-CG 4.14Å; F474-Y525 HydrophobicContact CD1-CE2 4.19Å; F474-Y525 AromaticContact CD2-CD2 3.85Å; F474-Y525 HydrophobicContact CD2-CD2 3.85Å; F474-Y525 AromaticContact CD2-CE2 3.67Å; F474-Y525 HydrophobicContact CD2-CE2 3.67Å; F474-Y525 AromaticContact CG-CD2 4Å; F474-Y525 HydrophobicContact CG-CD2 4Å; F474-Y525 AromaticContact CG-CE2 3.46Å; F474-Y525 HydrophobicContact CG-CE2 3.46Å; F474-Y525 VanDerWaalsContact CG-CE2 3.46Å; F474-Y525 AromaticContact CG-CZ 3.9Å; F474-Y525 PolarHBondContact N-O 3.47Å; F474-Y525 PolarHBondContact O-N 2.99Å; F474-Y525 VanDerWaalsContact O-N 3.15Å; R476-Y525 HydrophobicContact CB-CE1 4.14Å; Y525-W855 AromaticContact CD2-CH2 3.65Å; Y525-W855 HydrophobicContact CD2-CH2 3.65Å; Y525-W855 AromaticContact CD2-CZ3 3.93Å; Y525-W855 HydrophobicContact CD2-CZ3 3.93Å; Y525-W855 HydrophobicContact CE2-CH2 4.39Å; Y525-W855 HydrophobicContact CE2-CZ3 4.27Å
526	G	93.2	Very high	88.8	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.157	C	C	.	.	S	Bend	trans	145.7	-178.3	179.4	0	0	0	0	0	112.8	F472 C528 I529 D530 W855	F472-G526 CarbonylContact O-C 3.5Å; F472-G526 VanDerWaalsContact O-C 3.3Å; F472-G526 WeakPolarHBondContact O-CA 3.29Å; G526-C528 VanDerWaalsContact C-N 3.28Å; G526-C528 PolarHBondContact O-N 3.23Å; G526-I529 PolarHBondContact O-N 3.48Å; G526-I529 VanDerWaalsContact O-N 3.1Å; G526-D530 PolarHBondContact O-N 3.41Å; G526-W855 VanDerWaalsContact C-CZ2 3.48Å
527	Y	94.4	Very high	89.8	Confident	3 Å²	3	38.8 Å²	38.8	1%	0.012	19%	0.185	C	C	.	.	H	α-helix	trans	-52.5	-46.1	179.8	-174.5	-75.2	0	0	0	112.4	P471 F472 L531 F596 F597 L851 H852 W855	P471-Y527 PolarHBondContact O-N 2.84Å; F472-Y527 AromaticContact CD1-CD1 3.9Å; F472-Y527 HydrophobicContact CD1-CD1 3.9Å; F472-Y527 HydrophobicContact CD1-CG 4.07Å; F472-Y527 HydrophobicContact CE1-CD1 4.05Å; F472-Y527 HydrophobicContact CE1-CG 4.23Å; F472-Y527 PolarHBondContact O-N 2.86Å; F472-Y527 VanDerWaalsContact O-N 3.1Å; Y527-L531 WeakPolarHBondContact O-CB 3.33Å; Y527-L531 PolarHBondContact O-N 3.5Å; Y527-L531 VanDerWaalsContact O-N 3.15Å; Y527-F596 HydrophobicContact CD1-CE2 4.14Å; Y527-F596 AromaticContact CE1-CD2 3.7Å; Y527-F596 HydrophobicContact CE1-CD2 3.7Å; Y527-F596 AromaticContact CE1-CE2 3.75Å; Y527-F596 HydrophobicContact CE1-CE2 3.75Å; Y527-F597 HydrophobicContact CE1-CD2 4.45Å; Y527-F597 HydrophobicContact CE2-CD2 4.36Å; Y527-L851 HydrophobicContact CD2-CB 3.85Å; Y527-L851 HydrophobicContact CE1-CD1 4.42Å; Y527-L851 HydrophobicContact CE2-CB 3.46Å; Y527-L851 VanDerWaalsContact CE2-CB 3.46Å; Y527-H852 HydrophobicContact CE2-CB 4.39Å; Y527-W855 HydrophobicContact CD2-CB 4.44Å; Y527-W855 AromaticContact CD2-CD1 3.99Å; Y527-W855 HydrophobicContact CD2-CG 4.5Å
528	C	95.9	Very high	90.8	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-73.8	-28.5	-178.1	-79.3	0	0	0	0	112.8	F472 V473 G526 L532 V577 T578	F472-C528 HydrophobicContact CB-CB 4.49Å; F472-C528 WeakPolarHBondContact O-CB 3.41Å; F472-C528 PolarHBondContact O-N 3.45Å; V473-C528 HydrophobicContact CG2-CB 3.97Å; G526-C528 VanDerWaalsContact C-N 3.28Å; G526-C528 PolarHBondContact O-N 3.23Å; C528-L532 WeakPolarHBondContact O-CB 3.43Å; C528-L532 PolarHBondContact O-N 3.26Å; C528-V577 HydrophobicContact CB-CG1 4Å; C528-T578 VanDerWaalsContact SG-C 3.58Å
529	I	95.1	Very high	91.5	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-75.9	-44.9	178.9	-54.2	-52.9	0	0	0	110.2	V473 Q488 C524 G526 L531 L532 E533 L545	V473-I529 HydrophobicContact CG1-CD1 4.39Å; V473-I529 HydrophobicContact CG1-CG1 4.47Å; V473-I529 HydrophobicContact CG2-CD1 4.34Å; Q488-I529 HydrophobicContact CB-CG2 4.23Å; Q488-I529 HydrophobicContact CG-CG2 3.96Å; C524-I529 HydrophobicContact CB-CD1 4.32Å; C524-I529 HydrophobicContact CB-CG1 4.36Å; G526-I529 PolarHBondContact O-N 3.48Å; G526-I529 VanDerWaalsContact O-N 3.1Å; I529-L531 VanDerWaalsContact C-N 3.28Å; I529-L531 PolarHBondContact O-N 3.09Å; I529-L532 WeakPolarHBondContact O-CB 3.45Å; I529-L532 PolarHBondContact O-N 3.08Å; I529-L532 VanDerWaalsContact O-N 3.11Å; I529-E533 WeakPolarHBondContact O-CG 3.49Å; I529-E533 PolarHBondContact O-N 3Å; I529-L545 HydrophobicContact CD1-CD2 3.72Å
530	D	94.9	Very high	92.2	Very high	19 Å²	19	30.6 Å²	30.6	10%	0.102	14%	0.143	C	C	.	.	H	α-helix	trans	-60.6	-40.2	174.4	-68.8	-3.3	0	0	0	111.2	G526 L532 E533 K534 L851 K854 W855	G526-D530 PolarHBondContact O-N 3.41Å; D530-L532 VanDerWaalsContact C-N 3.35Å; D530-E533 PolarHBondContact O-N 3.03Å; D530-K534 WeakPolarHBondContact O-CB 3.41Å; D530-K534 PolarHBondContact O-N 2.67Å; D530-L851 HydrophobicContact CB-CD2 3.48Å; D530-L851 VanDerWaalsContact CB-CD2 3.48Å; D530-K854 IonicContact OD1-NZ 2.6Å; D530-K854 WeakPolarHBondContact OD2-CE 3.49Å; D530-K854 IonicContact OD2-NZ 3.43Å; D530-K854 PolarHBondContact OD2-NZ 2.84Å; D530-W855 WeakPolarHBondContact OD2-CZ2 2.99Å; D530-W855 PolarHBondContact OD2-NE1 3Å
531	L	95.8	Very high	92.5	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-62.9	-41.6	174.4	177	60.9	0	0	0	111.8	Y527 I529 K534 L535 F596 Y842 M848 L851	Y527-L531 WeakPolarHBondContact O-CB 3.33Å; Y527-L531 PolarHBondContact O-N 3.5Å; Y527-L531 VanDerWaalsContact O-N 3.15Å; I529-L531 VanDerWaalsContact C-N 3.28Å; I529-L531 PolarHBondContact O-N 3.09Å; L531-K534 PolarHBondContact O-N 2.89Å; L531-L535 HydrophobicContact CD1-CD1 4.43Å; L531-L535 HydrophobicContact CD1-CG 4.5Å; L531-L535 HydrophobicContact CG-CD1 4.23Å; L531-L535 WeakPolarHBondContact O-CG 3.41Å; L531-L535 PolarHBondContact O-N 3.07Å; L531-F596 HydrophobicContact CD2-CB 4.13Å; L531-F596 HydrophobicContact CD2-CD1 4.2Å; L531-F596 HydrophobicContact CD2-CD2 3.99Å; L531-F596 HydrophobicContact CD2-CE2 4.47Å; L531-F596 HydrophobicContact CD2-CG 3.85Å; L531-Y842 HydrophobicContact CD1-CD2 3.81Å; L531-Y842 HydrophobicContact CD1-CE2 4.09Å; L531-M848 HydrophobicContact CD1-CE 3.53Å; L531-M848 HydrophobicContact CD1-SD 4.27Å; L531-M848 HydrophobicContact CD2-CE 4.19Å; L531-L851 HydrophobicContact CB-CD1 4.14Å
532	L	95.8	Very high	92.7	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-66.3	-41.2	177.6	177.4	61.1	0	0	0	111.9	V464 C528 I529 D530 K534 L535 A536 F541 F543 L545 M575 V577	V464-L532 HydrophobicContact CB-CD2 4.31Å; V464-L532 HydrophobicContact CG1-CD2 3.92Å; V464-L532 HydrophobicContact CG2-CD1 4.3Å; V464-L532 HydrophobicContact CG2-CD2 4.23Å; C528-L532 WeakPolarHBondContact O-CB 3.43Å; C528-L532 PolarHBondContact O-N 3.26Å; I529-L532 WeakPolarHBondContact O-CB 3.45Å; I529-L532 PolarHBondContact O-N 3.08Å; I529-L532 VanDerWaalsContact O-N 3.11Å; D530-L532 VanDerWaalsContact C-N 3.35Å; L532-K534 VanDerWaalsContact C-N 3.33Å; L532-L535 PolarHBondContact O-N 3Å; L532-A536 VanDerWaalsContact O-CB 3.28Å; L532-A536 WeakPolarHBondContact O-CB 3.28Å; L532-A536 PolarHBondContact O-N 3.2Å; L532-F541 HydrophobicContact CD1-CE2 4.34Å; L532-F541 HydrophobicContact CD1-CZ 4.19Å; L532-F543 HydrophobicContact CD1-CD1 4.49Å; L532-F543 HydrophobicContact CD2-CD1 4.43Å; L532-F543 HydrophobicContact CD2-CD2 3.75Å; L532-F543 HydrophobicContact CD2-CE1 4.41Å; L532-F543 HydrophobicContact CD2-CE2 3.71Å; L532-F543 HydrophobicContact CD2-CG 4.11Å; L532-F543 HydrophobicContact CD2-CZ 4.05Å; L532-F543 HydrophobicContact CG-CD1 4.16Å; L532-F543 HydrophobicContact CG-CD2 4.35Å; L532-F543 HydrophobicContact CG-CE1 4.04Å; L532-F543 HydrophobicContact CG-CE2 4.23Å; L532-F543 HydrophobicContact CG-CG 4.31Å; L532-F543 HydrophobicContact CG-CZ 4.06Å; L532-L545 HydrophobicContact CD2-CD1 4.45Å; L532-M575 HydrophobicContact CD1-SD 4.31Å; L532-V577 HydrophobicContact CD1-CG2 4.34Å
533	E	93.4	Very high	92.9	Very high	49 Å²	49	31.2 Å²	31.2	23%	0.229	15%	0.149	C	C	.	.	H	α-helix	trans	-58.8	-46.5	173.2	-74.2	178.3	178	0	0	110.9	Q488 I529 D530 L535 A536 E537 F543	Q488-E533 HydrophobicContact CG-CG 4.12Å; Q488-E533 WeakPolarHBondContact CG-OE1 3.37Å; Q488-E533 PolarHBondContact NE2-OE1 3.22Å; I529-E533 WeakPolarHBondContact O-CG 3.49Å; I529-E533 PolarHBondContact O-N 3Å; D530-E533 PolarHBondContact O-N 3.03Å; E533-L535 VanDerWaalsContact C-N 3.34Å; E533-L535 PolarHBondContact O-N 3.11Å; E533-A536 WeakPolarHBondContact O-CB 3.36Å; E533-A536 PolarHBondContact O-N 2.96Å; E533-A536 VanDerWaalsContact O-N 3.14Å; E533-E537 WeakPolarHBondContact O-CG 3.19Å; E533-E537 PolarHBondContact O-N 3.27Å; E533-F543 HydrophobicContact CG-CZ 4.29Å
534	K	94.3	Very high	92.8	Very high	54 Å²	54	32.6 Å²	32.6	24%	0.235	16%	0.157	C	C	.	.	H	α-helix	trans	-63.5	-40.8	179.4	-174.2	53.5	-179.8	152.1	0	112.5	D530 L531 L532 E537 D538 Y842 Y847	D530-K534 WeakPolarHBondContact O-CB 3.41Å; D530-K534 PolarHBondContact O-N 2.67Å; L531-K534 PolarHBondContact O-N 2.89Å; L532-K534 VanDerWaalsContact C-N 3.33Å; K534-E537 PolarHBondContact O-N 3.39Å; K534-D538 WeakPolarHBondContact CE-OD2 3.31Å; K534-D538 IonicContact NZ-OD1 2.73Å; K534-D538 PolarHBondContact NZ-OD1 3.39Å; K534-D538 IonicContact NZ-OD2 3.75Å; K534-D538 PolarHBondContact NZ-OD2 3.12Å; K534-D538 PolarHBondContact O-N 2.9Å; K534-D538 VanDerWaalsContact O-N 3.08Å; K534-Y842 HydrophobicContact CG-CE1 3.98Å; K534-Y842 HydrophobicContact CG-CE2 4.18Å; K534-Y842 PolarHBondContact O-OH 3.32Å; K534-Y847 HydrophobicContact CB-CE1 3.93Å; K534-Y847 HydrophobicContact CG-CD1 4.39Å; K534-Y847 HydrophobicContact CG-CE1 3.76Å; K534-Y847 HydrophobicContact CG-CE2 4.43Å
535	L	94.8	Very high	92.8	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-63.1	-41.6	173.1	-75.4	168.2	0	0	0	111.8	L531 L532 E533 D538 L539 F541 I823 L835 F838 Y842	L531-L535 HydrophobicContact CD1-CD1 4.43Å; L531-L535 HydrophobicContact CD1-CG 4.5Å; L531-L535 HydrophobicContact CG-CD1 4.23Å; L531-L535 WeakPolarHBondContact O-CG 3.41Å; L531-L535 PolarHBondContact O-N 3.07Å; L532-L535 PolarHBondContact O-N 3Å; E533-L535 VanDerWaalsContact C-N 3.34Å; E533-L535 PolarHBondContact O-N 3.11Å; L535-D538 PolarHBondContact O-N 2.97Å; L535-L539 HydrophobicContact CD2-CD1 4.49Å; L535-L539 VanDerWaalsContact O-CB 3.25Å; L535-L539 WeakPolarHBondContact O-CB 3.38Å; L535-L539 PolarHBondContact O-N 3.5Å; L535-F541 HydrophobicContact CB-CE1 4.45Å; L535-F541 HydrophobicContact CB-CZ 4.44Å; L535-F541 WeakPolarHBondContact O-CE1 3.49Å; L535-I823 HydrophobicContact CD1-CD1 3.59Å; L535-L835 HydrophobicContact CD1-CD2 4.29Å; L535-L835 HydrophobicContact CD2-CD2 4.01Å; L535-F838 HydrophobicContact CD2-CB 3.8Å; L535-Y842 HydrophobicContact CD2-CE2 3.55Å; L535-Y842 HydrophobicContact CG-CE2 3.89Å
536	A	92.6	Very high	92.8	Very high	10 Å²	10	29.4 Å²	29.4	8%	0.083	14%	0.144	C	C	.	.	H	α-helix	trans	-64.4	-39.4	178.9	0	0	0	0	0	112.4	L532 E533 D540 F541 F543	L532-A536 VanDerWaalsContact O-CB 3.28Å; L532-A536 WeakPolarHBondContact O-CB 3.28Å; L532-A536 PolarHBondContact O-N 3.2Å; E533-A536 WeakPolarHBondContact O-CB 3.36Å; E533-A536 PolarHBondContact O-N 2.96Å; E533-A536 VanDerWaalsContact O-N 3.14Å; A536-D540 VanDerWaalsContact O-CA 3.25Å; A536-D540 WeakPolarHBondContact O-CA 3.23Å; A536-D540 PolarHBondContact O-N 3.31Å; A536-F541 HydrophobicContact CB-CD2 4.35Å; A536-F541 HydrophobicContact CB-CE1 4.27Å; A536-F541 HydrophobicContact CB-CE2 4.02Å; A536-F541 HydrophobicContact CB-CZ 3.97Å; A536-F541 WeakPolarHBondContact CB-O 3.23Å; A536-F541 PolarHBondContact O-N 3.25Å; A536-F543 HydrophobicContact CB-CD1 3.74Å; A536-F543 HydrophobicContact CB-CE1 3.7Å
537	E	91.7	Very high	92.8	Very high	136 Å²	136	30 Å²	30	64%	0.636	15%	0.147	S	C	*	.	H	α-helix	trans	-66.3	-46.9	174.8	-72.5	177.2	176.2	0	0	112.3	E533 K534	E533-E537 WeakPolarHBondContact O-CG 3.19Å; E533-E537 PolarHBondContact O-N 3.27Å; K534-E537 PolarHBondContact O-N 3.39Å
538	D	92.1	Very high	92.7	Very high	64 Å²	64	30 Å²	30	34%	0.342	15%	0.148	S	C	.	.	H	α-helix	trans	-77.7	-24.5	-174.3	-67.9	-18.9	0	0	0	113.1	K534 L535 F838 Y842	K534-D538 WeakPolarHBondContact CE-OD2 3.31Å; K534-D538 IonicContact NZ-OD1 2.73Å; K534-D538 PolarHBondContact NZ-OD1 3.39Å; K534-D538 IonicContact NZ-OD2 3.75Å; K534-D538 PolarHBondContact NZ-OD2 3.12Å; K534-D538 PolarHBondContact O-N 2.9Å; K534-D538 VanDerWaalsContact O-N 3.08Å; L535-D538 PolarHBondContact O-N 2.97Å; D538-F838 HydrophobicContact CB-CD1 4.14Å; D538-F838 HydrophobicContact CB-CE1 3.76Å; D538-Y842 WeakPolarHBondContact OD2-CE1 3.27Å; D538-Y842 VanDerWaalsContact OD2-CZ 3.25Å; D538-Y842 PolarHBondContact OD2-OH 3.15Å
539	L	89.3	Confident	92.3	Very high	21 Å²	21	31.1 Å²	31.1	11%	0.11	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.8	2.1	176	-69.7	168.4	0	0	0	113.7	L535 F541 N834 L835 F838	L535-L539 HydrophobicContact CD2-CD1 4.49Å; L535-L539 VanDerWaalsContact O-CB 3.25Å; L535-L539 WeakPolarHBondContact O-CB 3.38Å; L535-L539 PolarHBondContact O-N 3.5Å; L539-F541 HydrophobicContact CB-CD1 3.58Å; L539-F541 HydrophobicContact CB-CE1 3.82Å; L539-F541 HydrophobicContact CD1-CD1 4.42Å; L539-F541 HydrophobicContact CD1-CE1 3.94Å; L539-F541 PolarHBondContact O-N 3.47Å; L539-N834 VanDerWaalsContact CD2-ND2 3.34Å; L539-N834 WeakPolarHBondContact CD2-ND2 3.38Å; L539-L835 HydrophobicContact CD1-CD2 3.49Å; L539-L835 VanDerWaalsContact CD1-CD2 3.49Å; L539-L835 HydrophobicContact CD1-CG 4.49Å; L539-F838 HydrophobicContact CD1-CD2 4.35Å; L539-F838 HydrophobicContact CD2-CD2 3.78Å; L539-F838 HydrophobicContact CD2-CE2 3.31Å; L539-F838 HydrophobicContact CD2-CZ 3.94Å; L539-F838 HydrophobicContact CG-CD2 4.13Å; L539-F838 HydrophobicContact CG-CE2 3.98Å; L539-F838 HydrophobicContact CG-CZ 4.39Å
540	D	89.1	Confident	91.9	Very high	83 Å²	83	33.6 Å²	33.6	44%	0.444	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	47	51.3	-178.7	-169.5	42.4	0	0	0	114.1	E458 G459 A536	E458-D540 CarbonylContact C-O 3.6Å; E458-D540 WeakPolarHBondContact CA-O 3.5Å; E458-D540 HydrophobicContact CG-CB 4.14Å; G459-D540 PolarHBondContact N-O 2.73Å; A536-D540 VanDerWaalsContact O-CA 3.25Å; A536-D540 WeakPolarHBondContact O-CA 3.23Å; A536-D540 PolarHBondContact O-N 3.31Å
541	F	89.2	Confident	91.6	Very high	6 Å²	6	34.7 Å²	34.7	3%	0.026	19%	0.188	C	C	.	.			trans	-119.8	153.3	173.6	71.7	-91.8	0	0	0	112.7	V457 V462 L532 L535 A536 L539 F543	V457-F541 HydrophobicContact CG1-CB 3.51Å; V457-F541 HydrophobicContact CG1-CD1 3.68Å; V457-F541 HydrophobicContact CG1-CG 3.69Å; V457-F541 WeakPolarHBondContact O-CB 3.14Å; V462-F541 HydrophobicContact CB-CD2 4.14Å; V462-F541 HydrophobicContact CB-CE2 4.41Å; V462-F541 HydrophobicContact CG2-CD2 3.83Å; V462-F541 HydrophobicContact CG2-CE2 4.41Å; V462-F541 HydrophobicContact CG2-CG 4.29Å; L532-F541 HydrophobicContact CD1-CE2 4.34Å; L532-F541 HydrophobicContact CD1-CZ 4.19Å; L535-F541 HydrophobicContact CB-CE1 4.45Å; L535-F541 HydrophobicContact CB-CZ 4.44Å; L535-F541 WeakPolarHBondContact O-CE1 3.49Å; A536-F541 HydrophobicContact CB-CD2 4.35Å; A536-F541 HydrophobicContact CB-CE1 4.27Å; A536-F541 HydrophobicContact CB-CE2 4.02Å; A536-F541 HydrophobicContact CB-CZ 3.97Å; A536-F541 WeakPolarHBondContact CB-O 3.23Å; A536-F541 PolarHBondContact O-N 3.25Å; L539-F541 HydrophobicContact CB-CD1 3.58Å; L539-F541 HydrophobicContact CB-CE1 3.82Å; L539-F541 HydrophobicContact CD1-CD1 4.42Å; L539-F541 HydrophobicContact CD1-CE1 3.94Å; L539-F541 PolarHBondContact O-N 3.47Å; F541-F543 HydrophobicContact CD2-CB 4.42Å; F541-F543 HydrophobicContact CE2-CB 4.15Å; F541-F543 HydrophobicContact CE2-CD1 4.19Å
542	H	88.8	Confident	91.4	Very high	105 Å²	105	37.9 Å²	37.9	49%	0.486	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	150.5	171.1	-64.5	-52.8	0	0	0	109.8	T460 R461 V462	T460-H542 PolarHBondContact O-N 2.99Å; R461-H542 CarbonylContact C-O 3.46Å; R461-H542 VanDerWaalsContact CA-O 3.24Å; R461-H542 WeakPolarHBondContact CA-O 3.34Å; R461-H542 HydrophobicContact CG-CB 4.03Å; V462-H542 PolarHBondContact N-O 2.88Å
543	F	91.6	Very high	91.1	Very high	33 Å²	33	38.2 Å²	38.2	15%	0.145	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	149.8	178.6	59.5	-90.4	0	0	0	113.4	V462 V464 Q488 L532 E533 A536 F541 L545	V462-F543 CarbonylContact O-C 3.55Å; V462-F543 WeakPolarHBondContact O-CA 3.15Å; V464-F543 HydrophobicContact CG2-CB 3.84Å; Q488-F543 HydrophobicContact CB-CE2 4.34Å; Q488-F543 HydrophobicContact CG-CE2 4.14Å; Q488-F543 HydrophobicContact CG-CZ 3.91Å; L532-F543 HydrophobicContact CD1-CD1 4.49Å; L532-F543 HydrophobicContact CD2-CD1 4.43Å; L532-F543 HydrophobicContact CD2-CD2 3.75Å; L532-F543 HydrophobicContact CD2-CE1 4.41Å; L532-F543 HydrophobicContact CD2-CE2 3.71Å; L532-F543 HydrophobicContact CD2-CG 4.11Å; L532-F543 HydrophobicContact CD2-CZ 4.05Å; L532-F543 HydrophobicContact CG-CD1 4.16Å; L532-F543 HydrophobicContact CG-CD2 4.35Å; L532-F543 HydrophobicContact CG-CE1 4.04Å; L532-F543 HydrophobicContact CG-CE2 4.23Å; L532-F543 HydrophobicContact CG-CG 4.31Å; L532-F543 HydrophobicContact CG-CZ 4.06Å; E533-F543 HydrophobicContact CG-CZ 4.29Å; A536-F543 HydrophobicContact CB-CD1 3.74Å; A536-F543 HydrophobicContact CB-CE1 3.7Å; F541-F543 HydrophobicContact CD2-CB 4.42Å; F541-F543 HydrophobicContact CE2-CB 4.15Å; F541-F543 HydrophobicContact CE2-CD1 4.19Å; F543-L545 HydrophobicContact CD2-CB 4.21Å; F543-L545 HydrophobicContact CE2-CB 4.39Å
544	D	90.4	Very high	90.9	Very high	29 Å²	29	35.9 Å²	35.9	16%	0.155	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	106.8	173.1	-78.5	-45.1	0	0	0	108.3	R461 V462 R463 V464 F505	R461-D544 IonicContact CZ-OD1 3.76Å; R461-D544 IonicContact CZ-OD2 3.77Å; R461-D544 IonicContact NE-OD1 3.05Å; R461-D544 PolarHBondContact NE-OD1 2.93Å; R461-D544 IonicContact NE-OD2 3.17Å; R461-D544 PolarHBondContact NE-OD2 3.46Å; R461-D544 IonicContact NH2-OD1 3.56Å; R461-D544 PolarHBondContact NH2-OD1 2.89Å; R461-D544 IonicContact NH2-OD2 3.87Å; V462-D544 PolarHBondContact O-N 2.91Å; R463-D544 HydrophobicContact CG-CB 4.3Å; V464-D544 PolarHBondContact N-O 3.29Å; F505-D544 HydrophobicContact CD1-CB 3.92Å; F505-D544 HydrophobicContact CE1-CB 3.63Å; F505-D544 HydrophobicContact CE2-CB 4.41Å; F505-D544 HydrophobicContact CG-CB 4.43Å; F505-D544 HydrophobicContact CZ-CB 3.88Å
545	L	92.5	Very high	90.7	Very high	3 Å²	3	33.5 Å²	33.5	2%	0.016	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	131.4	-174.3	-172.8	62.3	0	0	0	111.5	V464 T466 C490 L491 C524 I529 L532 F543	V464-L545 HydrophobicContact CB-CD1 4.1Å; V464-L545 HydrophobicContact CG1-CD1 3.95Å; V464-L545 WeakPolarHBondContact O-CA 3.45Å; T466-L545 HydrophobicContact CG2-CD1 3.8Å; T466-L545 HydrophobicContact CG2-CG 4.25Å; C490-L545 WeakPolarHBondContact CA-O 3.29Å; C490-L545 HydrophobicContact CB-CB 4.14Å; C490-L545 HydrophobicContact CB-CD2 3.8Å; C490-L545 HydrophobicContact CB-CG 3.78Å; L491-L545 PolarHBondContact N-O 3.14Å; L491-L545 VanDerWaalsContact N-O 3.08Å; C524-L545 HydrophobicContact CB-CD2 3.75Å; I529-L545 HydrophobicContact CD1-CD2 3.72Å; L532-L545 HydrophobicContact CD2-CD1 4.45Å; F543-L545 HydrophobicContact CD2-CB 4.21Å; F543-L545 HydrophobicContact CE2-CB 4.39Å
546	Y	93.3	Very high	90.4	Very high	2 Å²	2	40.7 Å²	40.7	1%	0.008	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	154.8	170.8	74.8	-79.9	0	0	0	112.6	R463 V464 V465 T466 L491 L501 F505 D567 A573	R463-Y546 HydrophobicContact CG-CD1 3.88Å; R463-Y546 HydrophobicContact CG-CE1 3.77Å; V464-Y546 WeakPolarHBondContact O-CD1 3.43Å; V464-Y546 PolarHBondContact O-N 3.36Å; V465-Y546 WeakPolarHBondContact CA-O 3.46Å; V465-Y546 HydrophobicContact CB-CD1 4.42Å; V465-Y546 HydrophobicContact CB-CE1 3.74Å; V465-Y546 HydrophobicContact CB-CE2 4.08Å; V465-Y546 HydrophobicContact CG2-CD2 4.21Å; V465-Y546 HydrophobicContact CG2-CE1 4.19Å; V465-Y546 HydrophobicContact CG2-CE2 3.59Å; T466-Y546 PolarHBondContact N-O 3.31Å; L491-Y546 CarbonylContact O-C 3.52Å; L491-Y546 VanDerWaalsContact O-CA 3.27Å; L491-Y546 WeakPolarHBondContact O-CA 2.99Å; L491-Y546 WeakPolarHBondContact O-CB 3.35Å; L501-Y546 HydrophobicContact CD1-CD2 4.32Å; L501-Y546 HydrophobicContact CD1-CE2 4.04Å; L501-Y546 HydrophobicContact CD2-CD2 4.27Å; L501-Y546 HydrophobicContact CD2-CG 4.48Å; F505-Y546 HydrophobicContact CE2-CD1 4.36Å; F505-Y546 HydrophobicContact CZ-CD1 4.35Å; Y546-D567 WeakPolarHBondContact CE2-OD2 3.27Å; Y546-D567 PolarHBondContact OH-OD2 2.04Å; Y546-A573 HydrophobicContact CE1-CB 4.14Å; Y546-A573 WeakPolarHBondContact OH-CB 3.29Å
547	I	93.6	Very high	90.1	Very high	11 Å²	11	45 Å²	45	6%	0.056	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	136	177.8	-57.7	170.5	0	0	0	108.9	T466 V468 T475 L491 D492 G549	T466-I547 HydrophobicContact CG2-CG1 4.21Å; T466-I547 WeakPolarHBondContact O-CA 3.35Å; V468-I547 HydrophobicContact CG2-CD1 3.79Å; V468-I547 HydrophobicContact CG2-CG1 4.25Å; V468-I547 HydrophobicContact CG2-CG2 3.92Å; T475-I547 HydrophobicContact CG2-CD1 3.69Å; L491-I547 PolarHBondContact O-N 2.71Å; D492-I547 HydrophobicContact CB-CD1 4.1Å; I547-G549 PolarHBondContact O-N 3.45Å
548	V	92.9	Very high	89.7	Confident	4 Å²	4	43 Å²	43	2%	0.024	24%	0.242	C	C	.	.			trans	-58.8	129.9	179.2	65.7	0	0	0	0	111.6	V465 T466 L467 D550 G551 L564	V465-V548 HydrophobicContact CG2-CB 3.87Å; V465-V548 HydrophobicContact CG2-CG2 4.43Å; T466-V548 PolarHBondContact O-N 3.01Å; L467-V548 HydrophobicContact CB-CG1 4.21Å; L467-V548 HydrophobicContact CD1-CG1 3.45Å; L467-V548 VanDerWaalsContact CD1-CG1 3.45Å; L467-V548 HydrophobicContact CG-CG1 4.43Å; V548-D550 VanDerWaalsContact C-N 3.34Å; V548-D550 WeakPolarHBondContact CG2-OD1 3.4Å; V548-D550 PolarHBondContact O-N 3.35Å; V548-G551 PolarHBondContact O-N 2.93Å; V548-L564 HydrophobicContact CB-CD2 3.82Å; V548-L564 HydrophobicContact CG1-CD2 4.02Å; V548-L564 HydrophobicContact CG2-CD2 4.2Å
549	G	87.7	Confident	89.4	Confident	24 Å²	24	42.6 Å²	42.6	25%	0.247	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-24.6	-168.2	0	0	0	0	0	115.5	I547	I547-G549 PolarHBondContact O-N 3.45Å
550	D	86.8	Confident	89.5	Confident	52 Å²	52	50.1 Å²	50.1	28%	0.278	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-2.6	179.4	70.5	-5.3	0	0	0	114.1	V548 K552 G563	V548-D550 VanDerWaalsContact C-N 3.34Å; V548-D550 WeakPolarHBondContact CG2-OD1 3.4Å; V548-D550 PolarHBondContact O-N 3.35Å; D550-K552 VanDerWaalsContact C-N 3.3Å; D550-K552 HydrophobicContact CB-CD 4.48Å; D550-K552 WeakPolarHBondContact O-CG 3.4Å; D550-K552 PolarHBondContact O-N 3.33Å; D550-K552 PolarHBondContact OD1-N 2.95Å; D550-K552 VanDerWaalsContact OD1-N 3.16Å; D550-G563 VanDerWaalsContact OD1-CA 3.31Å; D550-G563 WeakPolarHBondContact OD1-CA 3.38Å; D550-G563 WeakPolarHBondContact OD2-CA 3.35Å; D550-G563 PolarHBondContact OD2-N 3.34Å
551	G	88.7	Confident	89.6	Confident	42 Å²	42	47.7 Å²	47.7	43%	0.433	27%	0.265	S	S	.	.			trans	65.6	24	179	0	0	0	0	0	114.9	L467 V548	L467-G551 VanDerWaalsContact CD1-C 3.47Å; V548-G551 PolarHBondContact O-N 2.93Å
552	K	90.7	Very high	89.7	Confident	67 Å²	67	49 Å²	49	29%	0.291	27%	0.274	S	S	.	.			trans	-122.1	150.4	-173.5	-66.3	166	-178.1	-169.9	0	113	D550 G554 G563 L564 E747	D550-K552 VanDerWaalsContact C-N 3.3Å; D550-K552 HydrophobicContact CB-CD 4.48Å; D550-K552 WeakPolarHBondContact O-CG 3.4Å; D550-K552 PolarHBondContact O-N 3.33Å; D550-K552 PolarHBondContact OD1-N 2.95Å; D550-K552 VanDerWaalsContact OD1-N 3.16Å; K552-G554 VanDerWaalsContact C-N 3.35Å; K552-G563 WeakPolarHBondContact O-CA 3.34Å; K552-L564 PolarHBondContact O-N 3.37Å; K552-L564 VanDerWaalsContact O-N 3.16Å; K552-E747 WeakPolarHBondContact CD-OE2 3.44Å; K552-E747 IonicContact NZ-OE1 2.9Å; K552-E747 PolarHBondContact NZ-OE1 2.89Å; K552-E747 IonicContact NZ-OE2 3.45Å
553	Y	90.5	Very high	89.9	Confident	7 Å²	7	44.1 Å²	44.1	3%	0.027	25%	0.251	C	S	.	.			trans	-67.4	-35.7	172.9	-65.2	-86.2	0	0	0	113	L467 E469 L564 S579 F580 M792	L467-Y553 HydrophobicContact CD2-CD1 3.73Å; L467-Y553 HydrophobicContact CD2-CD2 3.94Å; L467-Y553 HydrophobicContact CD2-CE1 3.54Å; L467-Y553 HydrophobicContact CD2-CE2 3.71Å; L467-Y553 HydrophobicContact CD2-CG 3.94Å; E469-Y553 WeakPolarHBondContact CG-OH 3.34Å; E469-Y553 PolarHBondContact OE1-OH 3.44Å; Y553-L564 HydrophobicContact CD1-CD1 4.35Å; Y553-L564 WeakPolarHBondContact O-CB 3.46Å; Y553-L564 PolarHBondContact O-N 3.34Å; Y553-S579 WeakPolarHBondContact CE1-O 3.36Å; Y553-F580 HydrophobicContact CD1-CD2 4.48Å; Y553-M792 HydrophobicContact CE2-CE 4.33Å
554	G	89.1	Confident	90	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	25%	0.245	C	C	.	.			trans	113.9	123.7	178.2	0	0	0	0	0	113.5	K552 T562 R586	K552-G554 VanDerWaalsContact C-N 3.35Å; G554-T562 WeakPolarHBondContact CA-O 3.43Å; G554-R586 PolarHBondContact O-NE 3.34Å; G554-R586 PolarHBondContact O-NH2 3.49Å
555	A	89.2	Confident	90.1	Very high	4 Å²	4	41.1 Å²	41.1	3%	0.033	24%	0.237	C	C	.	.			trans	-134.8	157.8	178.1	0	0	0	0	0	110.2	K557 T562 E747	A555-K557 PolarHBondContact O-N 3.33Å; A555-T562 PolarHBondContact N-OG1 3.15Å; A555-T562 VanDerWaalsContact N-OG1 3.11Å; A555-T562 PolarHBondContact O-N 3.23Å; A555-T562 PolarHBondContact O-OG1 3.17Å; A555-E747 HydrophobicContact CB-CB 3.85Å; A555-E747 HydrophobicContact CB-CG 3.96Å
556	W	89.4	Confident	90.1	Very high	152 Å²	152	41.4 Å²	41.4	58%	0.576	24%	0.241	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-81.1	105.1	175.7	-177.3	-102.6	0	0	0	110.4	G559 W561	W556-G559 VanDerWaalsContact CH2-C 3.49Å; W556-G559 WeakPolarHBondContact CH2-O 3.05Å; W556-W561 HydrophobicContact CB-CD2 4.47Å; W556-W561 HydrophobicContact CB-CE3 4.38Å; W556-W561 HydrophobicContact CB-CH2 4.21Å; W556-W561 HydrophobicContact CB-CZ2 4.29Å; W556-W561 HydrophobicContact CB-CZ3 4.26Å; W556-W561 AromaticContact CE3-CD1 3.44Å; W556-W561 VanDerWaalsContact CE3-CD1 3.44Å; W556-W561 AromaticContact CE3-CD2 3.91Å; W556-W561 HydrophobicContact CE3-CD2 3.91Å; W556-W561 AromaticContact CE3-CE2 3.63Å; W556-W561 AromaticContact CE3-CG 3.8Å; W556-W561 HydrophobicContact CE3-CG 3.8Å; W556-W561 HydrophobicContact CE3-CZ2 4.36Å; W556-W561 AromaticContact CE3-NE1 3.31Å; W556-W561 VanDerWaalsContact CE3-NE1 3.31Å; W556-W561 AromaticContact CZ3-CD1 3.47Å; W556-W561 VanDerWaalsContact CZ3-CD1 3.47Å; W556-W561 HydrophobicContact CZ3-CG 4.19Å; W556-W561 AromaticContact CZ3-NE1 3.53Å
557	K	85.7	Confident	90	Very high	101 Å²	101	41.8 Å²	41.8	44%	0.439	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	135.9	177.9	-74.4	-171.2	180	174.1	0	111.2	A555 G559 R560 E747	A555-K557 PolarHBondContact O-N 3.33Å; K557-G559 PolarHBondContact O-N 2.87Å; K557-R560 PolarHBondContact N-O 3.19Å; K557-R560 VanDerWaalsContact N-O 3.08Å; K557-R560 PolarHBondContact O-N 3.17Å; K557-E747 HydrophobicContact CD-CG 4.21Å; K557-E747 VanDerWaalsContact NZ-CD 3.28Å; K557-E747 IonicContact NZ-OE1 2.72Å; K557-E747 PolarHBondContact NZ-OE1 2.86Å
558	G	83.3	Confident	90	Very high	92 Å²	92	41.5 Å²	41.5	95%	0.948	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.1	26.6	174.7	0	0	0	0	0	114.9	R560	G558-R560 VanDerWaalsContact C-N 3.34Å
559	G	86.3	Confident	89.9	Confident	56 Å²	56	45.2 Å²	45.2	58%	0.577	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.9	9.3	-179.5	0	0	0	0	0	115.2	W556 K557	W556-G559 VanDerWaalsContact CH2-C 3.49Å; W556-G559 WeakPolarHBondContact CH2-O 3.05Å; K557-G559 PolarHBondContact O-N 2.87Å
560	R	91.1	Very high	89.9	Confident	179 Å²	179	46.7 Å²	46.7	68%	0.675	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.6	156	176	-163.8	176.4	179.2	178.8	-0.9	110.8	K557 G558	K557-R560 PolarHBondContact N-O 3.19Å; K557-R560 VanDerWaalsContact N-O 3.08Å; K557-R560 PolarHBondContact O-N 3.17Å; G558-R560 VanDerWaalsContact C-N 3.34Å
561	W	91.6	Very high	89.9	Confident	32 Å²	32	45.9 Å²	45.9	12%	0.121	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	132.7	168.2	-73.4	101.2	0	0	0	110.7	W556 V565 G566 L569 A585 R586 V589	W556-W561 HydrophobicContact CB-CD2 4.47Å; W556-W561 HydrophobicContact CB-CE3 4.38Å; W556-W561 HydrophobicContact CB-CH2 4.21Å; W556-W561 HydrophobicContact CB-CZ2 4.29Å; W556-W561 HydrophobicContact CB-CZ3 4.26Å; W556-W561 AromaticContact CE3-CD1 3.44Å; W556-W561 VanDerWaalsContact CE3-CD1 3.44Å; W556-W561 AromaticContact CE3-CD2 3.91Å; W556-W561 HydrophobicContact CE3-CD2 3.91Å; W556-W561 AromaticContact CE3-CE2 3.63Å; W556-W561 AromaticContact CE3-CG 3.8Å; W556-W561 HydrophobicContact CE3-CG 3.8Å; W556-W561 HydrophobicContact CE3-CZ2 4.36Å; W556-W561 AromaticContact CE3-NE1 3.31Å; W556-W561 VanDerWaalsContact CE3-NE1 3.31Å; W556-W561 AromaticContact CZ3-CD1 3.47Å; W556-W561 VanDerWaalsContact CZ3-CD1 3.47Å; W556-W561 HydrophobicContact CZ3-CG 4.19Å; W556-W561 AromaticContact CZ3-NE1 3.53Å; W561-V565 HydrophobicContact CB-CB 4.27Å; W561-V565 HydrophobicContact CB-CG1 3.88Å; W561-V565 HydrophobicContact CD2-CB 4.39Å; W561-V565 HydrophobicContact CD2-CG1 3.63Å; W561-V565 HydrophobicContact CE3-CB 4.06Å; W561-V565 HydrophobicContact CE3-CG1 3.72Å; W561-V565 HydrophobicContact CE3-CG2 4.32Å; W561-V565 HydrophobicContact CG-CG1 3.71Å; W561-V565 HydrophobicContact CZ3-CG1 4.44Å; W561-G566 WeakPolarHBondContact O-CA 3.09Å; W561-L569 HydrophobicContact CB-CD1 3.97Å; W561-L569 HydrophobicContact CG-CD1 3.77Å; W561-A585 HydrophobicContact CH2-CB 4.33Å; W561-R586 HydrophobicContact CZ3-CG 4.39Å; W561-V589 HydrophobicContact CZ2-CG1 4.34Å; W561-V589 HydrophobicContact CZ2-CG2 3.93Å
562	T	91.6	Very high	89.8	Confident	34 Å²	34	44.4 Å²	44.4	21%	0.209	25%	0.253	C	S	.	.			trans	-93	177.2	171.5	56.9	0	0	0	0	111.1	G554 A555 G566 E747	G554-T562 WeakPolarHBondContact CA-O 3.43Å; A555-T562 PolarHBondContact N-OG1 3.15Å; A555-T562 VanDerWaalsContact N-OG1 3.11Å; A555-T562 PolarHBondContact O-N 3.23Å; A555-T562 PolarHBondContact O-OG1 3.17Å; T562-G566 PolarHBondContact O-N 3.2Å; T562-G566 VanDerWaalsContact O-N 3.13Å; T562-E747 PolarHBondContact OG1-OE2 3.2Å
563	G	91.6	Very high	89.8	Confident	2 Å²	2	41.2 Å²	41.2	2%	0.021	24%	0.24	C	C	.	.	H	α-helix	trans	63.7	-154.6	168.6	0	0	0	0	0	115.7	D550 K552 V565 G566 D567	D550-G563 VanDerWaalsContact OD1-CA 3.31Å; D550-G563 WeakPolarHBondContact OD1-CA 3.38Å; D550-G563 WeakPolarHBondContact OD2-CA 3.35Å; D550-G563 PolarHBondContact OD2-N 3.34Å; K552-G563 WeakPolarHBondContact O-CA 3.34Å; G563-V565 PolarHBondContact O-N 3.01Å; G563-G566 WeakPolarHBondContact O-CA 3.49Å; G563-G566 PolarHBondContact O-N 3.09Å; G563-D567 PolarHBondContact O-N 2.76Å; G563-D567 VanDerWaalsContact O-N 3.1Å
564	L	93.6	Very high	89.8	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-52.6	-39.5	178.5	-56.9	167	0	0	0	112.6	V465 L467 V548 K552 Y553 G566 D567 L568 T578 F580	V465-L564 HydrophobicContact CB-CD2 4.43Å; V465-L564 HydrophobicContact CG1-CD2 3.97Å; V465-L564 HydrophobicContact CG2-CD2 3.73Å; L467-L564 HydrophobicContact CB-CD1 4.23Å; L467-L564 HydrophobicContact CB-CD2 4.4Å; V548-L564 HydrophobicContact CB-CD2 3.82Å; V548-L564 HydrophobicContact CG1-CD2 4.02Å; V548-L564 HydrophobicContact CG2-CD2 4.2Å; K552-L564 PolarHBondContact O-N 3.37Å; K552-L564 VanDerWaalsContact O-N 3.16Å; Y553-L564 HydrophobicContact CD1-CD1 4.35Å; Y553-L564 WeakPolarHBondContact O-CB 3.46Å; Y553-L564 PolarHBondContact O-N 3.34Å; L564-G566 VanDerWaalsContact C-N 3.35Å; L564-D567 PolarHBondContact O-N 2.61Å; L564-L568 WeakPolarHBondContact O-CG 3.34Å; L564-L568 PolarHBondContact O-N 3.37Å; L564-T578 HydrophobicContact CD1-CG2 3.49Å; L564-T578 VanDerWaalsContact CD1-CG2 3.49Å; L564-F580 HydrophobicContact CD1-CD2 4.27Å
565	V	94.1	Very high	90.1	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-63.5	-41.9	176.8	-176.3	0	0	0	0	111	W561 G563 D567 L568 L569 F580 R586 V589 I590	W561-V565 HydrophobicContact CB-CB 4.27Å; W561-V565 HydrophobicContact CB-CG1 3.88Å; W561-V565 HydrophobicContact CD2-CB 4.39Å; W561-V565 HydrophobicContact CD2-CG1 3.63Å; W561-V565 HydrophobicContact CE3-CB 4.06Å; W561-V565 HydrophobicContact CE3-CG1 3.72Å; W561-V565 HydrophobicContact CE3-CG2 4.32Å; W561-V565 HydrophobicContact CG-CG1 3.71Å; W561-V565 HydrophobicContact CZ3-CG1 4.44Å; G563-V565 PolarHBondContact O-N 3.01Å; V565-D567 VanDerWaalsContact C-N 3.34Å; V565-L568 PolarHBondContact O-N 3.16Å; V565-L569 HydrophobicContact CG1-CD1 3.91Å; V565-L569 HydrophobicContact CG1-CG 4.36Å; V565-L569 WeakPolarHBondContact O-CB 3.45Å; V565-L569 VanDerWaalsContact O-CG 3.27Å; V565-L569 WeakPolarHBondContact O-CG 3.28Å; V565-L569 PolarHBondContact O-N 3Å; V565-F580 HydrophobicContact CG2-CE2 4.22Å; V565-F580 HydrophobicContact CG2-CZ 3.72Å; V565-R586 HydrophobicContact CG2-CG 4.15Å; V565-V589 HydrophobicContact CG1-CG2 3.94Å; V565-I590 HydrophobicContact CG1-CG2 4.35Å; V565-I590 HydrophobicContact CG2-CD1 4.28Å
566	G	91.8	Very high	90.4	Very high	9 Å²	9	41.3 Å²	41.3	9%	0.093	24%	0.24	C	C	.	.	H	α-helix	trans	-62.4	-40.1	176.8	0	0	0	0	0	112.8	W561 T562 G563 L564 L569 S570	W561-G566 WeakPolarHBondContact O-CA 3.09Å; T562-G566 PolarHBondContact O-N 3.2Å; T562-G566 VanDerWaalsContact O-N 3.13Å; G563-G566 WeakPolarHBondContact O-CA 3.49Å; G563-G566 PolarHBondContact O-N 3.09Å; L564-G566 VanDerWaalsContact C-N 3.35Å; G566-L569 PolarHBondContact O-N 3.29Å; G566-S570 WeakPolarHBondContact O-CB 3.34Å; G566-S570 PolarHBondContact O-N 3.33Å; G566-S570 PolarHBondContact O-OG 3.21Å
567	D	91.6	Very high	90.8	Very high	10 Å²	10	34.2 Å²	34.2	5%	0.053	21%	0.213	C	C	.	.	H	α-helix	trans	-68	-40.6	178.6	-84.5	23	0	0	0	112.7	Y546 G563 L564 V565 S570 G571 L572 A573	Y546-D567 WeakPolarHBondContact CE2-OD2 3.27Å; Y546-D567 PolarHBondContact OH-OD2 2.04Å; G563-D567 PolarHBondContact O-N 2.76Å; G563-D567 VanDerWaalsContact O-N 3.1Å; L564-D567 PolarHBondContact O-N 2.61Å; V565-D567 VanDerWaalsContact C-N 3.34Å; D567-S570 WeakPolarHBondContact CA-OG 3.41Å; D567-S570 PolarHBondContact O-OG 2.96Å; D567-S570 VanDerWaalsContact O-OG 3.13Å; D567-G571 PolarHBondContact O-N 2.95Å; D567-L572 HydrophobicContact CB-CB 4.22Å; D567-L572 WeakPolarHBondContact O-CB 3.42Å; D567-L572 PolarHBondContact O-N 2.8Å; D567-L572 WeakPolarHBondContact OD1-CD1 3.32Å; D567-A573 PolarHBondContact O-N 2.82Å
568	L	92.5	Very high	91.2	Very high	4 Å²	4	29.4 Å²	29.4	2%	0.021	19%	0.193	C	C	.	.	H	α-helix	trans	-65.2	-45.1	174.2	-70.9	174	0	0	0	111.9	L564 V565 S570 G571 A573 A576 I590 P826	L564-L568 WeakPolarHBondContact O-CG 3.34Å; L564-L568 PolarHBondContact O-N 3.37Å; V565-L568 PolarHBondContact O-N 3.16Å; L568-S570 VanDerWaalsContact C-N 3.32Å; L568-S570 PolarHBondContact O-N 3.43Å; L568-G571 PolarHBondContact O-N 3.45Å; L568-A573 HydrophobicContact CD2-CB 4.16Å; L568-A576 HydrophobicContact CD1-CB 3.78Å; L568-A576 HydrophobicContact CD2-CB 4.12Å; L568-A576 HydrophobicContact CG-CB 4.11Å; L568-I590 HydrophobicContact CB-CG2 4.14Å; L568-I590 HydrophobicContact CD1-CD1 4.04Å; L568-I590 HydrophobicContact CD1-CG2 4.18Å; L568-P826 HydrophobicContact CD2-CG 4.46Å
569	L	91.8	Very high	91.7	Very high	82 Å²	82	25 Å²	25	43%	0.429	15%	0.148	S	C	.	.	H	α-helix	trans	-69	-29.4	-178.8	-72.6	177	0	0	0	113.4	W561 V565 G566 G571 V589 I590	W561-L569 HydrophobicContact CB-CD1 3.97Å; W561-L569 HydrophobicContact CG-CD1 3.77Å; V565-L569 HydrophobicContact CG1-CD1 3.91Å; V565-L569 HydrophobicContact CG1-CG 4.36Å; V565-L569 WeakPolarHBondContact O-CB 3.45Å; V565-L569 VanDerWaalsContact O-CG 3.27Å; V565-L569 WeakPolarHBondContact O-CG 3.28Å; V565-L569 PolarHBondContact O-N 3Å; G566-L569 PolarHBondContact O-N 3.29Å; L569-G571 VanDerWaalsContact C-N 3.27Å; L569-V589 HydrophobicContact CD1-CB 4.38Å; L569-V589 HydrophobicContact CD1-CG2 4.4Å; L569-V589 HydrophobicContact CD2-CB 4.31Å; L569-V589 WeakPolarHBondContact CD2-O 3.42Å; L569-I590 HydrophobicContact CD2-CG2 4.18Å; L569-I590 HydrophobicContact CG-CG2 4.31Å
570	S	87.5	Confident	92	Very high	55 Å²	55	22.4 Å²	22.4	39%	0.385	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-3.9	177.1	55.9	0	0	0	0	113.5	G566 D567 L568 L572	G566-S570 WeakPolarHBondContact O-CB 3.34Å; G566-S570 PolarHBondContact O-N 3.33Å; G566-S570 PolarHBondContact O-OG 3.21Å; D567-S570 WeakPolarHBondContact CA-OG 3.41Å; D567-S570 PolarHBondContact O-OG 2.96Å; D567-S570 VanDerWaalsContact O-OG 3.13Å; L568-S570 VanDerWaalsContact C-N 3.32Å; L568-S570 PolarHBondContact O-N 3.43Å; S570-L572 PolarHBondContact O-N 2.92Å; S570-L572 VanDerWaalsContact OG-CD1 3.31Å; S570-L572 WeakPolarHBondContact OG-CD1 3.44Å; S570-L572 VanDerWaalsContact OG-CG 3.27Å; S570-L572 WeakPolarHBondContact OG-CG 3.36Å
571	G	86.4	Confident	92.2	Very high	36 Å²	36	13.9 Å²	13.9	37%	0.371	9%	0.088	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.4	17.2	-175.4	0	0	0	0	0	113.4	R450 D567 L568 L569	R450-G571 PolarHBondContact NH2-O 3.03Å; D567-G571 PolarHBondContact O-N 2.95Å; L568-G571 PolarHBondContact O-N 3.45Å; L569-G571 VanDerWaalsContact C-N 3.27Å
572	L	86.4	Confident	92.2	Very high	10 Å²	10	14.5 Å²	14.5	5%	0.052	9%	0.093	C	C	.	.	S	Bend	trans	-66.3	-46.2	173.3	-74.4	172.7	0	0	0	110.1	R463 L501 D567 S570	R463-L572 VanDerWaalsContact CD-O 3.27Å; R463-L572 WeakPolarHBondContact CD-O 3.12Å; R463-L572 PolarHBondContact NH1-O 2.79Å; L501-L572 HydrophobicContact CD1-CD2 4.42Å; D567-L572 HydrophobicContact CB-CB 4.22Å; D567-L572 WeakPolarHBondContact O-CB 3.42Å; D567-L572 PolarHBondContact O-N 2.8Å; D567-L572 WeakPolarHBondContact OD1-CD1 3.32Å; S570-L572 PolarHBondContact O-N 2.92Å; S570-L572 VanDerWaalsContact OG-CD1 3.31Å; S570-L572 WeakPolarHBondContact OG-CD1 3.44Å; S570-L572 VanDerWaalsContact OG-CG 3.27Å; S570-L572 WeakPolarHBondContact OG-CG 3.36Å
573	A	90.8	Very high	92.1	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	9%	0.088	C	C	.	.			trans	-112.5	148.6	174.6	0	0	0	0	0	111.8	V465 Y546 D567 L568	V465-A573 HydrophobicContact CB-CB 3.73Å; V465-A573 HydrophobicContact CG1-CB 3.53Å; Y546-A573 HydrophobicContact CE1-CB 4.14Å; Y546-A573 WeakPolarHBondContact OH-CB 3.29Å; D567-A573 PolarHBondContact O-N 2.82Å; L568-A573 HydrophobicContact CD2-CB 4.16Å
574	D	91.7	Very high	91.9	Very high	13 Å²	13	17.2 Å²	17.2	7%	0.07	11%	0.112	C	C	.	.	S	Bend	trans	-94.7	-19.4	175.1	-53.7	-45.9	0	0	0	110.9	R450 W451 V462 R463 P826	R450-D574 IonicContact CZ-OD1 2.91Å; R450-D574 IonicContact CZ-OD2 2.75Å; R450-D574 IonicContact NE-OD1 3.49Å; R450-D574 IonicContact NE-OD2 3.36Å; R450-D574 PolarHBondContact NE-OD2 3.06Å; R450-D574 IonicContact NH2-OD1 2.89Å; R450-D574 PolarHBondContact NH2-OD1 3.29Å; R450-D574 IonicContact NH2-OD2 3.2Å; W451-D574 HydrophobicContact CE3-CB 4.08Å; W451-D574 HydrophobicContact CZ3-CB 4.29Å; V462-D574 HydrophobicContact CG1-CB 3.89Å; R463-D574 PolarHBondContact N-OD2 3.24Å; R463-D574 VanDerWaalsContact N-OD2 3.11Å; R463-D574 PolarHBondContact O-N 2.73Å; D574-P826 WeakPolarHBondContact O-CD 3.47Å
575	M	94.2	Very high	91.7	Very high	1 Å²	1	18.4 Å²	18.4	1%	0.005	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	145.6	178.9	-175.4	-173.4	-59.3	0	0	110.8	V462 R463 V464 V465 L532 V577 I823 G824 L825 L831 L835	V462-M575 HydrophobicContact CG1-CB 4.36Å; V462-M575 HydrophobicContact CG1-CE 4.46Å; R463-M575 PolarHBondContact O-N 3.31Å; V464-M575 CarbonylContact C-O 3.56Å; V464-M575 VanDerWaalsContact CA-O 3.32Å; V464-M575 WeakPolarHBondContact CA-O 3.24Å; V464-M575 HydrophobicContact CG2-CB 4.33Å; V464-M575 HydrophobicContact CG2-SD 4.47Å; V465-M575 PolarHBondContact N-O 3.32Å; L532-M575 HydrophobicContact CD1-SD 4.31Å; M575-V577 HydrophobicContact CG-CG2 3.77Å; M575-V577 HydrophobicContact SD-CG2 3.55Å; M575-V577 VanDerWaalsContact SD-CG2 3.55Å; M575-I823 HydrophobicContact CG-CG2 3.37Å; M575-I823 HydrophobicContact SD-CG2 3.71Å; M575-G824 CarbonylContact C-O 3.56Å; M575-G824 WeakPolarHBondContact CA-O 3.34Å; M575-L825 HydrophobicContact CB-CD2 4.1Å; M575-L825 HydrophobicContact CE-CD2 4.26Å; M575-L825 HydrophobicContact CG-CD2 3.9Å; M575-L831 HydrophobicContact CE-CD1 4.49Å; M575-L835 HydrophobicContact CE-CD1 3.47Å; M575-L835 VanDerWaalsContact CE-CD1 3.47Å; M575-L835 HydrophobicContact CE-CD2 4.37Å; M575-L835 HydrophobicContact SD-CD1 4.45Å
576	A	96.1	Very high	91.6	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	121.4	172.5	0	0	0	0	0	110.8	V465 L568 G824	V465-A576 HydrophobicContact CG1-CB 3.54Å; V465-A576 WeakPolarHBondContact O-CA 3.43Å; L568-A576 HydrophobicContact CD1-CB 3.78Å; L568-A576 HydrophobicContact CD2-CB 4.12Å; L568-A576 HydrophobicContact CG-CB 4.11Å; A576-G824 PolarHBondContact N-O 3.17Å; A576-G824 PolarHBondContact O-N 3.06Å
577	V	96.5	Very high	91.6	Very high	2 Å²	2	20.6 Å²	20.6	1%	0.012	14%	0.135	C	C	.	.			trans	-127.1	110.1	-176.7	-170.9	0	0	0	0	109.7	V464 V465 T466 C528 L532 M575 I823	V464-V577 HydrophobicContact CG1-CB 4.05Å; V464-V577 HydrophobicContact CG1-CG2 3.69Å; V465-V577 PolarHBondContact O-N 3.46Å; T466-V577 WeakPolarHBondContact CB-O 3.26Å; T466-V577 PolarHBondContact OG1-O 3.48Å; C528-V577 HydrophobicContact CB-CG1 4Å; L532-V577 HydrophobicContact CD1-CG2 4.34Å; M575-V577 HydrophobicContact CG-CG2 3.77Å; M575-V577 HydrophobicContact SD-CG2 3.55Å; M575-V577 VanDerWaalsContact SD-CG2 3.55Å; V577-I823 HydrophobicContact CG1-CG1 4.49Å; V577-I823 HydrophobicContact CG2-CD1 4.42Å; V577-I823 HydrophobicContact CG2-CG1 4.35Å; V577-I823 HydrophobicContact CG2-CG2 3.98Å
578	T	94.9	Very high	91.6	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.006	17%	0.166	C	C	.	.	S	Bend	trans	-169.8	-167.8	175.8	-174.4	0	0	0	0	108.5	L467 C528 L564 F580	L467-T578 HydrophobicContact CB-CG2 4.09Å; L467-T578 PolarHBondContact O-OG1 3.36Å; C528-T578 VanDerWaalsContact SG-C 3.58Å; L564-T578 HydrophobicContact CD1-CG2 3.49Å; L564-T578 VanDerWaalsContact CD1-CG2 3.49Å; T578-F580 HydrophobicContact CG2-CB 3.98Å; T578-F580 PolarHBondContact O-N 3.34Å
579	S	93.3	Very high	91.6	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.174	C	C	.	.	S	Bend	trans	-68.9	60.6	169.4	50.8	0	0	0	0	112	Y553 S581	Y553-S579 WeakPolarHBondContact CE1-O 3.36Å; S579-S581 PolarHBondContact O-N 2.88Å
580	F	94.1	Very high	91.7	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.154	C	C	.	.			trans	-95.3	103.2	-170	-167.6	-152.1	0	0	0	111.9	Y553 L564 V565 T578 I590 F592 Y821 G822	Y553-F580 HydrophobicContact CD1-CD2 4.48Å; L564-F580 HydrophobicContact CD1-CD2 4.27Å; V565-F580 HydrophobicContact CG2-CE2 4.22Å; V565-F580 HydrophobicContact CG2-CZ 3.72Å; T578-F580 HydrophobicContact CG2-CB 3.98Å; T578-F580 PolarHBondContact O-N 3.34Å; F580-I590 HydrophobicContact CE1-CD1 3.45Å; F580-I590 VanDerWaalsContact CE1-CD1 3.45Å; F580-I590 HydrophobicContact CZ-CD1 3.57Å; F580-F592 HydrophobicContact CD1-CD1 4.38Å; F580-F592 AromaticContact CD1-CE1 3.39Å; F580-F592 HydrophobicContact CD1-CE1 3.39Å; F580-F592 AromaticContact CD1-CZ 3.95Å; F580-F592 HydrophobicContact CD1-CZ 3.95Å; F580-F592 AromaticContact CE1-CE1 3.5Å; F580-F592 HydrophobicContact CE1-CE1 3.5Å; F580-F592 AromaticContact CE1-CZ 3.6Å; F580-F592 HydrophobicContact CE1-CZ 3.6Å; F580-F592 HydrophobicContact CE2-CZ 4.46Å; F580-F592 AromaticContact CG-CE1 3.98Å; F580-F592 HydrophobicContact CG-CE1 3.98Å; F580-F592 HydrophobicContact CZ-CE1 4.19Å; F580-F592 AromaticContact CZ-CZ 3.88Å; F580-F592 HydrophobicContact CZ-CZ 3.88Å; F580-Y821 WeakPolarHBondContact O-CA 3.28Å; F580-G822 PolarHBondContact O-N 3.38Å; F580-G822 VanDerWaalsContact O-N 3.09Å
581	S	93.5	Very high	92.1	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	15%	0.145	C	C	.	.	B	Isolated β-bridge	trans	-72.2	129.4	-174.8	-22.1	0	0	0	0	113.1	S579 N583 R586 S749 D793 E819 Y821	S579-S581 PolarHBondContact O-N 2.88Å; S581-N583 PolarHBondContact O-N 2.85Å; S581-R586 PolarHBondContact O-NH1 3.44Å; S581-S749 PolarHBondContact OG-OG 2.95Å; S581-D793 PolarHBondContact OG-OD2 2.93Å; S581-E819 WeakPolarHBondContact CB-OE2 3.39Å; S581-Y821 WeakPolarHBondContact OG-CE1 3.4Å
582	I	93.4	Very high	92.5	Very high	46 Å²	46	25.1 Å²	25.1	24%	0.236	13%	0.133	C	C	.	.			trans	-74.6	115	178.1	-57.9	166.7	0	0	0	109	F592 P595 G820	I582-F592 HydrophobicContact CD1-CB 4.36Å; I582-F592 HydrophobicContact CG1-CB 4.1Å; I582-F592 HydrophobicContact CG1-CD1 3.69Å; I582-F592 HydrophobicContact CG1-CD2 4.48Å; I582-F592 HydrophobicContact CG1-CE1 4.13Å; I582-F592 HydrophobicContact CG1-CG 3.86Å; I582-F592 HydrophobicContact CG2-CD2 4.23Å; I582-F592 HydrophobicContact CG2-CG 4.32Å; I582-P595 HydrophobicContact CD1-CB 4.01Å; I582-G820 VanDerWaalsContact CG1-O 3.27Å; I582-G820 WeakPolarHBondContact CG1-O 3.4Å; I582-G820 PolarHBondContact N-O 3.28Å
583	N	89.1	Confident	93	Very high	19 Å²	19	24.9 Å²	24.9	10%	0.102	13%	0.132	C	C	.	.			trans	-131.7	143.9	-179.1	179.1	-21.8	0	0	0	110.5	S581 A585 R586 S587	S581-N583 PolarHBondContact O-N 2.85Å; N583-A585 PolarHBondContact O-N 3.47Å; N583-A585 PolarHBondContact OD1-N 3.15Å; N583-R586 PolarHBondContact O-N 2.86Å; N583-S587 PolarHBondContact O-N 3.39Å; N583-S587 PolarHBondContact O-OG 3.11Å; N583-S587 VanDerWaalsContact O-OG 3.08Å
584	S	87.7	Confident	93.2	Very high	74 Å²	74	26.3 Å²	26.3	52%	0.517	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.3	-35.4	174.9	-175.2	0	0	0	0	114.6	R588	S584-R588 VanDerWaalsContact O-CG 3.31Å; S584-R588 WeakPolarHBondContact O-CG 3.33Å
585	A	88.1	Confident	93.3	Very high	25 Å²	25	28.7 Å²	28.7	21%	0.207	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-37.6	178.1	0	0	0	0	0	112.8	W561 N583	W561-A585 HydrophobicContact CH2-CB 4.33Å; N583-A585 PolarHBondContact O-N 3.47Å; N583-A585 PolarHBondContact OD1-N 3.15Å
586	R	91.6	Very high	93.4	Very high	1 Å²	1	29.1 Å²	29.1	0%	0.004	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-42	-179.2	-65.3	179.1	178.1	158.2	-1.3	111.1	G554 W561 V565 S581 N583 R588 V589 I590 F592	G554-R586 PolarHBondContact O-NE 3.34Å; G554-R586 PolarHBondContact O-NH2 3.49Å; W561-R586 HydrophobicContact CZ3-CG 4.39Å; V565-R586 HydrophobicContact CG2-CG 4.15Å; S581-R586 PolarHBondContact O-NH1 3.44Å; N583-R586 PolarHBondContact O-N 2.86Å; R586-R588 PolarHBondContact O-N 3.46Å; R586-V589 VanDerWaalsContact O-CG2 3.24Å; R586-V589 WeakPolarHBondContact O-CG2 2.93Å; R586-V589 PolarHBondContact O-N 3.14Å; R586-I590 HydrophobicContact CB-CD1 4.41Å; R586-I590 HydrophobicContact CB-CG1 4.37Å; R586-I590 WeakPolarHBondContact O-CG1 3.44Å; R586-I590 PolarHBondContact O-N 2.86Å; R586-F592 HydrophobicContact CB-CE2 3.87Å; R586-F592 HydrophobicContact CB-CZ 4.07Å
587	S	91.6	Very high	93.3	Very high	53 Å²	53	30.3 Å²	30.3	37%	0.371	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-9.2	177.8	-52.3	0	0	0	0	114.6	N583 I590	N583-S587 PolarHBondContact O-N 3.39Å; N583-S587 PolarHBondContact O-OG 3.11Å; N583-S587 VanDerWaalsContact O-OG 3.08Å; S587-I590 CarbonylContact C-O 3.36Å; S587-I590 WeakPolarHBondContact CA-O 3.42Å
588	R	92.3	Very high	93.1	Very high	184 Å²	184	34.6 Å²	34.6	69%	0.694	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-23	172.2	-75.5	172.8	-170.9	-162.8	0.8	113.4	S584 R586 Q827	S584-R588 VanDerWaalsContact O-CG 3.31Å; S584-R588 WeakPolarHBondContact O-CG 3.33Å; R586-R588 PolarHBondContact O-N 3.46Å; R588-Q827 PolarHBondContact O-NE2 2.91Å
589	V	92.6	Very high	93	Very high	33 Å²	33	34.9 Å²	34.9	20%	0.2	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.1	-20.6	-171.7	-62.4	0	0	0	0	113	W561 V565 L569 R586	W561-V589 HydrophobicContact CZ2-CG1 4.34Å; W561-V589 HydrophobicContact CZ2-CG2 3.93Å; V565-V589 HydrophobicContact CG1-CG2 3.94Å; L569-V589 HydrophobicContact CD1-CB 4.38Å; L569-V589 HydrophobicContact CD1-CG2 4.4Å; L569-V589 HydrophobicContact CD2-CB 4.31Å; L569-V589 WeakPolarHBondContact CD2-O 3.42Å; R586-V589 VanDerWaalsContact O-CG2 3.24Å; R586-V589 WeakPolarHBondContact O-CG2 2.93Å; R586-V589 PolarHBondContact O-N 3.14Å
590	I	94.6	Very high	92.9	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.005	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	156.4	176.1	56.5	163.4	0	0	0	109.6	V565 L568 L569 F580 R586 S587 F592 L825	V565-I590 HydrophobicContact CG1-CG2 4.35Å; V565-I590 HydrophobicContact CG2-CD1 4.28Å; L568-I590 HydrophobicContact CB-CG2 4.14Å; L568-I590 HydrophobicContact CD1-CD1 4.04Å; L568-I590 HydrophobicContact CD1-CG2 4.18Å; L569-I590 HydrophobicContact CD2-CG2 4.18Å; L569-I590 HydrophobicContact CG-CG2 4.31Å; F580-I590 HydrophobicContact CE1-CD1 3.45Å; F580-I590 VanDerWaalsContact CE1-CD1 3.45Å; F580-I590 HydrophobicContact CZ-CD1 3.57Å; R586-I590 HydrophobicContact CB-CD1 4.41Å; R586-I590 HydrophobicContact CB-CG1 4.37Å; R586-I590 WeakPolarHBondContact O-CG1 3.44Å; R586-I590 PolarHBondContact O-N 2.86Å; S587-I590 CarbonylContact C-O 3.36Å; S587-I590 WeakPolarHBondContact CA-O 3.42Å; I590-F592 HydrophobicContact CD1-CE1 4.41Å; I590-F592 HydrophobicContact CD1-CE2 3.76Å; I590-F592 HydrophobicContact CD1-CZ 3.67Å; I590-F592 HydrophobicContact CG1-CE2 3.88Å; I590-F592 HydrophobicContact CG1-CZ 4.32Å; I590-L825 WeakPolarHBondContact CB-O 3.26Å
591	D	94.8	Very high	92.9	Very high	38 Å²	38	35.5 Å²	35.5	20%	0.203	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	150.4	175.6	-69.2	-9.3	0	0	0	110.1	L825 N828 S829	D591-L825 HydrophobicContact CB-CB 4.38Å; D591-L825 PolarHBondContact N-O 3.48Å; D591-L825 PolarHBondContact O-N 3.12Å; D591-N828 VanDerWaalsContact OD2-CA 3.3Å; D591-N828 WeakPolarHBondContact OD2-CA 3.46Å; D591-N828 PolarHBondContact OD2-N 3.05Å; D591-S829 PolarHBondContact OD2-N 3.4Å
592	F	96.1	Very high	92.9	Very high	26 Å²	26	35.8 Å²	35.8	11%	0.114	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	148	175.2	-76	-87.4	0	0	0	110.2	F580 I582 R586 I590 I823	F580-F592 HydrophobicContact CD1-CD1 4.38Å; F580-F592 AromaticContact CD1-CE1 3.39Å; F580-F592 HydrophobicContact CD1-CE1 3.39Å; F580-F592 AromaticContact CD1-CZ 3.95Å; F580-F592 HydrophobicContact CD1-CZ 3.95Å; F580-F592 AromaticContact CE1-CE1 3.5Å; F580-F592 HydrophobicContact CE1-CE1 3.5Å; F580-F592 AromaticContact CE1-CZ 3.6Å; F580-F592 HydrophobicContact CE1-CZ 3.6Å; F580-F592 HydrophobicContact CE2-CZ 4.46Å; F580-F592 AromaticContact CG-CE1 3.98Å; F580-F592 HydrophobicContact CG-CE1 3.98Å; F580-F592 HydrophobicContact CZ-CE1 4.19Å; F580-F592 AromaticContact CZ-CZ 3.88Å; F580-F592 HydrophobicContact CZ-CZ 3.88Å; I582-F592 HydrophobicContact CD1-CB 4.36Å; I582-F592 HydrophobicContact CG1-CB 4.1Å; I582-F592 HydrophobicContact CG1-CD1 3.69Å; I582-F592 HydrophobicContact CG1-CD2 4.48Å; I582-F592 HydrophobicContact CG1-CE1 4.13Å; I582-F592 HydrophobicContact CG1-CG 3.86Å; I582-F592 HydrophobicContact CG2-CD2 4.23Å; I582-F592 HydrophobicContact CG2-CG 4.32Å; R586-F592 HydrophobicContact CB-CE2 3.87Å; R586-F592 HydrophobicContact CB-CZ 4.07Å; I590-F592 HydrophobicContact CD1-CE1 4.41Å; I590-F592 HydrophobicContact CD1-CE2 3.76Å; I590-F592 HydrophobicContact CD1-CZ 3.67Å; I590-F592 HydrophobicContact CG1-CE2 3.88Å; I590-F592 HydrophobicContact CG1-CZ 4.32Å; F592-I823 WeakPolarHBondContact CA-O 3.49Å
593	T	95.8	Very high	92.9	Very high	6 Å²	6	33.6 Å²	33.6	4%	0.037	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-71.9	173.5	167	64.6	0	0	0	0	111.9	I823 L825 L835 S836 I839	T593-I823 HydrophobicContact CG2-CB 3.74Å; T593-I823 HydrophobicContact CG2-CG2 4.34Å; T593-I823 PolarHBondContact N-O 3.31Å; T593-I823 VanDerWaalsContact N-O 3.08Å; T593-I823 PolarHBondContact OG1-N 3.32Å; T593-L825 HydrophobicContact CG2-CD1 4.07Å; T593-L835 HydrophobicContact CG2-CB 3.69Å; T593-L835 HydrophobicContact CG2-CD1 4.4Å; T593-S836 VanDerWaalsContact CA-OG 3.23Å; T593-S836 WeakPolarHBondContact CA-OG 3.15Å; T593-I839 HydrophobicContact CG2-CD1 4.17Å; T593-I839 VanDerWaalsContact OG1-CD1 3.26Å; T593-I839 WeakPolarHBondContact OG1-CD1 3.24Å
594	S	94.3	Very high	93	Very high	29 Å²	29	32.7 Å²	32.7	20%	0.203	19%	0.189	C	C	.	.	S	Bend	trans	-52.3	142	162.7	60.9	0	0	0	0	110.6	F596 S836 I839	S594-F596 PolarHBondContact O-N 3.08Å; S594-S836 PolarHBondContact N-OG 3.39Å; S594-S836 WeakPolarHBondContact OG-CA 3.35Å; S594-S836 PolarHBondContact OG-O 3.22Å; S594-I839 WeakPolarHBondContact OG-CG2 3.48Å
595	P	95.4	Very high	93.1	Very high	63 Å²	63	29.6 Å²	29.6	41%	0.409	17%	0.166	S	C	.	.	P	Polyproline II helix	trans	-68.3	120	-175.9	25.9	-33.2	0	0	0	110.4	I582 Y821	I582-P595 HydrophobicContact CD1-CB 4.01Å; P595-Y821 CarbonylContact C-O 3.55Å; P595-Y821 WeakPolarHBondContact CA-O 3.41Å
596	F	94.8	Very high	93.1	Very high	11 Å²	11	31.5 Å²	31.5	5%	0.048	17%	0.168	C	C	.	.	S	Bend	trans	-82.1	-25.2	178.3	67.4	-100.1	0	0	0	112	F472 Y527 L531 S594 Y821 I823 I839 M848	F472-F596 HydrophobicContact CE1-CE2 4.41Å; Y527-F596 HydrophobicContact CD1-CE2 4.14Å; Y527-F596 AromaticContact CE1-CD2 3.7Å; Y527-F596 HydrophobicContact CE1-CD2 3.7Å; Y527-F596 AromaticContact CE1-CE2 3.75Å; Y527-F596 HydrophobicContact CE1-CE2 3.75Å; L531-F596 HydrophobicContact CD2-CB 4.13Å; L531-F596 HydrophobicContact CD2-CD1 4.2Å; L531-F596 HydrophobicContact CD2-CD2 3.99Å; L531-F596 HydrophobicContact CD2-CE2 4.47Å; L531-F596 HydrophobicContact CD2-CG 3.85Å; S594-F596 PolarHBondContact O-N 3.08Å; F596-Y821 WeakPolarHBondContact CD1-O 3.45Å; F596-Y821 PolarHBondContact N-O 2.96Å; F596-I823 HydrophobicContact CD1-CG1 4.4Å; F596-I823 HydrophobicContact CE1-CG1 4.45Å; F596-I839 HydrophobicContact CB-CG2 3.77Å; F596-M848 HydrophobicContact CB-CE 3.82Å; F596-M848 HydrophobicContact CB-SD 4.29Å
597	F	94.4	Very high	92.5	Very high	24 Å²	24	32.7 Å²	32.7	11%	0.105	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	138.5	179	-162.1	-81.9	0	0	0	110.1	F472 Y527 A795 G820 Y821 H852 Y856	F472-F597 HydrophobicContact CE1-CD2 4.03Å; F472-F597 HydrophobicContact CE1-CE2 4.32Å; F472-F597 HydrophobicContact CE1-CG 4.2Å; F472-F597 HydrophobicContact CZ-CD1 4.25Å; F472-F597 HydrophobicContact CZ-CD2 4.21Å; F472-F597 HydrophobicContact CZ-CE1 4.28Å; F472-F597 HydrophobicContact CZ-CE2 4.19Å; F472-F597 HydrophobicContact CZ-CG 4.23Å; F472-F597 HydrophobicContact CZ-CZ 4.23Å; Y527-F597 HydrophobicContact CE1-CD2 4.45Å; Y527-F597 HydrophobicContact CE2-CD2 4.36Å; F597-A795 HydrophobicContact CD1-CB 4.35Å; F597-A795 HydrophobicContact CE1-CB 3.52Å; F597-A795 HydrophobicContact CZ-CB 4.09Å; F597-G820 CarbonylContact O-C 3.56Å; F597-G820 WeakPolarHBondContact O-CA 3.48Å; F597-Y821 HydrophobicContact CB-CD2 3.82Å; F597-Y821 HydrophobicContact CB-CG 4.37Å; F597-Y821 AromaticContact CD1-CD2 3.87Å; F597-Y821 HydrophobicContact CD1-CD2 3.87Å; F597-Y821 HydrophobicContact CD1-CE2 4.01Å; F597-Y821 HydrophobicContact CG-CD2 4.06Å; F597-Y821 PolarHBondContact O-N 3.24Å; F597-H852 AromaticContact CE2-ND1 3.57Å; F597-H852 AromaticContact CZ-ND1 3.99Å; F597-Y856 HydrophobicContact CE2-CE2 4.05Å; F597-Y856 HydrophobicContact CZ-CE2 4.18Å; F597-Y856 AromaticContact CZ-CZ 3.98Å
598	S	92.2	Very high	91.5	Very high	93 Å²	93	34.6 Å²	34.6	65%	0.65	18%	0.178	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-104.1	124.5	177.6	-170.7	0	0	0	0	109.5
599	T	92.4	Very high	90.2	Very high	7 Å²	7	31.7 Å²	31.7	4%	0.043	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	179	-179.4	-166.7	0	0	0	0	110.8	A795 E819 Y821	T599-A795 WeakPolarHBondContact OG1-CB 3.42Å; T599-A795 PolarHBondContact OG1-N 3.43Å; T599-E819 CarbonylContact C-O 3.57Å; T599-E819 HydrophobicContact CG2-CB 4.31Å; T599-E819 PolarHBondContact N-O 2.93Å; T599-E819 PolarHBondContact O-N 3.36Å; T599-Y821 HydrophobicContact CG2-CD1 3.96Å; T599-Y821 HydrophobicContact CG2-CE1 3.39Å; T599-Y821 HydrophobicContact CG2-CE2 4.21Å
600	S	93.3	Very high	88.5	Confident	13 Å²	13	33.1 Å²	33.1	9%	0.091	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	166.1	174.6	45.3	0	0	0	0	108.7	D793 K794 P815 A817	S600-D793 CarbonylContact O-C 3.59Å; S600-K794 WeakPolarHBondContact O-CB 3.27Å; S600-K794 PolarHBondContact O-N 3.13Å; S600-P815 WeakPolarHBondContact OG-CB 3.48Å; S600-A817 WeakPolarHBondContact CA-O 3.34Å
601	L	93.4	Very high	86.7	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	135.5	171.9	-63	178.2	0	0	0	110.9	A750 Y753 D793 F816 A817	L601-A750 HydrophobicContact CD1-CB 4.47Å; L601-A750 HydrophobicContact CD2-CB 3.61Å; L601-Y753 HydrophobicContact CD1-CD1 3.53Å; L601-Y753 HydrophobicContact CD1-CE1 4.2Å; L601-Y753 HydrophobicContact CD1-CG 3.83Å; L601-D793 WeakPolarHBondContact CD2-OD1 3.44Å; L601-F816 HydrophobicContact CB-CD2 4.01Å; L601-F816 HydrophobicContact CB-CE1 4.28Å; L601-F816 HydrophobicContact CB-CE2 3.62Å; L601-F816 HydrophobicContact CB-CZ 3.77Å; L601-F816 WeakPolarHBondContact CB-O 3.39Å; L601-F816 HydrophobicContact CD1-CD2 4.37Å; L601-F816 HydrophobicContact CD1-CE2 3.84Å; L601-F816 HydrophobicContact CG-CE2 4.38Å; L601-F816 PolarHBondContact N-O 3.36Å; L601-F816 PolarHBondContact O-N 3.02Å; L601-A817 HydrophobicContact CB-CB 4.39Å; L601-A817 HydrophobicContact CD1-CB 3.75Å; L601-A817 HydrophobicContact CG-CB 3.94Å
602	G	92.4	Very high	85.1	Confident	6 Å²	6	36 Å²	36	6%	0.062	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	165.9	175.7	0	0	0	0	0	111.6	I791 M792 L797	G602-I791 WeakPolarHBondContact O-CA 3.45Å; G602-M792 PolarHBondContact N-O 2.91Å; G602-M792 PolarHBondContact O-N 3.38Å; G602-L797 WeakPolarHBondContact O-CD1 3.23Å
603	I	93.3	Very high	83.9	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	120	175.6	-50.4	-179.2	0	0	0	107.4	V605 I728 L733 A789 F790 I791 T811 V812 F816	I603-V605 HydrophobicContact CG2-CG1 4.23Å; I603-I728 HydrophobicContact CD1-CB 4.48Å; I603-I728 HydrophobicContact CD1-CD1 4.43Å; I603-L733 HydrophobicContact CD1-CD1 3.83Å; I603-A789 HydrophobicContact CG2-CB 3.85Å; I603-F790 CarbonylContact C-O 3.59Å; I603-I791 HydrophobicContact CG1-CG1 4.3Å; I603-I791 HydrophobicContact CG2-CG1 4.46Å; I603-T811 CarbonylContact O-C 3.48Å; I603-T811 WeakPolarHBondContact O-CA 3.38Å; I603-V812 HydrophobicContact CB-CG2 3.98Å; I603-V812 HydrophobicContact CG2-CG2 4.1Å; I603-V812 PolarHBondContact O-N 2.99Å; I603-F816 HydrophobicContact CD1-CE1 4.39Å; I603-F816 HydrophobicContact CG1-CE1 4.13Å
604	L	92.2	Very high	83.1	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	131.9	173.1	-173.1	71.7	0	0	0	109.5	V777 L780 A789 F790 L797 V801 L809 T811	L604-V777 HydrophobicContact CD2-CG1 4.4Å; L604-V777 HydrophobicContact CD2-CG2 3.74Å; L604-L780 WeakPolarHBondContact O-CD1 3.45Å; L604-A789 WeakPolarHBondContact O-CA 3.21Å; L604-F790 HydrophobicContact CB-CB 4.33Å; L604-F790 PolarHBondContact N-O 3.44Å; L604-F790 PolarHBondContact O-N 3.39Å; L604-L797 HydrophobicContact CB-CD1 4.04Å; L604-L797 HydrophobicContact CB-CD2 3.88Å; L604-L797 HydrophobicContact CB-CG 4.41Å; L604-L797 HydrophobicContact CD2-CD2 4.11Å; L604-L797 HydrophobicContact CG-CD2 4.48Å; L604-V801 HydrophobicContact CD1-CG2 3.43Å; L604-V801 VanDerWaalsContact CD1-CG2 3.43Å; L604-L809 HydrophobicContact CD1-CB 4.17Å; L604-L809 HydrophobicContact CD2-CD1 4.27Å; L604-T811 HydrophobicContact CD1-CG2 4.16Å
605	V	90.6	Very high	82.2	Confident	8 Å²	8	43 Å²	43	5%	0.048	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	157.4	174.3	-61.4	0	0	0	0	110.5	I603 A789 A810 V812	I603-V605 HydrophobicContact CG2-CG1 4.23Å; V605-A789 HydrophobicContact CG1-CB 4.03Å; V605-A810 PolarHBondContact N-O 3.47Å; V605-A810 PolarHBondContact O-N 3.17Å; V605-V812 HydrophobicContact CG1-CG2 3.8Å; V605-V812 HydrophobicContact CG2-CB 4.35Å; V605-V812 HydrophobicContact CG2-CG1 3.43Å; V605-V812 VanDerWaalsContact CG2-CG1 3.43Å; V605-V812 HydrophobicContact CG2-CG2 3.97Å
606	R	87.3	Confident	81.3	Confident	65 Å²	65	40.9 Å²	40.9	25%	0.245	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	123.1	171.8	-172.3	176.6	-178.4	-178.1	7	108.8	K608 L780 K781 T782 K808 L809	R606-K608 PolarHBondContact O-N 3.01Å; R606-L780 HydrophobicContact CB-CD2 3.68Å; R606-L780 HydrophobicContact CB-CG 4.48Å; R606-L780 WeakPolarHBondContact CD-O 3.27Å; R606-K781 VanDerWaalsContact NH1-C 3.31Å; R606-K781 PolarHBondContact NH1-O 2.91Å; R606-T782 PolarHBondContact NH1-O 3.02Å; R606-T782 VanDerWaalsContact NH1-O 3.1Å; R606-K808 HydrophobicContact CG-CB 4.38Å; R606-L809 HydrophobicContact CB-CD2 4.28Å; R606-L809 HydrophobicContact CG-CD2 4.5Å
607	S	78.7	Confident	80.6	Confident	27 Å²	27	43 Å²	43	19%	0.189	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-62.7	133	170.3	61	0	0	0	0	109.8	K808	S607-K808 WeakPolarHBondContact CB-O 3.43Å; S607-K808 PolarHBondContact N-O 3.13Å; S607-K808 VanDerWaalsContact OG-CA 3.28Å; S607-K808 WeakPolarHBondContact OG-CA 3.41Å; S607-K808 PolarHBondContact OG-O 3.38Å
608	K	71.8	Confident	80.1	Confident	92 Å²	92	46.3 Å²	46.3	40%	0.4	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-100.3	130.6	177.1	-71.3	178.1	-175.8	160.9	0	109	R606 T610 E724	R606-K608 PolarHBondContact O-N 3.01Å; K608-T610 PolarHBondContact O-N 3.42Å; K608-E724 VanDerWaalsContact CD-OE1 3.3Å; K608-E724 WeakPolarHBondContact CD-OE1 3.44Å; K608-E724 WeakPolarHBondContact CE-OE1 3.37Å; K608-E724 IonicContact NZ-OE1 2.75Å; K608-E724 PolarHBondContact NZ-OE1 3.38Å; K608-E724 IonicContact NZ-OE2 3.17Å; K608-E724 PolarHBondContact NZ-OE2 3Å
609	D	63.7	Low	79.7	Confident	124 Å²	124	49.1 Å²	49.1	66%	0.663	27%	0.272	S	S	*	.			trans	-68.5	100.7	173.1	-63.2	-43.7	0	0	0	108.6	A611 K808	D609-A611 PolarHBondContact O-N 2.94Å; D609-A611 VanDerWaalsContact O-N 3.14Å; D609-K808 IonicContact OD2-NZ 3.6Å; D609-K808 PolarHBondContact OD2-NZ 3.46Å
610	T	56.5	Low	79.5	Confident	62 Å²	62	49.1 Å²	49.1	38%	0.38	27%	0.272	S	S	.	.			trans	-73.8	108.4	174.6	55.3	0	0	0	0	109.2	K608 A612 K720 F722	K608-T610 PolarHBondContact O-N 3.42Å; T610-A612 PolarHBondContact O-N 3.46Å; T610-K720 PolarHBondContact OG1-O 3.09Å; T610-F722 HydrophobicContact CG2-CD2 4.09Å
611	A	57.2	Low	79.2	Confident	81 Å²	81	49.4 Å²	49.4	67%	0.669	27%	0.272	S	S	*	.	P	Polyproline II helix	trans	-60.3	125.4	166.2	0	0	0	0	0	108	D609	D609-A611 PolarHBondContact O-N 2.94Å; D609-A611 VanDerWaalsContact O-N 3.14Å
612	A	61.8	Low	79	Confident	18 Å²	18	55 Å²	55	15%	0.149	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-57.4	128.9	177.5	0	0	0	0	0	108.6	T610 A616 H878	T610-A612 PolarHBondContact O-N 3.46Å; A612-A616 HydrophobicContact CB-CB 4.02Å; A612-H878 VanDerWaalsContact CB-ND1 3.29Å; A612-H878 WeakPolarHBondContact CB-ND1 3.19Å
613	P	70.3	Confident	78.9	Confident	67 Å²	67	63.2 Å²	63.2	44%	0.435	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-59.6	150.9	-179.3	23	-31.4	0	0	0	109.7	G615 A616 W619	P613-G615 PolarHBondContact O-N 3.03Å; P613-A616 HydrophobicContact CG-CB 4.31Å; P613-A616 WeakPolarHBondContact O-CB 3.32Å; P613-A616 PolarHBondContact O-N 3.45Å; P613-W619 HydrophobicContact CG-CH2 3.52Å; P613-W619 HydrophobicContact CG-CZ2 3.27Å
614	I	78.7	Confident	78.9	Confident	110 Å²	110	65.8 Å²	65.8	56%	0.564	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-27.5	-176	-58.1	173.4	0	0	0	111.8	F617 G881	I614-F617 WeakPolarHBondContact O-CD1 3.33Å; I614-F617 WeakPolarHBondContact O-CE1 3.26Å; I614-G881 VanDerWaalsContact CG2-CA 3.41Å; I614-G881 WeakPolarHBondContact O-CA 3.22Å
615	G	76.2	Confident	78.9	Confident	33 Å²	33	70.7 Å²	70.7	34%	0.34	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	4.8	176.6	0	0	0	0	0	116.8	P613 F617 M618	P613-G615 PolarHBondContact O-N 3.03Å; G615-F617 PolarHBondContact O-N 3.33Å; G615-F617 VanDerWaalsContact O-N 3.13Å; G615-M618 PolarHBondContact O-N 3.27Å
616	A	76.3	Confident	78.9	Confident	18 Å²	18	74.6 Å²	74.6	15%	0.149	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-60.2	-25.7	-173.7	0	0	0	0	0	113.9	A612 P613 M618 W619	A612-A616 HydrophobicContact CB-CB 4.02Å; P613-A616 HydrophobicContact CG-CB 4.31Å; P613-A616 WeakPolarHBondContact O-CB 3.32Å; P613-A616 PolarHBondContact O-N 3.45Å; A616-M618 PolarHBondContact O-N 2.99Å; A616-W619 HydrophobicContact CB-CD2 4.28Å; A616-W619 HydrophobicContact CB-CE3 4.27Å; A616-W619 HydrophobicContact CB-CZ3 4.48Å; A616-W619 WeakPolarHBondContact O-CB 3.35Å; A616-W619 PolarHBondContact O-N 3.06Å
617	F	79.8	Confident	79.2	Confident	56 Å²	56	75.3 Å²	75.3	25%	0.246	40%	0.395	C	S	.	.	G	3₁₀ helix	trans	-64.8	-18.3	176.6	72.2	-89.4	0	0	0	113.8	I614 G615 P620 Y708 L882 L885	I614-F617 WeakPolarHBondContact O-CD1 3.33Å; I614-F617 WeakPolarHBondContact O-CE1 3.26Å; G615-F617 PolarHBondContact O-N 3.33Å; G615-F617 VanDerWaalsContact O-N 3.13Å; F617-P620 WeakPolarHBondContact O-CD 3.33Å; F617-Y708 PolarHBondContact O-OH 3.01Å; F617-L882 HydrophobicContact CB-CD2 4.26Å; F617-L882 HydrophobicContact CD1-CD2 4.27Å; F617-L882 HydrophobicContact CD2-CD2 3.93Å; F617-L882 HydrophobicContact CE2-CD2 4.35Å; F617-L882 HydrophobicContact CG-CD2 3.89Å; F617-L882 HydrophobicContact CG-CG 4.49Å; F617-L885 HydrophobicContact CE2-CD2 4.44Å; F617-L885 HydrophobicContact CZ-CD2 4.36Å
618	M	84.3	Confident	79.8	Confident	92 Å²	92	75.8 Å²	75.8	45%	0.453	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-89.2	-15.6	178	-63.5	-175.6	65.8	0	0	113.4	G615 A616 L621	G615-M618 PolarHBondContact O-N 3.27Å; A616-M618 PolarHBondContact O-N 2.99Å; M618-L621 PolarHBondContact O-N 3.02Å
619	W	84.4	Confident	80.8	Confident	152 Å²	152	72 Å²	72	58%	0.576	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-31.5	-178.3	-66.7	-4	0	0	0	116.4	P613 A616 L621 V715	P613-W619 HydrophobicContact CG-CH2 3.52Å; P613-W619 HydrophobicContact CG-CZ2 3.27Å; A616-W619 HydrophobicContact CB-CD2 4.28Å; A616-W619 HydrophobicContact CB-CE3 4.27Å; A616-W619 HydrophobicContact CB-CZ3 4.48Å; A616-W619 WeakPolarHBondContact O-CB 3.35Å; A616-W619 PolarHBondContact O-N 3.06Å; W619-L621 PolarHBondContact O-N 2.97Å; W619-L621 VanDerWaalsContact O-N 3.09Å; W619-V715 HydrophobicContact CE3-CG1 4.25Å
620	P	87.2	Confident	82.1	Confident	8 Å²	8	71.7 Å²	71.7	5%	0.052	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-20.8	-177.6	-26.2	35.6	0	0	0	115.1	F617 Y708 N711 L712	F617-P620 WeakPolarHBondContact O-CD 3.33Å; P620-Y708 HydrophobicContact CB-CD2 4.06Å; P620-Y708 HydrophobicContact CB-CE2 4.1Å; P620-Y708 HydrophobicContact CG-CE2 4.09Å; P620-N711 HydrophobicContact CB-CB 3.92Å; P620-N711 PolarHBondContact O-ND2 2.97Å; P620-N711 VanDerWaalsContact O-ND2 3.11Å; P620-L712 HydrophobicContact CB-CB 4.24Å; P620-L712 HydrophobicContact CG-CB 3.78Å; P620-L712 HydrophobicContact CG-CD1 3.71Å; P620-L712 HydrophobicContact CG-CG 4.33Å
621	L	87.6	Confident	83.9	Confident	19 Å²	19	73.6 Å²	73.6	10%	0.099	39%	0.388	C	S	.	.	S	Bend	trans	-130.5	129.5	177.7	-71.9	174.5	0	0	0	109.5	M618 W619 M625 W626 I629 Y708	M618-L621 PolarHBondContact O-N 3.02Å; W619-L621 PolarHBondContact O-N 2.97Å; W619-L621 VanDerWaalsContact O-N 3.09Å; L621-M625 HydrophobicContact CB-CB 4.37Å; L621-M625 HydrophobicContact CD2-CB 4.38Å; L621-W626 HydrophobicContact CB-CZ2 4.16Å; L621-W626 HydrophobicContact CD1-CH2 4.28Å; L621-W626 HydrophobicContact CD1-CZ2 4.02Å; L621-W626 PolarHBondContact O-NE1 3.43Å; L621-W626 VanDerWaalsContact O-NE1 3.09Å; L621-I629 HydrophobicContact CD1-CD1 4.11Å; L621-Y708 HydrophobicContact CD1-CD2 3.9Å; L621-Y708 HydrophobicContact CG-CD2 4.17Å
622	H	90.1	Very high	85.6	Confident	116 Å²	116	71 Å²	71	54%	0.537	37%	0.367	S	S	.	.			trans	-59.9	147.1	174	-171.6	-101.1	0	0	0	111	S624 M625 W626	H622-S624 PolarHBondContact ND1-N 3.46Å; H622-S624 PolarHBondContact ND1-OG 3.33Å; H622-S624 PolarHBondContact O-N 3Å; H622-M625 WeakPolarHBondContact O-CB 3.21Å; H622-M625 PolarHBondContact O-N 3.47Å; H622-W626 PolarHBondContact O-N 3.1Å
623	W	90.1	Very high	87.1	Confident	180 Å²	180	70.2 Å²	70.2	68%	0.682	36%	0.36	S	S	*	.	H	α-helix	trans	-54.5	-31.3	-176.1	70.6	-92.5	0	0	0	113.4	M625 W626 V627	W623-M625 VanDerWaalsContact C-N 3.33Å; W623-M625 PolarHBondContact O-N 3.16Å; W623-W626 PolarHBondContact O-N 2.78Å; W623-V627 HydrophobicContact CE3-CG2 4.22Å; W623-V627 HydrophobicContact CZ3-CG2 4.45Å; W623-V627 PolarHBondContact O-N 3.13Å
624	S	93	Very high	88.1	Confident	54 Å²	54	69.3 Å²	69.3	38%	0.378	35%	0.35	S	S	.	.	H	α-helix	trans	-63.4	-35.4	174.9	61.9	0	0	0	0	113	H622 V627 G628	H622-S624 PolarHBondContact ND1-N 3.46Å; H622-S624 PolarHBondContact ND1-OG 3.33Å; H622-S624 PolarHBondContact O-N 3Å; S624-V627 PolarHBondContact O-N 3.46Å; S624-G628 PolarHBondContact O-N 3.43Å
625	M	91.6	Very high	88.7	Confident	103 Å²	103	67.5 Å²	67.5	51%	0.507	34%	0.341	S	S	.	.	H	α-helix	trans	-69.3	-37.8	177.8	-64.7	-60.1	-69.3	0	0	111.2	L621 H622 W623 G628 I629	L621-M625 HydrophobicContact CB-CB 4.37Å; L621-M625 HydrophobicContact CD2-CB 4.38Å; H622-M625 WeakPolarHBondContact O-CB 3.21Å; H622-M625 PolarHBondContact O-N 3.47Å; W623-M625 VanDerWaalsContact C-N 3.33Å; W623-M625 PolarHBondContact O-N 3.16Å; M625-G628 CarbonylContact O-C 3.57Å; M625-G628 PolarHBondContact O-N 3.36Å; M625-I629 VanDerWaalsContact O-CG1 3.28Å; M625-I629 WeakPolarHBondContact O-CG1 3.2Å; M625-I629 PolarHBondContact O-N 3.15Å
626	W	90.6	Very high	89.4	Confident	89 Å²	89	66.8 Å²	66.8	34%	0.337	33%	0.33	S	S	.	.	H	α-helix	trans	-61	-45.2	174.1	-69.5	104.7	0	0	0	111.9	L621 H622 W623 G628 I629 F630 Y708	L621-W626 HydrophobicContact CB-CZ2 4.16Å; L621-W626 HydrophobicContact CD1-CH2 4.28Å; L621-W626 HydrophobicContact CD1-CZ2 4.02Å; L621-W626 PolarHBondContact O-NE1 3.43Å; L621-W626 VanDerWaalsContact O-NE1 3.09Å; H622-W626 PolarHBondContact O-N 3.1Å; W623-W626 PolarHBondContact O-N 2.78Å; W626-G628 VanDerWaalsContact C-N 3.33Å; W626-I629 PolarHBondContact O-N 2.79Å; W626-F630 WeakPolarHBondContact O-CB 3.33Å; W626-F630 PolarHBondContact O-N 2.95Å; W626-Y708 HydrophobicContact CH2-CD2 4.26Å; W626-Y708 AromaticContact CH2-CE2 3.98Å; W626-Y708 HydrophobicContact CH2-CE2 3.98Å; W626-Y708 HydrophobicContact CZ2-CD2 4.27Å; W626-Y708 AromaticContact CZ2-CE2 3.93Å; W626-Y708 HydrophobicContact CZ2-CE2 3.93Å
627	V	92.6	Very high	90.1	Very high	81 Å²	81	66 Å²	66	49%	0.491	32%	0.323	S	S	.	.	H	α-helix	trans	-63.2	-41.4	173.8	176.6	0	0	0	0	110.7	W623 S624 F630 L631	W623-V627 HydrophobicContact CE3-CG2 4.22Å; W623-V627 HydrophobicContact CZ3-CG2 4.45Å; W623-V627 PolarHBondContact O-N 3.13Å; S624-V627 PolarHBondContact O-N 3.46Å; V627-F630 PolarHBondContact O-N 3.02Å; V627-L631 WeakPolarHBondContact O-CB 3.49Å; V627-L631 PolarHBondContact O-N 2.85Å
628	G	92.7	Very high	90.5	Very high	36 Å²	36	67.2 Å²	67.2	37%	0.371	33%	0.332	S	S	.	.	H	α-helix	trans	-60.1	-45	176	0	0	0	0	0	113.3	S624 M625 W626 L631 A632	S624-G628 PolarHBondContact O-N 3.43Å; M625-G628 CarbonylContact O-C 3.57Å; M625-G628 PolarHBondContact O-N 3.36Å; W626-G628 VanDerWaalsContact C-N 3.33Å; G628-L631 PolarHBondContact O-N 3.23Å; G628-A632 VanDerWaalsContact O-CB 3.25Å; G628-A632 WeakPolarHBondContact O-CB 3.05Å; G628-A632 PolarHBondContact O-N 2.64Å
629	I	92.2	Very high	90.6	Very high	14 Å²	14	67 Å²	67	7%	0.072	33%	0.329	C	S	.	.	H	α-helix	trans	-63.9	-44.3	176.2	-66.6	159.2	0	0	0	110.5	L621 M625 W626 L631 A632 L633 L675 V704	L621-I629 HydrophobicContact CD1-CD1 4.11Å; M625-I629 VanDerWaalsContact O-CG1 3.28Å; M625-I629 WeakPolarHBondContact O-CG1 3.2Å; M625-I629 PolarHBondContact O-N 3.15Å; W626-I629 PolarHBondContact O-N 2.79Å; I629-L631 PolarHBondContact O-N 3.01Å; I629-A632 PolarHBondContact O-N 3.27Å; I629-L633 VanDerWaalsContact O-CB 3.3Å; I629-L633 WeakPolarHBondContact O-CB 3.38Å; I629-L633 PolarHBondContact O-N 3.25Å; I629-L675 HydrophobicContact CG2-CD1 4.26Å; I629-L675 HydrophobicContact CG2-CD2 3.99Å; I629-V704 HydrophobicContact CD1-CG1 3.61Å; I629-V704 HydrophobicContact CG1-CG1 4.22Å
630	F	91.7	Very high	90.7	Very high	117 Å²	117	60 Å²	60	51%	0.513	30%	0.302	S	S	.	.	H	α-helix	trans	-60.1	-46.4	177	-179.5	-94.1	0	0	0	111.3	W626 V627 L633 H634	W626-F630 WeakPolarHBondContact O-CB 3.33Å; W626-F630 PolarHBondContact O-N 2.95Å; V627-F630 PolarHBondContact O-N 3.02Å; F630-L633 PolarHBondContact O-N 3.33Å; F630-H634 AromaticContact CD1-ND1 3.97Å; F630-H634 AromaticContact CD2-CE1 3.7Å; F630-H634 AromaticContact CE1-CE1 3.66Å; F630-H634 AromaticContact CE1-ND1 3.82Å; F630-H634 AromaticContact CE2-CE1 3.2Å; F630-H634 WeakPolarHBondContact CE2-CE1 3.38Å; F630-H634 AromaticContact CE2-ND1 3.95Å; F630-H634 AromaticContact CE2-NE2 3.99Å; F630-H634 AromaticContact CZ-CE1 3.17Å; F630-H634 WeakPolarHBondContact CZ-CE1 3.45Å; F630-H634 AromaticContact CZ-ND1 3.81Å; F630-H634 AromaticContact CZ-NE2 3.63Å; F630-H634 PolarHBondContact O-N 2.94Å; F630-H634 PolarHBondContact O-ND1 3.38Å
631	L	93.7	Very high	90.5	Very high	101 Å²	101	59.7 Å²	59.7	53%	0.529	30%	0.3	S	S	.	.	H	α-helix	trans	-65	-47.1	178.5	-178.1	60	0	0	0	111.6	V627 G628 I629 L633 H634 I635	V627-L631 WeakPolarHBondContact O-CB 3.49Å; V627-L631 PolarHBondContact O-N 2.85Å; G628-L631 PolarHBondContact O-N 3.23Å; I629-L631 PolarHBondContact O-N 3.01Å; L631-L633 VanDerWaalsContact C-N 3.31Å; L631-L633 PolarHBondContact O-N 3.1Å; L631-H634 PolarHBondContact O-N 2.78Å; L631-I635 HydrophobicContact CD1-CD1 3.97Å; L631-I635 HydrophobicContact CD1-CG1 4.27Å; L631-I635 HydrophobicContact CD2-CD1 4.47Å; L631-I635 HydrophobicContact CG-CD1 3.77Å; L631-I635 HydrophobicContact CG-CG1 4.45Å; L631-I635 WeakPolarHBondContact O-CB 3.46Å; L631-I635 VanDerWaalsContact O-CG1 3.27Å; L631-I635 WeakPolarHBondContact O-CG1 3.4Å; L631-I635 PolarHBondContact O-N 2.92Å
632	A	92.9	Very high	90.2	Very high	27 Å²	27	61.9 Å²	61.9	22%	0.223	31%	0.311	C	S	.	.	H	α-helix	trans	-58.6	-42.3	177.2	0	0	0	0	0	111.6	G628 I629 H634 I635 T636 W697	G628-A632 VanDerWaalsContact O-CB 3.25Å; G628-A632 WeakPolarHBondContact O-CB 3.05Å; G628-A632 PolarHBondContact O-N 2.64Å; I629-A632 PolarHBondContact O-N 3.27Å; A632-H634 PolarHBondContact O-N 3.27Å; A632-I635 PolarHBondContact O-N 3.38Å; A632-T636 WeakPolarHBondContact O-CB 3.42Å; A632-T636 PolarHBondContact O-N 2.71Å; A632-T636 PolarHBondContact O-OG1 2.91Å; A632-W697 HydrophobicContact CB-CH2 4.46Å; A632-W697 HydrophobicContact CB-CZ3 4.11Å
633	L	92.7	Very high	89.9	Confident	1 Å²	1	61 Å²	61	1%	0.005	30%	0.304	C	S	.	.	H	α-helix	trans	-59.3	-45.7	176.4	-177.3	150.2	0	0	0	112.1	I629 F630 L631 T636 A637 L668 C671 Y672 L675 W697	I629-L633 VanDerWaalsContact O-CB 3.3Å; I629-L633 WeakPolarHBondContact O-CB 3.38Å; I629-L633 PolarHBondContact O-N 3.25Å; F630-L633 PolarHBondContact O-N 3.33Å; L631-L633 VanDerWaalsContact C-N 3.31Å; L631-L633 PolarHBondContact O-N 3.1Å; L633-T636 PolarHBondContact O-N 3.07Å; L633-A637 WeakPolarHBondContact O-CB 3.27Å; L633-A637 PolarHBondContact O-N 2.84Å; L633-L668 HydrophobicContact CD2-CD2 3.58Å; L633-C671 HydrophobicContact CD1-CB 4.46Å; L633-C671 HydrophobicContact CD2-CB 4.44Å; L633-C671 HydrophobicContact CG-CB 4.01Å; L633-Y672 HydrophobicContact CD1-CD1 3.51Å; L633-Y672 HydrophobicContact CD1-CD2 4.24Å; L633-Y672 HydrophobicContact CD1-CE1 3.56Å; L633-Y672 HydrophobicContact CD1-CE2 4.26Å; L633-Y672 HydrophobicContact CD1-CG 3.88Å; L633-Y672 HydrophobicContact CD2-CD2 3.96Å; L633-Y672 HydrophobicContact CD2-CE1 4.24Å; L633-Y672 HydrophobicContact CD2-CE2 3.57Å; L633-Y672 HydrophobicContact CD2-CG 4.43Å; L633-L675 HydrophobicContact CD1-CD2 3.78Å; L633-W697 HydrophobicContact CB-CH2 3.8Å; L633-W697 HydrophobicContact CB-CZ2 3.93Å; L633-W697 HydrophobicContact CD1-CZ2 4.17Å; L633-W697 HydrophobicContact CG-CH2 4.45Å; L633-W697 HydrophobicContact CG-CZ2 4.07Å
634	H	91.3	Very high	89.3	Confident	48 Å²	48	53.6 Å²	53.6	22%	0.222	28%	0.277	C	S	.	.	H	α-helix	trans	-68.8	-37.4	-180	-74.8	70.9	0	0	0	111.9	F630 L631 A632 L638 Y664	F630-H634 AromaticContact CD1-ND1 3.97Å; F630-H634 AromaticContact CD2-CE1 3.7Å; F630-H634 AromaticContact CE1-CE1 3.66Å; F630-H634 AromaticContact CE1-ND1 3.82Å; F630-H634 AromaticContact CE2-CE1 3.2Å; F630-H634 WeakPolarHBondContact CE2-CE1 3.38Å; F630-H634 AromaticContact CE2-ND1 3.95Å; F630-H634 AromaticContact CE2-NE2 3.99Å; F630-H634 AromaticContact CZ-CE1 3.17Å; F630-H634 WeakPolarHBondContact CZ-CE1 3.45Å; F630-H634 AromaticContact CZ-ND1 3.81Å; F630-H634 AromaticContact CZ-NE2 3.63Å; F630-H634 PolarHBondContact O-N 2.94Å; F630-H634 PolarHBondContact O-ND1 3.38Å; L631-H634 PolarHBondContact O-N 2.78Å; A632-H634 PolarHBondContact O-N 3.27Å; H634-L638 WeakPolarHBondContact O-CB 3.16Å; H634-L638 PolarHBondContact O-N 3.33Å; H634-Y664 PolarHBondContact CD2-OH 2.56Å; H634-Y664 VanDerWaalsContact CD2-OH 3.28Å
635	I	92.6	Very high	88.4	Confident	72 Å²	72	57 Å²	57	37%	0.369	28%	0.282	S	S	.	.	H	α-helix	trans	-64.7	-48.6	174.7	-71.1	172.8	0	0	0	110.4	L631 A632 A637 L638 F639	L631-I635 HydrophobicContact CD1-CD1 3.97Å; L631-I635 HydrophobicContact CD1-CG1 4.27Å; L631-I635 HydrophobicContact CD2-CD1 4.47Å; L631-I635 HydrophobicContact CG-CD1 3.77Å; L631-I635 HydrophobicContact CG-CG1 4.45Å; L631-I635 WeakPolarHBondContact O-CB 3.46Å; L631-I635 VanDerWaalsContact O-CG1 3.27Å; L631-I635 WeakPolarHBondContact O-CG1 3.4Å; L631-I635 PolarHBondContact O-N 2.92Å; A632-I635 PolarHBondContact O-N 3.38Å; I635-A637 PolarHBondContact O-N 2.98Å; I635-L638 WeakPolarHBondContact O-CB 3.42Å; I635-L638 PolarHBondContact O-N 3.26Å; I635-F639 HydrophobicContact CG2-CD2 3.52Å; I635-F639 HydrophobicContact CG2-CE2 3.44Å; I635-F639 VanDerWaalsContact CG2-CE2 3.44Å; I635-F639 WeakPolarHBondContact O-CD2 3.19Å; I635-F639 PolarHBondContact O-N 3.48Å
636	T	91	Very high	87.5	Confident	19 Å²	19	60.9 Å²	60.9	12%	0.117	30%	0.296	C	S	.	.	H	α-helix	trans	-63.5	-41.1	178.3	-59.3	0	0	0	0	111.6	A632 L633 L638 F639 L640 L693 W697	A632-T636 WeakPolarHBondContact O-CB 3.42Å; A632-T636 PolarHBondContact O-N 2.71Å; A632-T636 PolarHBondContact O-OG1 2.91Å; L633-T636 PolarHBondContact O-N 3.07Å; T636-L638 VanDerWaalsContact C-N 3.34Å; T636-L638 PolarHBondContact O-N 3.42Å; T636-F639 PolarHBondContact O-N 2.62Å; T636-L640 HydrophobicContact CG2-CD1 4.22Å; T636-L640 HydrophobicContact CG2-CG 4.47Å; T636-L640 WeakPolarHBondContact O-CB 3.31Å; T636-L640 VanDerWaalsContact O-CG 3.29Å; T636-L640 WeakPolarHBondContact O-CG 3.22Å; T636-L640 PolarHBondContact O-N 2.84Å; T636-L693 HydrophobicContact CG2-CD2 4.36Å; T636-L693 HydrophobicContact CG2-CG 4.3Å; T636-W697 HydrophobicContact CG2-CB 3.99Å; T636-W697 HydrophobicContact CG2-CD2 3.89Å; T636-W697 HydrophobicContact CG2-CE3 3.99Å; T636-W697 HydrophobicContact CG2-CG 3.89Å
637	A	89.3	Confident	86.5	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-62.3	-40.2	173.9	0	0	0	0	0	112.3	L633 I635 L640 T641 Y664 A667 L668	L633-A637 WeakPolarHBondContact O-CB 3.27Å; L633-A637 PolarHBondContact O-N 2.84Å; I635-A637 PolarHBondContact O-N 2.98Å; A637-L640 PolarHBondContact O-N 2.93Å; A637-T641 WeakPolarHBondContact O-CG2 3.22Å; A637-T641 PolarHBondContact O-N 3Å; A637-T641 PolarHBondContact O-OG1 3.1Å; A637-Y664 HydrophobicContact CB-CD2 4.44Å; A637-Y664 HydrophobicContact CB-CE2 3.88Å; A637-A667 HydrophobicContact CB-CB 4.21Å; A637-L668 HydrophobicContact CB-CD2 3.5Å; A637-L668 VanDerWaalsContact CB-CD2 3.5Å; A637-L668 HydrophobicContact CB-CG 3.87Å
638	L	88.6	Confident	84.9	Confident	82 Å²	82	58.5 Å²	58.5	43%	0.429	29%	0.294	S	S	.	.	H	α-helix	trans	-63.3	-49.3	176	179.9	66.3	0	0	0	110.7	H634 I635 T636 L640 T641 L642 Y664	H634-L638 WeakPolarHBondContact O-CB 3.16Å; H634-L638 PolarHBondContact O-N 3.33Å; I635-L638 WeakPolarHBondContact O-CB 3.42Å; I635-L638 PolarHBondContact O-N 3.26Å; T636-L638 VanDerWaalsContact C-N 3.34Å; T636-L638 PolarHBondContact O-N 3.42Å; L638-L640 PolarHBondContact O-N 2.95Å; L638-T641 PolarHBondContact O-N 2.82Å; L638-T641 VanDerWaalsContact O-N 3.13Å; L638-T641 PolarHBondContact O-OG1 3.27Å; L638-L642 HydrophobicContact CD1-CD1 4.43Å; L638-L642 HydrophobicContact CD1-CG 4.45Å; L638-L642 HydrophobicContact CG-CD1 4.08Å; L638-L642 HydrophobicContact CG-CG 4.47Å; L638-L642 WeakPolarHBondContact O-CG 3.22Å; L638-L642 PolarHBondContact O-N 3.1Å; L638-Y664 HydrophobicContact CB-CE2 4.12Å
639	F	87.8	Confident	83.3	Confident	89 Å²	89	64.2 Å²	64.2	39%	0.39	31%	0.309	S	S	.	.	H	α-helix	trans	-64	-38.6	178.2	-79.6	-65.9	0	0	0	112.9	I635 T636 T641 L642 Y643 L693	I635-F639 HydrophobicContact CG2-CD2 3.52Å; I635-F639 HydrophobicContact CG2-CE2 3.44Å; I635-F639 VanDerWaalsContact CG2-CE2 3.44Å; I635-F639 WeakPolarHBondContact O-CD2 3.19Å; I635-F639 PolarHBondContact O-N 3.48Å; T636-F639 PolarHBondContact O-N 2.62Å; F639-T641 VanDerWaalsContact C-N 3.3Å; F639-T641 PolarHBondContact O-N 3.36Å; F639-L642 HydrophobicContact CD1-CD1 4.44Å; F639-L642 PolarHBondContact O-N 2.95Å; F639-Y643 HydrophobicContact CB-CE2 4.25Å; F639-Y643 HydrophobicContact CD1-CE1 4.43Å; F639-Y643 VanDerWaalsContact O-CB 3.32Å; F639-Y643 WeakPolarHBondContact O-CB 3.38Å; F639-Y643 WeakPolarHBondContact O-CD2 3.14Å; F639-Y643 PolarHBondContact O-N 3Å; F639-L693 HydrophobicContact CB-CD2 3.91Å
640	L	85.6	Confident	81.5	Confident	3 Å²	3	65.4 Å²	65.4	2%	0.016	33%	0.325	C	S	.	.	H	α-helix	trans	-58.9	-43	171.9	-75.6	172.3	0	0	0	111.2	T636 A637 L638 E644 G690 L693	T636-L640 HydrophobicContact CG2-CD1 4.22Å; T636-L640 HydrophobicContact CG2-CG 4.47Å; T636-L640 WeakPolarHBondContact O-CB 3.31Å; T636-L640 VanDerWaalsContact O-CG 3.29Å; T636-L640 WeakPolarHBondContact O-CG 3.22Å; T636-L640 PolarHBondContact O-N 2.84Å; A637-L640 PolarHBondContact O-N 2.93Å; L638-L640 PolarHBondContact O-N 2.95Å; L640-E644 WeakPolarHBondContact O-CB 3.21Å; L640-E644 WeakPolarHBondContact O-CG 3.41Å; L640-E644 PolarHBondContact O-N 3.22Å; L640-G690 WeakPolarHBondContact CD2-O 3.02Å; L640-L693 HydrophobicContact CD2-CB 4.22Å; L640-L693 HydrophobicContact CD2-CD2 3.85Å; L640-L693 HydrophobicContact CD2-CG 4.21Å; L640-L693 HydrophobicContact CG-CD2 3.89Å
641	T	82.1	Confident	79.7	Confident	2 Å²	2	66.3 Å²	66.3	1%	0.012	33%	0.333	C	S	.	.	H	α-helix	trans	-66.8	-42	175	55.9	0	0	0	0	113.8	A637 L638 F639 E644 W645 F662 Y664 A667	A637-T641 WeakPolarHBondContact O-CG2 3.22Å; A637-T641 PolarHBondContact O-N 3Å; A637-T641 PolarHBondContact O-OG1 3.1Å; L638-T641 PolarHBondContact O-N 2.82Å; L638-T641 VanDerWaalsContact O-N 3.13Å; L638-T641 PolarHBondContact O-OG1 3.27Å; F639-T641 VanDerWaalsContact C-N 3.3Å; F639-T641 PolarHBondContact O-N 3.36Å; T641-E644 PolarHBondContact O-N 3.08Å; T641-W645 WeakPolarHBondContact O-CB 3.34Å; T641-W645 PolarHBondContact O-N 2.73Å; T641-F662 HydrophobicContact CG2-CD1 4.23Å; T641-F662 HydrophobicContact CG2-CE1 4.4Å; T641-Y664 VanDerWaalsContact CG2-CA 3.44Å; T641-Y664 HydrophobicContact CG2-CD2 4.17Å; T641-A667 HydrophobicContact CG2-CB 3.55Å
642	L	82.4	Confident	77.6	Confident	65 Å²	65	66.9 Å²	66.9	34%	0.34	34%	0.34	S	S	.	.	H	α-helix	trans	-65	-42.3	178.1	-69.9	174.2	0	0	0	111.6	L638 F639 W645 K646	L638-L642 HydrophobicContact CD1-CD1 4.43Å; L638-L642 HydrophobicContact CD1-CG 4.45Å; L638-L642 HydrophobicContact CG-CD1 4.08Å; L638-L642 HydrophobicContact CG-CG 4.47Å; L638-L642 WeakPolarHBondContact O-CG 3.22Å; L638-L642 PolarHBondContact O-N 3.1Å; F639-L642 HydrophobicContact CD1-CD1 4.44Å; F639-L642 PolarHBondContact O-N 2.95Å; L642-W645 PolarHBondContact O-N 2.75Å; L642-K646 VanDerWaalsContact O-CB 3.29Å; L642-K646 WeakPolarHBondContact O-CB 3.37Å; L642-K646 WeakPolarHBondContact O-CG 3.48Å; L642-K646 PolarHBondContact O-N 3.2Å
643	Y	82.6	Confident	75.6	Confident	98 Å²	98	70.1 Å²	70.1	38%	0.384	36%	0.359	S	S	.	.	H	α-helix	trans	-65.7	-37.1	176.9	-67.8	-22.2	0	0	0	112.3	F639 S647 L693	F639-Y643 HydrophobicContact CB-CE2 4.25Å; F639-Y643 HydrophobicContact CD1-CE1 4.43Å; F639-Y643 VanDerWaalsContact O-CB 3.32Å; F639-Y643 WeakPolarHBondContact O-CB 3.38Å; F639-Y643 WeakPolarHBondContact O-CD2 3.14Å; F639-Y643 PolarHBondContact O-N 3Å; Y643-S647 WeakPolarHBondContact O-CB 3.32Å; Y643-S647 PolarHBondContact O-N 3.39Å; Y643-L693 HydrophobicContact CD2-CD2 3.91Å; Y643-L693 HydrophobicContact CE2-CD2 3.74Å
644	E	78.5	Confident	73.5	Confident	24 Å²	24	79 Å²	79	11%	0.112	40%	0.4	C	S	.	.	H	α-helix	trans	-70.5	-36	172.4	-76.3	-162.2	-158.2	0	0	113	L640 T641 F662 P685	L640-E644 WeakPolarHBondContact O-CB 3.21Å; L640-E644 WeakPolarHBondContact O-CG 3.41Å; L640-E644 PolarHBondContact O-N 3.22Å; T641-E644 PolarHBondContact O-N 3.08Å; E644-F662 HydrophobicContact CB-CD1 4.47Å; E644-F662 HydrophobicContact CG-CD1 4.26Å; E644-F662 WeakPolarHBondContact OE1-CD1 3.43Å; E644-F662 WeakPolarHBondContact OE1-CE1 3.17Å; E644-F662 WeakPolarHBondContact OE2-CB 3.48Å; E644-F662 VanDerWaalsContact OE2-CD1 3.27Å; E644-F662 WeakPolarHBondContact OE2-CD1 3.16Å; E644-F662 WeakPolarHBondContact OE2-CG 3.41Å; E644-P685 HydrophobicContact CG-CB 4.48Å; E644-P685 WeakPolarHBondContact OE1-CA 3.4Å; E644-P685 WeakPolarHBondContact OE1-CB 3.42Å
645	W	74.3	Confident	71.2	Confident	126 Å²	126	79.3 Å²	79.3	48%	0.477	42%	0.416	S	S	.	.	H	α-helix	trans	-73.9	-32.1	179.1	-70	9.2	0	0	0	113	T641 L642 M651 F662	T641-W645 WeakPolarHBondContact O-CB 3.34Å; T641-W645 PolarHBondContact O-N 2.73Å; L642-W645 PolarHBondContact O-N 2.75Å; W645-M651 WeakPolarHBondContact O-CE 3.37Å; W645-F662 PolarHBondContact NE1-O 3.1Å
646	K	73.1	Confident	68.9	Low	184 Å²	184	88 Å²	88	80%	0.8	44%	0.444	S	S	*	.	H	α-helix	trans	-93.1	-14.6	-179	-68	-69.8	-172.1	174	0	113.9	L642	L642-K646 VanDerWaalsContact O-CB 3.29Å; L642-K646 WeakPolarHBondContact O-CB 3.37Å; L642-K646 WeakPolarHBondContact O-CG 3.48Å; L642-K646 PolarHBondContact O-N 3.2Å
647	S	68.2	Low	66.9	Low	20 Å²	20	93.2 Å²	93.2	14%	0.14	47%	0.471	C	S	.	.	S	Bend	trans	-78.6	133.8	179.2	-177.3	0	0	0	0	111.9	Y643 F649 G650 C687	Y643-S647 WeakPolarHBondContact O-CB 3.32Å; Y643-S647 PolarHBondContact O-N 3.39Å; S647-F649 PolarHBondContact O-N 3.17Å; S647-F649 VanDerWaalsContact O-N 3.14Å; S647-G650 PolarHBondContact O-N 3.05Å; S647-C687 WeakPolarHBondContact OG-CB 3.13Å
648	P	60.8	Low	65.1	Low	101 Å²	101	103.3 Å²	103.3	66%	0.656	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-18.8	177.8	25.2	-33.9	0	0	0	113.5
649	F	57.1	Low	63.1	Low	155 Å²	155	103 Å²	103	68%	0.68	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-13	173.1	-63.2	-79.1	0	0	0	113.5	S647	S647-F649 PolarHBondContact O-N 3.17Å; S647-F649 VanDerWaalsContact O-N 3.14Å
650	G	54.9	Low	61.4	Low	40 Å²	40	107.6 Å²	107.6	41%	0.412	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-31.2	175.8	0	0	0	0	0	113.3	S647	S647-G650 PolarHBondContact O-N 3.05Å
651	M	55.3	Low	60.1	Low	136 Å²	136	111.6 Å²	111.6	67%	0.67	55%	0.55	S	S	*	.			trans	-126.1	92.5	174.2	-77.2	-155	-96.9	0	0	111.5	W645	W645-M651 WeakPolarHBondContact O-CE 3.37Å
652	T	49.5	Very low	59.2	Low	112 Å²	112	112.6 Å²	112.6	69%	0.687	55%	0.554	S	S	*	*			trans	-83.3	135.2	163.1	45.5	0	0	0	0	110.3	H654	T652-H654 PolarHBondContact O-N 2.72Å
653	P	50.6	Low	58.6	Low	96 Å²	96	112.4 Å²	112.4	62%	0.623	56%	0.558	S	S	*	*	S	Bend	trans	-81.2	-17.3	-164.9	-11.2	28.1	0	0	0	115.6
654	H	47.5	Very low	58.6	Low	188 Å²	188	111.6 Å²	111.6	87%	0.87	56%	0.555	S	S	*	*	S	Bend	trans	-133	71.8	-171.5	-74	86.8	0	0	0	112.9	T652	T652-H654 PolarHBondContact O-N 2.72Å
655	G	43	Very low	58.6	Low	53 Å²	53	114.3 Å²	114.3	55%	0.546	58%	0.577	S	S	.	*			trans	-158.6	132.4	174.8	0	0	0	0	0	113.4	N657	G655-N657 PolarHBondContact O-N 2.82Å
656	R	45	Very low	58.9	Low	256 Å²	256	110 Å²	110	97%	0.966	57%	0.566	S	S	*	*	S	Bend	trans	-61.6	58.4	-173.3	-169.5	174.6	132.3	106.5	-3.5	114.6
657	N	49.2	Very low	59.4	Low	127 Å²	127	101.3 Å²	101.3	68%	0.679	53%	0.528	S	S	*	.			trans	-158.5	46.8	169.6	-118.6	-22.1	0	0	0	114.4	G655 V659	G655-N657 PolarHBondContact O-N 2.82Å; N657-V659 PolarHBondContact O-N 2.97Å
658	R	51	Low	60.2	Low	212 Å²	212	101.7 Å²	101.7	80%	0.8	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	7.8	169.9	-76	-173.6	179.6	177.4	1.5	114.9
659	V	46.9	Very low	61.4	Low	76 Å²	76	100.5 Å²	100.5	46%	0.461	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-4.2	-171	-173.9	0	0	0	0	113	N657	N657-V659 PolarHBondContact O-N 2.97Å
660	R	52.3	Low	62.7	Low	185 Å²	185	93.8 Å²	93.8	70%	0.698	49%	0.488	S	S	*	.			trans	-143	73.5	-177.5	-61.1	-169.7	-168.8	-171.1	10.3	112.4
661	V	57	Low	64.3	Low	88 Å²	88	91.9 Å²	91.9	53%	0.533	47%	0.468	S	S	.	.			trans	-71.4	138.2	163.9	-176.3	0	0	0	0	108.2	S663	V661-S663 PolarHBondContact O-N 2.88Å
662	F	63.5	Low	65.9	Low	22 Å²	22	89.1 Å²	89.1	10%	0.096	45%	0.451	C	S	.	.			trans	-64.2	106.2	171.1	-171.3	-107.3	0	0	0	108.5	T641 E644 W645 A667 L670 K683	T641-F662 HydrophobicContact CG2-CD1 4.23Å; T641-F662 HydrophobicContact CG2-CE1 4.4Å; E644-F662 HydrophobicContact CB-CD1 4.47Å; E644-F662 HydrophobicContact CG-CD1 4.26Å; E644-F662 WeakPolarHBondContact OE1-CD1 3.43Å; E644-F662 WeakPolarHBondContact OE1-CE1 3.17Å; E644-F662 WeakPolarHBondContact OE2-CB 3.48Å; E644-F662 VanDerWaalsContact OE2-CD1 3.27Å; E644-F662 WeakPolarHBondContact OE2-CD1 3.16Å; E644-F662 WeakPolarHBondContact OE2-CG 3.41Å; W645-F662 PolarHBondContact NE1-O 3.1Å; F662-A667 HydrophobicContact CD1-CB 4.22Å; F662-A667 HydrophobicContact CE1-CB 3.38Å; F662-A667 HydrophobicContact CZ-CB 3.78Å; F662-L670 HydrophobicContact CZ-CD2 4.31Å; F662-K683 WeakPolarHBondContact CE2-O 3.49Å
663	S	71.4	Confident	67.8	Low	62 Å²	62	84.2 Å²	84.2	43%	0.434	42%	0.422	S	S	.	.			trans	-82.3	152.8	-178	176.2	0	0	0	0	109.9	V661 S665 S666 A667	V661-S663 PolarHBondContact O-N 2.88Å; S663-S665 PolarHBondContact O-N 3.38Å; S663-S665 VanDerWaalsContact O-N 3.15Å; S663-S665 PolarHBondContact OG-N 3.44Å; S663-S666 WeakPolarHBondContact O-CA 3.42Å; S663-S666 VanDerWaalsContact O-CB 3.26Å; S663-S666 WeakPolarHBondContact O-CB 3.39Å; S663-S666 PolarHBondContact O-N 3.37Å; S663-A667 PolarHBondContact O-N 3.32Å
664	Y	81.4	Confident	69.5	Low	80 Å²	80	81.8 Å²	81.8	31%	0.314	40%	0.403	S	S	.	.	H	α-helix	trans	-50.3	-36.5	171	-178.7	-109.9	0	0	0	113	H634 A637 L638 T641 S666 A667 L668	H634-Y664 PolarHBondContact CD2-OH 2.56Å; H634-Y664 VanDerWaalsContact CD2-OH 3.28Å; A637-Y664 HydrophobicContact CB-CD2 4.44Å; A637-Y664 HydrophobicContact CB-CE2 3.88Å; L638-Y664 HydrophobicContact CB-CE2 4.12Å; T641-Y664 VanDerWaalsContact CG2-CA 3.44Å; T641-Y664 HydrophobicContact CG2-CD2 4.17Å; Y664-S666 VanDerWaalsContact C-N 3.34Å; Y664-S666 PolarHBondContact O-N 2.72Å; Y664-A667 PolarHBondContact O-N 3.35Å; Y664-L668 HydrophobicContact CD1-CD1 3.72Å; Y664-L668 HydrophobicContact CD1-CG 4.25Å; Y664-L668 HydrophobicContact CE1-CD1 3.25Å; Y664-L668 HydrophobicContact CE1-CD2 4.42Å; Y664-L668 HydrophobicContact CE1-CG 3.85Å; Y664-L668 HydrophobicContact CE2-CD1 4.48Å; Y664-L668 HydrophobicContact CE2-CD2 4.45Å; Y664-L668 HydrophobicContact CE2-CG 4.2Å; Y664-L668 WeakPolarHBondContact O-CB 3.5Å; Y664-L668 WeakPolarHBondContact O-CG 3.48Å; Y664-L668 PolarHBondContact O-N 3.15Å
665	S	79.4	Confident	71.5	Confident	82 Å²	82	74.2 Å²	74.2	57%	0.573	37%	0.369	S	S	*	.	H	α-helix	trans	-64	-35	173.2	171.7	0	0	0	0	113.4	S663 N669	S663-S665 PolarHBondContact O-N 3.38Å; S663-S665 VanDerWaalsContact O-N 3.15Å; S663-S665 PolarHBondContact OG-N 3.44Å; S665-N669 WeakPolarHBondContact O-CB 3.46Å; S665-N669 PolarHBondContact O-N 3.26Å
666	S	79.2	Confident	73.5	Confident	36 Å²	36	78.5 Å²	78.5	25%	0.252	37%	0.373	S	S	.	.	H	α-helix	trans	-72.1	-35.7	175.5	-164.7	0	0	0	0	111.8	S663 Y664 L670 S682	S663-S666 WeakPolarHBondContact O-CA 3.42Å; S663-S666 VanDerWaalsContact O-CB 3.26Å; S663-S666 WeakPolarHBondContact O-CB 3.39Å; S663-S666 PolarHBondContact O-N 3.37Å; Y664-S666 VanDerWaalsContact C-N 3.34Å; Y664-S666 PolarHBondContact O-N 2.72Å; S666-L670 PolarHBondContact O-N 2.9Å; S666-L670 VanDerWaalsContact O-N 3.13Å; S666-S682 PolarHBondContact O-OG 3.16Å; S666-S682 PolarHBondContact OG-OG 3.37Å
667	A	83.4	Confident	75.1	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-68.1	-47.4	174.7	0	0	0	0	0	111.5	A637 T641 F662 S663 Y664 N669 L670 C671	A637-A667 HydrophobicContact CB-CB 4.21Å; T641-A667 HydrophobicContact CG2-CB 3.55Å; F662-A667 HydrophobicContact CD1-CB 4.22Å; F662-A667 HydrophobicContact CE1-CB 3.38Å; F662-A667 HydrophobicContact CZ-CB 3.78Å; S663-A667 PolarHBondContact O-N 3.32Å; Y664-A667 PolarHBondContact O-N 3.35Å; A667-N669 VanDerWaalsContact C-N 3.34Å; A667-N669 PolarHBondContact O-N 3.37Å; A667-L670 WeakPolarHBondContact O-CB 3.25Å; A667-L670 PolarHBondContact O-N 3.01Å; A667-C671 PolarHBondContact O-N 2.94Å; A667-C671 PolarHBondContact O-SG 3.26Å; A667-C671 VanDerWaalsContact O-SG 3.37Å
668	L	86.8	Confident	76.6	Confident	28 Å²	28	72.7 Å²	72.7	15%	0.147	36%	0.362	C	S	.	.	H	α-helix	trans	-58.2	-45.9	174.8	-79.4	176.3	0	0	0	111.6	L633 A637 Y664 L670 C671 Y672	L633-L668 HydrophobicContact CD2-CD2 3.58Å; A637-L668 HydrophobicContact CB-CD2 3.5Å; A637-L668 VanDerWaalsContact CB-CD2 3.5Å; A637-L668 HydrophobicContact CB-CG 3.87Å; Y664-L668 HydrophobicContact CD1-CD1 3.72Å; Y664-L668 HydrophobicContact CD1-CG 4.25Å; Y664-L668 HydrophobicContact CE1-CD1 3.25Å; Y664-L668 HydrophobicContact CE1-CD2 4.42Å; Y664-L668 HydrophobicContact CE1-CG 3.85Å; Y664-L668 HydrophobicContact CE2-CD1 4.48Å; Y664-L668 HydrophobicContact CE2-CD2 4.45Å; Y664-L668 HydrophobicContact CE2-CG 4.2Å; Y664-L668 WeakPolarHBondContact O-CB 3.5Å; Y664-L668 WeakPolarHBondContact O-CG 3.48Å; Y664-L668 PolarHBondContact O-N 3.15Å; L668-L670 VanDerWaalsContact C-N 3.28Å; L668-L670 PolarHBondContact O-N 3.2Å; L668-C671 PolarHBondContact O-N 3Å; L668-Y672 WeakPolarHBondContact O-CB 3.47Å; L668-Y672 VanDerWaalsContact O-CD2 3.27Å; L668-Y672 WeakPolarHBondContact O-CD2 3.22Å; L668-Y672 PolarHBondContact O-N 2.86Å
669	N	85.3	Confident	77.4	Confident	76 Å²	76	69.9 Å²	69.9	41%	0.406	37%	0.368	S	S	.	.	H	α-helix	trans	-61	-38.3	177.8	-169.5	37.5	0	0	0	112	S665 A667 A673 V680	S665-N669 WeakPolarHBondContact O-CB 3.46Å; S665-N669 PolarHBondContact O-N 3.26Å; A667-N669 VanDerWaalsContact C-N 3.34Å; A667-N669 PolarHBondContact O-N 3.37Å; N669-A673 WeakPolarHBondContact O-CB 3.29Å; N669-A673 PolarHBondContact O-N 3.03Å; N669-V680 WeakPolarHBondContact ND2-CG1 3.38Å
670	L	85.1	Confident	78.5	Confident	15 Å²	15	69.3 Å²	69.3	8%	0.079	37%	0.365	C	S	.	.	H	α-helix	trans	-67.2	-45.4	174.3	-177.7	65.9	0	0	0	111.9	F662 S666 A667 L668 Y672 A673 I674 M694	F662-L670 HydrophobicContact CZ-CD2 4.31Å; S666-L670 PolarHBondContact O-N 2.9Å; S666-L670 VanDerWaalsContact O-N 3.13Å; A667-L670 WeakPolarHBondContact O-CB 3.25Å; A667-L670 PolarHBondContact O-N 3.01Å; L668-L670 VanDerWaalsContact C-N 3.28Å; L668-L670 PolarHBondContact O-N 3.2Å; L670-Y672 PolarHBondContact O-N 3.45Å; L670-A673 WeakPolarHBondContact O-CB 3.39Å; L670-A673 PolarHBondContact O-N 2.86Å; L670-I674 HydrophobicContact CD1-CD1 4.35Å; L670-I674 HydrophobicContact CG-CD1 4.17Å; L670-I674 WeakPolarHBondContact O-CG1 3.45Å; L670-I674 PolarHBondContact O-N 3.44Å; L670-M694 HydrophobicContact CD2-SD 4.13Å
671	C	88.3	Confident	78.8	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-62.9	-41.8	177.9	-67.8	0	0	0	0	112.4	L633 A667 L668 I674 L675 W697	L633-C671 HydrophobicContact CD1-CB 4.46Å; L633-C671 HydrophobicContact CD2-CB 4.44Å; L633-C671 HydrophobicContact CG-CB 4.01Å; A667-C671 PolarHBondContact O-N 2.94Å; A667-C671 PolarHBondContact O-SG 3.26Å; A667-C671 VanDerWaalsContact O-SG 3.37Å; L668-C671 PolarHBondContact O-N 3Å; C671-I674 PolarHBondContact O-N 3.16Å; C671-L675 WeakPolarHBondContact O-CB 3.49Å; C671-L675 PolarHBondContact O-N 3.34Å; C671-W697 PolarHBondContact O-NE1 3.03Å
672	Y	89.1	Confident	79.2	Confident	77 Å²	77	63.8 Å²	63.8	30%	0.302	36%	0.358	S	S	.	.	H	α-helix	trans	-65.6	-39.9	174.3	-86.1	-64.4	0	0	0	112.3	L633 L668 L670 I674 L675 F676	L633-Y672 HydrophobicContact CD1-CD1 3.51Å; L633-Y672 HydrophobicContact CD1-CD2 4.24Å; L633-Y672 HydrophobicContact CD1-CE1 3.56Å; L633-Y672 HydrophobicContact CD1-CE2 4.26Å; L633-Y672 HydrophobicContact CD1-CG 3.88Å; L633-Y672 HydrophobicContact CD2-CD2 3.96Å; L633-Y672 HydrophobicContact CD2-CE1 4.24Å; L633-Y672 HydrophobicContact CD2-CE2 3.57Å; L633-Y672 HydrophobicContact CD2-CG 4.43Å; L668-Y672 WeakPolarHBondContact O-CB 3.47Å; L668-Y672 VanDerWaalsContact O-CD2 3.27Å; L668-Y672 WeakPolarHBondContact O-CD2 3.22Å; L668-Y672 PolarHBondContact O-N 2.86Å; L670-Y672 PolarHBondContact O-N 3.45Å; Y672-I674 VanDerWaalsContact C-N 3.33Å; Y672-I674 PolarHBondContact O-N 3.33Å; Y672-L675 PolarHBondContact O-N 3Å; Y672-F676 HydrophobicContact CD1-CD2 4.27Å; Y672-F676 AromaticContact CD1-CE2 3.62Å; Y672-F676 HydrophobicContact CD1-CE2 3.62Å; Y672-F676 HydrophobicContact CD1-CZ 4.48Å; Y672-F676 HydrophobicContact CE1-CE2 4.3Å; Y672-F676 WeakPolarHBondContact O-CD2 3.43Å; Y672-F676 PolarHBondContact O-N 3.37Å
673	A	87.5	Confident	79.4	Confident	10 Å²	10	68.7 Å²	68.7	8%	0.083	38%	0.38	C	S	.	.	H	α-helix	trans	-60.2	-43.2	176.4	0	0	0	0	0	111.7	N669 L670 G677 R678 V680	N669-A673 WeakPolarHBondContact O-CB 3.29Å; N669-A673 PolarHBondContact O-N 3.03Å; L670-A673 WeakPolarHBondContact O-CB 3.39Å; L670-A673 PolarHBondContact O-N 2.86Å; A673-G677 PolarHBondContact O-N 3.05Å; A673-G677 VanDerWaalsContact O-N 3.14Å; A673-R678 CarbonylContact C-O 3.55Å; A673-R678 WeakPolarHBondContact CB-O 3.39Å; A673-R678 PolarHBondContact O-N 2.97Å; A673-R678 VanDerWaalsContact O-O 3.08Å; A673-V680 HydrophobicContact CB-CB 3.92Å; A673-V680 HydrophobicContact CB-CG2 3.71Å
674	I	87.9	Confident	79.2	Confident	44 Å²	44	69.7 Å²	69.7	23%	0.226	38%	0.383	C	S	.	.	H	α-helix	trans	-66.6	-43.6	176.2	-64.8	167	0	0	0	111.1	L670 C671 Y672 F676 G677 M694 A698 C701	L670-I674 HydrophobicContact CD1-CD1 4.35Å; L670-I674 HydrophobicContact CG-CD1 4.17Å; L670-I674 WeakPolarHBondContact O-CG1 3.45Å; L670-I674 PolarHBondContact O-N 3.44Å; C671-I674 PolarHBondContact O-N 3.16Å; Y672-I674 VanDerWaalsContact C-N 3.33Å; Y672-I674 PolarHBondContact O-N 3.33Å; I674-F676 PolarHBondContact O-N 3.13Å; I674-G677 PolarHBondContact O-N 2.69Å; I674-M694 HydrophobicContact CD1-CG 3.76Å; I674-M694 HydrophobicContact CD1-SD 4.45Å; I674-A698 HydrophobicContact CG2-CB 3.96Å; I674-C701 HydrophobicContact CG2-CB 4.25Å
675	L	88.2	Confident	78.7	Confident	29 Å²	29	65.9 Å²	65.9	15%	0.152	37%	0.368	C	S	.	.	H	α-helix	trans	-61.6	-41.3	179.4	-178.5	65.6	0	0	0	112.6	I629 L633 C671 Y672 G677 C701	I629-L675 HydrophobicContact CG2-CD1 4.26Å; I629-L675 HydrophobicContact CG2-CD2 3.99Å; L633-L675 HydrophobicContact CD1-CD2 3.78Å; C671-L675 WeakPolarHBondContact O-CB 3.49Å; C671-L675 PolarHBondContact O-N 3.34Å; Y672-L675 PolarHBondContact O-N 3Å; L675-G677 VanDerWaalsContact C-N 3.33Å; L675-C701 HydrophobicContact CD1-CB 4.29Å
676	F	85.5	Confident	78.3	Confident	144 Å²	144	69.4 Å²	69.4	63%	0.632	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	6.3	179.5	-66.3	-60.2	0	0	0	114	Y672 I674 R678	Y672-F676 HydrophobicContact CD1-CD2 4.27Å; Y672-F676 AromaticContact CD1-CE2 3.62Å; Y672-F676 HydrophobicContact CD1-CE2 3.62Å; Y672-F676 HydrophobicContact CD1-CZ 4.48Å; Y672-F676 HydrophobicContact CE1-CE2 4.3Å; Y672-F676 WeakPolarHBondContact O-CD2 3.43Å; Y672-F676 PolarHBondContact O-N 3.37Å; I674-F676 PolarHBondContact O-N 3.13Å; F676-R678 PolarHBondContact O-N 3.34Å
677	G	79.7	Confident	78.3	Confident	65 Å²	65	67.9 Å²	67.9	67%	0.67	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.1	25.9	179.8	0	0	0	0	0	114.3	A673 I674 L675	A673-G677 PolarHBondContact O-N 3.05Å; A673-G677 VanDerWaalsContact O-N 3.14Å; I674-G677 PolarHBondContact O-N 2.69Å; L675-G677 VanDerWaalsContact C-N 3.33Å
678	R	79.1	Confident	78.1	Confident	196 Å²	196	78.4 Å²	78.4	74%	0.74	40%	0.402	S	S	*	.			trans	-106	136.2	-179.7	-69.3	-125.9	179.9	122.8	-0.6	111	A673 F676 V680	A673-R678 CarbonylContact C-O 3.55Å; A673-R678 WeakPolarHBondContact CB-O 3.39Å; A673-R678 PolarHBondContact O-N 2.97Å; A673-R678 VanDerWaalsContact O-O 3.08Å; F676-R678 PolarHBondContact O-N 3.34Å; R678-V680 PolarHBondContact O-N 3.4Å
679	T	69.4	Low	78	Confident	152 Å²	152	81 Å²	81	93%	0.933	42%	0.419	S	S	*	.			trans	-84	99.2	175.1	49	0	0	0	0	110.1
680	V	68.9	Low	78	Confident	65 Å²	65	77.3 Å²	77.3	39%	0.394	40%	0.4	S	S	.	.			trans	-94.2	137.8	171	-178.9	0	0	0	0	108.9	N669 A673 R678 S682	N669-V680 WeakPolarHBondContact ND2-CG1 3.38Å; A673-V680 HydrophobicContact CB-CB 3.92Å; A673-V680 HydrophobicContact CB-CG2 3.71Å; R678-V680 PolarHBondContact O-N 3.4Å; V680-S682 PolarHBondContact O-N 3.12Å
681	S	57.7	Low	78	Confident	132 Å²	132	82.1 Å²	82.1	92%	0.923	42%	0.417	S	S	*	.			trans	-68.3	80.9	172.8	-169.2	0	0	0	0	110.1
682	S	67	Low	77.9	Confident	24 Å²	24	88.7 Å²	88.7	17%	0.168	45%	0.446	C	S	.	.			trans	-116.9	148.8	171.4	-167.9	0	0	0	0	109.1	S666 V680	S666-S682 PolarHBondContact O-OG 3.16Å; S666-S682 PolarHBondContact OG-OG 3.37Å; V680-S682 PolarHBondContact O-N 3.12Å
683	K	66.7	Low	78	Confident	126 Å²	126	86.5 Å²	86.5	55%	0.548	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-72.8	132.4	178.7	-67.5	-174.4	176.9	-172.3	0	109.1	F662	F662-K683 WeakPolarHBondContact CE2-O 3.49Å
684	T	67.9	Low	77.9	Confident	83 Å²	83	87.7 Å²	87.7	51%	0.509	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-75.6	149.6	178.4	50.7	0	0	0	0	111.6	K686	T684-K686 PolarHBondContact O-N 3.02Å
685	P	70.3	Confident	77.9	Confident	0 Å²	0	90.1 Å²	90.1	0%	0	46%	0.456	C	S	.	.	P	Polyproline II helix	trans	-60.2	136.4	177.2	23	-32.4	0	0	0	111.3	E644 R691 M694	E644-P685 HydrophobicContact CG-CB 4.48Å; E644-P685 WeakPolarHBondContact OE1-CA 3.4Å; E644-P685 WeakPolarHBondContact OE1-CB 3.42Å; P685-R691 HydrophobicContact CG-CG 4.27Å; P685-R691 WeakPolarHBondContact O-CG 3.41Å; P685-R691 PolarHBondContact O-NE 2.83Å; P685-M694 HydrophobicContact CG-CB 4.41Å; P685-M694 HydrophobicContact CG-SD 3.93Å
686	K	71.5	Confident	78.1	Confident	156 Å²	156	93.3 Å²	93.3	68%	0.678	47%	0.473	S	S	*	.			trans	-84.7	-31.5	-179.6	-67.6	-175.7	179.4	-179.7	0	113	T684	T684-K686 PolarHBondContact O-N 3.02Å
687	C	78.6	Confident	78.4	Confident	3 Å²	3	86.9 Å²	86.9	2%	0.02	45%	0.445	C	S	.	.	S	Bend	trans	-74.2	144.9	-179.3	59.4	0	0	0	0	111.3	S647 T689 G690 R691	S647-C687 WeakPolarHBondContact OG-CB 3.13Å; C687-T689 VanDerWaalsContact C-N 3.32Å; C687-T689 PolarHBondContact O-N 2.92Å; C687-G690 PolarHBondContact O-N 2.95Å; C687-G690 VanDerWaalsContact SG-CA 3.57Å; C687-G690 PolarHBondContact SG-N 2.93Å; C687-R691 PolarHBondContact O-N 3.22Å
688	W	80.6	Confident	78.9	Confident	222 Å²	222	85.1 Å²	85.1	84%	0.841	42%	0.424	S	S	*	.	H	α-helix	trans	-63.8	-39.5	-179.8	-130.8	74	0	0	0	111.7	G690 R691 F692	W688-G690 PolarHBondContact O-N 2.78Å; W688-R691 PolarHBondContact O-N 3.36Å; W688-F692 PolarHBondContact O-N 3.23Å
689	T	84.6	Confident	79.5	Confident	81 Å²	81	80.9 Å²	80.9	50%	0.497	42%	0.415	S	S	.	.	H	α-helix	trans	-63.2	-39.3	175	51.1	0	0	0	0	112.7	C687 F692 L693	C687-T689 VanDerWaalsContact C-N 3.32Å; C687-T689 PolarHBondContact O-N 2.92Å; T689-F692 PolarHBondContact O-N 3.06Å; T689-L693 WeakPolarHBondContact O-CB 3.35Å; T689-L693 PolarHBondContact O-N 3.18Å
690	G	83.7	Confident	80.6	Confident	0 Å²	0	77.5 Å²	77.5	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-68.4	-36.8	175.2	0	0	0	0	0	112.8	L640 C687 W688 M694	L640-G690 WeakPolarHBondContact CD2-O 3.02Å; C687-G690 PolarHBondContact O-N 2.95Å; C687-G690 VanDerWaalsContact SG-CA 3.57Å; C687-G690 PolarHBondContact SG-N 2.93Å; W688-G690 PolarHBondContact O-N 2.78Å; G690-M694 VanDerWaalsContact O-CB 3.26Å; G690-M694 WeakPolarHBondContact O-CB 3.47Å; G690-M694 PolarHBondContact O-N 2.81Å
691	R	85.1	Confident	81.6	Confident	116 Å²	116	74.7 Å²	74.7	44%	0.438	37%	0.37	S	S	.	.	H	α-helix	trans	-66.5	-41.5	173.3	-72	-178.6	174.8	171.5	-6.7	112.3	P685 C687 W688 M694 N695	P685-R691 HydrophobicContact CG-CG 4.27Å; P685-R691 WeakPolarHBondContact O-CG 3.41Å; P685-R691 PolarHBondContact O-NE 2.83Å; C687-R691 PolarHBondContact O-N 3.22Å; W688-R691 PolarHBondContact O-N 3.36Å; R691-M694 PolarHBondContact O-N 2.9Å; R691-N695 PolarHBondContact O-N 2.76Å
692	F	88	Confident	83.2	Confident	138 Å²	138	74 Å²	74	61%	0.605	36%	0.356	S	S	*	.	H	α-helix	trans	-62.5	-48.3	174.1	180	-102.1	0	0	0	111.6	W688 T689 M694 N695 L696	W688-F692 PolarHBondContact O-N 3.23Å; T689-F692 PolarHBondContact O-N 3.06Å; F692-M694 VanDerWaalsContact C-N 3.28Å; F692-M694 PolarHBondContact O-N 3.23Å; F692-N695 PolarHBondContact O-N 3.26Å; F692-L696 PolarHBondContact O-N 2.71Å
693	L	89.5	Confident	84.3	Confident	31 Å²	31	78.3 Å²	78.3	16%	0.162	38%	0.376	C	S	.	.	H	α-helix	trans	-60.7	-38	176.2	-176.9	64.3	0	0	0	111.9	T636 F639 L640 Y643 T689 L696 W697	T636-L693 HydrophobicContact CG2-CD2 4.36Å; T636-L693 HydrophobicContact CG2-CG 4.3Å; F639-L693 HydrophobicContact CB-CD2 3.91Å; L640-L693 HydrophobicContact CD2-CB 4.22Å; L640-L693 HydrophobicContact CD2-CD2 3.85Å; L640-L693 HydrophobicContact CD2-CG 4.21Å; L640-L693 HydrophobicContact CG-CD2 3.89Å; Y643-L693 HydrophobicContact CD2-CD2 3.91Å; Y643-L693 HydrophobicContact CE2-CD2 3.74Å; T689-L693 WeakPolarHBondContact O-CB 3.35Å; T689-L693 PolarHBondContact O-N 3.18Å; L693-L696 PolarHBondContact O-N 2.9Å; L693-W697 WeakPolarHBondContact O-CB 3.22Å; L693-W697 PolarHBondContact O-N 3.29Å
694	M	86.1	Confident	85.5	Confident	34 Å²	34	73.7 Å²	73.7	17%	0.167	36%	0.358	C	S	.	.	H	α-helix	trans	-64.5	-42.1	175.6	-173.6	-177.3	74.6	0	0	112	L670 I674 P685 G690 R691 F692 W697 A698	L670-M694 HydrophobicContact CD2-SD 4.13Å; I674-M694 HydrophobicContact CD1-CG 3.76Å; I674-M694 HydrophobicContact CD1-SD 4.45Å; P685-M694 HydrophobicContact CG-CB 4.41Å; P685-M694 HydrophobicContact CG-SD 3.93Å; G690-M694 VanDerWaalsContact O-CB 3.26Å; G690-M694 WeakPolarHBondContact O-CB 3.47Å; G690-M694 PolarHBondContact O-N 2.81Å; R691-M694 PolarHBondContact O-N 2.9Å; F692-M694 VanDerWaalsContact C-N 3.28Å; F692-M694 PolarHBondContact O-N 3.23Å; M694-W697 PolarHBondContact O-N 2.83Å; M694-A698 WeakPolarHBondContact O-CB 3.45Å; M694-A698 PolarHBondContact O-N 3.3Å
695	N	88.8	Confident	86.5	Confident	95 Å²	95	73.7 Å²	73.7	51%	0.508	36%	0.355	S	S	.	.	H	α-helix	trans	-66.2	-40.4	175.3	-71.6	-17	0	0	0	111.7	R691 F692 A698 I699	R691-N695 PolarHBondContact O-N 2.76Å; F692-N695 PolarHBondContact O-N 3.26Å; N695-A698 WeakPolarHBondContact O-CB 3.47Å; N695-A698 PolarHBondContact O-N 3.46Å; N695-I699 WeakPolarHBondContact O-CG1 3.35Å; N695-I699 PolarHBondContact O-N 3.21Å
696	L	91.3	Very high	87.5	Confident	96 Å²	96	77 Å²	77	50%	0.503	38%	0.378	S	S	.	.	H	α-helix	trans	-64.4	-43.1	175.6	-169.4	113.3	0	0	0	111.6	F692 L693 A698 I699 F700	F692-L696 PolarHBondContact O-N 2.71Å; L693-L696 PolarHBondContact O-N 2.9Å; L696-A698 VanDerWaalsContact C-N 3.31Å; L696-A698 PolarHBondContact O-N 3.04Å; L696-I699 PolarHBondContact O-N 2.81Å; L696-F700 PolarHBondContact O-N 2.91Å
697	W	91.8	Very high	88.4	Confident	10 Å²	10	72.1 Å²	72.1	4%	0.038	36%	0.364	C	S	.	.	H	α-helix	trans	-61	-40.2	173	178.3	-110	0	0	0	111.9	A632 L633 T636 C671 L693 M694 F700 C701	A632-W697 HydrophobicContact CB-CH2 4.46Å; A632-W697 HydrophobicContact CB-CZ3 4.11Å; L633-W697 HydrophobicContact CB-CH2 3.8Å; L633-W697 HydrophobicContact CB-CZ2 3.93Å; L633-W697 HydrophobicContact CD1-CZ2 4.17Å; L633-W697 HydrophobicContact CG-CH2 4.45Å; L633-W697 HydrophobicContact CG-CZ2 4.07Å; T636-W697 HydrophobicContact CG2-CB 3.99Å; T636-W697 HydrophobicContact CG2-CD2 3.89Å; T636-W697 HydrophobicContact CG2-CE3 3.99Å; T636-W697 HydrophobicContact CG2-CG 3.89Å; C671-W697 PolarHBondContact O-NE1 3.03Å; L693-W697 WeakPolarHBondContact O-CB 3.22Å; L693-W697 PolarHBondContact O-N 3.29Å; M694-W697 PolarHBondContact O-N 2.83Å; W697-F700 AromaticContact CE3-CD1 3.78Å; W697-F700 HydrophobicContact CE3-CD1 3.78Å; W697-F700 HydrophobicContact CE3-CE1 4.41Å; W697-F700 HydrophobicContact CH2-CD1 4.05Å; W697-F700 HydrophobicContact CH2-CE1 4.01Å; W697-F700 AromaticContact CZ3-CD1 3.45Å; W697-F700 HydrophobicContact CZ3-CD1 3.45Å; W697-F700 VanDerWaalsContact CZ3-CD1 3.45Å; W697-F700 AromaticContact CZ3-CE1 3.63Å; W697-F700 HydrophobicContact CZ3-CE1 3.63Å; W697-F700 PolarHBondContact O-N 3.05Å; W697-C701 VanDerWaalsContact CZ2-SG 3.6Å; W697-C701 PolarHBondContact NE1-SG 3.27Å; W697-C701 VanDerWaalsContact NE1-SG 3.38Å; W697-C701 WeakPolarHBondContact O-CB 3.39Å; W697-C701 PolarHBondContact O-N 3.28Å; W697-C701 PolarHBondContact O-SG 3.1Å
698	A	90	Very high	89	Confident	28 Å²	28	74.4 Å²	74.4	23%	0.231	37%	0.372	C	S	.	.	H	α-helix	trans	-63.7	-43.2	176.2	0	0	0	0	0	112	I674 M694 N695 L696 C701 L702	I674-A698 HydrophobicContact CG2-CB 3.96Å; M694-A698 WeakPolarHBondContact O-CB 3.45Å; M694-A698 PolarHBondContact O-N 3.3Å; N695-A698 WeakPolarHBondContact O-CB 3.47Å; N695-A698 PolarHBondContact O-N 3.46Å; L696-A698 VanDerWaalsContact C-N 3.31Å; L696-A698 PolarHBondContact O-N 3.04Å; A698-C701 PolarHBondContact O-N 3Å; A698-L702 WeakPolarHBondContact O-CG 3.39Å; A698-L702 PolarHBondContact O-N 3.12Å
699	I	91.9	Very high	89.4	Confident	106 Å²	106	67.3 Å²	67.3	54%	0.544	35%	0.354	S	S	.	.	H	α-helix	trans	-60.8	-45.7	174.1	-66.5	165.5	0	0	0	110.5	N695 L696 C701 L702 L703	N695-I699 WeakPolarHBondContact O-CG1 3.35Å; N695-I699 PolarHBondContact O-N 3.21Å; L696-I699 PolarHBondContact O-N 2.81Å; I699-C701 PolarHBondContact O-N 3.38Å; I699-L702 PolarHBondContact O-N 2.97Å; I699-L703 HydrophobicContact CG2-CD1 4.26Å; I699-L703 WeakPolarHBondContact O-CG 3.15Å; I699-L703 PolarHBondContact O-N 3.19Å
700	F	92.1	Very high	89.7	Confident	81 Å²	81	66.1 Å²	66.1	36%	0.355	35%	0.352	S	S	.	.	H	α-helix	trans	-59.2	-45.5	176	174.6	-101	0	0	0	112.2	L696 W697 L702 L703 V704	L696-F700 PolarHBondContact O-N 2.91Å; W697-F700 AromaticContact CE3-CD1 3.78Å; W697-F700 HydrophobicContact CE3-CD1 3.78Å; W697-F700 HydrophobicContact CE3-CE1 4.41Å; W697-F700 HydrophobicContact CH2-CD1 4.05Å; W697-F700 HydrophobicContact CH2-CE1 4.01Å; W697-F700 AromaticContact CZ3-CD1 3.45Å; W697-F700 HydrophobicContact CZ3-CD1 3.45Å; W697-F700 VanDerWaalsContact CZ3-CD1 3.45Å; W697-F700 AromaticContact CZ3-CE1 3.63Å; W697-F700 HydrophobicContact CZ3-CE1 3.63Å; W697-F700 PolarHBondContact O-N 3.05Å; F700-L702 VanDerWaalsContact C-N 3.34Å; F700-L702 PolarHBondContact O-N 3.5Å; F700-L703 PolarHBondContact O-N 3.36Å; F700-V704 HydrophobicContact CD1-CG2 4.34Å; F700-V704 HydrophobicContact CD2-CG2 4.38Å; F700-V704 HydrophobicContact CE1-CG2 3.89Å; F700-V704 HydrophobicContact CE2-CG2 3.94Å; F700-V704 HydrophobicContact CZ-CG2 3.67Å; F700-V704 WeakPolarHBondContact O-CG2 3.36Å; F700-V704 PolarHBondContact O-N 3.1Å
701	C	91.2	Very high	89.9	Confident	6 Å²	6	69.2 Å²	69.2	4%	0.041	37%	0.368	C	S	.	.	H	α-helix	trans	-61.9	-40.5	176.5	-68.6	0	0	0	0	112.2	I674 L675 W697 A698 I699 V704 L705	I674-C701 HydrophobicContact CG2-CB 4.25Å; L675-C701 HydrophobicContact CD1-CB 4.29Å; W697-C701 VanDerWaalsContact CZ2-SG 3.6Å; W697-C701 PolarHBondContact NE1-SG 3.27Å; W697-C701 VanDerWaalsContact NE1-SG 3.38Å; W697-C701 WeakPolarHBondContact O-CB 3.39Å; W697-C701 PolarHBondContact O-N 3.28Å; W697-C701 PolarHBondContact O-SG 3.1Å; A698-C701 PolarHBondContact O-N 3Å; I699-C701 PolarHBondContact O-N 3.38Å; C701-V704 PolarHBondContact O-N 2.68Å; C701-L705 VanDerWaalsContact O-CB 3.26Å; C701-L705 WeakPolarHBondContact O-CB 3.47Å; C701-L705 PolarHBondContact O-N 2.83Å
702	L	90.1	Very high	89.8	Confident	117 Å²	117	65.9 Å²	65.9	61%	0.613	36%	0.359	S	S	*	.	H	α-helix	trans	-63.5	-41	175.6	-73.1	173.3	0	0	0	111.8	A698 I699 F700 S706	A698-L702 WeakPolarHBondContact O-CG 3.39Å; A698-L702 PolarHBondContact O-N 3.12Å; I699-L702 PolarHBondContact O-N 2.97Å; F700-L702 VanDerWaalsContact C-N 3.34Å; F700-L702 PolarHBondContact O-N 3.5Å; L702-S706 WeakPolarHBondContact O-CB 3.46Å; L702-S706 PolarHBondContact O-N 3.03Å
703	L	91.2	Very high	89.4	Confident	115 Å²	115	61.7 Å²	61.7	60%	0.602	35%	0.35	S	S	*	.	H	α-helix	trans	-64.8	-44.7	175.9	-69.8	175.3	0	0	0	111.9	I699 F700 S706 S707	I699-L703 HydrophobicContact CG2-CD1 4.26Å; I699-L703 WeakPolarHBondContact O-CG 3.15Å; I699-L703 PolarHBondContact O-N 3.19Å; F700-L703 PolarHBondContact O-N 3.36Å; L703-S706 PolarHBondContact O-N 2.71Å; L703-S707 WeakPolarHBondContact O-CB 3.37Å; L703-S707 PolarHBondContact O-N 3.06Å
704	V	90.9	Very high	89	Confident	29 Å²	29	63.3 Å²	63.3	18%	0.176	37%	0.367	C	S	.	.	H	α-helix	trans	-63.5	-44.8	176.9	170.8	0	0	0	0	111.1	I629 F700 C701 S707 Y708	I629-V704 HydrophobicContact CD1-CG1 3.61Å; I629-V704 HydrophobicContact CG1-CG1 4.22Å; F700-V704 HydrophobicContact CD1-CG2 4.34Å; F700-V704 HydrophobicContact CD2-CG2 4.38Å; F700-V704 HydrophobicContact CE1-CG2 3.89Å; F700-V704 HydrophobicContact CE2-CG2 3.94Å; F700-V704 HydrophobicContact CZ-CG2 3.67Å; F700-V704 WeakPolarHBondContact O-CG2 3.36Å; F700-V704 PolarHBondContact O-N 3.1Å; C701-V704 PolarHBondContact O-N 2.68Å; V704-S707 PolarHBondContact O-N 2.76Å; V704-Y708 WeakPolarHBondContact O-CB 3.42Å; V704-Y708 PolarHBondContact O-N 3.22Å
705	L	89.3	Confident	88.5	Confident	84 Å²	84	64.6 Å²	64.6	44%	0.44	38%	0.377	S	S	.	.	H	α-helix	trans	-62.4	-46.7	177.4	-178.8	62.9	0	0	0	111.2	C701 Y708 T709	C701-L705 VanDerWaalsContact O-CB 3.26Å; C701-L705 WeakPolarHBondContact O-CB 3.47Å; C701-L705 PolarHBondContact O-N 2.83Å; L705-Y708 PolarHBondContact O-N 2.66Å; L705-T709 HydrophobicContact CD1-CG2 4.47Å; L705-T709 WeakPolarHBondContact O-CG2 3.38Å; L705-T709 PolarHBondContact O-N 3.34Å; L705-T709 PolarHBondContact O-OG1 3.44Å; L705-T709 VanDerWaalsContact O-OG1 3.14Å
706	S	90.3	Very high	87.8	Confident	70 Å²	70	63.1 Å²	63.1	49%	0.49	37%	0.368	S	S	.	.	H	α-helix	trans	-58.9	-48.8	176.8	-178.4	0	0	0	0	111.5	L702 L703 Y708 T709 A710	L702-S706 WeakPolarHBondContact O-CB 3.46Å; L702-S706 PolarHBondContact O-N 3.03Å; L703-S706 PolarHBondContact O-N 2.71Å; S706-Y708 PolarHBondContact O-N 3.01Å; S706-T709 WeakPolarHBondContact CA-OG1 3.23Å; S706-T709 PolarHBondContact O-N 3.37Å; S706-T709 PolarHBondContact O-OG1 3.32Å; S706-A710 WeakPolarHBondContact O-CB 3.35Å; S706-A710 PolarHBondContact O-N 3.21Å
707	S	91.7	Very high	86.7	Confident	52 Å²	52	64.3 Å²	64.3	36%	0.364	38%	0.379	S	S	.	.	H	α-helix	trans	-63.2	-41.3	177.6	177	0	0	0	0	112.6	L703 V704 A710 N711	L703-S707 WeakPolarHBondContact O-CB 3.37Å; L703-S707 PolarHBondContact O-N 3.06Å; V704-S707 PolarHBondContact O-N 2.76Å; S707-A710 PolarHBondContact O-N 2.97Å; S707-N711 WeakPolarHBondContact O-CB 3.48Å; S707-N711 PolarHBondContact O-N 3.19Å
708	Y	91.3	Very high	85.3	Confident	52 Å²	52	65.7 Å²	65.7	20%	0.204	40%	0.396	C	S	.	.	H	α-helix	trans	-60.3	-46.5	174.2	175.1	-93.6	0	0	0	111.1	F617 P620 L621 W626 V704 L705 S706 A710 L712	F617-Y708 PolarHBondContact O-OH 3.01Å; P620-Y708 HydrophobicContact CB-CD2 4.06Å; P620-Y708 HydrophobicContact CB-CE2 4.1Å; P620-Y708 HydrophobicContact CG-CE2 4.09Å; L621-Y708 HydrophobicContact CD1-CD2 3.9Å; L621-Y708 HydrophobicContact CG-CD2 4.17Å; W626-Y708 HydrophobicContact CH2-CD2 4.26Å; W626-Y708 AromaticContact CH2-CE2 3.98Å; W626-Y708 HydrophobicContact CH2-CE2 3.98Å; W626-Y708 HydrophobicContact CZ2-CD2 4.27Å; W626-Y708 AromaticContact CZ2-CE2 3.93Å; W626-Y708 HydrophobicContact CZ2-CE2 3.93Å; V704-Y708 WeakPolarHBondContact O-CB 3.42Å; V704-Y708 PolarHBondContact O-N 3.22Å; L705-Y708 PolarHBondContact O-N 2.66Å; S706-Y708 PolarHBondContact O-N 3.01Å; Y708-A710 PolarHBondContact O-N 3.37Å; Y708-L712 HydrophobicContact CE1-CD2 4.03Å; Y708-L712 WeakPolarHBondContact O-CB 3.18Å; Y708-L712 PolarHBondContact O-N 3.42Å
709	T	89.6	Confident	83.6	Confident	73 Å²	73	73.1 Å²	73.1	45%	0.448	43%	0.426	S	S	.	.	H	α-helix	trans	-65.4	-37.6	178.9	54.4	0	0	0	0	112.8	L705 S706 A713	L705-T709 HydrophobicContact CD1-CG2 4.47Å; L705-T709 WeakPolarHBondContact O-CG2 3.38Å; L705-T709 PolarHBondContact O-N 3.34Å; L705-T709 PolarHBondContact O-OG1 3.44Å; L705-T709 VanDerWaalsContact O-OG1 3.14Å; S706-T709 WeakPolarHBondContact CA-OG1 3.23Å; S706-T709 PolarHBondContact O-N 3.37Å; S706-T709 PolarHBondContact O-OG1 3.32Å; T709-A713 WeakPolarHBondContact O-CB 3.45Å; T709-A713 PolarHBondContact O-N 3.46Å
710	A	88.9	Confident	81.7	Confident	55 Å²	55	71.3 Å²	71.3	46%	0.455	41%	0.414	S	S	.	.	H	α-helix	trans	-69.1	-46	177.7	0	0	0	0	0	112.1	S706 S707 Y708 A713 A714	S706-A710 WeakPolarHBondContact O-CB 3.35Å; S706-A710 PolarHBondContact O-N 3.21Å; S707-A710 PolarHBondContact O-N 2.97Å; Y708-A710 PolarHBondContact O-N 3.37Å; A710-A713 PolarHBondContact O-N 3.4Å; A710-A714 PolarHBondContact O-N 3.48Å
711	N	88.9	Confident	79.9	Confident	66 Å²	66	72 Å²	72	35%	0.353	43%	0.425	S	S	.	.	H	α-helix	trans	-68.1	-37.5	178.3	-71.4	-3.3	0	0	0	111.7	P620 S707 A714 V715	P620-N711 HydrophobicContact CB-CB 3.92Å; P620-N711 PolarHBondContact O-ND2 2.97Å; P620-N711 VanDerWaalsContact O-ND2 3.11Å; S707-N711 WeakPolarHBondContact O-CB 3.48Å; S707-N711 PolarHBondContact O-N 3.19Å; N711-A714 PolarHBondContact O-N 3.28Å; N711-V715 WeakPolarHBondContact O-CB 3.32Å; N711-V715 WeakPolarHBondContact O-CG2 3.44Å; N711-V715 PolarHBondContact O-N 3.39Å
712	L	83.4	Confident	78.2	Confident	46 Å²	46	78.6 Å²	78.6	24%	0.241	45%	0.453	C	S	.	.	H	α-helix	trans	-61.6	-46.3	174	178.3	63.3	0	0	0	110.5	P620 Y708 A714 V715 M716	P620-L712 HydrophobicContact CB-CB 4.24Å; P620-L712 HydrophobicContact CG-CB 3.78Å; P620-L712 HydrophobicContact CG-CD1 3.71Å; P620-L712 HydrophobicContact CG-CG 4.33Å; Y708-L712 HydrophobicContact CE1-CD2 4.03Å; Y708-L712 WeakPolarHBondContact O-CB 3.18Å; Y708-L712 PolarHBondContact O-N 3.42Å; L712-A714 PolarHBondContact O-N 2.96Å; L712-V715 PolarHBondContact O-N 3.08Å; L712-M716 HydrophobicContact CD1-CG 4.05Å; L712-M716 HydrophobicContact CD1-SD 3.76Å; L712-M716 HydrophobicContact CD2-SD 4.25Å; L712-M716 HydrophobicContact CG-CG 4.35Å; L712-M716 HydrophobicContact CG-SD 3.62Å; L712-M716 VanDerWaalsContact O-CB 3.23Å; L712-M716 WeakPolarHBondContact O-CB 3.44Å; L712-M716 WeakPolarHBondContact O-CG 3.43Å; L712-M716 PolarHBondContact O-N 3.19Å
713	A	79.6	Confident	77	Confident	50 Å²	50	78.6 Å²	78.6	41%	0.413	45%	0.45	S	S	.	.	H	α-helix	trans	-59.1	-45.3	175.1	0	0	0	0	0	111.7	T709 A710 V715 M716 V717	T709-A713 WeakPolarHBondContact O-CB 3.45Å; T709-A713 PolarHBondContact O-N 3.46Å; A710-A713 PolarHBondContact O-N 3.4Å; A713-V715 PolarHBondContact O-N 3.32Å; A713-M716 PolarHBondContact O-N 2.84Å; A713-V717 WeakPolarHBondContact O-CB 3.49Å; A713-V717 WeakPolarHBondContact O-CG2 3.48Å; A713-V717 PolarHBondContact O-N 3.06Å
714	A	81.3	Confident	75.8	Confident	64 Å²	64	76.1 Å²	76.1	53%	0.529	44%	0.436	S	S	.	.	H	α-helix	trans	-61.1	-45	177.7	0	0	0	0	0	113	A710 N711 L712 M716 V717 G718	A710-A714 PolarHBondContact O-N 3.48Å; N711-A714 PolarHBondContact O-N 3.28Å; L712-A714 PolarHBondContact O-N 2.96Å; A714-M716 VanDerWaalsContact C-N 3.32Å; A714-M716 PolarHBondContact O-N 2.83Å; A714-V717 PolarHBondContact O-N 2.6Å; A714-G718 PolarHBondContact O-N 3.25Å
715	V	75.6	Confident	75.2	Confident	61 Å²	61	74.8 Å²	74.8	37%	0.37	43%	0.427	S	S	.	.	H	α-helix	trans	-69.9	-30.7	177.4	171.6	0	0	0	0	112	W619 N711 L712 A713	W619-V715 HydrophobicContact CE3-CG1 4.25Å; N711-V715 WeakPolarHBondContact O-CB 3.32Å; N711-V715 WeakPolarHBondContact O-CG2 3.44Å; N711-V715 PolarHBondContact O-N 3.39Å; L712-V715 PolarHBondContact O-N 3.08Å; A713-V715 PolarHBondContact O-N 3.32Å
716	M	72.5	Confident	74.8	Confident	64 Å²	64	75 Å²	75	32%	0.315	44%	0.436	S	S	.	.	H	α-helix	trans	-71.5	-36.7	175.8	-78.7	175.2	72.7	0	0	112.3	L712 A713 A714 M874	L712-M716 HydrophobicContact CD1-CG 4.05Å; L712-M716 HydrophobicContact CD1-SD 3.76Å; L712-M716 HydrophobicContact CD2-SD 4.25Å; L712-M716 HydrophobicContact CG-CG 4.35Å; L712-M716 HydrophobicContact CG-SD 3.62Å; L712-M716 VanDerWaalsContact O-CB 3.23Å; L712-M716 WeakPolarHBondContact O-CB 3.44Å; L712-M716 WeakPolarHBondContact O-CG 3.43Å; L712-M716 PolarHBondContact O-N 3.19Å; A713-M716 PolarHBondContact O-N 2.84Å; A714-M716 VanDerWaalsContact C-N 3.32Å; A714-M716 PolarHBondContact O-N 2.83Å; M716-M874 HydrophobicContact CB-CE 3.52Å; M716-M874 HydrophobicContact CE-CB 4.46Å; M716-M874 HydrophobicContact CE-CE 3.39Å; M716-M874 HydrophobicContact CE-CG 3.5Å; M716-M874 VanDerWaalsContact CE-CG 3.5Å; M716-M874 HydrophobicContact CE-SD 3.56Å; M716-M874 VanDerWaalsContact CE-SD 3.56Å; M716-M874 HydrophobicContact CG-CE 3.58Å; M716-M874 HydrophobicContact CG-SD 4.5Å; M716-M874 HydrophobicContact SD-CE 4.31Å
717	V	69.1	Low	74.6	Confident	122 Å²	122	72.1 Å²	72.1	74%	0.739	42%	0.417	S	S	*	.	H	α-helix	trans	-77.7	-28.2	177.7	170.9	0	0	0	0	112.4	A713 A714 E719	A713-V717 WeakPolarHBondContact O-CB 3.49Å; A713-V717 WeakPolarHBondContact O-CG2 3.48Å; A713-V717 PolarHBondContact O-N 3.06Å; A714-V717 PolarHBondContact O-N 2.6Å; V717-E719 PolarHBondContact O-N 2.78Å
718	G	62.6	Low	74.5	Confident	38 Å²	38	70.2 Å²	70.2	39%	0.392	40%	0.403	S	S	.	.	S	Bend	trans	-52	129.6	177.1	0	0	0	0	0	112.1	A714 K720	A714-G718 PolarHBondContact O-N 3.25Å; G718-K720 PolarHBondContact O-N 2.73Å
719	E	53.3	Low	74.4	Confident	184 Å²	184	74.6 Å²	74.6	86%	0.86	43%	0.425	S	S	*	.			trans	-57	123.7	-178.7	-64.9	173.7	174.1	0	0	110.3	V717	V717-E719 PolarHBondContact O-N 2.78Å
720	K	51.9	Low	74.3	Confident	69 Å²	69	72.4 Å²	72.4	30%	0.3	41%	0.41	S	S	.	.			trans	-104.9	13.5	-174.9	-72.7	177.2	-174.5	135.6	0	114	T610 G718 F722	T610-K720 PolarHBondContact OG1-O 3.09Å; G718-K720 PolarHBondContact O-N 2.73Å; K720-F722 PolarHBondContact O-N 2.92Å; K720-F722 VanDerWaalsContact O-N 3.16Å
721	T	56.3	Low	74.1	Confident	95 Å²	95	72.3 Å²	72.3	58%	0.583	41%	0.409	S	S	*	.			trans	-81.8	91.9	171.8	48	0	0	0	0	108.2	E723	T721-E723 PolarHBondContact O-N 2.84Å
722	F	55.4	Low	74	Confident	144 Å²	144	72.5 Å²	72.5	63%	0.632	41%	0.407	S	S	*	.			trans	-77.5	114.4	170.6	-69.7	-82.9	0	0	0	108.8	T610 K720 E724	T610-F722 HydrophobicContact CG2-CD2 4.09Å; K720-F722 PolarHBondContact O-N 2.92Å; K720-F722 VanDerWaalsContact O-N 3.16Å; F722-E724 PolarHBondContact O-N 2.93Å
723	E	63.1	Low	74.2	Confident	117 Å²	117	70.3 Å²	70.3	55%	0.547	40%	0.395	S	S	.	.			trans	-67.9	122.9	165.2	-65	177.8	-177	0	0	108.4	T721 V725 V812	T721-E723 PolarHBondContact O-N 2.84Å; E723-V725 PolarHBondContact O-N 3.01Å; E723-V812 HydrophobicContact CB-CG1 4.04Å; E723-V812 VanDerWaalsContact CD-CG1 3.45Å; E723-V812 HydrophobicContact CG-CG1 3.72Å; E723-V812 WeakPolarHBondContact OE2-CG1 3.42Å
724	E	66.3	Low	74.5	Confident	64 Å²	64	71 Å²	71	30%	0.299	39%	0.39	S	S	.	.	S	Bend	trans	-71.7	-20.9	-178.3	-72.7	-166.9	150.1	0	0	113	K608 F722 K732	K608-E724 VanDerWaalsContact CD-OE1 3.3Å; K608-E724 WeakPolarHBondContact CD-OE1 3.44Å; K608-E724 WeakPolarHBondContact CE-OE1 3.37Å; K608-E724 IonicContact NZ-OE1 2.75Å; K608-E724 PolarHBondContact NZ-OE1 3.38Å; K608-E724 IonicContact NZ-OE2 3.17Å; K608-E724 PolarHBondContact NZ-OE2 3Å; F722-E724 PolarHBondContact O-N 2.93Å; E724-K732 PolarHBondContact O-NZ 3.02Å
725	V	79.4	Confident	74.6	Confident	1 Å²	1	73.4 Å²	73.4	1%	0.006	39%	0.39	C	S	.	.			trans	-132.4	129.9	-175.3	173.9	0	0	0	0	109.4	E723 G727 D730 L733 F740 V812	E723-V725 PolarHBondContact O-N 3.01Å; V725-G727 WeakPolarHBondContact CG1-O 3.46Å; V725-D730 HydrophobicContact CG1-CB 3.98Å; V725-L733 HydrophobicContact CG1-CD1 4Å; V725-F740 HydrophobicContact CG2-CE1 3.83Å; V725-F740 HydrophobicContact CG2-CE2 3.97Å; V725-F740 HydrophobicContact CG2-CZ 3.32Å; V725-V812 HydrophobicContact CB-CG2 4.43Å
726	S	80.5	Confident	74.3	Confident	89 Å²	89	72.2 Å²	72.2	62%	0.622	38%	0.384	S	S	*	.			trans	-84.6	-19.1	-179.3	56.4	0	0	0	0	114	D730 G813	S726-D730 PolarHBondContact N-OD2 3.37Å; S726-D730 PolarHBondContact OG-OD2 3.37Å; S726-G813 WeakPolarHBondContact O-CA 3.46Å
727	G	87.1	Confident	73.6	Confident	8 Å²	8	74.5 Å²	74.5	8%	0.082	41%	0.406	C	S	.	.	S	Bend	trans	156.9	-167.4	178.5	0	0	0	0	0	112.7	V725 H729 D730 L733	V725-G727 WeakPolarHBondContact CG1-O 3.46Å; G727-H729 VanDerWaalsContact C-N 3.29Å; G727-H729 PolarHBondContact O-N 3.26Å; G727-D730 VanDerWaalsContact O-CB 3.29Å; G727-D730 WeakPolarHBondContact O-CB 3.34Å; G727-D730 PolarHBondContact O-N 3.31Å; G727-L733 WeakPolarHBondContact O-CD1 3.42Å
728	I	89.3	Confident	73.4	Confident	13 Å²	13	76 Å²	76	7%	0.067	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-30.9	-173.7	-166.8	58.6	0	0	0	114	I603 D730 L733 M754 F758 M761 F816	I603-I728 HydrophobicContact CD1-CB 4.48Å; I603-I728 HydrophobicContact CD1-CD1 4.43Å; I728-D730 VanDerWaalsContact C-N 3.25Å; I728-D730 PolarHBondContact O-N 3.18Å; I728-L733 HydrophobicContact CD1-CD1 4.4Å; I728-M754 HydrophobicContact CD1-CE 4.27Å; I728-M754 HydrophobicContact CD1-SD 4.32Å; I728-F758 HydrophobicContact CG1-CE2 3.94Å; I728-F758 HydrophobicContact CG1-CZ 4.25Å; I728-M761 HydrophobicContact CD1-CE 3.83Å; I728-M761 HydrophobicContact CD1-SD 4.31Å; I728-M761 HydrophobicContact CG1-CE 4.45Å; I728-F816 HydrophobicContact CB-CD1 3.92Å; I728-F816 HydrophobicContact CB-CE1 3.74Å; I728-F816 HydrophobicContact CB-CE2 4.48Å; I728-F816 HydrophobicContact CB-CG 4.39Å; I728-F816 HydrophobicContact CB-CZ 4.04Å; I728-F816 HydrophobicContact CD1-CE1 4.13Å; I728-F816 HydrophobicContact CD1-CE2 4.05Å; I728-F816 HydrophobicContact CD1-CZ 3.61Å; I728-F816 HydrophobicContact CG1-CD1 4.45Å; I728-F816 HydrophobicContact CG1-CD2 4.39Å; I728-F816 HydrophobicContact CG1-CE1 4.07Å; I728-F816 HydrophobicContact CG1-CE2 3.99Å; I728-F816 HydrophobicContact CG1-CZ 3.82Å; I728-F816 HydrophobicContact CG2-CD1 4.04Å; I728-F816 HydrophobicContact CG2-CE1 4.38Å; I728-F816 HydrophobicContact CG2-CG 4.22Å
729	H	87.9	Confident	74.1	Confident	144 Å²	144	76.7 Å²	76.7	67%	0.667	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	13.1	-179.7	-62.6	-52.2	0	0	0	113.9	G727 H734 F758	G727-H729 VanDerWaalsContact C-N 3.29Å; G727-H729 PolarHBondContact O-N 3.26Å; H729-H734 AromaticContact ND1-NE2 3.73Å; H729-F758 AromaticContact CE1-CZ 3.94Å
730	D	88.4	Confident	75.8	Confident	27 Å²	27	68.6 Å²	68.6	14%	0.144	37%	0.371	C	S	.	.			trans	-65.8	137.4	177.5	-160	-51.2	0	0	0	110.8	V725 S726 G727 I728 K732 L733 H734	V725-D730 HydrophobicContact CG1-CB 3.98Å; S726-D730 PolarHBondContact N-OD2 3.37Å; S726-D730 PolarHBondContact OG-OD2 3.37Å; G727-D730 VanDerWaalsContact O-CB 3.29Å; G727-D730 WeakPolarHBondContact O-CB 3.34Å; G727-D730 PolarHBondContact O-N 3.31Å; I728-D730 VanDerWaalsContact C-N 3.25Å; I728-D730 PolarHBondContact O-N 3.18Å; D730-K732 PolarHBondContact O-N 3.47Å; D730-K732 VanDerWaalsContact O-N 3.12Å; D730-K732 PolarHBondContact OD1-N 3.01Å; D730-L733 PolarHBondContact O-N 2.92Å; D730-H734 PolarHBondContact O-N 3.39Å
731	A	85.4	Confident	77.7	Confident	52 Å²	52	68.8 Å²	68.8	43%	0.43	37%	0.37	S	S	.	.	H	α-helix	trans	-59	-25.2	177.8	0	0	0	0	0	112.5	H735	A731-H735 WeakPolarHBondContact O-CB 3.4Å; A731-H735 PolarHBondContact O-N 2.83Å
732	K	85.2	Confident	79.4	Confident	71 Å²	71	64.3 Å²	64.3	31%	0.309	34%	0.343	S	S	.	.	H	α-helix	trans	-67.2	-33.1	175.5	-67.9	179.2	-178.9	177.1	0	113.4	E724 D730 F740	E724-K732 PolarHBondContact O-NZ 3.02Å; D730-K732 PolarHBondContact O-N 3.47Å; D730-K732 VanDerWaalsContact O-N 3.12Å; D730-K732 PolarHBondContact OD1-N 3.01Å; K732-F740 HydrophobicContact CB-CD1 4.49Å; K732-F740 HydrophobicContact CB-CG 4.44Å
733	L	87.9	Confident	81.2	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-81.6	-42.3	177.9	-71.7	170.8	0	0	0	111.5	I603 V725 G727 I728 D730 F740 F742 M761	I603-L733 HydrophobicContact CD1-CD1 3.83Å; V725-L733 HydrophobicContact CG1-CD1 4Å; G727-L733 WeakPolarHBondContact O-CD1 3.42Å; I728-L733 HydrophobicContact CD1-CD1 4.4Å; D730-L733 PolarHBondContact O-N 2.92Å; L733-F740 HydrophobicContact CD2-CD1 4.05Å; L733-F740 HydrophobicContact CD2-CE1 3.73Å; L733-F740 HydrophobicContact CG-CE1 4.43Å; L733-F742 HydrophobicContact CD2-CB 4.19Å; L733-F742 HydrophobicContact CD2-CD1 3.61Å; L733-F742 HydrophobicContact CD2-CD2 4.07Å; L733-F742 HydrophobicContact CD2-CE1 3.99Å; L733-F742 HydrophobicContact CD2-CE2 4.42Å; L733-F742 HydrophobicContact CD2-CG 3.67Å; L733-F742 HydrophobicContact CD2-CZ 4.41Å; L733-M761 HydrophobicContact CB-SD 3.99Å
734	H	86.1	Confident	82.7	Confident	63 Å²	63	51.9 Å²	51.9	29%	0.292	29%	0.286	S	S	.	.	H	α-helix	trans	-70.8	-29.7	178.8	-78.2	-77.1	0	0	0	113.6	H729 D730 P736 F758	H729-H734 AromaticContact ND1-NE2 3.73Å; D730-H734 PolarHBondContact O-N 3.39Å; H734-P736 WeakPolarHBondContact O-CD 3.33Å; H734-F758 AromaticContact CE1-CD1 3.82Å; H734-F758 AromaticContact CE1-CE1 3.8Å
735	H	83.8	Confident	84	Confident	116 Å²	116	49 Å²	49	54%	0.537	27%	0.273	S	S	.	.			trans	-120.4	84.1	178.6	-58.8	99.8	0	0	0	111.1	A731 S737	A731-H735 WeakPolarHBondContact O-CB 3.4Å; A731-H735 PolarHBondContact O-N 2.83Å; H735-S737 PolarHBondContact O-N 3.38Å
736	P	69.6	Low	84.6	Confident	36 Å²	36	55.3 Å²	55.3	23%	0.234	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-66.5	-3.4	-177.1	23.8	-32	0	0	0	114.6	H734 K738 G739 Y764	H734-P736 WeakPolarHBondContact O-CD 3.33Å; P736-K738 PolarHBondContact O-N 3.3Å; P736-G739 PolarHBondContact O-N 2.92Å; P736-Y764 HydrophobicContact CB-CD1 3.7Å; P736-Y764 HydrophobicContact CB-CD2 3.65Å; P736-Y764 HydrophobicContact CB-CE1 3.69Å; P736-Y764 HydrophobicContact CB-CE2 3.67Å; P736-Y764 HydrophobicContact CB-CG 3.64Å; P736-Y764 HydrophobicContact CG-CD1 4.27Å; P736-Y764 HydrophobicContact CG-CD2 3.94Å; P736-Y764 HydrophobicContact CG-CE2 4.42Å; P736-Y764 HydrophobicContact CG-CG 3.83Å
737	S	57.8	Low	85.1	Confident	112 Å²	112	51.6 Å²	51.6	78%	0.783	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-58.9	-8	176.8	53.6	0	0	0	0	114.9	H735	H735-S737 PolarHBondContact O-N 3.38Å
738	K	63.4	Low	85.3	Confident	153 Å²	153	51.2 Å²	51.2	67%	0.665	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-92.6	6.2	174.9	-64.7	-178.4	179.6	175.5	0	114.5	P736	P736-K738 PolarHBondContact O-N 3.3Å
739	G	78.8	Confident	85.3	Confident	52 Å²	52	50.7 Å²	50.7	54%	0.536	26%	0.263	S	S	.	.			trans	76.9	19.6	176.6	0	0	0	0	0	114.8	P736	P736-G739 PolarHBondContact O-N 2.92Å
740	F	88.4	Confident	85.5	Confident	15 Å²	15	43.9 Å²	43.9	7%	0.066	23%	0.232	C	C	.	.			trans	-82.5	119.4	176.8	-167.7	-104.9	0	0	0	109.8	V725 K732 L733 F742 Y764 D788 A789	V725-F740 HydrophobicContact CG2-CE1 3.83Å; V725-F740 HydrophobicContact CG2-CE2 3.97Å; V725-F740 HydrophobicContact CG2-CZ 3.32Å; K732-F740 HydrophobicContact CB-CD1 4.49Å; K732-F740 HydrophobicContact CB-CG 4.44Å; L733-F740 HydrophobicContact CD2-CD1 4.05Å; L733-F740 HydrophobicContact CD2-CE1 3.73Å; L733-F740 HydrophobicContact CG-CE1 4.43Å; F740-F742 AromaticContact CD1-CD1 3.97Å; F740-F742 HydrophobicContact CD1-CD1 3.97Å; F740-F742 HydrophobicContact CE1-CB 4.45Å; F740-F742 HydrophobicContact CE1-CD1 4.43Å; F740-Y764 VanDerWaalsContact O-CE1 3.22Å; F740-Y764 WeakPolarHBondContact O-CE1 3.33Å; F740-Y764 PolarHBondContact O-OH 3.19Å; F740-D788 HydrophobicContact CD2-CB 3.74Å; F740-D788 HydrophobicContact CE2-CB 3.45Å; F740-D788 VanDerWaalsContact CE2-CB 3.45Å; F740-D788 HydrophobicContact CG-CB 4.43Å; F740-D788 HydrophobicContact CZ-CB 3.91Å; F740-A789 HydrophobicContact CE1-CB 3.74Å; F740-A789 HydrophobicContact CZ-CB 3.67Å
741	R	90.7	Very high	85.7	Confident	73 Å²	73	43.9 Å²	43.9	28%	0.275	23%	0.231	S	C	.	.			trans	-101.1	125.4	-176.1	-65	163.7	-66.4	166.6	7	110.1	F768 P785 Q786 L787 D788 A789	R741-F768 HydrophobicContact CB-CE1 4.44Å; R741-F768 HydrophobicContact CG-CE1 3.95Å; R741-F768 HydrophobicContact CG-CE2 4.34Å; R741-F768 HydrophobicContact CG-CZ 3.85Å; R741-P785 VanDerWaalsContact CZ-O 3.23Å; R741-P785 PolarHBondContact NH1-O 3.34Å; R741-P785 PolarHBondContact NH2-O 2.93Å; R741-Q786 WeakPolarHBondContact CD-O 3.45Å; R741-Q786 PolarHBondContact NE-O 3.43Å; R741-Q786 PolarHBondContact NH1-O 2.86Å; R741-Q786 VanDerWaalsContact NH1-O 3.13Å; R741-L787 HydrophobicContact CB-CD2 4.44Å; R741-D788 IonicContact CZ-OD2 2.92Å; R741-D788 PolarHBondContact N-OD2 3.03Å; R741-D788 IonicContact NE-OD2 3.19Å; R741-D788 PolarHBondContact NE-OD2 3.38Å; R741-D788 IonicContact NH2-OD1 2.97Å; R741-D788 PolarHBondContact NH2-OD1 3.48Å; R741-D788 IonicContact NH2-OD2 3.11Å; R741-D788 WeakPolarHBondContact O-CA 3.31Å; R741-D788 WeakPolarHBondContact O-CB 3.33Å; R741-D788 PolarHBondContact O-N 3.13Å; R741-A789 PolarHBondContact O-N 2.93Å
742	F	92.3	Very high	85.9	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	149.7	176.4	62.7	-85	0	0	0	110.8	L733 F740 M761 Y764 M765 A789 I791	L733-F742 HydrophobicContact CD2-CB 4.19Å; L733-F742 HydrophobicContact CD2-CD1 3.61Å; L733-F742 HydrophobicContact CD2-CD2 4.07Å; L733-F742 HydrophobicContact CD2-CE1 3.99Å; L733-F742 HydrophobicContact CD2-CE2 4.42Å; L733-F742 HydrophobicContact CD2-CG 3.67Å; L733-F742 HydrophobicContact CD2-CZ 4.41Å; F740-F742 AromaticContact CD1-CD1 3.97Å; F740-F742 HydrophobicContact CD1-CD1 3.97Å; F740-F742 HydrophobicContact CE1-CB 4.45Å; F740-F742 HydrophobicContact CE1-CD1 4.43Å; F742-M761 HydrophobicContact CE2-CG 3.41Å; F742-M761 VanDerWaalsContact CE2-CG 3.41Å; F742-M761 HydrophobicContact CE2-SD 3.98Å; F742-M761 HydrophobicContact CZ-CG 3.39Å; F742-M761 HydrophobicContact CZ-SD 4.14Å; F742-Y764 HydrophobicContact CD1-CD1 4.2Å; F742-Y764 AromaticContact CD1-CE1 4Å; F742-Y764 HydrophobicContact CD1-CE1 4Å; F742-Y764 AromaticContact CE1-CD1 3.47Å; F742-Y764 HydrophobicContact CE1-CD1 3.47Å; F742-Y764 VanDerWaalsContact CE1-CD1 3.47Å; F742-Y764 AromaticContact CE1-CE1 3.63Å; F742-Y764 HydrophobicContact CE1-CE1 3.63Å; F742-Y764 AromaticContact CZ-CD1 3.64Å; F742-Y764 HydrophobicContact CZ-CD1 3.64Å; F742-Y764 HydrophobicContact CZ-CE1 4.26Å; F742-M765 HydrophobicContact CD2-CB 4.16Å; F742-M765 HydrophobicContact CD2-CG 3.89Å; F742-M765 HydrophobicContact CD2-SD 4.37Å; F742-M765 HydrophobicContact CE2-CB 3.7Å; F742-M765 HydrophobicContact CE2-CG 3.91Å; F742-M765 HydrophobicContact CE2-SD 4.37Å; F742-M765 HydrophobicContact CZ-CB 4.49Å; F742-A789 WeakPolarHBondContact CA-O 3.08Å; F742-A789 HydrophobicContact CB-CB 4.05Å; F742-A789 WeakPolarHBondContact CB-O 3.39Å; F742-I791 HydrophobicContact CD2-CD1 4.06Å
743	G	93.8	Very high	86.2	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	172	-173.8	0	0	0	0	0	111.9	A789 F790 I791	G743-A789 PolarHBondContact N-O 2.84Å; G743-F790 WeakPolarHBondContact O-CD2 3.32Å; G743-I791 PolarHBondContact O-N 3.07Å
744	T	95.1	Very high	86.5	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.215	C	C	.	.			trans	-141.6	179.1	173.1	-169.2	0	0	0	0	110.3	A750 E751 M765 N769 E770 I791	T744-A750 VanDerWaalsContact OG1-CB 3.31Å; T744-A750 WeakPolarHBondContact OG1-CB 3.19Å; T744-E751 HydrophobicContact CG2-CB 3.89Å; T744-E751 HydrophobicContact CG2-CG 4.43Å; T744-M765 HydrophobicContact CG2-CE 3.42Å; T744-M765 VanDerWaalsContact CG2-CE 3.42Å; T744-M765 HydrophobicContact CG2-SD 3.72Å; T744-N769 PolarHBondContact N-OD1 3.14Å; T744-N769 CarbonylContact O-C 3.59Å; T744-N769 WeakPolarHBondContact O-CA 3.48Å; T744-N769 WeakPolarHBondContact O-CB 3.17Å; T744-E770 PolarHBondContact O-N 2.63Å; T744-I791 WeakPolarHBondContact CA-O 3.45Å; T744-I791 WeakPolarHBondContact CB-O 3.38Å; T744-I791 PolarHBondContact OG1-O 3.39Å
745	V	94.2	Very high	86.8	Confident	3 Å²	3	45.3 Å²	45.3	2%	0.018	23%	0.227	C	C	.	.	B	Isolated β-bridge	trans	-73.9	134	175.6	-179.9	0	0	0	0	110.6	S748 E770 P771 F790 M792	V745-S748 VanDerWaalsContact O-CB 3.31Å; V745-S748 WeakPolarHBondContact O-CB 3.29Å; V745-S748 PolarHBondContact O-OG 3.14Å; V745-E770 CarbonylContact C-O 3.56Å; V745-E770 VanDerWaalsContact CA-O 3.28Å; V745-E770 WeakPolarHBondContact CA-O 3Å; V745-P771 WeakPolarHBondContact CG1-O 3.03Å; V745-F790 HydrophobicContact CG2-CE2 4.46Å; V745-F790 HydrophobicContact CG2-CZ 3.75Å; V745-M792 HydrophobicContact CB-CE 4.27Å; V745-M792 HydrophobicContact CB-SD 3.98Å; V745-M792 HydrophobicContact CG2-CE 3.99Å; V745-M792 HydrophobicContact CG2-CG 4.28Å; V745-M792 HydrophobicContact CG2-SD 3.64Å
746	R	91.4	Very high	87.1	Confident	134 Å²	134	45.9 Å²	45.9	51%	0.506	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	139.9	176.6	-65.1	175.5	-172.6	179.6	5.7	111.6	S748 N769 E770	R746-S748 PolarHBondContact O-N 3.23Å; R746-N769 HydrophobicContact CG-CB 3.7Å; R746-N769 PolarHBondContact NE-O 3.1Å; R746-N769 PolarHBondContact NH2-O 2.88Å; R746-E770 WeakPolarHBondContact CG-O 3.39Å; R746-E770 PolarHBondContact N-O 3.17Å
747	E	89.8	Confident	88.2	Confident	12 Å²	12	46.7 Å²	46.7	6%	0.056	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	29.4	178.9	-61.8	178.3	-136.6	0	0	113.7	K552 A555 K557 T562 E751	K552-E747 WeakPolarHBondContact CD-OE2 3.44Å; K552-E747 IonicContact NZ-OE1 2.9Å; K552-E747 PolarHBondContact NZ-OE1 2.89Å; K552-E747 IonicContact NZ-OE2 3.45Å; A555-E747 HydrophobicContact CB-CB 3.85Å; A555-E747 HydrophobicContact CB-CG 3.96Å; K557-E747 HydrophobicContact CD-CG 4.21Å; K557-E747 VanDerWaalsContact NZ-CD 3.28Å; K557-E747 IonicContact NZ-OE1 2.72Å; K557-E747 PolarHBondContact NZ-OE1 2.86Å; T562-E747 PolarHBondContact OG1-OE2 3.2Å; E747-E751 PolarHBondContact N-OE2 2.93Å
748	S	91.3	Very high	89.9	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.205	C	C	.	.	S	Bend	trans	-94.5	166.7	176.4	68.2	0	0	0	0	112.7	V745 R746 A750 E751 D752	V745-S748 VanDerWaalsContact O-CB 3.31Å; V745-S748 WeakPolarHBondContact O-CB 3.29Å; V745-S748 PolarHBondContact O-OG 3.14Å; R746-S748 PolarHBondContact O-N 3.23Å; S748-A750 VanDerWaalsContact C-N 3.27Å; S748-A750 PolarHBondContact O-N 3.18Å; S748-A750 PolarHBondContact OG-N 2.75Å; S748-E751 PolarHBondContact O-N 3.39Å; S748-E751 PolarHBondContact OG-N 2.96Å; S748-E751 VanDerWaalsContact OG-N 3.11Å; S748-D752 PolarHBondContact O-N 3.23Å
749	S	90.2	Very high	91.3	Very high	2 Å²	2	39.9 Å²	39.9	1%	0.014	20%	0.199	C	C	.	.	H	α-helix	trans	-58.4	-39.9	168.8	44.5	0	0	0	0	111.7	S581 D752 Y753	S581-S749 PolarHBondContact OG-OG 2.95Å; S749-D752 PolarHBondContact O-N 3.49Å; S749-Y753 WeakPolarHBondContact O-CB 3.4Å; S749-Y753 PolarHBondContact O-N 2.7Å
750	A	91.9	Very high	91.8	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-60.3	-45	177.6	0	0	0	0	0	112.1	L601 T744 S748 D752 Y753 M754 M792	L601-A750 HydrophobicContact CD1-CB 4.47Å; L601-A750 HydrophobicContact CD2-CB 3.61Å; T744-A750 VanDerWaalsContact OG1-CB 3.31Å; T744-A750 WeakPolarHBondContact OG1-CB 3.19Å; S748-A750 VanDerWaalsContact C-N 3.27Å; S748-A750 PolarHBondContact O-N 3.18Å; S748-A750 PolarHBondContact OG-N 2.75Å; A750-D752 PolarHBondContact O-N 3.11Å; A750-Y753 PolarHBondContact O-N 3.45Å; A750-M754 WeakPolarHBondContact O-CB 2.88Å; A750-M754 WeakPolarHBondContact O-CG 3.47Å; A750-M754 PolarHBondContact O-N 2.72Å; A750-M792 HydrophobicContact CB-SD 4.26Å
751	E	92.4	Very high	91.9	Very high	27 Å²	27	44.6 Å²	44.6	13%	0.126	21%	0.207	C	C	.	.	H	α-helix	trans	-61.4	-46.2	176.2	-174.2	179.3	-160.3	0	0	111.8	T744 E747 S748 Y753 M754 K755 H762 N769	T744-E751 HydrophobicContact CG2-CB 3.89Å; T744-E751 HydrophobicContact CG2-CG 4.43Å; E747-E751 PolarHBondContact N-OE2 2.93Å; S748-E751 PolarHBondContact O-N 3.39Å; S748-E751 PolarHBondContact OG-N 2.96Å; S748-E751 VanDerWaalsContact OG-N 3.11Å; E751-Y753 VanDerWaalsContact C-N 3.35Å; E751-Y753 PolarHBondContact O-N 3.38Å; E751-M754 PolarHBondContact O-N 3.14Å; E751-K755 WeakPolarHBondContact O-CB 3.31Å; E751-K755 PolarHBondContact O-N 3.16Å; E751-H762 IonicContact OE1-CE1 3.64Å; E751-N769 PolarHBondContact OE1-ND2 3.42Å; E751-N769 VanDerWaalsContact OE1-ND2 3.16Å
752	D	90.4	Very high	92	Very high	28 Å²	28	42.3 Å²	42.3	15%	0.15	20%	0.2	C	C	.	.	H	α-helix	trans	-64.3	-38.3	179.3	-89.3	-14.2	0	0	0	112.4	S748 S749 A750 K756	S748-D752 PolarHBondContact O-N 3.23Å; S749-D752 PolarHBondContact O-N 3.49Å; A750-D752 PolarHBondContact O-N 3.11Å; D752-K756 WeakPolarHBondContact O-CG 3.49Å; D752-K756 PolarHBondContact O-N 3.19Å
753	Y	91.8	Very high	92	Very high	63 Å²	63	48 Å²	48	25%	0.247	23%	0.226	C	C	.	.	H	α-helix	trans	-64.4	-48.5	174.7	180	-93.6	0	0	0	111	L601 S749 A750 E751 K755 K756 S757 F758 F816 A817	L601-Y753 HydrophobicContact CD1-CD1 3.53Å; L601-Y753 HydrophobicContact CD1-CE1 4.2Å; L601-Y753 HydrophobicContact CD1-CG 3.83Å; S749-Y753 WeakPolarHBondContact O-CB 3.4Å; S749-Y753 PolarHBondContact O-N 2.7Å; A750-Y753 PolarHBondContact O-N 3.45Å; E751-Y753 VanDerWaalsContact C-N 3.35Å; E751-Y753 PolarHBondContact O-N 3.38Å; Y753-K755 VanDerWaalsContact C-N 3.29Å; Y753-K755 PolarHBondContact O-N 3.39Å; Y753-K756 PolarHBondContact O-N 2.69Å; Y753-K756 VanDerWaalsContact O-N 3.17Å; Y753-S757 WeakPolarHBondContact CE2-OG 3.45Å; Y753-S757 WeakPolarHBondContact O-CB 3.43Å; Y753-S757 PolarHBondContact O-N 3.16Å; Y753-S757 PolarHBondContact O-OG 2.04Å; Y753-F758 HydrophobicContact CE1-CE2 4.3Å; Y753-F816 HydrophobicContact CD1-CE2 4.38Å; Y753-F816 AromaticContact CE1-CD2 3.84Å; Y753-F816 HydrophobicContact CE1-CD2 3.84Å; Y753-F816 AromaticContact CE1-CE2 3.94Å; Y753-F816 HydrophobicContact CE1-CE2 3.94Å; Y753-A817 HydrophobicContact CD1-CB 4.2Å; Y753-A817 HydrophobicContact CD2-CB 3.77Å; Y753-A817 HydrophobicContact CE1-CB 3.94Å; Y753-A817 HydrophobicContact CE2-CB 3.48Å; Y753-A817 VanDerWaalsContact CE2-CB 3.48Å; Y753-A817 HydrophobicContact CG-CB 4.12Å
754	M	93.1	Very high	91.9	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-61.5	-39.9	179.5	-67.8	-66.6	-84.2	0	0	111.4	I728 A750 E751 K756 F758 M761 H762 M765 I791	I728-M754 HydrophobicContact CD1-CE 4.27Å; I728-M754 HydrophobicContact CD1-SD 4.32Å; A750-M754 WeakPolarHBondContact O-CB 2.88Å; A750-M754 WeakPolarHBondContact O-CG 3.47Å; A750-M754 PolarHBondContact O-N 2.72Å; E751-M754 PolarHBondContact O-N 3.14Å; M754-K756 VanDerWaalsContact C-N 3.35Å; M754-K756 PolarHBondContact O-N 2.99Å; M754-F758 CarbonylContact O-C 3.6Å; M754-F758 WeakPolarHBondContact O-CA 3.44Å; M754-F758 PolarHBondContact O-N 3.43Å; M754-F758 HydrophobicContact SD-CD2 4.14Å; M754-M761 HydrophobicContact CE-CE 3.2Å; M754-M761 HydrophobicContact CE-CG 3.95Å; M754-M761 HydrophobicContact CE-SD 3.55Å; M754-M761 VanDerWaalsContact CE-SD 3.55Å; M754-M761 HydrophobicContact SD-CE 3.88Å; M754-H762 HydrophobicContact CB-CB 4.42Å; M754-M765 HydrophobicContact CB-CE 3.66Å; M754-M765 HydrophobicContact CB-SD 4.32Å; M754-M765 HydrophobicContact CE-SD 3.86Å; M754-M765 HydrophobicContact CG-CE 4.01Å; M754-M765 HydrophobicContact CG-SD 4.11Å; M754-I791 HydrophobicContact CE-CD1 3.58Å
755	K	92.1	Very high	91.8	Very high	125 Å²	125	49.9 Å²	49.9	54%	0.543	23%	0.234	S	C	.	.	H	α-helix	trans	-61.8	-38.7	176.1	-175.7	177.7	177.9	-177	0	113.2	E751 Y753	E751-K755 WeakPolarHBondContact O-CB 3.31Å; E751-K755 PolarHBondContact O-N 3.16Å; Y753-K755 VanDerWaalsContact C-N 3.29Å; Y753-K755 PolarHBondContact O-N 3.39Å
756	K	91	Very high	91.7	Very high	128 Å²	128	57.1 Å²	57.1	56%	0.557	26%	0.261	S	S	*	.	H	α-helix	trans	-80.5	-45.3	-178.9	-71.5	174.2	-172.9	172.2	0	112.5	D752 Y753 M754	D752-K756 WeakPolarHBondContact O-CG 3.49Å; D752-K756 PolarHBondContact O-N 3.19Å; Y753-K756 PolarHBondContact O-N 2.69Å; Y753-K756 VanDerWaalsContact O-N 3.17Å; M754-K756 VanDerWaalsContact C-N 3.35Å; M754-K756 PolarHBondContact O-N 2.99Å
757	S	92.1	Very high	91.7	Very high	53 Å²	53	59.1 Å²	59.1	37%	0.371	27%	0.268	S	S	.	.	H	α-helix	trans	-86.5	-33.6	-172.1	-58.6	0	0	0	0	112.8	Y753	Y753-S757 WeakPolarHBondContact CE2-OG 3.45Å; Y753-S757 WeakPolarHBondContact O-CB 3.43Å; Y753-S757 PolarHBondContact O-N 3.16Å; Y753-S757 PolarHBondContact O-OG 2.04Å
758	F	93	Very high	91.8	Very high	39 Å²	39	61.3 Å²	61.3	17%	0.171	28%	0.278	C	S	.	.			trans	-139.6	71.7	-174.2	-57.1	-72.9	0	0	0	112	I728 H729 H734 Y753 M754 E760 M761 H762	I728-F758 HydrophobicContact CG1-CE2 3.94Å; I728-F758 HydrophobicContact CG1-CZ 4.25Å; H729-F758 AromaticContact CE1-CZ 3.94Å; H734-F758 AromaticContact CE1-CD1 3.82Å; H734-F758 AromaticContact CE1-CE1 3.8Å; Y753-F758 HydrophobicContact CE1-CE2 4.3Å; M754-F758 CarbonylContact O-C 3.6Å; M754-F758 WeakPolarHBondContact O-CA 3.44Å; M754-F758 PolarHBondContact O-N 3.43Å; M754-F758 HydrophobicContact SD-CD2 4.14Å; F758-E760 PolarHBondContact O-N 2.87Å; F758-M761 HydrophobicContact CB-CB 3.86Å; F758-M761 HydrophobicContact CB-CE 3.27Å; F758-M761 HydrophobicContact CD1-CE 4Å; F758-M761 HydrophobicContact CD2-CE 3.41Å; F758-M761 VanDerWaalsContact CD2-CE 3.41Å; F758-M761 HydrophobicContact CE2-CE 4.19Å; F758-M761 HydrophobicContact CG-CE 3.29Å; F758-M761 PolarHBondContact O-N 3.1Å; F758-H762 PolarHBondContact O-N 3.32Å
759	P	92.8	Very high	91.9	Very high	83 Å²	83	61.4 Å²	61.4	54%	0.539	28%	0.278	S	S	.	.	H	α-helix	trans	-61.4	-40.2	-171.6	23.2	-33.9	0	0	0	113.9	H762 E763	P759-H762 PolarHBondContact O-N 2.69Å; P759-E763 PolarHBondContact O-N 3.09Å
760	E	90.1	Very high	92.1	Very high	160 Å²	160	63.1 Å²	63.1	75%	0.748	29%	0.286	S	S	*	.	H	α-helix	trans	-63.5	-42.8	177.5	-64.5	-178.2	173.1	0	0	111.7	F758 E763 Y764	F758-E760 PolarHBondContact O-N 2.87Å; E760-E763 PolarHBondContact O-N 3.2Å; E760-Y764 PolarHBondContact O-N 3.45Å
761	M	91.4	Very high	92	Very high	7 Å²	7	65.8 Å²	65.8	3%	0.034	30%	0.303	C	S	.	.	H	α-helix	trans	-64.8	-42.3	177.3	-172.8	170.2	38.3	0	0	110.8	I728 L733 F742 M754 F758 E763 Y764 M765	I728-M761 HydrophobicContact CD1-CE 3.83Å; I728-M761 HydrophobicContact CD1-SD 4.31Å; I728-M761 HydrophobicContact CG1-CE 4.45Å; L733-M761 HydrophobicContact CB-SD 3.99Å; F742-M761 HydrophobicContact CE2-CG 3.41Å; F742-M761 VanDerWaalsContact CE2-CG 3.41Å; F742-M761 HydrophobicContact CE2-SD 3.98Å; F742-M761 HydrophobicContact CZ-CG 3.39Å; F742-M761 HydrophobicContact CZ-SD 4.14Å; M754-M761 HydrophobicContact CE-CE 3.2Å; M754-M761 HydrophobicContact CE-CG 3.95Å; M754-M761 HydrophobicContact CE-SD 3.55Å; M754-M761 VanDerWaalsContact CE-SD 3.55Å; M754-M761 HydrophobicContact SD-CE 3.88Å; F758-M761 HydrophobicContact CB-CB 3.86Å; F758-M761 HydrophobicContact CB-CE 3.27Å; F758-M761 HydrophobicContact CD1-CE 4Å; F758-M761 HydrophobicContact CD2-CE 3.41Å; F758-M761 VanDerWaalsContact CD2-CE 3.41Å; F758-M761 HydrophobicContact CE2-CE 4.19Å; F758-M761 HydrophobicContact CG-CE 3.29Å; F758-M761 PolarHBondContact O-N 3.1Å; M761-E763 VanDerWaalsContact C-N 3.34Å; M761-E763 PolarHBondContact O-N 3.25Å; M761-Y764 PolarHBondContact O-N 3.32Å; M761-M765 VanDerWaalsContact O-CB 3.29Å; M761-M765 WeakPolarHBondContact O-CB 3.45Å; M761-M765 PolarHBondContact O-N 2.66Å
762	H	92.8	Very high	91.9	Very high	25 Å²	25	66.7 Å²	66.7	12%	0.116	31%	0.311	C	S	.	.	H	α-helix	trans	-62.4	-37.4	176.5	173.6	77.3	0	0	0	112.8	E751 M754 F758 P759 Y764 M765 R766	E751-H762 IonicContact OE1-CE1 3.64Å; M754-H762 HydrophobicContact CB-CB 4.42Å; F758-H762 PolarHBondContact O-N 3.32Å; P759-H762 PolarHBondContact O-N 2.69Å; H762-Y764 VanDerWaalsContact C-N 3.27Å; H762-Y764 PolarHBondContact O-N 2.85Å; H762-M765 PolarHBondContact O-N 3.07Å; H762-R766 WeakPolarHBondContact O-CB 3.3Å; H762-R766 PolarHBondContact O-N 3.04Å
763	E	92	Very high	91.9	Very high	119 Å²	119	65.4 Å²	65.4	56%	0.556	30%	0.304	S	S	*	.	H	α-helix	trans	-63.9	-32.2	178.4	-169.4	-179.4	174.7	0	0	113.1	P759 E760 M761 R766	P759-E763 PolarHBondContact O-N 3.09Å; E760-E763 PolarHBondContact O-N 3.2Å; M761-E763 VanDerWaalsContact C-N 3.34Å; M761-E763 PolarHBondContact O-N 3.25Å; E763-R766 WeakPolarHBondContact O-CD 3.15Å; E763-R766 WeakPolarHBondContact O-CG 3.47Å
764	Y	91.5	Very high	91.9	Very high	39 Å²	39	64.9 Å²	64.9	15%	0.153	31%	0.308	C	S	.	.	H	α-helix	trans	-77.2	-49.3	170.9	179.1	-98.6	0	0	0	111.5	P736 F740 F742 E760 M761 H762 R766 R767 F768	P736-Y764 HydrophobicContact CB-CD1 3.7Å; P736-Y764 HydrophobicContact CB-CD2 3.65Å; P736-Y764 HydrophobicContact CB-CE1 3.69Å; P736-Y764 HydrophobicContact CB-CE2 3.67Å; P736-Y764 HydrophobicContact CB-CG 3.64Å; P736-Y764 HydrophobicContact CG-CD1 4.27Å; P736-Y764 HydrophobicContact CG-CD2 3.94Å; P736-Y764 HydrophobicContact CG-CE2 4.42Å; P736-Y764 HydrophobicContact CG-CG 3.83Å; F740-Y764 VanDerWaalsContact O-CE1 3.22Å; F740-Y764 WeakPolarHBondContact O-CE1 3.33Å; F740-Y764 PolarHBondContact O-OH 3.19Å; F742-Y764 HydrophobicContact CD1-CD1 4.2Å; F742-Y764 AromaticContact CD1-CE1 4Å; F742-Y764 HydrophobicContact CD1-CE1 4Å; F742-Y764 AromaticContact CE1-CD1 3.47Å; F742-Y764 HydrophobicContact CE1-CD1 3.47Å; F742-Y764 VanDerWaalsContact CE1-CD1 3.47Å; F742-Y764 AromaticContact CE1-CE1 3.63Å; F742-Y764 HydrophobicContact CE1-CE1 3.63Å; F742-Y764 AromaticContact CZ-CD1 3.64Å; F742-Y764 HydrophobicContact CZ-CD1 3.64Å; F742-Y764 HydrophobicContact CZ-CE1 4.26Å; E760-Y764 PolarHBondContact O-N 3.45Å; M761-Y764 PolarHBondContact O-N 3.32Å; H762-Y764 VanDerWaalsContact C-N 3.27Å; H762-Y764 PolarHBondContact O-N 2.85Å; Y764-R766 VanDerWaalsContact C-N 3.31Å; Y764-R766 PolarHBondContact O-N 3.39Å; Y764-R767 PolarHBondContact O-N 3.31Å; Y764-F768 HydrophobicContact CE1-CD2 4.29Å; Y764-F768 AromaticContact CE1-CE2 3.94Å; Y764-F768 HydrophobicContact CE1-CE2 3.94Å; Y764-F768 HydrophobicContact CE2-CE2 4.03Å; Y764-F768 AromaticContact CZ-CE2 3.67Å
765	M	92.4	Very high	91.8	Very high	0 Å²	0	69.2 Å²	69.2	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-55.2	-41	-176.2	-169.8	-175.3	65.3	0	0	113.1	F742 T744 M754 M761 H762 R767 F768 N769	F742-M765 HydrophobicContact CD2-CB 4.16Å; F742-M765 HydrophobicContact CD2-CG 3.89Å; F742-M765 HydrophobicContact CD2-SD 4.37Å; F742-M765 HydrophobicContact CE2-CB 3.7Å; F742-M765 HydrophobicContact CE2-CG 3.91Å; F742-M765 HydrophobicContact CE2-SD 4.37Å; F742-M765 HydrophobicContact CZ-CB 4.49Å; T744-M765 HydrophobicContact CG2-CE 3.42Å; T744-M765 VanDerWaalsContact CG2-CE 3.42Å; T744-M765 HydrophobicContact CG2-SD 3.72Å; M754-M765 HydrophobicContact CB-CE 3.66Å; M754-M765 HydrophobicContact CB-SD 4.32Å; M754-M765 HydrophobicContact CE-SD 3.86Å; M754-M765 HydrophobicContact CG-CE 4.01Å; M754-M765 HydrophobicContact CG-SD 4.11Å; M761-M765 VanDerWaalsContact O-CB 3.29Å; M761-M765 WeakPolarHBondContact O-CB 3.45Å; M761-M765 PolarHBondContact O-N 2.66Å; H762-M765 PolarHBondContact O-N 3.07Å; M765-R767 PolarHBondContact O-N 3.16Å; M765-F768 PolarHBondContact O-N 3.12Å; M765-N769 WeakPolarHBondContact CG-OD1 3Å; M765-N769 PolarHBondContact O-N 3.39Å; M765-N769 PolarHBondContact O-OD1 3.14Å; M765-N769 VanDerWaalsContact O-OD1 3.12Å
766	R	91.8	Very high	91.8	Very high	156 Å²	156	63.3 Å²	63.3	59%	0.589	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-20.7	-176.8	65.8	-178.6	-71	-171.2	0	115.3	H762 E763 Y764 F768	H762-R766 WeakPolarHBondContact O-CB 3.3Å; H762-R766 PolarHBondContact O-N 3.04Å; E763-R766 WeakPolarHBondContact O-CD 3.15Å; E763-R766 WeakPolarHBondContact O-CG 3.47Å; Y764-R766 VanDerWaalsContact C-N 3.31Å; Y764-R766 PolarHBondContact O-N 3.39Å; R766-F768 VanDerWaalsContact C-N 3.33Å
767	R	91.2	Very high	91.9	Very high	175 Å²	175	57.4 Å²	57.4	66%	0.66	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-22.4	179.2	-58.6	176.4	-167.5	-179.9	2	112.5	Y764 M765	Y764-R767 PolarHBondContact O-N 3.31Å; M765-R767 PolarHBondContact O-N 3.16Å
768	F	92.6	Very high	91.8	Very high	59 Å²	59	57.4 Å²	57.4	26%	0.259	28%	0.28	S	S	.	.	S	Bend	trans	-118.1	17.3	-176.2	-52.7	-80.3	0	0	0	112.1	R741 Y764 M765 R766 L787	R741-F768 HydrophobicContact CB-CE1 4.44Å; R741-F768 HydrophobicContact CG-CE1 3.95Å; R741-F768 HydrophobicContact CG-CE2 4.34Å; R741-F768 HydrophobicContact CG-CZ 3.85Å; Y764-F768 HydrophobicContact CE1-CD2 4.29Å; Y764-F768 AromaticContact CE1-CE2 3.94Å; Y764-F768 HydrophobicContact CE1-CE2 3.94Å; Y764-F768 HydrophobicContact CE2-CE2 4.03Å; Y764-F768 AromaticContact CZ-CE2 3.67Å; M765-F768 PolarHBondContact O-N 3.12Å; R766-F768 VanDerWaalsContact C-N 3.33Å; F768-L787 HydrophobicContact CB-CD2 3.69Å; F768-L787 HydrophobicContact CG-CD2 4.39Å
769	N	93.9	Very high	91.8	Very high	2 Å²	2	56.4 Å²	56.4	1%	0.011	28%	0.278	C	S	.	.			trans	-73.2	131.9	176.3	-76	-2.7	0	0	0	110.6	T744 R746 E751 M765	T744-N769 PolarHBondContact N-OD1 3.14Å; T744-N769 CarbonylContact O-C 3.59Å; T744-N769 WeakPolarHBondContact O-CA 3.48Å; T744-N769 WeakPolarHBondContact O-CB 3.17Å; R746-N769 HydrophobicContact CG-CB 3.7Å; R746-N769 PolarHBondContact NE-O 3.1Å; R746-N769 PolarHBondContact NH2-O 2.88Å; E751-N769 PolarHBondContact OE1-ND2 3.42Å; E751-N769 VanDerWaalsContact OE1-ND2 3.16Å; M765-N769 WeakPolarHBondContact CG-OD1 3Å; M765-N769 PolarHBondContact O-N 3.39Å; M765-N769 PolarHBondContact O-OD1 3.14Å; M765-N769 VanDerWaalsContact O-OD1 3.12Å
770	E	93.7	Very high	91.7	Very high	37 Å²	37	52.5 Å²	52.5	17%	0.173	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-98.2	156.2	179.2	-63.9	-56.7	161.7	0	0	111.1	T744 V745 R746 L787	T744-E770 PolarHBondContact O-N 2.63Å; V745-E770 CarbonylContact C-O 3.56Å; V745-E770 VanDerWaalsContact CA-O 3.28Å; V745-E770 WeakPolarHBondContact CA-O 3Å; R746-E770 WeakPolarHBondContact CG-O 3.39Å; R746-E770 PolarHBondContact N-O 3.17Å; E770-L787 HydrophobicContact CG-CD1 4.19Å
771	P	89.8	Confident	91.7	Very high	56 Å²	56	48.2 Å²	48.2	36%	0.364	23%	0.231	S	C	.	.	S	Bend	trans	-78.1	-29.6	-177	32	-35.7	0	0	0	113.1	V745 E775	V745-P771 WeakPolarHBondContact CG1-O 3.03Å; P771-E775 WeakPolarHBondContact CD-OE2 3.13Å; P771-E775 WeakPolarHBondContact CG-OE2 3.15Å
772	T	90.1	Very high	91.6	Very high	46 Å²	46	50.3 Å²	50.3	28%	0.282	24%	0.244	S	C	.	.	S	Bend	trans	-136.6	157.5	-177.4	65.3	0	0	0	0	111.9	E775 G776	T772-E775 PolarHBondContact O-N 3.38Å; T772-E775 WeakPolarHBondContact OG1-CB 3.42Å; T772-E775 VanDerWaalsContact OG1-CD 3.27Å; T772-E775 VanDerWaalsContact OG1-CG 3.26Å; T772-E775 WeakPolarHBondContact OG1-CG 3.28Å; T772-E775 PolarHBondContact OG1-OE1 3.2Å; T772-G776 PolarHBondContact O-N 3.19Å; T772-G776 VanDerWaalsContact O-N 3.16Å
773	T	91.6	Very high	91.1	Very high	2 Å²	2	56 Å²	56	1%	0.012	28%	0.275	C	S	.	.	H	α-helix	trans	-58.8	-49	177.8	-48.4	0	0	0	0	112.4	E469 E775 G776 V777 F790 M792 L796	E469-T773 PolarHBondContact OE2-OG1 2.72Å; T773-E775 VanDerWaalsContact C-N 3.32Å; T773-E775 PolarHBondContact O-N 3.04Å; T773-G776 PolarHBondContact O-N 3.31Å; T773-G776 VanDerWaalsContact O-N 3.13Å; T773-V777 WeakPolarHBondContact O-CG2 3.21Å; T773-V777 PolarHBondContact O-N 3.31Å; T773-F790 HydrophobicContact CG2-CE1 4.09Å; T773-M792 HydrophobicContact CG2-CG 4.24Å; T773-L796 HydrophobicContact CG2-CB 4.25Å
774	P	90.6	Very high	90.6	Very high	51 Å²	51	55.3 Å²	55.3	33%	0.331	28%	0.282	S	S	.	.	H	α-helix	trans	-63.8	-33.8	-178.5	-23.7	36.7	0	0	0	113.4	V777 A778	P774-V777 PolarHBondContact O-N 2.93Å; P774-A778 WeakPolarHBondContact O-CB 3.16Å; P774-A778 PolarHBondContact O-N 2.98Å
775	E	91.2	Very high	90.2	Very high	92 Å²	92	54.9 Å²	54.9	43%	0.43	28%	0.284	S	S	.	.	H	α-helix	trans	-67.3	-39.2	174.3	-73.4	172.9	-130.3	0	0	112	P771 T772 T773 V777 A778 T779	P771-E775 WeakPolarHBondContact CD-OE2 3.13Å; P771-E775 WeakPolarHBondContact CG-OE2 3.15Å; T772-E775 PolarHBondContact O-N 3.38Å; T772-E775 WeakPolarHBondContact OG1-CB 3.42Å; T772-E775 VanDerWaalsContact OG1-CD 3.27Å; T772-E775 VanDerWaalsContact OG1-CG 3.26Å; T772-E775 WeakPolarHBondContact OG1-CG 3.28Å; T772-E775 PolarHBondContact OG1-OE1 3.2Å; T773-E775 VanDerWaalsContact C-N 3.32Å; T773-E775 PolarHBondContact O-N 3.04Å; E775-V777 VanDerWaalsContact C-N 3.31Å; E775-V777 PolarHBondContact O-N 2.83Å; E775-A778 PolarHBondContact O-N 3.06Å; E775-T779 WeakPolarHBondContact O-CG2 3.27Å; E775-T779 PolarHBondContact O-N 3.08Å; E775-T779 PolarHBondContact O-OG1 3.23Å
776	G	92	Very high	90	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-60.2	-38.8	171.3	0	0	0	0	0	113.3	T772 T773 T779 L780	T772-G776 PolarHBondContact O-N 3.19Å; T772-G776 VanDerWaalsContact O-N 3.16Å; T773-G776 PolarHBondContact O-N 3.31Å; T773-G776 VanDerWaalsContact O-N 3.13Å; G776-T779 PolarHBondContact O-OG1 3.43Å; G776-L780 WeakPolarHBondContact O-CB 3.4Å; G776-L780 PolarHBondContact O-N 2.96Å
777	V	92.3	Very high	90	Very high	4 Å²	4	53 Å²	53	2%	0.024	28%	0.281	C	S	.	.	H	α-helix	trans	-70.5	-41.6	174.3	178.2	0	0	0	0	111.3	L604 T773 P774 E775 L780 K781 E800 L809	L604-V777 HydrophobicContact CD2-CG1 4.4Å; L604-V777 HydrophobicContact CD2-CG2 3.74Å; T773-V777 WeakPolarHBondContact O-CG2 3.21Å; T773-V777 PolarHBondContact O-N 3.31Å; P774-V777 PolarHBondContact O-N 2.93Å; E775-V777 VanDerWaalsContact C-N 3.31Å; E775-V777 PolarHBondContact O-N 2.83Å; V777-L780 PolarHBondContact O-N 2.97Å; V777-K781 HydrophobicContact CG1-CD 4.36Å; V777-K781 WeakPolarHBondContact O-CG 3.39Å; V777-K781 PolarHBondContact O-N 3.22Å; V777-E800 HydrophobicContact CG2-CB 4.12Å; V777-E800 HydrophobicContact CG2-CG 3.9Å; V777-L809 HydrophobicContact CG1-CD1 3.72Å
778	A	91.5	Very high	89.9	Confident	53 Å²	53	45.7 Å²	45.7	44%	0.438	26%	0.256	S	S	.	.	H	α-helix	trans	-62.3	-45.5	179.5	0	0	0	0	0	111.9	P774 E775 L780 K781 T782	P774-A778 WeakPolarHBondContact O-CB 3.16Å; P774-A778 PolarHBondContact O-N 2.98Å; E775-A778 PolarHBondContact O-N 3.06Å; A778-L780 PolarHBondContact O-N 3.43Å; A778-K781 CarbonylContact O-C 3.48Å; A778-K781 WeakPolarHBondContact O-CA 3.47Å; A778-K781 PolarHBondContact O-N 3.07Å; A778-T782 WeakPolarHBondContact O-CG2 3.47Å; A778-T782 PolarHBondContact O-N 3.46Å
779	T	92.3	Very high	89.9	Confident	18 Å²	18	42.9 Å²	42.9	11%	0.11	24%	0.243	C	C	.	.	H	α-helix	trans	-62.2	-31.4	177.1	49.6	0	0	0	0	112.7	E775 G776 T782 Q786 L787	E775-T779 WeakPolarHBondContact O-CG2 3.27Å; E775-T779 PolarHBondContact O-N 3.08Å; E775-T779 PolarHBondContact O-OG1 3.23Å; G776-T779 PolarHBondContact O-OG1 3.43Å; T779-T782 PolarHBondContact O-OG1 3.44Å; T779-Q786 PolarHBondContact O-N 2.96Å; T779-L787 WeakPolarHBondContact OG1-CD1 3.08Å
780	L	91.3	Very high	89.9	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-75	-27.9	173.7	-168.5	139.7	0	0	0	112.7	L604 R606 G776 V777 A778 L787 F790 L809	L604-L780 WeakPolarHBondContact O-CD1 3.45Å; R606-L780 HydrophobicContact CB-CD2 3.68Å; R606-L780 HydrophobicContact CB-CG 4.48Å; R606-L780 WeakPolarHBondContact CD-O 3.27Å; G776-L780 WeakPolarHBondContact O-CB 3.4Å; G776-L780 PolarHBondContact O-N 2.96Å; V777-L780 PolarHBondContact O-N 2.97Å; A778-L780 PolarHBondContact O-N 3.43Å; L780-L787 HydrophobicContact CB-CB 4.49Å; L780-F790 HydrophobicContact CD1-CB 3.8Å; L780-L809 HydrophobicContact CD2-CD2 3.33Å
781	K	89.6	Confident	90	Very high	70 Å²	70	41 Å²	41	30%	0.304	23%	0.234	S	C	.	.	H	α-helix	trans	-83.7	-16.6	174.1	-69.8	-174.3	-171.1	-172.8	0	114.7	R606 V777 A778 D804 L809	R606-K781 VanDerWaalsContact NH1-C 3.31Å; R606-K781 PolarHBondContact NH1-O 2.91Å; V777-K781 HydrophobicContact CG1-CD 4.36Å; V777-K781 WeakPolarHBondContact O-CG 3.39Å; V777-K781 PolarHBondContact O-N 3.22Å; A778-K781 CarbonylContact O-C 3.48Å; A778-K781 WeakPolarHBondContact O-CA 3.47Å; A778-K781 PolarHBondContact O-N 3.07Å; K781-D804 VanDerWaalsContact CE-OD1 3.32Å; K781-D804 WeakPolarHBondContact CE-OD1 3.21Å; K781-D804 IonicContact NZ-OD1 2.84Å; K781-D804 PolarHBondContact NZ-OD1 3.24Å; K781-L809 HydrophobicContact CG-CD2 4.29Å
782	T	89.1	Confident	90.2	Very high	51 Å²	51	38.3 Å²	38.3	31%	0.313	22%	0.217	S	C	.	.	S	Bend	trans	-59	151.9	175.8	58	0	0	0	0	112.4	R606 A778 T779 P784 P785 Q786	R606-T782 PolarHBondContact NH1-O 3.02Å; R606-T782 VanDerWaalsContact NH1-O 3.1Å; A778-T782 WeakPolarHBondContact O-CG2 3.47Å; A778-T782 PolarHBondContact O-N 3.46Å; T779-T782 PolarHBondContact O-OG1 3.44Å; T782-P784 CarbonylContact O-C 3.59Å; T782-P784 PolarHBondContact OG1-O 3.13Å; T782-P785 WeakPolarHBondContact O-CA 3.29Å; T782-P785 VanDerWaalsContact O-N 3.13Å; T782-Q786 PolarHBondContact OG1-N 3.2Å
783	D	81.6	Confident	90.4	Very high	144 Å²	144	36.2 Å²	36.2	77%	0.77	20%	0.204	S	C	*	.	S	Bend	trans	-126.3	110.5	175.8	-170	15	0	0	0	109.5
784	P	82.4	Confident	90.4	Very high	106 Å²	106	39 Å²	39	69%	0.688	22%	0.216	S	C	*	.	S	Bend	cis	-69.9	147.2	2.4	30.3	-35.2	0	0	0	112.4	T782 Q786	T782-P784 CarbonylContact O-C 3.59Å; T782-P784 PolarHBondContact OG1-O 3.13Å; P784-Q786 PolarHBondContact O-N 3.48Å
785	P	83.9	Confident	90.4	Very high	30 Å²	30	36.8 Å²	36.8	20%	0.195	20%	0.202	C	C	.	.			trans	-61.6	136.1	-179.7	24	-32.5	0	0	0	110.4	R741 T782	R741-P785 VanDerWaalsContact CZ-O 3.23Å; R741-P785 PolarHBondContact NH1-O 3.34Å; R741-P785 PolarHBondContact NH2-O 2.93Å; T782-P785 WeakPolarHBondContact O-CA 3.29Å; T782-P785 VanDerWaalsContact O-N 3.13Å
786	Q	88.3	Confident	90.4	Very high	112 Å²	112	32.4 Å²	32.4	52%	0.523	18%	0.182	S	C	.	.	S	Bend	trans	-84.7	-32.3	173	-66.3	-172.5	17	0	0	111.7	R741 T779 T782 P784	R741-Q786 WeakPolarHBondContact CD-O 3.45Å; R741-Q786 PolarHBondContact NE-O 3.43Å; R741-Q786 PolarHBondContact NH1-O 2.86Å; R741-Q786 VanDerWaalsContact NH1-O 3.13Å; T779-Q786 PolarHBondContact O-N 2.96Å; T782-Q786 PolarHBondContact OG1-N 3.2Å; P784-Q786 PolarHBondContact O-N 3.48Å
787	L	90.9	Very high	90.4	Very high	3 Å²	3	32.4 Å²	32.4	2%	0.016	18%	0.182	C	C	.	.			trans	-117.2	137.1	172.5	-74.9	178.2	0	0	0	110.1	R741 F768 E770 T779 L780 F790	R741-L787 HydrophobicContact CB-CD2 4.44Å; F768-L787 HydrophobicContact CB-CD2 3.69Å; F768-L787 HydrophobicContact CG-CD2 4.39Å; E770-L787 HydrophobicContact CG-CD1 4.19Å; T779-L787 WeakPolarHBondContact OG1-CD1 3.08Å; L780-L787 HydrophobicContact CB-CB 4.49Å; L787-F790 HydrophobicContact CD1-CD2 4.19Å
788	D	90.1	Very high	90.3	Very high	22 Å²	22	34.6 Å²	34.6	12%	0.118	19%	0.194	C	C	.	.	S	Bend	trans	-93.9	-28.5	176.3	-54.1	-57.9	0	0	0	111.4	F740 R741	F740-D788 HydrophobicContact CD2-CB 3.74Å; F740-D788 HydrophobicContact CE2-CB 3.45Å; F740-D788 VanDerWaalsContact CE2-CB 3.45Å; F740-D788 HydrophobicContact CG-CB 4.43Å; F740-D788 HydrophobicContact CZ-CB 3.91Å; R741-D788 IonicContact CZ-OD2 2.92Å; R741-D788 PolarHBondContact N-OD2 3.03Å; R741-D788 IonicContact NE-OD2 3.19Å; R741-D788 PolarHBondContact NE-OD2 3.38Å; R741-D788 IonicContact NH2-OD1 2.97Å; R741-D788 PolarHBondContact NH2-OD1 3.48Å; R741-D788 IonicContact NH2-OD2 3.11Å; R741-D788 WeakPolarHBondContact O-CA 3.31Å; R741-D788 WeakPolarHBondContact O-CB 3.33Å; R741-D788 PolarHBondContact O-N 3.13Å
789	A	92	Very high	90.2	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	149	171	0	0	0	0	0	111.9	I603 L604 V605 F740 R741 F742 G743	I603-A789 HydrophobicContact CG2-CB 3.85Å; L604-A789 WeakPolarHBondContact O-CA 3.21Å; V605-A789 HydrophobicContact CG1-CB 4.03Å; F740-A789 HydrophobicContact CE1-CB 3.74Å; F740-A789 HydrophobicContact CZ-CB 3.67Å; R741-A789 PolarHBondContact O-N 2.93Å; F742-A789 WeakPolarHBondContact CA-O 3.08Å; F742-A789 HydrophobicContact CB-CB 4.05Å; F742-A789 WeakPolarHBondContact CB-O 3.39Å; G743-A789 PolarHBondContact N-O 2.84Å
790	F	94.4	Very high	90	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	127.5	178.2	-178.6	-111.3	0	0	0	110.4	I603 L604 G743 V745 T773 L780 L787 M792 L797	I603-F790 CarbonylContact C-O 3.59Å; L604-F790 HydrophobicContact CB-CB 4.33Å; L604-F790 PolarHBondContact N-O 3.44Å; L604-F790 PolarHBondContact O-N 3.39Å; G743-F790 WeakPolarHBondContact O-CD2 3.32Å; V745-F790 HydrophobicContact CG2-CE2 4.46Å; V745-F790 HydrophobicContact CG2-CZ 3.75Å; T773-F790 HydrophobicContact CG2-CE1 4.09Å; L780-F790 HydrophobicContact CD1-CB 3.8Å; L787-F790 HydrophobicContact CD1-CD2 4.19Å; F790-M792 HydrophobicContact CD1-CB 4.32Å; F790-M792 HydrophobicContact CE1-CB 3.75Å; F790-M792 HydrophobicContact CE1-CG 4.34Å; F790-M792 HydrophobicContact CZ-CB 4.28Å; F790-L797 HydrophobicContact CD1-CD2 3.87Å; F790-L797 HydrophobicContact CE1-CD2 4.1Å
791	I	94.9	Very high	89.9	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	121.4	-174.7	-55.3	175.3	0	0	0	108.7	G602 I603 F742 G743 T744 M754 F816	G602-I791 WeakPolarHBondContact O-CA 3.45Å; I603-I791 HydrophobicContact CG1-CG1 4.3Å; I603-I791 HydrophobicContact CG2-CG1 4.46Å; F742-I791 HydrophobicContact CD2-CD1 4.06Å; G743-I791 PolarHBondContact O-N 3.07Å; T744-I791 WeakPolarHBondContact CA-O 3.45Å; T744-I791 WeakPolarHBondContact CB-O 3.38Å; T744-I791 PolarHBondContact OG1-O 3.39Å; M754-I791 HydrophobicContact CE-CD1 3.58Å; I791-F816 HydrophobicContact CG2-CZ 4.26Å
792	M	94.2	Very high	89.6	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.7	176.4	178.2	-165.7	51.6	-173.2	0	0	110	Y553 G602 V745 A750 T773 F790 K794 L796 L797	Y553-M792 HydrophobicContact CE2-CE 4.33Å; G602-M792 PolarHBondContact N-O 2.91Å; G602-M792 PolarHBondContact O-N 3.38Å; V745-M792 HydrophobicContact CB-CE 4.27Å; V745-M792 HydrophobicContact CB-SD 3.98Å; V745-M792 HydrophobicContact CG2-CE 3.99Å; V745-M792 HydrophobicContact CG2-CG 4.28Å; V745-M792 HydrophobicContact CG2-SD 3.64Å; A750-M792 HydrophobicContact CB-SD 4.26Å; T773-M792 HydrophobicContact CG2-CG 4.24Å; F790-M792 HydrophobicContact CD1-CB 4.32Å; F790-M792 HydrophobicContact CE1-CB 3.75Å; F790-M792 HydrophobicContact CE1-CG 4.34Å; F790-M792 HydrophobicContact CZ-CB 4.28Å; M792-K794 PolarHBondContact O-N 3.22Å; M792-L796 HydrophobicContact CE-CD1 3.68Å; M792-L796 HydrophobicContact CG-CD1 4.15Å; M792-L797 HydrophobicContact CB-CD1 4.34Å; M792-L797 HydrophobicContact CB-CD2 3.87Å; M792-L797 HydrophobicContact CB-CG 4.12Å; M792-L797 WeakPolarHBondContact O-CD1 3.21Å
793	D	93.7	Very high	89.5	Confident	1 Å²	1	33 Å²	33	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	124.2	174.6	-66.9	-10.8	0	0	0	111.3	S581 S600 L601 A795 L796 L797 Y821	S581-D793 PolarHBondContact OG-OD2 2.93Å; S600-D793 CarbonylContact O-C 3.59Å; L601-D793 WeakPolarHBondContact CD2-OD1 3.44Å; D793-A795 PolarHBondContact O-N 2.99Å; D793-A795 VanDerWaalsContact O-N 3.16Å; D793-L796 HydrophobicContact CB-CD1 4.27Å; D793-L796 HydrophobicContact CB-CG 4.39Å; D793-L796 WeakPolarHBondContact O-CB 3.42Å; D793-L796 PolarHBondContact O-N 3.5Å; D793-L797 PolarHBondContact O-N 3.4Å; D793-L797 VanDerWaalsContact O-N 3.12Å; D793-Y821 WeakPolarHBondContact CB-OH 3.25Å; D793-Y821 WeakPolarHBondContact OD2-CE1 3.5Å; D793-Y821 PolarHBondContact OD2-OH 3.24Å
794	K	91.9	Very high	89.6	Confident	60 Å²	60	26.4 Å²	26.4	26%	0.261	14%	0.143	S	C	.	.	H	α-helix	trans	-55.3	-35.3	-176.2	-174.4	179.6	-173.4	-62.4	0	112.2	S600 M792 L796 L797 D798 P815	S600-K794 WeakPolarHBondContact O-CB 3.27Å; S600-K794 PolarHBondContact O-N 3.13Å; M792-K794 PolarHBondContact O-N 3.22Å; K794-L796 VanDerWaalsContact C-N 3.31Å; K794-L796 PolarHBondContact O-N 3.26Å; K794-L797 PolarHBondContact O-N 2.86Å; K794-D798 VanDerWaalsContact NZ-CG 3.27Å; K794-D798 IonicContact NZ-OD1 3.02Å; K794-D798 PolarHBondContact NZ-OD1 3.38Å; K794-D798 VanDerWaalsContact NZ-OD1 3.11Å; K794-D798 IonicContact NZ-OD2 2.69Å; K794-D798 PolarHBondContact NZ-OD2 3.47Å; K794-D798 VanDerWaalsContact O-CB 3.31Å; K794-D798 WeakPolarHBondContact O-CB 3.41Å; K794-D798 PolarHBondContact O-N 3.49Å; K794-P815 HydrophobicContact CD-CB 4.23Å; K794-P815 HydrophobicContact CD-CG 4.15Å
795	A	91.2	Very high	89.5	Confident	6 Å²	6	24.6 Å²	24.6	5%	0.05	14%	0.137	C	C	.	.	H	α-helix	trans	-57	-43.5	175.5	0	0	0	0	0	112.7	F472 F597 T599 D793 Y799 Y821 Y856	F472-A795 HydrophobicContact CE2-CB 4.36Å; F472-A795 HydrophobicContact CZ-CB 4.35Å; F597-A795 HydrophobicContact CD1-CB 4.35Å; F597-A795 HydrophobicContact CE1-CB 3.52Å; F597-A795 HydrophobicContact CZ-CB 4.09Å; T599-A795 WeakPolarHBondContact OG1-CB 3.42Å; T599-A795 PolarHBondContact OG1-N 3.43Å; D793-A795 PolarHBondContact O-N 2.99Å; D793-A795 VanDerWaalsContact O-N 3.16Å; A795-Y799 PolarHBondContact O-N 3.34Å; A795-Y821 HydrophobicContact CB-CE2 4.22Å; A795-Y856 WeakPolarHBondContact O-CE1 3.45Å; A795-Y856 PolarHBondContact O-OH 3.2Å
796	L	91.8	Very high	89.1	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-71.4	-42	177.2	-58.1	173.7	0	0	0	110.6	H470 F472 T773 M792 D793 K794 Y799 E800	H470-L796 VanDerWaalsContact O-CD2 3.25Å; H470-L796 WeakPolarHBondContact O-CD2 3.47Å; F472-L796 HydrophobicContact CD2-CD2 3.77Å; F472-L796 HydrophobicContact CE2-CD2 3.86Å; T773-L796 HydrophobicContact CG2-CB 4.25Å; M792-L796 HydrophobicContact CE-CD1 3.68Å; M792-L796 HydrophobicContact CG-CD1 4.15Å; D793-L796 HydrophobicContact CB-CD1 4.27Å; D793-L796 HydrophobicContact CB-CG 4.39Å; D793-L796 WeakPolarHBondContact O-CB 3.42Å; D793-L796 PolarHBondContact O-N 3.5Å; K794-L796 VanDerWaalsContact C-N 3.31Å; K794-L796 PolarHBondContact O-N 3.26Å; L796-Y799 WeakPolarHBondContact O-CB 3.36Å; L796-Y799 PolarHBondContact O-N 3.49Å; L796-E800 WeakPolarHBondContact O-CG 3.33Å; L796-E800 PolarHBondContact O-N 3.09Å
797	L	91.6	Very high	88.8	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-65.9	-41.3	-180	-60.7	-177.5	0	0	0	112.9	G602 L604 F790 M792 D793 K794 Y799 E800 V801 T811	G602-L797 WeakPolarHBondContact O-CD1 3.23Å; L604-L797 HydrophobicContact CB-CD1 4.04Å; L604-L797 HydrophobicContact CB-CD2 3.88Å; L604-L797 HydrophobicContact CB-CG 4.41Å; L604-L797 HydrophobicContact CD2-CD2 4.11Å; L604-L797 HydrophobicContact CG-CD2 4.48Å; F790-L797 HydrophobicContact CD1-CD2 3.87Å; F790-L797 HydrophobicContact CE1-CD2 4.1Å; M792-L797 HydrophobicContact CB-CD1 4.34Å; M792-L797 HydrophobicContact CB-CD2 3.87Å; M792-L797 HydrophobicContact CB-CG 4.12Å; M792-L797 WeakPolarHBondContact O-CD1 3.21Å; D793-L797 PolarHBondContact O-N 3.4Å; D793-L797 VanDerWaalsContact O-N 3.12Å; K794-L797 PolarHBondContact O-N 2.86Å; L797-Y799 VanDerWaalsContact C-N 3.27Å; L797-Y799 PolarHBondContact O-N 3.09Å; L797-E800 PolarHBondContact O-N 2.84Å; L797-V801 WeakPolarHBondContact O-CG2 3.15Å; L797-V801 PolarHBondContact O-N 3.41Å; L797-T811 HydrophobicContact CB-CG2 3.59Å; L797-T811 HydrophobicContact CD1-CG2 4.38Å
798	D	89.1	Confident	88.4	Confident	50 Å²	50	27.8 Å²	27.8	27%	0.267	16%	0.157	S	C	.	.	H	α-helix	trans	-63.8	-36.9	177.9	-74.5	-14.5	0	0	0	110.8	K794 S802 T811	K794-D798 VanDerWaalsContact NZ-CG 3.27Å; K794-D798 IonicContact NZ-OD1 3.02Å; K794-D798 PolarHBondContact NZ-OD1 3.38Å; K794-D798 VanDerWaalsContact NZ-OD1 3.11Å; K794-D798 IonicContact NZ-OD2 2.69Å; K794-D798 PolarHBondContact NZ-OD2 3.47Å; K794-D798 VanDerWaalsContact O-CB 3.31Å; K794-D798 WeakPolarHBondContact O-CB 3.41Å; K794-D798 PolarHBondContact O-N 3.49Å; D798-S802 WeakPolarHBondContact O-CB 3.37Å; D798-S802 PolarHBondContact O-N 3.45Å; D798-T811 PolarHBondContact OD1-OG1 2.93Å
799	Y	89.8	Confident	88.2	Confident	23 Å²	23	27.2 Å²	27.2	9%	0.09	15%	0.153	C	C	.	.	H	α-helix	trans	-62.7	-49	172	178	-103.8	0	0	0	111.3	H470 P471 F474 A795 L796 L797 V801 S802 I803	H470-Y799 HydrophobicContact CB-CD1 4.01Å; H470-Y799 HydrophobicContact CB-CE1 3.52Å; P471-Y799 HydrophobicContact CB-CD1 4.31Å; P471-Y799 HydrophobicContact CB-CD2 3.66Å; P471-Y799 HydrophobicContact CB-CE1 4.31Å; P471-Y799 HydrophobicContact CB-CE2 3.66Å; P471-Y799 HydrophobicContact CB-CG 4Å; P471-Y799 HydrophobicContact CG-CD1 4.41Å; P471-Y799 HydrophobicContact CG-CD2 3.75Å; P471-Y799 HydrophobicContact CG-CE2 4.28Å; P471-Y799 HydrophobicContact CG-CG 3.82Å; F474-Y799 AromaticContact CZ-CZ 3.97Å; F474-Y799 WeakPolarHBondContact CZ-OH 3.24Å; A795-Y799 PolarHBondContact O-N 3.34Å; L796-Y799 WeakPolarHBondContact O-CB 3.36Å; L796-Y799 PolarHBondContact O-N 3.49Å; L797-Y799 VanDerWaalsContact C-N 3.27Å; L797-Y799 PolarHBondContact O-N 3.09Å; Y799-V801 VanDerWaalsContact C-N 3.31Å; Y799-V801 PolarHBondContact O-N 3.47Å; Y799-S802 WeakPolarHBondContact O-CA 3.4Å; Y799-S802 WeakPolarHBondContact O-CB 3.49Å; Y799-S802 PolarHBondContact O-N 2.86Å; Y799-S802 PolarHBondContact O-OG 3.05Å; Y799-I803 HydrophobicContact CD1-CD1 4.28Å; Y799-I803 HydrophobicContact CD2-CG2 4.29Å; Y799-I803 HydrophobicContact CE1-CD1 3.75Å; Y799-I803 HydrophobicContact CE1-CG2 4.15Å; Y799-I803 HydrophobicContact CE2-CG2 3.76Å; Y799-I803 PolarHBondContact O-N 3.21Å
800	E	89.3	Confident	88	Confident	18 Å²	18	28.6 Å²	28.6	8%	0.084	17%	0.165	C	C	.	.	H	α-helix	trans	-61.5	-35.9	178.4	-72.4	-69	163.1	0	0	113.3	V777 L796 L797 D804	V777-E800 HydrophobicContact CG2-CB 4.12Å; V777-E800 HydrophobicContact CG2-CG 3.9Å; L796-E800 WeakPolarHBondContact O-CG 3.33Å; L796-E800 PolarHBondContact O-N 3.09Å; L797-E800 PolarHBondContact O-N 2.84Å; E800-D804 PolarHBondContact O-N 3.03Å
801	V	88.1	Confident	87.7	Confident	32 Å²	32	30.5 Å²	30.5	19%	0.194	18%	0.177	C	C	.	.	H	α-helix	trans	-65.9	-43.5	170.7	169.6	0	0	0	0	110.8	L604 L797 Y799 I803 D804 L809 T811	L604-V801 HydrophobicContact CD1-CG2 3.43Å; L604-V801 VanDerWaalsContact CD1-CG2 3.43Å; L797-V801 WeakPolarHBondContact O-CG2 3.15Å; L797-V801 PolarHBondContact O-N 3.41Å; Y799-V801 VanDerWaalsContact C-N 3.31Å; Y799-V801 PolarHBondContact O-N 3.47Å; V801-I803 PolarHBondContact O-N 3.5Å; V801-D804 WeakPolarHBondContact O-CB 3.48Å; V801-D804 PolarHBondContact O-N 3.4Å; V801-L809 HydrophobicContact CG2-CB 4Å; V801-T811 HydrophobicContact CG2-CG2 4.11Å
802	S	84.3	Confident	87.3	Confident	27 Å²	27	30.9 Å²	30.9	19%	0.189	18%	0.179	C	C	.	.	H	α-helix	trans	-60.9	-46	-179.6	79	0	0	0	0	111.2	D798 Y799 D804 P860	D798-S802 WeakPolarHBondContact O-CB 3.37Å; D798-S802 PolarHBondContact O-N 3.45Å; Y799-S802 WeakPolarHBondContact O-CA 3.4Å; Y799-S802 WeakPolarHBondContact O-CB 3.49Å; Y799-S802 PolarHBondContact O-N 2.86Å; Y799-S802 PolarHBondContact O-OG 3.05Å; S802-D804 VanDerWaalsContact C-N 3.26Å; S802-D804 PolarHBondContact O-N 3.11Å; S802-P860 WeakPolarHBondContact O-CB 3.2Å; S802-P860 WeakPolarHBondContact O-CD 3.36Å; S802-P860 WeakPolarHBondContact O-CG 3.48Å
803	I	85.8	Confident	86.7	Confident	59 Å²	59	32.6 Å²	32.6	30%	0.303	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-4.2	-175.3	67.1	172.2	0	0	0	114.1	Y799 V801 A805	Y799-I803 HydrophobicContact CD1-CD1 4.28Å; Y799-I803 HydrophobicContact CD2-CG2 4.29Å; Y799-I803 HydrophobicContact CE1-CD1 3.75Å; Y799-I803 HydrophobicContact CE1-CG2 4.15Å; Y799-I803 HydrophobicContact CE2-CG2 3.76Å; Y799-I803 PolarHBondContact O-N 3.21Å; V801-I803 PolarHBondContact O-N 3.5Å; I803-A805 PolarHBondContact O-N 3.41Å
804	D	84.7	Confident	86.3	Confident	5 Å²	5	41.4 Å²	41.4	3%	0.027	24%	0.235	C	C	.	.			trans	-64	121.3	-177.7	-169.2	37.4	0	0	0	111.4	K781 E800 V801 S802 D806 C807 K808 L809 C861	K781-D804 VanDerWaalsContact CE-OD1 3.32Å; K781-D804 WeakPolarHBondContact CE-OD1 3.21Å; K781-D804 IonicContact NZ-OD1 2.84Å; K781-D804 PolarHBondContact NZ-OD1 3.24Å; E800-D804 PolarHBondContact O-N 3.03Å; V801-D804 WeakPolarHBondContact O-CB 3.48Å; V801-D804 PolarHBondContact O-N 3.4Å; S802-D804 VanDerWaalsContact C-N 3.26Å; S802-D804 PolarHBondContact O-N 3.11Å; D804-D806 VanDerWaalsContact C-N 3.29Å; D804-D806 PolarHBondContact O-N 3Å; D804-C807 PolarHBondContact O-N 3.46Å; D804-C807 WeakPolarHBondContact OD2-CA 3.47Å; D804-C807 PolarHBondContact OD2-N 3.45Å; D804-C807 VanDerWaalsContact OD2-N 3.07Å; D804-K808 PolarHBondContact OD2-N 3.12Å; D804-L809 HydrophobicContact CB-CB 4.49Å; D804-L809 HydrophobicContact CB-CD1 4.39Å; D804-L809 HydrophobicContact CB-CG 4.47Å; D804-L809 PolarHBondContact OD2-N 3.3Å; D804-C861 PolarHBondContact O-SG 3.04Å
805	A	79.5	Confident	85.9	Confident	68 Å²	68	42 Å²	42	56%	0.562	25%	0.245	S	C	*	.	S	Bend	trans	-67.9	-32.9	-179	0	0	0	0	0	112.4	I803 R864	I803-A805 PolarHBondContact O-N 3.41Å; A805-R864 PolarHBondContact O-NH1 3.11Å
806	D	76.1	Confident	85.7	Confident	110 Å²	110	43 Å²	43	59%	0.588	25%	0.248	S	C	*	.	S	Bend	trans	-89.6	-12.2	-176	-66.8	-26.9	0	0	0	113	D804 K808	D804-D806 VanDerWaalsContact C-N 3.29Å; D804-D806 PolarHBondContact O-N 3Å; D806-K808 HydrophobicContact CB-CB 4.46Å; D806-K808 HydrophobicContact CB-CD 4.42Å; D806-K808 HydrophobicContact CB-CG 4.05Å; D806-K808 PolarHBondContact O-N 2.97Å; D806-K808 VanDerWaalsContact O-N 3.16Å
807	C	81	Confident	85.5	Confident	44 Å²	44	44 Å²	44	30%	0.297	26%	0.256	S	S	.	.			trans	49.9	34.5	-174.1	-55.8	0	0	0	0	113.3	D804 C861	D804-C807 PolarHBondContact O-N 3.46Å; D804-C807 WeakPolarHBondContact OD2-CA 3.47Å; D804-C807 PolarHBondContact OD2-N 3.45Å; D804-C807 VanDerWaalsContact OD2-N 3.07Å; C807-C861 WeakPolarHBondContact CA-SG 3.48Å; C807-C861 HydrophobicContact CB-CB 3.89Å; C807-C861 WeakPolarHBondContact CB-SG 3.45Å; C807-C861 WeakPolarHBondContact SG-CA 3.35Å; C807-C861 WeakPolarHBondContact SG-CB 3.34Å; C807-C861 CovalentContact SG-SG 2.04Å; C807-C861 PolarHBondContact SG-SG 2.94Å
808	K	82.4	Confident	85.4	Confident	59 Å²	59	50.5 Å²	50.5	26%	0.257	29%	0.29	S	S	.	.			trans	-96.4	-18.2	179.4	-69.6	-169.6	-174.7	-166.3	0	112.1	R606 S607 D609 D804 D806	R606-K808 HydrophobicContact CG-CB 4.38Å; S607-K808 WeakPolarHBondContact CB-O 3.43Å; S607-K808 PolarHBondContact N-O 3.13Å; S607-K808 VanDerWaalsContact OG-CA 3.28Å; S607-K808 WeakPolarHBondContact OG-CA 3.41Å; S607-K808 PolarHBondContact OG-O 3.38Å; D609-K808 IonicContact OD2-NZ 3.6Å; D609-K808 PolarHBondContact OD2-NZ 3.46Å; D804-K808 PolarHBondContact OD2-N 3.12Å; D806-K808 HydrophobicContact CB-CB 4.46Å; D806-K808 HydrophobicContact CB-CD 4.42Å; D806-K808 HydrophobicContact CB-CG 4.05Å; D806-K808 PolarHBondContact O-N 2.97Å; D806-K808 VanDerWaalsContact O-N 3.16Å
809	L	87.3	Confident	85.4	Confident	9 Å²	9	49.3 Å²	49.3	5%	0.047	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	141.6	175.4	-64.1	-173.4	0	0	0	111.9	L604 R606 V777 L780 K781 V801 D804	L604-L809 HydrophobicContact CD1-CB 4.17Å; L604-L809 HydrophobicContact CD2-CD1 4.27Å; R606-L809 HydrophobicContact CB-CD2 4.28Å; R606-L809 HydrophobicContact CG-CD2 4.5Å; V777-L809 HydrophobicContact CG1-CD1 3.72Å; L780-L809 HydrophobicContact CD2-CD2 3.33Å; K781-L809 HydrophobicContact CG-CD2 4.29Å; V801-L809 HydrophobicContact CG2-CB 4Å; D804-L809 HydrophobicContact CB-CB 4.49Å; D804-L809 HydrophobicContact CB-CD1 4.39Å; D804-L809 HydrophobicContact CB-CG 4.47Å; D804-L809 PolarHBondContact OD2-N 3.3Å
810	A	86.6	Confident	85.6	Confident	29 Å²	29	48.9 Å²	48.9	24%	0.24	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	143	174.5	0	0	0	0	0	110.9	V605	V605-A810 PolarHBondContact N-O 3.47Å; V605-A810 PolarHBondContact O-N 3.17Å
811	T	88.9	Confident	85.9	Confident	41 Å²	41	48 Å²	48	25%	0.252	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	127.4	168.5	45.8	0	0	0	0	109.6	I603 L604 L797 D798 V801	I603-T811 CarbonylContact O-C 3.48Å; I603-T811 WeakPolarHBondContact O-CA 3.38Å; L604-T811 HydrophobicContact CD1-CG2 4.16Å; L797-T811 HydrophobicContact CB-CG2 3.59Å; L797-T811 HydrophobicContact CD1-CG2 4.38Å; D798-T811 PolarHBondContact OD1-OG1 2.93Å; V801-T811 HydrophobicContact CG2-CG2 4.11Å
812	V	86.6	Confident	86.2	Confident	7 Å²	7	46.5 Å²	46.5	4%	0.042	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	152	-172.6	-62.7	0	0	0	0	113.1	I603 V605 E723 V725	I603-V812 HydrophobicContact CB-CG2 3.98Å; I603-V812 HydrophobicContact CG2-CG2 4.1Å; I603-V812 PolarHBondContact O-N 2.99Å; V605-V812 HydrophobicContact CG1-CG2 3.8Å; V605-V812 HydrophobicContact CG2-CB 4.35Å; V605-V812 HydrophobicContact CG2-CG1 3.43Å; V605-V812 VanDerWaalsContact CG2-CG1 3.43Å; V605-V812 HydrophobicContact CG2-CG2 3.97Å; E723-V812 HydrophobicContact CB-CG1 4.04Å; E723-V812 VanDerWaalsContact CD-CG1 3.45Å; E723-V812 HydrophobicContact CG-CG1 3.72Å; E723-V812 WeakPolarHBondContact OE2-CG1 3.42Å; V725-V812 HydrophobicContact CB-CG2 4.43Å
813	G	82.3	Confident	86.8	Confident	36 Å²	36	45.2 Å²	45.2	37%	0.371	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	80.6	173.3	178.8	0	0	0	0	0	114.6	S726	S726-G813 WeakPolarHBondContact O-CA 3.46Å
814	K	85.1	Confident	87.3	Confident	186 Å²	186	42.4 Å²	42.4	81%	0.809	25%	0.249	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-74.4	139.1	175.2	-67.3	-177.1	-178.8	179.8	0	109.5	F816	K814-F816 PolarHBondContact O-N 3.05Å
815	P	82.1	Confident	87.8	Confident	72 Å²	72	42.2 Å²	42.2	47%	0.468	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	138	174.6	-6.4	16.9	0	0	0	110.6	S600 K794	S600-P815 WeakPolarHBondContact OG-CB 3.48Å; K794-P815 HydrophobicContact CD-CB 4.23Å; K794-P815 HydrophobicContact CD-CG 4.15Å
816	F	87.6	Confident	88.4	Confident	28 Å²	28	40.6 Å²	40.6	12%	0.123	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	161.7	179.6	62.5	-85.7	0	0	0	109.7	L601 I603 I728 Y753 I791 K814	L601-F816 HydrophobicContact CB-CD2 4.01Å; L601-F816 HydrophobicContact CB-CE1 4.28Å; L601-F816 HydrophobicContact CB-CE2 3.62Å; L601-F816 HydrophobicContact CB-CZ 3.77Å; L601-F816 WeakPolarHBondContact CB-O 3.39Å; L601-F816 HydrophobicContact CD1-CD2 4.37Å; L601-F816 HydrophobicContact CD1-CE2 3.84Å; L601-F816 HydrophobicContact CG-CE2 4.38Å; L601-F816 PolarHBondContact N-O 3.36Å; L601-F816 PolarHBondContact O-N 3.02Å; I603-F816 HydrophobicContact CD1-CE1 4.39Å; I603-F816 HydrophobicContact CG1-CE1 4.13Å; I728-F816 HydrophobicContact CB-CD1 3.92Å; I728-F816 HydrophobicContact CB-CE1 3.74Å; I728-F816 HydrophobicContact CB-CE2 4.48Å; I728-F816 HydrophobicContact CB-CG 4.39Å; I728-F816 HydrophobicContact CB-CZ 4.04Å; I728-F816 HydrophobicContact CD1-CE1 4.13Å; I728-F816 HydrophobicContact CD1-CE2 4.05Å; I728-F816 HydrophobicContact CD1-CZ 3.61Å; I728-F816 HydrophobicContact CG1-CD1 4.45Å; I728-F816 HydrophobicContact CG1-CD2 4.39Å; I728-F816 HydrophobicContact CG1-CE1 4.07Å; I728-F816 HydrophobicContact CG1-CE2 3.99Å; I728-F816 HydrophobicContact CG1-CZ 3.82Å; I728-F816 HydrophobicContact CG2-CD1 4.04Å; I728-F816 HydrophobicContact CG2-CE1 4.38Å; I728-F816 HydrophobicContact CG2-CG 4.22Å; Y753-F816 HydrophobicContact CD1-CE2 4.38Å; Y753-F816 AromaticContact CE1-CD2 3.84Å; Y753-F816 HydrophobicContact CE1-CD2 3.84Å; Y753-F816 AromaticContact CE1-CE2 3.94Å; Y753-F816 HydrophobicContact CE1-CE2 3.94Å; I791-F816 HydrophobicContact CG2-CZ 4.26Å; K814-F816 PolarHBondContact O-N 3.05Å
817	A	88	Confident	89.1	Confident	21 Å²	21	40.4 Å²	40.4	17%	0.174	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	52.5	69.9	-172.9	0	0	0	0	0	112.1	S600 L601 Y753 E819	S600-A817 WeakPolarHBondContact CA-O 3.34Å; L601-A817 HydrophobicContact CB-CB 4.39Å; L601-A817 HydrophobicContact CD1-CB 3.75Å; L601-A817 HydrophobicContact CG-CB 3.94Å; Y753-A817 HydrophobicContact CD1-CB 4.2Å; Y753-A817 HydrophobicContact CD2-CB 3.77Å; Y753-A817 HydrophobicContact CE1-CB 3.94Å; Y753-A817 HydrophobicContact CE2-CB 3.48Å; Y753-A817 VanDerWaalsContact CE2-CB 3.48Å; Y753-A817 HydrophobicContact CG-CB 4.12Å; A817-E819 PolarHBondContact O-N 3.42Å
818	I	88.4	Confident	89.3	Confident	136 Å²	136	44.9 Å²	44.9	70%	0.697	25%	0.248	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-67	122.4	177.4	-57.7	170.7	0	0	0	108.2
819	E	90.2	Very high	89.4	Confident	26 Å²	26	42.8 Å²	42.8	12%	0.121	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	157.3	-178	-68	-172.8	174.4	0	0	109.7	S581 T599 A817	S581-E819 WeakPolarHBondContact CB-OE2 3.39Å; T599-E819 CarbonylContact C-O 3.57Å; T599-E819 HydrophobicContact CG2-CB 4.31Å; T599-E819 PolarHBondContact N-O 2.93Å; T599-E819 PolarHBondContact O-N 3.36Å; A817-E819 PolarHBondContact O-N 3.42Å
820	G	93.3	Very high	89.3	Confident	14 Å²	14	45.7 Å²	45.7	14%	0.144	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	143.9	171.3	0	0	0	0	0	110.4	I582 F597	I582-G820 VanDerWaalsContact CG1-O 3.27Å; I582-G820 WeakPolarHBondContact CG1-O 3.4Å; I582-G820 PolarHBondContact N-O 3.28Å; F597-G820 CarbonylContact O-C 3.56Å; F597-G820 WeakPolarHBondContact O-CA 3.48Å
821	Y	95.6	Very high	89.3	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	130.7	163.5	-58.2	-31.4	0	0	0	109.7	F472 F580 S581 P595 F596 F597 T599 D793 A795	F472-Y821 AromaticContact CE1-CD2 3.99Å; F472-Y821 HydrophobicContact CE1-CD2 3.99Å; F472-Y821 HydrophobicContact CE1-CE2 4.11Å; F472-Y821 HydrophobicContact CE2-CD2 4.37Å; F472-Y821 AromaticContact CE2-CE2 3.68Å; F472-Y821 HydrophobicContact CE2-CE2 3.68Å; F472-Y821 AromaticContact CZ-CD2 3.79Å; F472-Y821 HydrophobicContact CZ-CD2 3.79Å; F472-Y821 AromaticContact CZ-CE2 3.44Å; F472-Y821 HydrophobicContact CZ-CE2 3.44Å; F472-Y821 VanDerWaalsContact CZ-CE2 3.44Å; F580-Y821 WeakPolarHBondContact O-CA 3.28Å; S581-Y821 WeakPolarHBondContact OG-CE1 3.4Å; P595-Y821 CarbonylContact C-O 3.55Å; P595-Y821 WeakPolarHBondContact CA-O 3.41Å; F596-Y821 WeakPolarHBondContact CD1-O 3.45Å; F596-Y821 PolarHBondContact N-O 2.96Å; F597-Y821 HydrophobicContact CB-CD2 3.82Å; F597-Y821 HydrophobicContact CB-CG 4.37Å; F597-Y821 AromaticContact CD1-CD2 3.87Å; F597-Y821 HydrophobicContact CD1-CD2 3.87Å; F597-Y821 HydrophobicContact CD1-CE2 4.01Å; F597-Y821 HydrophobicContact CG-CD2 4.06Å; F597-Y821 PolarHBondContact O-N 3.24Å; T599-Y821 HydrophobicContact CG2-CD1 3.96Å; T599-Y821 HydrophobicContact CG2-CE1 3.39Å; T599-Y821 HydrophobicContact CG2-CE2 4.21Å; D793-Y821 WeakPolarHBondContact CB-OH 3.25Å; D793-Y821 WeakPolarHBondContact OD2-CE1 3.5Å; D793-Y821 PolarHBondContact OD2-OH 3.24Å; A795-Y821 HydrophobicContact CB-CE2 4.22Å
822	G	95.4	Very high	89.3	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.245	C	C	.	.			trans	-132.1	159.4	177.4	0	0	0	0	0	111	F580	F580-G822 PolarHBondContact O-N 3.38Å; F580-G822 VanDerWaalsContact O-N 3.09Å
823	I	97.1	Very high	89.4	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	27%	0.27	C	S	.	.			trans	-75.3	127.9	171.3	-62.6	179	0	0	0	107.7	L535 M575 V577 F592 T593 F596 I839	L535-I823 HydrophobicContact CD1-CD1 3.59Å; M575-I823 HydrophobicContact CG-CG2 3.37Å; M575-I823 HydrophobicContact SD-CG2 3.71Å; V577-I823 HydrophobicContact CG1-CG1 4.49Å; V577-I823 HydrophobicContact CG2-CD1 4.42Å; V577-I823 HydrophobicContact CG2-CG1 4.35Å; V577-I823 HydrophobicContact CG2-CG2 3.98Å; F592-I823 WeakPolarHBondContact CA-O 3.49Å; T593-I823 HydrophobicContact CG2-CB 3.74Å; T593-I823 HydrophobicContact CG2-CG2 4.34Å; T593-I823 PolarHBondContact N-O 3.31Å; T593-I823 VanDerWaalsContact N-O 3.08Å; T593-I823 PolarHBondContact OG1-N 3.32Å; F596-I823 HydrophobicContact CD1-CG1 4.4Å; F596-I823 HydrophobicContact CE1-CG1 4.45Å; I823-I839 HydrophobicContact CD1-CD1 3.92Å; I823-I839 HydrophobicContact CG1-CD1 4.29Å
824	G	96	Very high	89.8	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	134	178.3	0	0	0	0	0	111.4	M575 A576	M575-G824 CarbonylContact C-O 3.56Å; M575-G824 WeakPolarHBondContact CA-O 3.34Å; A576-G824 PolarHBondContact N-O 3.17Å; A576-G824 PolarHBondContact O-N 3.06Å
825	L	95.1	Very high	90.1	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	154	179.5	-64.3	165.7	0	0	0	110.2	M575 I590 D591 T593 L831 L835	M575-L825 HydrophobicContact CB-CD2 4.1Å; M575-L825 HydrophobicContact CE-CD2 4.26Å; M575-L825 HydrophobicContact CG-CD2 3.9Å; I590-L825 WeakPolarHBondContact CB-O 3.26Å; D591-L825 HydrophobicContact CB-CB 4.38Å; D591-L825 PolarHBondContact N-O 3.48Å; D591-L825 PolarHBondContact O-N 3.12Å; T593-L825 HydrophobicContact CG2-CD1 4.07Å; L825-L831 HydrophobicContact CD1-CB 4.26Å; L825-L831 HydrophobicContact CD2-CB 4.25Å; L825-L835 HydrophobicContact CD1-CD1 4.08Å; L825-L835 HydrophobicContact CD2-CD1 4.04Å
826	P	92.4	Very high	90.7	Very high	35 Å²	35	36.9 Å²	36.9	23%	0.227	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.3	150.5	168.4	-23.2	34	0	0	0	111.2	L568 D574 N828 S829	L568-P826 HydrophobicContact CD2-CG 4.46Å; D574-P826 WeakPolarHBondContact O-CD 3.47Å; P826-N828 PolarHBondContact O-N 2.94Å; P826-S829 WeakPolarHBondContact O-CB 3.49Å; P826-S829 PolarHBondContact O-N 2.93Å
827	Q	89.4	Confident	90.9	Very high	105 Å²	105	40.1 Å²	40.1	49%	0.491	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	136.5	-179	-167.6	169.4	34	0	0	112.1	R588 S829	R588-Q827 PolarHBondContact O-NE2 2.91Å; Q827-S829 VanDerWaalsContact C-N 3.31Å
828	N	85.6	Confident	91.3	Very high	139 Å²	139	40.5 Å²	40.5	74%	0.743	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.7	34.9	-174	-52.3	-56.6	0	0	0	113.7	D591 P826	D591-N828 VanDerWaalsContact OD2-CA 3.3Å; D591-N828 WeakPolarHBondContact OD2-CA 3.46Å; D591-N828 PolarHBondContact OD2-N 3.05Å; P826-N828 PolarHBondContact O-N 2.94Å
829	S	84.8	Confident	91.6	Very high	14 Å²	14	34.1 Å²	34.1	10%	0.098	19%	0.194	C	C	.	.			trans	-72.7	130.5	178.7	-178.7	0	0	0	0	111.3	D591 P826 Q827 L831 S832	D591-S829 PolarHBondContact OD2-N 3.4Å; P826-S829 WeakPolarHBondContact O-CB 3.49Å; P826-S829 PolarHBondContact O-N 2.93Å; Q827-S829 VanDerWaalsContact C-N 3.31Å; S829-L831 PolarHBondContact O-N 3.05Å; S829-L831 VanDerWaalsContact O-N 3.12Å; S829-L831 PolarHBondContact OG-N 3.21Å; S829-S832 WeakPolarHBondContact O-CB 3.38Å; S829-S832 PolarHBondContact O-N 3.03Å; S829-S832 VanDerWaalsContact O-N 3.17Å
830	P	85.1	Confident	91.8	Very high	70 Å²	70	35.9 Å²	35.9	46%	0.455	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-13.9	177.1	30.1	-36.8	0	0	0	112.8	W451 S832	W451-P830 HydrophobicContact CH2-CG 4.17Å; W451-P830 HydrophobicContact CZ2-CG 3.96Å; P830-S832 VanDerWaalsContact C-N 3.33Å
831	L	86.1	Confident	91.8	Very high	4 Å²	4	40.6 Å²	40.6	2%	0.021	22%	0.223	C	C	.	.	H	α-helix	trans	-75.8	-20	177.2	-81.8	170.1	0	0	0	113.6	W451 V457 M575 L825 S829 S833 N834 L835	W451-L831 HydrophobicContact CD2-CD1 4.44Å; W451-L831 HydrophobicContact CE3-CD1 4.33Å; W451-L831 HydrophobicContact CH2-CD1 3.56Å; W451-L831 HydrophobicContact CH2-CG 4.03Å; W451-L831 HydrophobicContact CZ2-CD1 3.7Å; W451-L831 HydrophobicContact CZ2-CG 3.87Å; W451-L831 HydrophobicContact CZ3-CD1 3.91Å; V457-L831 HydrophobicContact CB-CD2 4.29Å; V457-L831 HydrophobicContact CG1-CD2 4.27Å; V457-L831 HydrophobicContact CG2-CD1 4.39Å; V457-L831 HydrophobicContact CG2-CD2 3.32Å; V457-L831 HydrophobicContact CG2-CG 4.02Å; M575-L831 HydrophobicContact CE-CD1 4.49Å; L825-L831 HydrophobicContact CD1-CB 4.26Å; L825-L831 HydrophobicContact CD2-CB 4.25Å; S829-L831 PolarHBondContact O-N 3.05Å; S829-L831 VanDerWaalsContact O-N 3.12Å; S829-L831 PolarHBondContact OG-N 3.21Å; L831-S833 PolarHBondContact O-N 3.4Å; L831-N834 PolarHBondContact O-N 3.24Å; L831-L835 HydrophobicContact CB-CD1 3.91Å; L831-L835 HydrophobicContact CB-CG 4.48Å; L831-L835 HydrophobicContact CD2-CD1 4.37Å; L831-L835 HydrophobicContact CD2-CG 4.46Å; L831-L835 WeakPolarHBondContact O-CB 3.28Å; L831-L835 VanDerWaalsContact O-CG 3.29Å; L831-L835 WeakPolarHBondContact O-CG 3.35Å; L831-L835 PolarHBondContact O-N 3.49Å
832	S	89.2	Confident	91.8	Very high	22 Å²	22	40.9 Å²	40.9	15%	0.154	22%	0.224	C	C	.	.	H	α-helix	trans	-63	-45.9	-169.5	-173.8	0	0	0	0	112.9	S829 P830 S836	S829-S832 WeakPolarHBondContact O-CB 3.38Å; S829-S832 PolarHBondContact O-N 3.03Å; S829-S832 VanDerWaalsContact O-N 3.17Å; P830-S832 VanDerWaalsContact C-N 3.33Å; S832-S836 VanDerWaalsContact O-CB 3.23Å; S832-S836 WeakPolarHBondContact O-CB 3.39Å; S832-S836 PolarHBondContact O-N 2.98Å; S832-S836 VanDerWaalsContact O-N 3.07Å; S832-S836 PolarHBondContact O-OG 2.96Å
833	S	88.8	Confident	91.7	Very high	83 Å²	83	47.4 Å²	47.4	58%	0.58	25%	0.252	S	S	*	.	H	α-helix	trans	-66.6	-48.8	178.3	51.4	0	0	0	0	111.8	L831 S836 E837	L831-S833 PolarHBondContact O-N 3.4Å; S833-S836 PolarHBondContact O-N 3.49Å; S833-E837 PolarHBondContact O-N 3.49Å
834	N	89.7	Confident	91.5	Very high	55 Å²	55	51.9 Å²	51.9	29%	0.294	28%	0.283	S	S	.	.	H	α-helix	trans	-61.1	-50.1	-178.3	-169.2	6	0	0	0	111.5	L539 L831 S836 E837 F838	L539-N834 VanDerWaalsContact CD2-ND2 3.34Å; L539-N834 WeakPolarHBondContact CD2-ND2 3.38Å; L831-N834 PolarHBondContact O-N 3.24Å; N834-S836 VanDerWaalsContact C-N 3.32Å; N834-S836 PolarHBondContact O-N 2.93Å; N834-E837 WeakPolarHBondContact O-CB 3.35Å; N834-E837 PolarHBondContact O-N 3.36Å; N834-F838 WeakPolarHBondContact O-CD2 3.37Å; N834-F838 PolarHBondContact O-N 3.32Å; N834-F838 VanDerWaalsContact O-N 3.16Å; N834-F838 WeakPolarHBondContact OD1-CD2 3.37Å; N834-F838 VanDerWaalsContact OD1-CE2 3.27Å; N834-F838 WeakPolarHBondContact OD1-CE2 3.38Å
835	L	92.5	Very high	91.4	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-63.6	-37.2	177.4	-68.5	169.1	0	0	0	112.4	L535 L539 M575 T593 L825 L831 E837 F838 I839	L535-L835 HydrophobicContact CD1-CD2 4.29Å; L535-L835 HydrophobicContact CD2-CD2 4.01Å; L539-L835 HydrophobicContact CD1-CD2 3.49Å; L539-L835 VanDerWaalsContact CD1-CD2 3.49Å; L539-L835 HydrophobicContact CD1-CG 4.49Å; M575-L835 HydrophobicContact CE-CD1 3.47Å; M575-L835 VanDerWaalsContact CE-CD1 3.47Å; M575-L835 HydrophobicContact CE-CD2 4.37Å; M575-L835 HydrophobicContact SD-CD1 4.45Å; T593-L835 HydrophobicContact CG2-CB 3.69Å; T593-L835 HydrophobicContact CG2-CD1 4.4Å; L825-L835 HydrophobicContact CD1-CD1 4.08Å; L825-L835 HydrophobicContact CD2-CD1 4.04Å; L831-L835 HydrophobicContact CB-CD1 3.91Å; L831-L835 HydrophobicContact CB-CG 4.48Å; L831-L835 HydrophobicContact CD2-CD1 4.37Å; L831-L835 HydrophobicContact CD2-CG 4.46Å; L831-L835 WeakPolarHBondContact O-CB 3.28Å; L831-L835 VanDerWaalsContact O-CG 3.29Å; L831-L835 WeakPolarHBondContact O-CG 3.35Å; L831-L835 PolarHBondContact O-N 3.49Å; L835-E837 VanDerWaalsContact C-N 3.29Å; L835-E837 PolarHBondContact O-N 3.03Å; L835-F838 PolarHBondContact O-N 2.93Å; L835-I839 VanDerWaalsContact O-CG1 3.32Å; L835-I839 WeakPolarHBondContact O-CG1 3.49Å; L835-I839 PolarHBondContact O-N 3.09Å
836	S	93.8	Very high	91.3	Very high	23 Å²	23	58.6 Å²	58.6	16%	0.161	32%	0.323	C	S	.	.	H	α-helix	trans	-64.3	-34.6	176.5	-63.7	0	0	0	0	112.6	T593 S594 S832 S833 N834 S840	T593-S836 VanDerWaalsContact CA-OG 3.23Å; T593-S836 WeakPolarHBondContact CA-OG 3.15Å; S594-S836 PolarHBondContact N-OG 3.39Å; S594-S836 WeakPolarHBondContact OG-CA 3.35Å; S594-S836 PolarHBondContact OG-O 3.22Å; S832-S836 VanDerWaalsContact O-CB 3.23Å; S832-S836 WeakPolarHBondContact O-CB 3.39Å; S832-S836 PolarHBondContact O-N 2.98Å; S832-S836 VanDerWaalsContact O-N 3.07Å; S832-S836 PolarHBondContact O-OG 2.96Å; S833-S836 PolarHBondContact O-N 3.49Å; N834-S836 VanDerWaalsContact C-N 3.32Å; N834-S836 PolarHBondContact O-N 2.93Å; S836-S840 WeakPolarHBondContact O-CB 3.37Å; S836-S840 PolarHBondContact O-N 2.99Å; S836-S840 VanDerWaalsContact O-N 3.07Å; S836-S840 PolarHBondContact O-OG 2.83Å
837	E	93.3	Very high	91.4	Very high	95 Å²	95	59.6 Å²	59.6	44%	0.444	32%	0.323	S	S	.	.	H	α-helix	trans	-65.4	-49.5	174.7	-172.7	-179.9	177.6	0	0	110.9	S833 N834 L835 I839 S840 R841	S833-E837 PolarHBondContact O-N 3.49Å; N834-E837 WeakPolarHBondContact O-CB 3.35Å; N834-E837 PolarHBondContact O-N 3.36Å; L835-E837 VanDerWaalsContact C-N 3.29Å; L835-E837 PolarHBondContact O-N 3.03Å; E837-I839 PolarHBondContact O-N 3.09Å; E837-S840 WeakPolarHBondContact O-CB 3.39Å; E837-S840 PolarHBondContact O-N 2.73Å; E837-S840 VanDerWaalsContact O-N 3.1Å; E837-R841 WeakPolarHBondContact O-CG 3.19Å; E837-R841 PolarHBondContact O-N 3.11Å; E837-R841 IonicContact OE1-CZ 3.67Å; E837-R841 IonicContact OE1-NE 2.65Å; E837-R841 IonicContact OE1-NH2 2.8Å; E837-R841 PolarHBondContact OE1-NH2 3.48Å
838	F	94.8	Very high	91.5	Very high	30 Å²	30	55 Å²	55	13%	0.132	30%	0.302	C	S	.	.	H	α-helix	trans	-62.5	-42.1	178.1	-84.3	-82.8	0	0	0	112.8	L535 D538 L539 N834 L835 S840 R841 Y842	L535-F838 HydrophobicContact CD2-CB 3.8Å; D538-F838 HydrophobicContact CB-CD1 4.14Å; D538-F838 HydrophobicContact CB-CE1 3.76Å; L539-F838 HydrophobicContact CD1-CD2 4.35Å; L539-F838 HydrophobicContact CD2-CD2 3.78Å; L539-F838 HydrophobicContact CD2-CE2 3.31Å; L539-F838 HydrophobicContact CD2-CZ 3.94Å; L539-F838 HydrophobicContact CG-CD2 4.13Å; L539-F838 HydrophobicContact CG-CE2 3.98Å; L539-F838 HydrophobicContact CG-CZ 4.39Å; N834-F838 WeakPolarHBondContact O-CD2 3.37Å; N834-F838 PolarHBondContact O-N 3.32Å; N834-F838 VanDerWaalsContact O-N 3.16Å; N834-F838 WeakPolarHBondContact OD1-CD2 3.37Å; N834-F838 VanDerWaalsContact OD1-CE2 3.27Å; N834-F838 WeakPolarHBondContact OD1-CE2 3.38Å; L835-F838 PolarHBondContact O-N 2.93Å; F838-S840 VanDerWaalsContact C-N 3.25Å; F838-S840 PolarHBondContact O-N 3.47Å; F838-R841 WeakPolarHBondContact O-CB 3.44Å; F838-R841 PolarHBondContact O-N 2.7Å; F838-R841 VanDerWaalsContact O-N 3.16Å; F838-Y842 HydrophobicContact CB-CE2 4.34Å; F838-Y842 HydrophobicContact CD1-CE1 4.44Å; F838-Y842 WeakPolarHBondContact O-CD2 3.17Å; F838-Y842 VanDerWaalsContact O-CG 3.24Å; F838-Y842 PolarHBondContact O-N 3.04Å
839	I	95.7	Very high	91.8	Very high	2 Å²	2	53.7 Å²	53.7	1%	0.01	29%	0.294	C	S	.	.	H	α-helix	trans	-59.6	-39.9	173.8	-71.6	169.9	0	0	0	111	T593 S594 F596 I823 L835 E837 Y842 K843 M848	T593-I839 HydrophobicContact CG2-CD1 4.17Å; T593-I839 VanDerWaalsContact OG1-CD1 3.26Å; T593-I839 WeakPolarHBondContact OG1-CD1 3.24Å; S594-I839 WeakPolarHBondContact OG-CG2 3.48Å; F596-I839 HydrophobicContact CB-CG2 3.77Å; I823-I839 HydrophobicContact CD1-CD1 3.92Å; I823-I839 HydrophobicContact CG1-CD1 4.29Å; L835-I839 VanDerWaalsContact O-CG1 3.32Å; L835-I839 WeakPolarHBondContact O-CG1 3.49Å; L835-I839 PolarHBondContact O-N 3.09Å; E837-I839 PolarHBondContact O-N 3.09Å; I839-Y842 PolarHBondContact O-N 3.4Å; I839-K843 PolarHBondContact O-N 3.24Å; I839-K843 VanDerWaalsContact O-N 3.08Å; I839-M848 HydrophobicContact CG2-CE 4.06Å
840	S	93.8	Very high	92.2	Very high	63 Å²	63	58.7 Å²	58.7	44%	0.441	32%	0.32	S	S	.	.	H	α-helix	trans	-66.2	-40.1	177.4	-56.2	0	0	0	0	111.6	S836 E837 F838 K843 S844	S836-S840 WeakPolarHBondContact O-CB 3.37Å; S836-S840 PolarHBondContact O-N 2.99Å; S836-S840 VanDerWaalsContact O-N 3.07Å; S836-S840 PolarHBondContact O-OG 2.83Å; E837-S840 WeakPolarHBondContact O-CB 3.39Å; E837-S840 PolarHBondContact O-N 2.73Å; E837-S840 VanDerWaalsContact O-N 3.1Å; F838-S840 VanDerWaalsContact C-N 3.25Å; F838-S840 PolarHBondContact O-N 3.47Å; S840-K843 PolarHBondContact O-N 3.47Å; S840-S844 PolarHBondContact O-N 3.33Å
841	R	94.7	Very high	92.6	Very high	112 Å²	112	55.6 Å²	55.6	42%	0.423	30%	0.299	S	S	.	.	H	α-helix	trans	-62.9	-46.6	173.7	-68.9	179.4	-174.3	178.8	1.5	111.9	E837 F838 K843 S844 D845	E837-R841 WeakPolarHBondContact O-CG 3.19Å; E837-R841 PolarHBondContact O-N 3.11Å; E837-R841 IonicContact OE1-CZ 3.67Å; E837-R841 IonicContact OE1-NE 2.65Å; E837-R841 IonicContact OE1-NH2 2.8Å; E837-R841 PolarHBondContact OE1-NH2 3.48Å; F838-R841 WeakPolarHBondContact O-CB 3.44Å; F838-R841 PolarHBondContact O-N 2.7Å; F838-R841 VanDerWaalsContact O-N 3.16Å; R841-K843 PolarHBondContact O-N 3.15Å; R841-S844 WeakPolarHBondContact CA-OG 3.5Å; R841-S844 PolarHBondContact O-N 3.32Å; R841-S844 PolarHBondContact O-OG 3.33Å; R841-D845 WeakPolarHBondContact O-CB 3.23Å; R841-D845 PolarHBondContact O-N 3.12Å
842	Y	95.4	Very high	92.8	Very high	7 Å²	7	58.7 Å²	58.7	3%	0.027	31%	0.313	C	S	.	.	H	α-helix	trans	-60.7	-30.7	176.5	-63.9	-24	0	0	0	113.5	L531 K534 L535 D538 F838 I839 G846 Y847 M848	L531-Y842 HydrophobicContact CD1-CD2 3.81Å; L531-Y842 HydrophobicContact CD1-CE2 4.09Å; K534-Y842 HydrophobicContact CG-CE1 3.98Å; K534-Y842 HydrophobicContact CG-CE2 4.18Å; K534-Y842 PolarHBondContact O-OH 3.32Å; L535-Y842 HydrophobicContact CD2-CE2 3.55Å; L535-Y842 HydrophobicContact CG-CE2 3.89Å; D538-Y842 WeakPolarHBondContact OD2-CE1 3.27Å; D538-Y842 VanDerWaalsContact OD2-CZ 3.25Å; D538-Y842 PolarHBondContact OD2-OH 3.15Å; F838-Y842 HydrophobicContact CB-CE2 4.34Å; F838-Y842 HydrophobicContact CD1-CE1 4.44Å; F838-Y842 WeakPolarHBondContact O-CD2 3.17Å; F838-Y842 VanDerWaalsContact O-CG 3.24Å; F838-Y842 PolarHBondContact O-N 3.04Å; I839-Y842 PolarHBondContact O-N 3.4Å; Y842-G846 PolarHBondContact O-N 3.38Å; Y842-Y847 HydrophobicContact CD1-CD1 4.39Å; Y842-Y847 HydrophobicContact CD2-CD1 4.4Å; Y842-Y847 HydrophobicContact CG-CD1 4.05Å; Y842-Y847 PolarHBondContact O-N 3.21Å; Y842-M848 HydrophobicContact CD2-CE 4Å; Y842-M848 HydrophobicContact CG-CE 4.38Å; Y842-M848 PolarHBondContact O-N 3.34Å
843	K	92.6	Very high	92.8	Very high	137 Å²	137	61.6 Å²	61.6	60%	0.596	33%	0.327	S	S	*	.	H	α-helix	trans	-73	-41.5	173.4	-169	175.7	-176.7	175.1	0	112.1	I839 S840 R841 D845 G846 M848	I839-K843 PolarHBondContact O-N 3.24Å; I839-K843 VanDerWaalsContact O-N 3.08Å; S840-K843 PolarHBondContact O-N 3.47Å; R841-K843 PolarHBondContact O-N 3.15Å; K843-D845 VanDerWaalsContact C-N 3.34Å; K843-G846 PolarHBondContact O-N 3.38Å; K843-M848 HydrophobicContact CB-CG 4.31Å
844	S	92.8	Very high	92.8	Very high	93 Å²	93	63.7 Å²	63.7	65%	0.65	33%	0.326	S	S	*	.	H	α-helix	trans	-68.3	-34.6	176.2	58.8	0	0	0	0	112.9	S840 R841 G846	S840-S844 PolarHBondContact O-N 3.33Å; R841-S844 WeakPolarHBondContact CA-OG 3.5Å; R841-S844 PolarHBondContact O-N 3.32Å; R841-S844 PolarHBondContact O-OG 3.33Å; S844-G846 PolarHBondContact O-N 2.86Å
845	D	93.3	Very high	92.8	Very high	123 Å²	123	62.9 Å²	62.9	66%	0.658	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-7.7	-177.7	-63.1	-5.8	0	0	0	112.4	R841 K843 Y847	R841-D845 WeakPolarHBondContact O-CB 3.23Å; R841-D845 PolarHBondContact O-N 3.12Å; K843-D845 VanDerWaalsContact C-N 3.34Å; D845-Y847 VanDerWaalsContact C-N 3.29Å; D845-Y847 PolarHBondContact O-N 3.48Å
846	G	92.8	Very high	92.3	Very high	18 Å²	18	64.5 Å²	64.5	19%	0.186	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.1	8.8	-177.7	0	0	0	0	0	114.4	Y842 K843 S844 M848 D849 L850	Y842-G846 PolarHBondContact O-N 3.38Å; K843-G846 PolarHBondContact O-N 3.38Å; S844-G846 PolarHBondContact O-N 2.86Å; G846-M848 VanDerWaalsContact C-N 3.3Å; G846-M848 PolarHBondContact O-N 3.44Å; G846-D849 WeakPolarHBondContact O-CB 3.28Å; G846-D849 PolarHBondContact O-N 3.12Å; G846-L850 PolarHBondContact O-N 3.35Å; G846-L850 VanDerWaalsContact O-N 3.14Å
847	Y	94.6	Very high	91.3	Very high	57 Å²	57	70.4 Å²	70.4	22%	0.224	35%	0.348	C	S	.	.	H	α-helix	trans	-63	-37.1	176.9	179.6	-105.9	0	0	0	112.1	K534 Y842 D845 D849 L850 L851	K534-Y847 HydrophobicContact CB-CE1 3.93Å; K534-Y847 HydrophobicContact CG-CD1 4.39Å; K534-Y847 HydrophobicContact CG-CE1 3.76Å; K534-Y847 HydrophobicContact CG-CE2 4.43Å; Y842-Y847 HydrophobicContact CD1-CD1 4.39Å; Y842-Y847 HydrophobicContact CD2-CD1 4.4Å; Y842-Y847 HydrophobicContact CG-CD1 4.05Å; Y842-Y847 PolarHBondContact O-N 3.21Å; D845-Y847 VanDerWaalsContact C-N 3.29Å; D845-Y847 PolarHBondContact O-N 3.48Å; Y847-D849 VanDerWaalsContact C-N 3.26Å; Y847-D849 PolarHBondContact O-N 2.85Å; Y847-L850 WeakPolarHBondContact O-CB 3.36Å; Y847-L850 PolarHBondContact O-N 3.19Å; Y847-L851 HydrophobicContact CD1-CD1 3.92Å; Y847-L851 HydrophobicContact CD1-CG 4.37Å; Y847-L851 HydrophobicContact CE1-CD1 3.37Å; Y847-L851 HydrophobicContact CE1-CG 3.86Å; Y847-L851 PolarHBondContact O-N 3.36Å
848	M	92.9	Very high	89.7	Confident	9 Å²	9	69.3 Å²	69.3	4%	0.044	35%	0.347	C	S	.	.	H	α-helix	trans	-61.9	-34.6	175.5	-66.8	-64.1	179.1	0	0	112.6	L531 F596 I839 Y842 K843 G846 L851 H852	L531-M848 HydrophobicContact CD1-CE 3.53Å; L531-M848 HydrophobicContact CD1-SD 4.27Å; L531-M848 HydrophobicContact CD2-CE 4.19Å; F596-M848 HydrophobicContact CB-CE 3.82Å; F596-M848 HydrophobicContact CB-SD 4.29Å; I839-M848 HydrophobicContact CG2-CE 4.06Å; Y842-M848 HydrophobicContact CD2-CE 4Å; Y842-M848 HydrophobicContact CG-CE 4.38Å; Y842-M848 PolarHBondContact O-N 3.34Å; K843-M848 HydrophobicContact CB-CG 4.31Å; G846-M848 VanDerWaalsContact C-N 3.3Å; G846-M848 PolarHBondContact O-N 3.44Å; M848-L851 HydrophobicContact SD-CD1 4.43Å; M848-H852 WeakPolarHBondContact O-CB 3.44Å; M848-H852 PolarHBondContact O-N 3.33Å
849	D	91.8	Very high	87.9	Confident	110 Å²	110	72.3 Å²	72.3	59%	0.588	37%	0.368	S	S	*	.	H	α-helix	trans	-71.6	-39	176.2	-62.7	-30.9	0	0	0	110.9	G846 Y847 L851 H852 D853	G846-D849 WeakPolarHBondContact O-CB 3.28Å; G846-D849 PolarHBondContact O-N 3.12Å; Y847-D849 VanDerWaalsContact C-N 3.26Å; Y847-D849 PolarHBondContact O-N 2.85Å; D849-L851 PolarHBondContact O-N 2.74Å; D849-H852 PolarHBondContact O-N 2.85Å; D849-D853 WeakPolarHBondContact O-CB 3.37Å; D849-D853 PolarHBondContact O-N 3.41Å
850	L	93.4	Very high	86.1	Confident	120 Å²	120	73.7 Å²	73.7	63%	0.628	38%	0.377	S	S	*	.	H	α-helix	trans	-61.1	-43.1	173.3	-66.3	174.8	0	0	0	112	G846 Y847 H852 D853 K854	G846-L850 PolarHBondContact O-N 3.35Å; G846-L850 VanDerWaalsContact O-N 3.14Å; Y847-L850 WeakPolarHBondContact O-CB 3.36Å; Y847-L850 PolarHBondContact O-N 3.19Å; L850-H852 VanDerWaalsContact C-N 3.35Å; L850-D853 PolarHBondContact O-N 3.48Å; L850-K854 WeakPolarHBondContact O-CB 3.29Å; L850-K854 PolarHBondContact O-N 2.81Å
851	L	92.4	Very high	84.6	Confident	4 Å²	4	71.5 Å²	71.5	2%	0.021	36%	0.362	C	S	.	.	H	α-helix	trans	-62.8	-43	173.7	-79.4	174.7	0	0	0	111.3	Y527 D530 L531 Y847 M848 D849 K854 W855	Y527-L851 HydrophobicContact CD2-CB 3.85Å; Y527-L851 HydrophobicContact CE1-CD1 4.42Å; Y527-L851 HydrophobicContact CE2-CB 3.46Å; Y527-L851 VanDerWaalsContact CE2-CB 3.46Å; D530-L851 HydrophobicContact CB-CD2 3.48Å; D530-L851 VanDerWaalsContact CB-CD2 3.48Å; L531-L851 HydrophobicContact CB-CD1 4.14Å; Y847-L851 HydrophobicContact CD1-CD1 3.92Å; Y847-L851 HydrophobicContact CD1-CG 4.37Å; Y847-L851 HydrophobicContact CE1-CD1 3.37Å; Y847-L851 HydrophobicContact CE1-CG 3.86Å; Y847-L851 PolarHBondContact O-N 3.36Å; M848-L851 HydrophobicContact SD-CD1 4.43Å; D849-L851 PolarHBondContact O-N 2.74Å; L851-K854 PolarHBondContact O-N 2.8Å; L851-W855 VanDerWaalsContact O-CD1 3.22Å; L851-W855 PolarHBondContact O-N 3.36Å; L851-W855 VanDerWaalsContact O-N 3.1Å
852	H	90.3	Very high	82.5	Confident	69 Å²	69	68.2 Å²	68.2	32%	0.319	36%	0.363	S	S	.	.	H	α-helix	trans	-61.1	-48.6	178.1	-171.8	70.4	0	0	0	110.8	Y527 F597 M848 D849 L850 K854 W855 Y856	Y527-H852 HydrophobicContact CE2-CB 4.39Å; F597-H852 AromaticContact CE2-ND1 3.57Å; F597-H852 AromaticContact CZ-ND1 3.99Å; M848-H852 WeakPolarHBondContact O-CB 3.44Å; M848-H852 PolarHBondContact O-N 3.33Å; D849-H852 PolarHBondContact O-N 2.85Å; L850-H852 VanDerWaalsContact C-N 3.35Å; H852-K854 VanDerWaalsContact C-N 3.32Å; H852-K854 PolarHBondContact O-N 3.36Å; H852-W855 PolarHBondContact O-N 2.78Å; H852-Y856 AromaticContact CE1-CD1 3.82Å; H852-Y856 AromaticContact CE1-CD2 3.56Å; H852-Y856 AromaticContact CE1-CG 3.44Å; H852-Y856 VanDerWaalsContact CE1-CG 3.44Å; H852-Y856 AromaticContact ND1-CD2 3.37Å; H852-Y856 WeakPolarHBondContact ND1-CD2 3.48Å; H852-Y856 AromaticContact ND1-CE2 3.81Å; H852-Y856 AromaticContact ND1-CG 3.74Å; H852-Y856 VanDerWaalsContact O-CB 3.31Å; H852-Y856 WeakPolarHBondContact O-CB 3.37Å; H852-Y856 PolarHBondContact O-N 3.41Å
853	D	89.4	Confident	80.1	Confident	83 Å²	83	73.9 Å²	73.9	44%	0.444	39%	0.393	S	S	.	.	H	α-helix	trans	-60.8	-37.8	176	-99.7	30.1	0	0	0	112.5	D849 L850 K857	D849-D853 WeakPolarHBondContact O-CB 3.37Å; D849-D853 PolarHBondContact O-N 3.41Å; L850-D853 PolarHBondContact O-N 3.48Å; D853-K857 WeakPolarHBondContact O-CB 3.4Å; D853-K857 PolarHBondContact O-N 2.8Å; D853-K857 IonicContact OD2-NZ 2.68Å; D853-K857 PolarHBondContact OD2-NZ 2.82Å
854	K	89.7	Confident	78	Confident	127 Å²	127	73.7 Å²	73.7	55%	0.552	39%	0.389	S	S	*	.	H	α-helix	trans	-63.8	-44.4	177.9	-177.2	-178.3	175.2	-170.2	0	112	D530 L850 L851 H852	D530-K854 IonicContact OD1-NZ 2.6Å; D530-K854 WeakPolarHBondContact OD2-CE 3.49Å; D530-K854 IonicContact OD2-NZ 3.43Å; D530-K854 PolarHBondContact OD2-NZ 2.84Å; L850-K854 WeakPolarHBondContact O-CB 3.29Å; L850-K854 PolarHBondContact O-N 2.81Å; L851-K854 PolarHBondContact O-N 2.8Å; H852-K854 VanDerWaalsContact C-N 3.32Å; H852-K854 PolarHBondContact O-N 3.36Å
855	W	88.8	Confident	75.7	Confident	38 Å²	38	73 Å²	73	14%	0.144	38%	0.381	C	S	.	.	H	α-helix	trans	-96.7	-27.8	-169.6	-67.8	105.3	0	0	0	114.6	F474 Y525 G526 Y527 D530 L851 H852	F474-W855 HydrophobicContact CD2-CE3 4.41Å; F474-W855 AromaticContact CD2-CZ3 3.98Å; F474-W855 HydrophobicContact CD2-CZ3 3.98Å; F474-W855 AromaticContact CE2-CE3 3.78Å; F474-W855 HydrophobicContact CE2-CE3 3.78Å; F474-W855 AromaticContact CE2-CZ3 3.75Å; F474-W855 HydrophobicContact CE2-CZ3 3.75Å; Y525-W855 AromaticContact CD2-CH2 3.65Å; Y525-W855 HydrophobicContact CD2-CH2 3.65Å; Y525-W855 AromaticContact CD2-CZ3 3.93Å; Y525-W855 HydrophobicContact CD2-CZ3 3.93Å; Y525-W855 HydrophobicContact CE2-CH2 4.39Å; Y525-W855 HydrophobicContact CE2-CZ3 4.27Å; G526-W855 VanDerWaalsContact C-CZ2 3.48Å; Y527-W855 HydrophobicContact CD2-CB 4.44Å; Y527-W855 AromaticContact CD2-CD1 3.99Å; Y527-W855 HydrophobicContact CD2-CG 4.5Å; D530-W855 WeakPolarHBondContact OD2-CZ2 2.99Å; D530-W855 PolarHBondContact OD2-NE1 3Å; L851-W855 VanDerWaalsContact O-CD1 3.22Å; L851-W855 PolarHBondContact O-N 3.36Å; L851-W855 VanDerWaalsContact O-N 3.1Å; H852-W855 PolarHBondContact O-N 2.78Å
856	Y	83.2	Confident	73.3	Confident	34 Å²	34	74.8 Å²	74.8	13%	0.133	38%	0.383	C	S	.	.	H	α-helix	trans	-99.5	-15	-178.7	-79.1	-101.9	0	0	0	114.2	P471 F472 F597 A795 H852 V858	P471-Y856 HydrophobicContact CG-CD2 4.19Å; P471-Y856 HydrophobicContact CG-CE1 4.17Å; P471-Y856 HydrophobicContact CG-CE2 3.54Å; F472-Y856 VanDerWaalsContact CE2-OH 3.29Å; F472-Y856 WeakPolarHBondContact CE2-OH 3.46Å; F472-Y856 HydrophobicContact CZ-CE2 4.48Å; F472-Y856 WeakPolarHBondContact CZ-OH 3.48Å; F597-Y856 HydrophobicContact CE2-CE2 4.05Å; F597-Y856 HydrophobicContact CZ-CE2 4.18Å; F597-Y856 AromaticContact CZ-CZ 3.98Å; A795-Y856 WeakPolarHBondContact O-CE1 3.45Å; A795-Y856 PolarHBondContact O-OH 3.2Å; H852-Y856 AromaticContact CE1-CD1 3.82Å; H852-Y856 AromaticContact CE1-CD2 3.56Å; H852-Y856 AromaticContact CE1-CG 3.44Å; H852-Y856 VanDerWaalsContact CE1-CG 3.44Å; H852-Y856 AromaticContact ND1-CD2 3.37Å; H852-Y856 WeakPolarHBondContact ND1-CD2 3.48Å; H852-Y856 AromaticContact ND1-CE2 3.81Å; H852-Y856 AromaticContact ND1-CG 3.74Å; H852-Y856 VanDerWaalsContact O-CB 3.31Å; H852-Y856 WeakPolarHBondContact O-CB 3.37Å; H852-Y856 PolarHBondContact O-N 3.41Å; Y856-V858 PolarHBondContact O-N 2.9Å
857	K	72.1	Confident	70.9	Confident	147 Å²	147	76.3 Å²	76.3	64%	0.639	39%	0.394	S	S	*	.			trans	-80.8	39	-177.7	-160.9	175.4	-171	161.4	0	113.7	D853	D853-K857 WeakPolarHBondContact O-CB 3.4Å; D853-K857 PolarHBondContact O-N 2.8Å; D853-K857 IonicContact OD2-NZ 2.68Å; D853-K857 PolarHBondContact OD2-NZ 2.82Å
858	V	59.2	Low	68.4	Low	72 Å²	72	77.5 Å²	77.5	44%	0.436	41%	0.407	S	S	.	.			trans	-95.3	108.2	175.6	-168.9	0	0	0	0	107.7	Y856 P860	Y856-V858 PolarHBondContact O-N 2.9Å; V858-P860 VanDerWaalsContact C-CD 3.48Å; V858-P860 WeakPolarHBondContact O-CD 3.43Å
859	V	57.8	Low	66.2	Low	94 Å²	94	81.4 Å²	81.4	57%	0.57	43%	0.431	S	S	*	.			trans	-103	99.5	-175.3	-113	0	0	0	0	112.9
860	P	57.4	Low	64	Low	30 Å²	30	84.3 Å²	84.3	20%	0.195	44%	0.441	C	S	.	.	S	Bend	trans	-88.9	-43.2	151.2	-22.4	31.1	0	0	0	114	S802 V858 R864	S802-P860 WeakPolarHBondContact O-CB 3.2Å; S802-P860 WeakPolarHBondContact O-CD 3.36Å; S802-P860 WeakPolarHBondContact O-CG 3.48Å; V858-P860 VanDerWaalsContact C-CD 3.48Å; V858-P860 WeakPolarHBondContact O-CD 3.43Å; P860-R864 WeakPolarHBondContact O-CB 3.3Å; P860-R864 WeakPolarHBondContact O-CD 3.25Å; P860-R864 WeakPolarHBondContact O-CG 3.17Å
861	C	61.7	Low	61.6	Low	18 Å²	18	82.9 Å²	82.9	12%	0.122	44%	0.438	C	S	.	.	S	Bend	trans	-99.6	-31	-168.5	-61.4	0	0	0	0	115.6	D804 C807 N863 R864 V865	D804-C861 PolarHBondContact O-SG 3.04Å; C807-C861 WeakPolarHBondContact CA-SG 3.48Å; C807-C861 HydrophobicContact CB-CB 3.89Å; C807-C861 WeakPolarHBondContact CB-SG 3.45Å; C807-C861 WeakPolarHBondContact SG-CA 3.35Å; C807-C861 WeakPolarHBondContact SG-CB 3.34Å; C807-C861 CovalentContact SG-SG 2.04Å; C807-C861 PolarHBondContact SG-SG 2.94Å; C861-N863 VanDerWaalsContact C-N 3.31Å; C861-N863 PolarHBondContact O-N 3.49Å; C861-R864 PolarHBondContact O-N 3.33Å; C861-R864 VanDerWaalsContact O-N 3.09Å; C861-V865 VanDerWaalsContact O-CG2 3.27Å; C861-V865 WeakPolarHBondContact O-CG2 3.46Å; C861-V865 PolarHBondContact O-N 2.91Å
862	G	50.4	Low	59.7	Low	43 Å²	43	89.2 Å²	89.2	44%	0.443	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-32.8	-176.1	0	0	0	0	0	115.3
863	N	45.8	Very low	58	Low	125 Å²	125	94.3 Å²	94.3	67%	0.668	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-18.8	174.2	-75.3	-23.2	0	0	0	113.4	C861	C861-N863 VanDerWaalsContact C-N 3.31Å; C861-N863 PolarHBondContact O-N 3.49Å
864	R	48.2	Very low	56.7	Low	133 Å²	133	93.3 Å²	93.3	50%	0.502	49%	0.488	S	S	.	.	H	α-helix	trans	-82	-28.9	176.4	-74.5	-175.1	-173.4	-175.6	1	112.2	A805 P860 C861 F866 A867 V868	A805-R864 PolarHBondContact O-NH1 3.11Å; P860-R864 WeakPolarHBondContact O-CB 3.3Å; P860-R864 WeakPolarHBondContact O-CD 3.25Å; P860-R864 WeakPolarHBondContact O-CG 3.17Å; C861-R864 PolarHBondContact O-N 3.33Å; C861-R864 VanDerWaalsContact O-N 3.09Å; R864-F866 VanDerWaalsContact C-N 3.26Å; R864-F866 PolarHBondContact O-N 3.02Å; R864-A867 CarbonylContact O-C 3.51Å; R864-A867 PolarHBondContact O-N 3.47Å; R864-A867 VanDerWaalsContact O-N 3.1Å; R864-V868 HydrophobicContact CB-CG2 4.18Å; R864-V868 WeakPolarHBondContact O-CA 3.2Å; R864-V868 WeakPolarHBondContact O-CB 3.28Å; R864-V868 WeakPolarHBondContact O-CG2 3.36Å; R864-V868 PolarHBondContact O-N 3.22Å
865	V	45.6	Very low	55.5	Low	79 Å²	79	88.8 Å²	88.8	48%	0.479	48%	0.477	S	S	.	.	H	α-helix	trans	-60.4	-37.1	176.2	171.6	0	0	0	0	111	C861 T869	C861-V865 VanDerWaalsContact O-CG2 3.27Å; C861-V865 WeakPolarHBondContact O-CG2 3.46Å; C861-V865 PolarHBondContact O-N 2.91Å; V865-T869 HydrophobicContact CG1-CG2 4.44Å; V865-T869 VanDerWaalsContact O-CB 3.27Å; V865-T869 WeakPolarHBondContact O-CB 3.46Å; V865-T869 WeakPolarHBondContact O-CG2 3.41Å; V865-T869 PolarHBondContact O-N 3.19Å; V865-T869 VanDerWaalsContact O-N 3.14Å; V865-T869 PolarHBondContact O-OG1 2.88Å
866	F	42.8	Very low	54.8	Low	161 Å²	161	93.4 Å²	93.4	71%	0.706	50%	0.504	S	S	*	.	H	α-helix	trans	-74.5	-31.2	173.5	-74.4	-77.7	0	0	0	114	R864 T869	R864-F866 VanDerWaalsContact C-N 3.26Å; R864-F866 PolarHBondContact O-N 3.02Å; F866-T869 PolarHBondContact O-OG1 3.03Å
867	A	41.2	Very low	54.1	Low	50 Å²	50	95.2 Å²	95.2	41%	0.413	52%	0.521	S	S	.	.	H	α-helix	trans	-86.6	-26.9	179.3	0	0	0	0	0	114.2	R864 T871	R864-A867 CarbonylContact O-C 3.51Å; R864-A867 PolarHBondContact O-N 3.47Å; R864-A867 VanDerWaalsContact O-N 3.1Å; A867-T871 PolarHBondContact O-OG1 3.1Å; A867-T871 VanDerWaalsContact O-OG1 3.07Å
868	V	43.5	Very low	54.1	Low	81 Å²	81	91 Å²	91	49%	0.491	50%	0.504	S	S	.	.	H	α-helix	trans	-86.2	-33.4	179	175.4	0	0	0	0	110.6	R864 E870 T871 L872	R864-V868 HydrophobicContact CB-CG2 4.18Å; R864-V868 WeakPolarHBondContact O-CA 3.2Å; R864-V868 WeakPolarHBondContact O-CB 3.28Å; R864-V868 WeakPolarHBondContact O-CG2 3.36Å; R864-V868 PolarHBondContact O-N 3.22Å; V868-E870 PolarHBondContact O-N 3.42Å; V868-T871 CarbonylContact O-C 3.48Å; V868-T871 PolarHBondContact O-N 3.33Å; V868-L872 PolarHBondContact O-N 3.03Å
869	T	46.5	Very low	54.9	Low	91 Å²	91	91.6 Å²	91.6	56%	0.558	50%	0.501	S	S	*	.	H	α-helix	trans	-64.5	-28.5	168.4	53	0	0	0	0	112.1	V865 F866 T871	V865-T869 HydrophobicContact CG1-CG2 4.44Å; V865-T869 VanDerWaalsContact O-CB 3.27Å; V865-T869 WeakPolarHBondContact O-CB 3.46Å; V865-T869 WeakPolarHBondContact O-CG2 3.41Å; V865-T869 PolarHBondContact O-N 3.19Å; V865-T869 VanDerWaalsContact O-N 3.14Å; V865-T869 PolarHBondContact O-OG1 2.88Å; F866-T869 PolarHBondContact O-OG1 3.03Å; T869-T871 VanDerWaalsContact C-N 3.29Å; T869-T871 PolarHBondContact O-N 3.43Å
870	E	43.9	Very low	56.1	Low	171 Å²	171	89 Å²	89	80%	0.799	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-16.6	170.6	-83.2	-167.5	154	0	0	114.1	V868	V868-E870 PolarHBondContact O-N 3.42Å
871	T	44.8	Very low	57.3	Low	91 Å²	91	87.9 Å²	87.9	56%	0.558	48%	0.48	S	S	*	.			trans	-126.8	17.1	-170.5	57.1	0	0	0	0	115.4	A867 V868 T869 Q873	A867-T871 PolarHBondContact O-OG1 3.1Å; A867-T871 VanDerWaalsContact O-OG1 3.07Å; V868-T871 CarbonylContact O-C 3.48Å; V868-T871 PolarHBondContact O-N 3.33Å; T869-T871 VanDerWaalsContact C-N 3.29Å; T869-T871 PolarHBondContact O-N 3.43Å; T871-Q873 PolarHBondContact O-N 2.83Å
872	L	50.8	Low	58.5	Low	137 Å²	137	90.6 Å²	90.6	72%	0.717	49%	0.493	S	S	*	.			trans	-63.6	76.9	163.7	-90.6	165.3	0	0	0	109.7	V868 M874	V868-L872 PolarHBondContact O-N 3.03Å; L872-M874 PolarHBondContact O-N 3.02Å; L872-M874 VanDerWaalsContact O-N 3.13Å
873	Q	54.7	Low	60.2	Low	176 Å²	176	93.9 Å²	93.9	82%	0.822	50%	0.495	S	S	*	.			trans	-60.3	116	169.2	-70.1	-177.7	-14.1	0	0	106.6	T871 G875	T871-Q873 PolarHBondContact O-N 2.83Å; Q873-G875 PolarHBondContact O-N 2.93Å
874	M	62.4	Low	62.3	Low	61 Å²	61	91.9 Å²	91.9	30%	0.3	49%	0.487	S	S	.	.			trans	-58.9	102.9	175.4	-74.6	-93	176.6	0	0	109.2	M716 L872 H878 F879	M716-M874 HydrophobicContact CB-CE 3.52Å; M716-M874 HydrophobicContact CE-CB 4.46Å; M716-M874 HydrophobicContact CE-CE 3.39Å; M716-M874 HydrophobicContact CE-CG 3.5Å; M716-M874 VanDerWaalsContact CE-CG 3.5Å; M716-M874 HydrophobicContact CE-SD 3.56Å; M716-M874 VanDerWaalsContact CE-SD 3.56Å; M716-M874 HydrophobicContact CG-CE 3.58Å; M716-M874 HydrophobicContact CG-SD 4.5Å; M716-M874 HydrophobicContact SD-CE 4.31Å; L872-M874 PolarHBondContact O-N 3.02Å; L872-M874 VanDerWaalsContact O-N 3.13Å; M874-H878 HydrophobicContact SD-CB 4.1Å; M874-F879 HydrophobicContact CB-CE2 3.87Å; M874-F879 HydrophobicContact CB-CZ 4.3Å
875	G	65.1	Low	64.2	Low	32 Å²	32	90.1 Å²	90.1	33%	0.33	49%	0.488	S	S	.	.			trans	-63.3	164.7	177.1	0	0	0	0	0	113.1	Q873 S877 H878	Q873-G875 PolarHBondContact O-N 2.93Å; G875-S877 PolarHBondContact O-N 3.44Å; G875-S877 VanDerWaalsContact O-N 3.14Å; G875-H878 PolarHBondContact O-N 3.48Å; G875-H878 VanDerWaalsContact O-N 3.1Å
876	I	73.5	Confident	66.3	Low	136 Å²	136	91.7 Å²	91.7	70%	0.697	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-58.4	-28.8	-179.8	-62.1	163.9	0	0	0	111.7	H878 F879 S880 F883	I876-H878 VanDerWaalsContact C-N 3.31Å; I876-H878 PolarHBondContact O-N 3.27Å; I876-F879 CarbonylContact O-C 3.54Å; I876-F879 PolarHBondContact O-N 3.24Å; I876-F879 VanDerWaalsContact O-N 3.12Å; I876-S880 PolarHBondContact O-N 3.45Å; I876-S880 VanDerWaalsContact O-N 3.16Å; I876-F883 HydrophobicContact CG2-CE2 3.99Å
877	S	69.3	Low	68.6	Low	71 Å²	71	88.3 Å²	88.3	50%	0.497	49%	0.488	S	S	.	.	G	3₁₀ helix	trans	-59.4	-37.4	176.9	51.2	0	0	0	0	112.9	G875 F879 S880	G875-S877 PolarHBondContact O-N 3.44Å; G875-S877 VanDerWaalsContact O-N 3.14Å; S877-F879 PolarHBondContact O-N 3.16Å; S877-S880 WeakPolarHBondContact O-CB 3.46Å; S877-S880 PolarHBondContact O-N 3.4Å; S877-S880 PolarHBondContact O-OG 2.86Å
878	H	71.4	Confident	71.1	Confident	60 Å²	60	90.5 Å²	90.5	28%	0.278	50%	0.496	S	S	.	.	G	3₁₀ helix	trans	-67.4	-23.9	177.7	-64.5	-76.1	0	0	0	112.9	A612 M874 G875 I876	A612-H878 VanDerWaalsContact CB-ND1 3.29Å; A612-H878 WeakPolarHBondContact CB-ND1 3.19Å; M874-H878 HydrophobicContact SD-CB 4.1Å; G875-H878 PolarHBondContact O-N 3.48Å; G875-H878 VanDerWaalsContact O-N 3.1Å; I876-H878 VanDerWaalsContact C-N 3.31Å; I876-H878 PolarHBondContact O-N 3.27Å
879	F	76.7	Confident	73.4	Confident	84 Å²	84	88.8 Å²	88.8	37%	0.368	50%	0.495	S	S	.	.	G	3₁₀ helix	trans	-100.7	3.7	177.3	-61.4	-71.8	0	0	0	113.4	M874 I876 S877 G881 L882 F883	M874-F879 HydrophobicContact CB-CE2 3.87Å; M874-F879 HydrophobicContact CB-CZ 4.3Å; I876-F879 CarbonylContact O-C 3.54Å; I876-F879 PolarHBondContact O-N 3.24Å; I876-F879 VanDerWaalsContact O-N 3.12Å; S877-F879 PolarHBondContact O-N 3.16Å; F879-G881 VanDerWaalsContact C-N 3.25Å; F879-G881 PolarHBondContact O-N 3.44Å; F879-L882 HydrophobicContact CD1-CD1 3.93Å; F879-L882 WeakPolarHBondContact O-CB 3.26Å; F879-L882 PolarHBondContact O-N 2.8Å; F879-F883 HydrophobicContact CB-CD2 4.49Å; F879-F883 HydrophobicContact CB-CE2 3.98Å; F879-F883 VanDerWaalsContact O-CD2 3.25Å; F879-F883 WeakPolarHBondContact O-CD2 3.19Å; F879-F883 PolarHBondContact O-N 2.87Å
880	S	81.8	Confident	75.6	Confident	40 Å²	40	88.3 Å²	88.3	28%	0.28	49%	0.492	S	S	.	.	H	α-helix	trans	-51.2	-41.2	-178.3	59.2	0	0	0	0	113.2	I876 S877 L882 F883 V884	I876-S880 PolarHBondContact O-N 3.45Å; I876-S880 VanDerWaalsContact O-N 3.16Å; S877-S880 WeakPolarHBondContact O-CB 3.46Å; S877-S880 PolarHBondContact O-N 3.4Å; S877-S880 PolarHBondContact O-OG 2.86Å; S880-L882 VanDerWaalsContact C-N 3.34Å; S880-L882 PolarHBondContact O-N 3.44Å; S880-F883 PolarHBondContact O-N 2.75Å; S880-V884 WeakPolarHBondContact O-CG2 3.46Å; S880-V884 PolarHBondContact O-N 3.46Å
881	G	84.3	Confident	78	Confident	5 Å²	5	81.9 Å²	81.9	5%	0.052	47%	0.471	C	S	.	.	H	α-helix	trans	-62.5	-33.6	177.1	0	0	0	0	0	115.2	I614 F879 V884 L885	I614-G881 VanDerWaalsContact CG2-CA 3.41Å; I614-G881 WeakPolarHBondContact O-CA 3.22Å; F879-G881 VanDerWaalsContact C-N 3.25Å; F879-G881 PolarHBondContact O-N 3.44Å; G881-V884 PolarHBondContact O-N 2.95Å; G881-L885 WeakPolarHBondContact O-CB 3.49Å; G881-L885 PolarHBondContact O-N 2.76Å
882	L	85.4	Confident	80.3	Confident	75 Å²	75	79 Å²	79	39%	0.393	46%	0.46	S	S	.	.	H	α-helix	trans	-69.8	-37.5	175.4	-65.5	176.9	0	0	0	111.4	F617 F879 S880 L885 L886	F617-L882 HydrophobicContact CB-CD2 4.26Å; F617-L882 HydrophobicContact CD1-CD2 4.27Å; F617-L882 HydrophobicContact CD2-CD2 3.93Å; F617-L882 HydrophobicContact CE2-CD2 4.35Å; F617-L882 HydrophobicContact CG-CD2 3.89Å; F617-L882 HydrophobicContact CG-CG 4.49Å; F879-L882 HydrophobicContact CD1-CD1 3.93Å; F879-L882 WeakPolarHBondContact O-CB 3.26Å; F879-L882 PolarHBondContact O-N 2.8Å; S880-L882 VanDerWaalsContact C-N 3.34Å; S880-L882 PolarHBondContact O-N 3.44Å; L882-L885 PolarHBondContact O-N 2.93Å; L882-L886 WeakPolarHBondContact O-CB 3.48Å; L882-L886 PolarHBondContact O-N 3.41Å
883	F	87.6	Confident	82.3	Confident	113 Å²	113	75.2 Å²	75.2	50%	0.496	45%	0.449	S	S	.	.	H	α-helix	trans	-66.1	-40.2	174.9	-65.2	-66.3	0	0	0	111.7	I876 F879 S880 L886 C887	I876-F883 HydrophobicContact CG2-CE2 3.99Å; F879-F883 HydrophobicContact CB-CD2 4.49Å; F879-F883 HydrophobicContact CB-CE2 3.98Å; F879-F883 VanDerWaalsContact O-CD2 3.25Å; F879-F883 WeakPolarHBondContact O-CD2 3.19Å; F879-F883 PolarHBondContact O-N 2.87Å; S880-F883 PolarHBondContact O-N 2.75Å; F883-L886 PolarHBondContact O-N 2.75Å; F883-C887 PolarHBondContact O-N 3.37Å; F883-C887 PolarHBondContact O-SG 2.79Å
884	V	88.3	Confident	84.1	Confident	82 Å²	82	72 Å²	72	50%	0.497	44%	0.436	S	S	.	.	H	α-helix	trans	-62.6	-46.1	173.4	175	0	0	0	0	110.7	S880 G881 L886 C887 V888	S880-V884 WeakPolarHBondContact O-CG2 3.46Å; S880-V884 PolarHBondContact O-N 3.46Å; G881-V884 PolarHBondContact O-N 2.95Å; V884-L886 VanDerWaalsContact C-N 3.32Å; V884-L886 PolarHBondContact O-N 3.14Å; V884-C887 WeakPolarHBondContact O-CB 3.27Å; V884-C887 PolarHBondContact O-N 2.89Å; V884-C887 VanDerWaalsContact O-N 3.13Å; V884-V888 WeakPolarHBondContact O-CG2 3.45Å; V884-V888 PolarHBondContact O-N 3.18Å
885	L	88.7	Confident	85.4	Confident	97 Å²	97	75.2 Å²	75.2	51%	0.508	45%	0.454	S	S	.	.	H	α-helix	trans	-61.1	-39.6	177.5	-174.9	68.1	0	0	0	112.1	F617 G881 L882 V888 G889	F617-L885 HydrophobicContact CE2-CD2 4.44Å; F617-L885 HydrophobicContact CZ-CD2 4.36Å; G881-L885 WeakPolarHBondContact O-CB 3.49Å; G881-L885 PolarHBondContact O-N 2.76Å; L882-L885 PolarHBondContact O-N 2.93Å; L885-V888 PolarHBondContact O-N 3.39Å; L885-G889 PolarHBondContact O-N 3.22Å
886	L	90.3	Very high	86.6	Confident	111 Å²	111	78.3 Å²	78.3	58%	0.581	47%	0.467	S	S	*	.	H	α-helix	trans	-61.4	-44.5	173.9	-179.5	66.1	0	0	0	111.3	L882 F883 V884 V888 G889 V890	L882-L886 WeakPolarHBondContact O-CB 3.48Å; L882-L886 PolarHBondContact O-N 3.41Å; F883-L886 PolarHBondContact O-N 2.75Å; V884-L886 VanDerWaalsContact C-N 3.32Å; V884-L886 PolarHBondContact O-N 3.14Å; L886-V888 VanDerWaalsContact C-N 3.34Å; L886-V888 PolarHBondContact O-N 2.84Å; L886-G889 PolarHBondContact O-N 3.23Å; L886-V890 HydrophobicContact CD1-CG2 4.44Å; L886-V890 WeakPolarHBondContact O-CG2 3.38Å; L886-V890 PolarHBondContact O-N 2.76Å
887	C	91.4	Very high	87.3	Confident	90 Å²	90	76.8 Å²	76.8	61%	0.608	46%	0.46	S	S	*	.	H	α-helix	trans	-61.6	-42.8	176.6	-66.3	0	0	0	0	111.5	F883 V884 G889 V890 G891	F883-C887 PolarHBondContact O-N 3.37Å; F883-C887 PolarHBondContact O-SG 2.79Å; V884-C887 WeakPolarHBondContact O-CB 3.27Å; V884-C887 PolarHBondContact O-N 2.89Å; V884-C887 VanDerWaalsContact O-N 3.13Å; C887-G889 VanDerWaalsContact C-N 3.34Å; C887-V890 PolarHBondContact O-N 3.32Å; C887-G891 PolarHBondContact O-N 3.35Å
888	V	92.4	Very high	88.2	Confident	96 Å²	96	76.2 Å²	76.2	58%	0.582	46%	0.459	S	S	*	.	H	α-helix	trans	-62.2	-42.1	173.8	173.3	0	0	0	0	111	V884 L885 L886 G891 G892	V884-V888 WeakPolarHBondContact O-CG2 3.45Å; V884-V888 PolarHBondContact O-N 3.18Å; L885-V888 PolarHBondContact O-N 3.39Å; L886-V888 VanDerWaalsContact C-N 3.34Å; L886-V888 PolarHBondContact O-N 2.84Å; V888-G891 PolarHBondContact O-N 3.47Å; V888-G892 PolarHBondContact O-N 3.44Å
889	G	91.6	Very high	88.9	Confident	46 Å²	46	75.4 Å²	75.4	47%	0.474	47%	0.467	S	S	.	.	H	α-helix	trans	-64.2	-43	177.3	0	0	0	0	0	113.2	L885 L886 C887 G892 A893	L885-G889 PolarHBondContact O-N 3.22Å; L886-G889 PolarHBondContact O-N 3.23Å; C887-G889 VanDerWaalsContact C-N 3.34Å; G889-G892 PolarHBondContact O-N 2.9Å; G889-A893 WeakPolarHBondContact O-CB 3.3Å; G889-A893 PolarHBondContact O-N 3.09Å
890	V	94.1	Very high	89.4	Confident	80 Å²	80	76.4 Å²	76.4	49%	0.485	47%	0.473	S	S	.	.	H	α-helix	trans	-66.2	-43	174.4	173.3	0	0	0	0	110.6	L886 C887 G892 A893 L894	L886-V890 HydrophobicContact CD1-CG2 4.44Å; L886-V890 WeakPolarHBondContact O-CG2 3.38Å; L886-V890 PolarHBondContact O-N 2.76Å; C887-V890 PolarHBondContact O-N 3.32Å; V890-G892 VanDerWaalsContact C-N 3.35Å; V890-G892 PolarHBondContact O-N 2.83Å; V890-A893 PolarHBondContact O-N 3.34Å; V890-L894 HydrophobicContact CG1-CD1 4.16Å; V890-L894 HydrophobicContact CG1-CG 4.48Å; V890-L894 WeakPolarHBondContact O-CG 3.35Å; V890-L894 PolarHBondContact O-N 2.88Å
891	G	93.7	Very high	89.5	Confident	36 Å²	36	79.5 Å²	79.5	37%	0.371	48%	0.482	S	S	.	.	H	α-helix	trans	-59.5	-44.6	174.1	0	0	0	0	0	112.1	C887 V888 L894 L895	C887-G891 PolarHBondContact O-N 3.35Å; V888-G891 PolarHBondContact O-N 3.47Å; G891-L894 PolarHBondContact O-N 3.16Å; G891-L895 WeakPolarHBondContact O-CB 3.43Å; G891-L895 PolarHBondContact O-N 3.49Å
892	G	93.3	Very high	89.4	Confident	32 Å²	32	80.3 Å²	80.3	33%	0.33	49%	0.491	S	S	.	.	H	α-helix	trans	-63.4	-40.2	173.6	0	0	0	0	0	112.7	V888 G889 V890 L895 T896	V888-G892 PolarHBondContact O-N 3.44Å; G889-G892 PolarHBondContact O-N 2.9Å; V890-G892 VanDerWaalsContact C-N 3.35Å; V890-G892 PolarHBondContact O-N 2.83Å; G892-L895 PolarHBondContact O-N 3.39Å; G892-T896 WeakPolarHBondContact O-CB 3.38Å; G892-T896 WeakPolarHBondContact O-CG2 3.34Å; G892-T896 PolarHBondContact O-N 3.44Å; G892-T896 PolarHBondContact O-OG1 3.26Å
893	A	91.5	Very high	89.1	Confident	57 Å²	57	80.2 Å²	80.2	47%	0.471	49%	0.487	S	S	.	.	H	α-helix	trans	-63.8	-42.1	175.3	0	0	0	0	0	112	G889 V890 T896 L897	G889-A893 WeakPolarHBondContact O-CB 3.3Å; G889-A893 PolarHBondContact O-N 3.09Å; V890-A893 PolarHBondContact O-N 3.34Å; A893-T896 VanDerWaalsContact CA-OG1 3.28Å; A893-T896 WeakPolarHBondContact CA-OG1 3.46Å; A893-T896 PolarHBondContact O-OG1 3.23Å; A893-L897 VanDerWaalsContact O-CB 3.23Å; A893-L897 WeakPolarHBondContact O-CB 3.49Å; A893-L897 PolarHBondContact O-N 3.33Å
894	L	92.4	Very high	88.5	Confident	108 Å²	108	79.9 Å²	79.9	57%	0.565	48%	0.484	S	S	*	.	H	α-helix	trans	-66.3	-40.5	174.1	-70.7	172.2	0	0	0	111.8	V890 G891 L897 A898	V890-L894 HydrophobicContact CG1-CD1 4.16Å; V890-L894 HydrophobicContact CG1-CG 4.48Å; V890-L894 WeakPolarHBondContact O-CG 3.35Å; V890-L894 PolarHBondContact O-N 2.88Å; G891-L894 PolarHBondContact O-N 3.16Å; L894-L897 PolarHBondContact O-N 2.82Å; L894-A898 VanDerWaalsContact O-CB 3.28Å; L894-A898 WeakPolarHBondContact O-CB 3.37Å; L894-A898 PolarHBondContact O-N 2.78Å
895	L	90.3	Very high	87.8	Confident	129 Å²	129	84.3 Å²	84.3	68%	0.675	49%	0.491	S	S	*	.	H	α-helix	trans	-66.6	-42.2	177.3	-173.9	70.2	0	0	0	111.6	G891 G892 A898 G899	G891-L895 WeakPolarHBondContact O-CB 3.43Å; G891-L895 PolarHBondContact O-N 3.49Å; G892-L895 PolarHBondContact O-N 3.39Å; L895-A898 PolarHBondContact O-N 2.88Å; L895-G899 PolarHBondContact O-N 3.44Å
896	T	90	Very high	87.1	Confident	97 Å²	97	85.4 Å²	85.4	60%	0.595	50%	0.497	S	S	*	.	H	α-helix	trans	-68.1	-36.9	175	47.8	0	0	0	0	111.9	G892 A893 G899 E900	G892-T896 WeakPolarHBondContact O-CB 3.38Å; G892-T896 WeakPolarHBondContact O-CG2 3.34Å; G892-T896 PolarHBondContact O-N 3.44Å; G892-T896 PolarHBondContact O-OG1 3.26Å; A893-T896 VanDerWaalsContact CA-OG1 3.28Å; A893-T896 WeakPolarHBondContact CA-OG1 3.46Å; A893-T896 PolarHBondContact O-OG1 3.23Å; T896-G899 CarbonylContact O-C 3.52Å; T896-G899 PolarHBondContact O-N 2.84Å; T896-E900 WeakPolarHBondContact O-CB 3.27Å; T896-E900 PolarHBondContact O-N 3.18Å
897	L	89.8	Confident	86	Confident	104 Å²	104	82.9 Å²	82.9	55%	0.545	49%	0.486	S	S	.	.	H	α-helix	trans	-64.2	-43.7	170.8	179.4	67.3	0	0	0	111.3	A893 L894 G899 E900 H901	A893-L897 VanDerWaalsContact O-CB 3.23Å; A893-L897 WeakPolarHBondContact O-CB 3.49Å; A893-L897 PolarHBondContact O-N 3.33Å; L894-L897 PolarHBondContact O-N 2.82Å; L897-G899 VanDerWaalsContact C-N 3.32Å; L897-E900 PolarHBondContact O-N 2.91Å; L897-H901 VanDerWaalsContact O-CB 3.27Å; L897-H901 WeakPolarHBondContact O-CB 3.35Å; L897-H901 PolarHBondContact O-N 3.23Å
898	A	87.2	Confident	84.8	Confident	59 Å²	59	79.4 Å²	79.4	49%	0.488	46%	0.461	S	S	.	.	H	α-helix	trans	-65.2	-37.9	175.1	0	0	0	0	0	111.4	L894 L895 H901 G902	L894-A898 VanDerWaalsContact O-CB 3.28Å; L894-A898 WeakPolarHBondContact O-CB 3.37Å; L894-A898 PolarHBondContact O-N 2.78Å; L895-A898 PolarHBondContact O-N 2.88Å; A898-H901 PolarHBondContact O-N 3.21Å; A898-G902 PolarHBondContact O-N 3.31Å
899	G	86.6	Confident	83.5	Confident	43 Å²	43	77 Å²	77	44%	0.443	45%	0.447	S	S	.	.	H	α-helix	trans	-66.7	-42.5	174.3	0	0	0	0	0	112.4	L895 T896 L897 G902 F903	L895-G899 PolarHBondContact O-N 3.44Å; T896-G899 CarbonylContact O-C 3.52Å; T896-G899 PolarHBondContact O-N 2.84Å; L897-G899 VanDerWaalsContact C-N 3.32Å; G899-G902 PolarHBondContact O-N 3.02Å; G899-F903 WeakPolarHBondContact O-CB 3.32Å; G899-F903 PolarHBondContact O-N 3.42Å
900	E	86.8	Confident	82.3	Confident	104 Å²	104	80.9 Å²	80.9	49%	0.486	45%	0.453	S	S	.	.	H	α-helix	trans	-63.6	-47.3	171.9	-178.6	174.2	-167.4	0	0	109.9	T896 L897 G902 F903 Y904	T896-E900 WeakPolarHBondContact O-CB 3.27Å; T896-E900 PolarHBondContact O-N 3.18Å; L897-E900 PolarHBondContact O-N 2.91Å; E900-G902 VanDerWaalsContact C-N 3.32Å; E900-G902 PolarHBondContact O-N 3.46Å; E900-F903 PolarHBondContact O-N 2.86Å; E900-Y904 HydrophobicContact CG-CD2 3.62Å; E900-Y904 HydrophobicContact CG-CE2 3.69Å; E900-Y904 WeakPolarHBondContact O-CB 3.34Å; E900-Y904 VanDerWaalsContact O-CD2 3.3Å; E900-Y904 WeakPolarHBondContact O-CD2 3.2Å; E900-Y904 PolarHBondContact O-N 3.14Å; E900-Y904 WeakPolarHBondContact OE1-CE2 3.48Å
901	H	83.8	Confident	80.8	Confident	105 Å²	105	80.1 Å²	80.1	49%	0.486	45%	0.446	S	S	.	.	H	α-helix	trans	-60.1	-43.2	177.1	-161.4	72.6	0	0	0	111.6	L897 A898 Y904 R905	L897-H901 VanDerWaalsContact O-CB 3.27Å; L897-H901 WeakPolarHBondContact O-CB 3.35Å; L897-H901 PolarHBondContact O-N 3.23Å; A898-H901 PolarHBondContact O-N 3.21Å; H901-Y904 PolarHBondContact O-N 3.01Å; H901-R905 PolarHBondContact NE2-NE 2.96Å; H901-R905 VanDerWaalsContact NE2-NE 3.16Å; H901-R905 WeakPolarHBondContact O-CB 3.42Å; H901-R905 WeakPolarHBondContact O-CG 3.33Å; H901-R905 PolarHBondContact O-N 3.44Å
902	G	81.5	Confident	79.3	Confident	22 Å²	22	85.2 Å²	85.2	23%	0.227	45%	0.454	C	S	.	.	H	α-helix	trans	-65.8	-41.5	175.1	0	0	0	0	0	112.5	A898 G899 E900 R905 L906	A898-G902 PolarHBondContact O-N 3.31Å; G899-G902 PolarHBondContact O-N 3.02Å; E900-G902 VanDerWaalsContact C-N 3.32Å; E900-G902 PolarHBondContact O-N 3.46Å; G902-R905 PolarHBondContact O-N 2.88Å; G902-L906 WeakPolarHBondContact O-CA 3.44Å; G902-L906 VanDerWaalsContact O-CB 3.29Å; G902-L906 WeakPolarHBondContact O-CB 3.29Å; G902-L906 PolarHBondContact O-N 3.25Å
903	F	79.8	Confident	77.7	Confident	73 Å²	73	92.9 Å²	92.9	32%	0.32	47%	0.473	S	S	.	.	I	π-helix	trans	-62.8	-45.3	174.7	-177.8	-97	0	0	0	111.2	G899 E900 V907 L908	G899-F903 WeakPolarHBondContact O-CB 3.32Å; G899-F903 PolarHBondContact O-N 3.42Å; E900-F903 PolarHBondContact O-N 2.86Å; F903-V907 HydrophobicContact CD2-CB 3.69Å; F903-V907 HydrophobicContact CD2-CG1 3.67Å; F903-V907 HydrophobicContact CD2-CG2 4.06Å; F903-V907 HydrophobicContact CE2-CB 4.07Å; F903-V907 HydrophobicContact CE2-CG1 3.54Å; F903-V907 HydrophobicContact CG-CB 4.26Å; F903-V907 HydrophobicContact CZ-CG1 4.38Å; F903-V907 CarbonylContact O-C 3.58Å; F903-V907 WeakPolarHBondContact O-CA 3.42Å; F903-V907 WeakPolarHBondContact O-CB 3.43Å; F903-V907 PolarHBondContact O-N 3.17Å; F903-L908 HydrophobicContact CD1-CD1 3.86Å; F903-L908 HydrophobicContact CE1-CD1 3.54Å; F903-L908 HydrophobicContact CZ-CD1 4.36Å; F903-L908 PolarHBondContact O-N 3.45Å
904	Y	74.9	Confident	76.1	Confident	107 Å²	107	100.4 Å²	100.4	42%	0.42	49%	0.489	S	S	.	.	I	π-helix	trans	-68.8	-34.7	176.8	-87.5	-81.3	0	0	0	113.4	E900 H901 L908 A930	E900-Y904 HydrophobicContact CG-CD2 3.62Å; E900-Y904 HydrophobicContact CG-CE2 3.69Å; E900-Y904 WeakPolarHBondContact O-CB 3.34Å; E900-Y904 VanDerWaalsContact O-CD2 3.3Å; E900-Y904 WeakPolarHBondContact O-CD2 3.2Å; E900-Y904 PolarHBondContact O-N 3.14Å; E900-Y904 WeakPolarHBondContact OE1-CE2 3.48Å; H901-Y904 PolarHBondContact O-N 3.01Å; Y904-L908 HydrophobicContact CD1-CD1 4Å; Y904-L908 HydrophobicContact CD1-CD2 4.06Å; Y904-L908 HydrophobicContact CE1-CD1 4.28Å; Y904-L908 HydrophobicContact CE1-CD2 4.37Å; Y904-L908 HydrophobicContact CG-CD1 4.45Å; Y904-L908 WeakPolarHBondContact O-CB 3.46Å; Y904-A930 HydrophobicContact CE1-CB 3.95Å
905	R	74.6	Confident	74.3	Confident	175 Å²	175	103.5 Å²	103.5	66%	0.66	50%	0.501	S	S	*	.	I	π-helix	trans	-87.6	-35.4	-176.8	-74.6	-96.6	-163.1	170.4	-0.2	114.7	H901 G902 P909	H901-R905 PolarHBondContact NE2-NE 2.96Å; H901-R905 VanDerWaalsContact NE2-NE 3.16Å; H901-R905 WeakPolarHBondContact O-CB 3.42Å; H901-R905 WeakPolarHBondContact O-CG 3.33Å; H901-R905 PolarHBondContact O-N 3.44Å; G902-R905 PolarHBondContact O-N 2.88Å; R905-P909 WeakPolarHBondContact O-CG 3.46Å
906	L	72.6	Confident	72.5	Confident	119 Å²	119	104.9 Å²	104.9	62%	0.623	51%	0.508	S	S	*	.	I	π-helix	trans	-108.9	-46.8	-173.4	-63.2	171	0	0	0	112	G902 H910	G902-L906 WeakPolarHBondContact O-CA 3.44Å; G902-L906 VanDerWaalsContact O-CB 3.29Å; G902-L906 WeakPolarHBondContact O-CB 3.29Å; G902-L906 PolarHBondContact O-N 3.25Å; L906-H910 WeakPolarHBondContact O-CB 3.42Å; L906-H910 PolarHBondContact O-N 3.23Å; L906-H910 PolarHBondContact O-ND1 2.96Å
907	V	67.6	Low	70.8	Confident	58 Å²	58	105.6 Å²	105.6	35%	0.352	51%	0.508	S	S	.	.	I	π-helix	trans	-81.4	-43.8	-172.6	-178.4	0	0	0	0	111.7	F903 H910 I911	F903-V907 HydrophobicContact CD2-CB 3.69Å; F903-V907 HydrophobicContact CD2-CG1 3.67Å; F903-V907 HydrophobicContact CD2-CG2 4.06Å; F903-V907 HydrophobicContact CE2-CB 4.07Å; F903-V907 HydrophobicContact CE2-CG1 3.54Å; F903-V907 HydrophobicContact CG-CB 4.26Å; F903-V907 HydrophobicContact CZ-CG1 4.38Å; F903-V907 CarbonylContact O-C 3.58Å; F903-V907 WeakPolarHBondContact O-CA 3.42Å; F903-V907 WeakPolarHBondContact O-CB 3.43Å; F903-V907 PolarHBondContact O-N 3.17Å; V907-H910 PolarHBondContact O-N 2.86Å; V907-H910 VanDerWaalsContact O-N 3.16Å; V907-I911 HydrophobicContact CG1-CD1 3.49Å; V907-I911 VanDerWaalsContact CG1-CD1 3.49Å; V907-I911 HydrophobicContact CG1-CG1 4.02Å; V907-I911 WeakPolarHBondContact O-CB 3.44Å; V907-I911 WeakPolarHBondContact O-CG1 3.21Å; V907-I911 PolarHBondContact O-N 3.38Å
908	L	66.9	Low	69.1	Low	17 Å²	17	109.7 Å²	109.7	9%	0.089	52%	0.522	C	S	.	.	H	α-helix	trans	-57.3	-47.3	176.3	-120.6	94.6	0	0	0	113.4	F903 Y904 H910 R912 A930 L931	F903-L908 HydrophobicContact CD1-CD1 3.86Å; F903-L908 HydrophobicContact CE1-CD1 3.54Å; F903-L908 HydrophobicContact CZ-CD1 4.36Å; F903-L908 PolarHBondContact O-N 3.45Å; Y904-L908 HydrophobicContact CD1-CD1 4Å; Y904-L908 HydrophobicContact CD1-CD2 4.06Å; Y904-L908 HydrophobicContact CE1-CD1 4.28Å; Y904-L908 HydrophobicContact CE1-CD2 4.37Å; Y904-L908 HydrophobicContact CG-CD1 4.45Å; Y904-L908 WeakPolarHBondContact O-CB 3.46Å; L908-H910 VanDerWaalsContact C-N 3.34Å; L908-R912 WeakPolarHBondContact O-CB 3.48Å; L908-R912 PolarHBondContact O-N 3.43Å; L908-A930 HydrophobicContact CD2-CB 4.49Å; L908-L931 HydrophobicContact CD2-CD2 4.31Å; L908-L931 HydrophobicContact CG-CD2 4.08Å
909	P	64.2	Low	67.4	Low	45 Å²	45	117.8 Å²	117.8	29%	0.292	54%	0.541	S	S	.	.	H	α-helix	trans	-73.9	-19.1	175.6	22.2	-26.9	0	0	0	114.5	R905 R913	R905-P909 WeakPolarHBondContact O-CG 3.46Å; P909-R913 PolarHBondContact O-NE 2.94Å
910	H	65.8	Low	65.5	Low	128 Å²	128	125.7 Å²	125.7	59%	0.593	56%	0.558	S	S	*	*	H	α-helix	trans	-76.7	-43.2	170	-102.7	81.8	0	0	0	112.1	L906 V907 L908 R912 R913 R914	L906-H910 WeakPolarHBondContact O-CB 3.42Å; L906-H910 PolarHBondContact O-N 3.23Å; L906-H910 PolarHBondContact O-ND1 2.96Å; V907-H910 PolarHBondContact O-N 2.86Å; V907-H910 VanDerWaalsContact O-N 3.16Å; L908-H910 VanDerWaalsContact C-N 3.34Å; H910-R912 VanDerWaalsContact C-N 3.35Å; H910-R913 PolarHBondContact O-N 3.46Å; H910-R913 VanDerWaalsContact O-N 3.09Å; H910-R914 PolarHBondContact O-N 2.94Å
911	I	64.3	Low	63.8	Low	65 Å²	65	123 Å²	123	33%	0.333	55%	0.547	S	S	.	.	H	α-helix	trans	-67.6	-35.5	176	-67.1	176.5	0	0	0	110.7	V907 R913 R914	V907-I911 HydrophobicContact CG1-CD1 3.49Å; V907-I911 VanDerWaalsContact CG1-CD1 3.49Å; V907-I911 HydrophobicContact CG1-CG1 4.02Å; V907-I911 WeakPolarHBondContact O-CB 3.44Å; V907-I911 WeakPolarHBondContact O-CG1 3.21Å; V907-I911 PolarHBondContact O-N 3.38Å; I911-R913 PolarHBondContact O-N 3.31Å; I911-R914 PolarHBondContact O-N 2.96Å
912	R	60.4	Low	62.1	Low	143 Å²	143	126.6 Å²	126.6	54%	0.54	56%	0.563	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59	-26.4	169.9	-109.7	179.6	-165.4	168.4	4	113.5	L908 H910 L931 L933	L908-R912 WeakPolarHBondContact O-CB 3.48Å; L908-R912 PolarHBondContact O-N 3.43Å; H910-R912 VanDerWaalsContact C-N 3.35Å; R912-L931 HydrophobicContact CG-CD2 4.24Å; R912-L931 PolarHBondContact NE-O 2.88Å; R912-L931 PolarHBondContact NH2-O 3.18Å; R912-L933 PolarHBondContact NH2-O 3.28Å
913	R	61	Low	60.5	Low	193 Å²	193	131.6 Å²	131.6	73%	0.728	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	-23.6	-178	-82.9	-173.2	-96.5	-172.3	-7.8	114.5	P909 H910 I911	P909-R913 PolarHBondContact O-NE 2.94Å; H910-R913 PolarHBondContact O-N 3.46Å; H910-R913 VanDerWaalsContact O-N 3.09Å; I911-R913 PolarHBondContact O-N 3.31Å
914	R	58.1	Low	59	Low	215 Å²	215	129.9 Å²	129.9	81%	0.811	59%	0.587	S	S	*	*			trans	-109.3	106.2	175.1	-85.8	-169.4	175.4	-163.4	0.3	111	H910 I911 N916	H910-R914 PolarHBondContact O-N 2.94Å; I911-R914 PolarHBondContact O-N 2.96Å; R914-N916 VanDerWaalsContact C-N 3.26Å; R914-N916 PolarHBondContact O-N 3.44Å
915	Q	54.5	Low	58	Low	173 Å²	173	132.2 Å²	132.2	81%	0.808	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	3.7	-176.5	-69.4	-172.2	-11.4	0	0	116.1	L917	Q915-L917 PolarHBondContact O-N 3.2Å
916	N	52.4	Low	57	Low	157 Å²	157	132 Å²	132	84%	0.84	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.3	9.6	-167.6	-75.7	-2.4	0	0	0	116.5	R914	R914-N916 VanDerWaalsContact C-N 3.26Å; R914-N916 PolarHBondContact O-N 3.44Å
917	L	54.4	Low	56.1	Low	113 Å²	113	129.2 Å²	129.2	59%	0.592	59%	0.59	S	S	*	*			trans	-117.4	45.7	179.8	-71.2	168.1	0	0	0	112.9	Q915 Y919	Q915-L917 PolarHBondContact O-N 3.2Å; L917-Y919 VanDerWaalsContact C-N 3.28Å; L917-Y919 PolarHBondContact O-N 2.94Å
918	K	53.9	Low	55.4	Low	190 Å²	190	131 Å²	131	83%	0.826	59%	0.594	S	S	*	*	S	Bend	trans	-64.7	-27.8	175.4	-107.2	175.8	178.3	174.7	0	113.5
919	Y	50.9	Low	54.9	Low	228 Å²	228	137.5 Å²	137.5	89%	0.894	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-79.3	-24.9	-173.7	-146.9	-96.6	0	0	0	113.8	L917 L921	L917-Y919 VanDerWaalsContact C-N 3.28Å; L917-Y919 PolarHBondContact O-N 2.94Å; Y919-L921 VanDerWaalsContact C-N 3.34Å; Y919-L921 PolarHBondContact O-N 3.48Å
920	W	47	Very low	54.4	Low	210 Å²	210	136.3 Å²	136.3	80%	0.795	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-89.3	2.9	-176.2	-136.8	77	0	0	0	113.9
921	L	51.7	Low	53.9	Low	48 Å²	48	131.3 Å²	131.3	25%	0.251	59%	0.589	S	S	.	*	G	3₁₀ helix	trans	-93.8	-1.7	-172.7	-124	82.9	0	0	0	114.8	Y919 L931	Y919-L921 VanDerWaalsContact C-N 3.34Å; Y919-L921 PolarHBondContact O-N 3.48Å; L921-L931 HydrophobicContact CD1-CD1 4.27Å; L921-L931 HydrophobicContact CD2-CD1 3.93Å; L921-L931 HydrophobicContact CG-CD1 4.49Å
922	H	47.8	Very low	53.4	Low	180 Å²	180	133.9 Å²	133.9	83%	0.833	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	-8.9	-176.5	-99.4	-82	0	0	0	114.9
923	T	46.4	Very low	53.1	Low	127 Å²	127	130 Å²	130	78%	0.779	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	-8.4	-174.8	55	0	0	0	0	114.1
924	S	50.2	Low	53	Low	37 Å²	37	125 Å²	125	26%	0.259	58%	0.584	S	S	.	*			trans	-146.6	103	177.9	177	0	0	0	0	113.7	K926 I927 H928	S924-K926 PolarHBondContact O-N 3.38Å; S924-I927 PolarHBondContact O-N 3.45Å; S924-I927 WeakPolarHBondContact OG-CG1 3.49Å; S924-I927 PolarHBondContact OG-N 3.41Å; S924-H928 PolarHBondContact O-N 2.92Å
925	Q	53.2	Low	52.6	Low	156 Å²	156	124 Å²	124	73%	0.729	58%	0.582	S	S	*	*	H	α-helix	trans	-59.4	-23.6	172.4	-95	-179.5	-24.1	0	0	113.7	R929	Q925-R929 PolarHBondContact O-N 3.17Å
926	K	53.2	Low	52.7	Low	170 Å²	170	120.9 Å²	120.9	74%	0.739	57%	0.571	S	S	*	*	H	α-helix	trans	-72.9	-40.2	177.7	-81.2	-174.1	175.8	178.3	0	112	S924 R929 A930	S924-K926 PolarHBondContact O-N 3.38Å; K926-R929 PolarHBondContact O-N 3.02Å; K926-A930 PolarHBondContact O-N 2.83Å
927	I	54.2	Low	52.9	Low	60 Å²	60	116.7 Å²	116.7	31%	0.308	55%	0.548	S	S	.	.	H	α-helix	trans	-70.7	-39.4	179.4	-64.4	171.3	0	0	0	110.2	S924 R929 A930 L931	S924-I927 PolarHBondContact O-N 3.45Å; S924-I927 WeakPolarHBondContact OG-CG1 3.49Å; S924-I927 PolarHBondContact OG-N 3.41Å; I927-R929 PolarHBondContact O-N 3.36Å; I927-A930 PolarHBondContact O-N 3.25Å; I927-L931 HydrophobicContact CG2-CD1 3.79Å; I927-L931 HydrophobicContact CG2-CG 4.5Å; I927-L931 WeakPolarHBondContact O-CB 3.4Å; I927-L931 WeakPolarHBondContact O-CG 3.26Å; I927-L931 PolarHBondContact O-N 3.29Å
928	H	53.4	Low	53.1	Low	95 Å²	95	115.2 Å²	115.2	44%	0.44	54%	0.544	S	S	.	.	H	α-helix	trans	-61.9	-31.1	174.5	-160.5	-59	0	0	0	112.9	S924 N932	S924-H928 PolarHBondContact O-N 2.92Å; H928-N932 PolarHBondContact O-N 3.5Å
929	R	55.5	Low	53	Low	155 Å²	155	113 Å²	113	59%	0.585	53%	0.534	S	S	*	.	H	α-helix	trans	-80.7	-38	176.4	-142.9	179.4	-163.1	173.9	4.9	112.5	Q925 K926 I927 L931 N932 L933	Q925-R929 PolarHBondContact O-N 3.17Å; K926-R929 PolarHBondContact O-N 3.02Å; I927-R929 PolarHBondContact O-N 3.36Å; R929-L931 VanDerWaalsContact C-N 3.31Å; R929-L931 PolarHBondContact O-N 2.83Å; R929-N932 PolarHBondContact O-N 2.98Å; R929-L933 WeakPolarHBondContact O-CG 3.37Å; R929-L933 PolarHBondContact O-N 3.37Å; R929-L933 VanDerWaalsContact O-N 3.12Å
930	A	54.3	Low	53.4	Low	19 Å²	19	110.8 Å²	110.8	16%	0.157	52%	0.524	C	S	.	.	H	α-helix	trans	-64.3	-34.6	173.7	0	0	0	0	0	112.5	Y904 L908 K926 I927	Y904-A930 HydrophobicContact CE1-CB 3.95Å; L908-A930 HydrophobicContact CD2-CB 4.49Å; K926-A930 PolarHBondContact O-N 2.83Å; I927-A930 PolarHBondContact O-N 3.25Å
931	L	54.2	Low	53.9	Low	23 Å²	23	106.1 Å²	106.1	12%	0.12	51%	0.511	C	S	.	.	H	α-helix	trans	-72	-30.5	175.9	-78	161.2	0	0	0	113.2	L908 R912 L921 I927 R929	L908-L931 HydrophobicContact CD2-CD2 4.31Å; L908-L931 HydrophobicContact CG-CD2 4.08Å; R912-L931 HydrophobicContact CG-CD2 4.24Å; R912-L931 PolarHBondContact NE-O 2.88Å; R912-L931 PolarHBondContact NH2-O 3.18Å; L921-L931 HydrophobicContact CD1-CD1 4.27Å; L921-L931 HydrophobicContact CD2-CD1 3.93Å; L921-L931 HydrophobicContact CG-CD1 4.49Å; I927-L931 HydrophobicContact CG2-CD1 3.79Å; I927-L931 HydrophobicContact CG2-CG 4.5Å; I927-L931 WeakPolarHBondContact O-CB 3.4Å; I927-L931 WeakPolarHBondContact O-CG 3.26Å; I927-L931 PolarHBondContact O-N 3.29Å; R929-L931 VanDerWaalsContact C-N 3.31Å; R929-L931 PolarHBondContact O-N 2.83Å
932	N	53.6	Low	54.1	Low	119 Å²	119	112.7 Å²	112.7	64%	0.636	53%	0.533	S	S	*	.	H	α-helix	trans	-97.6	0.6	-178.8	-86.3	-0.1	0	0	0	115.5	H928 R929 T934	H928-N932 PolarHBondContact O-N 3.5Å; R929-N932 PolarHBondContact O-N 2.98Å; N932-T934 PolarHBondContact O-N 3.17Å
933	L	54.6	Low	54.4	Low	63 Å²	63	106.2 Å²	106.2	33%	0.33	51%	0.51	S	S	.	.			trans	-74.4	110.6	170.2	-86.2	154.3	0	0	0	109.3	R912 R929 D937	R912-L933 PolarHBondContact NH2-O 3.28Å; R929-L933 WeakPolarHBondContact O-CG 3.37Å; R929-L933 PolarHBondContact O-N 3.37Å; R929-L933 VanDerWaalsContact O-N 3.12Å; L933-D937 HydrophobicContact CD2-CB 3.71Å
934	T	58.3	Low	55.2	Low	86 Å²	86	106.7 Å²	106.7	53%	0.528	50%	0.503	S	S	.	.			trans	-74.8	151.9	170.4	33.7	0	0	0	0	110.3	N932 D936 D937	N932-T934 PolarHBondContact O-N 3.17Å; T934-D936 PolarHBondContact O-N 3.46Å; T934-D937 PolarHBondContact O-N 3.13Å
935	Y	51.2	Low	55.4	Low	196 Å²	196	114 Å²	114	77%	0.769	53%	0.525	S	S	*	.	H	α-helix	trans	-52.3	-29.6	-176	-178.2	-99.4	0	0	0	113.4	K939	Y935-K939 PolarHBondContact O-N 3.32Å
936	D	55.1	Low	55.5	Low	107 Å²	107	112.5 Å²	112.5	57%	0.572	52%	0.518	S	S	*	.	H	α-helix	trans	-69.3	-30.8	178.4	-66.4	-44.9	0	0	0	114.4	T934 K939 R940	T934-D936 PolarHBondContact O-N 3.46Å; D936-K939 PolarHBondContact O-N 3.31Å; D936-R940 PolarHBondContact O-N 3.25Å; D936-R940 VanDerWaalsContact O-N 3.08Å
937	D	57.9	Low	55.8	Low	68 Å²	68	111.8 Å²	111.8	36%	0.364	52%	0.515	S	S	.	.	H	α-helix	trans	-75	-32.5	179.5	-76.9	-25.4	0	0	0	112	L933 T934 R940 Q941	L933-D937 HydrophobicContact CD2-CB 3.71Å; T934-D937 PolarHBondContact O-N 3.13Å; D937-R940 PolarHBondContact O-N 3.45Å; D937-Q941 PolarHBondContact O-N 3.35Å; D937-Q941 VanDerWaalsContact O-N 3.09Å
938	V	57.9	Low	55.9	Low	83 Å²	83	117.8 Å²	117.8	50%	0.503	53%	0.534	S	S	.	.	H	α-helix	trans	-68.9	-37.5	174.3	-178.7	0	0	0	0	110.5	R942	V938-R942 PolarHBondContact O-N 3.04Å; V938-R942 VanDerWaalsContact O-N 3.14Å
939	K	52.7	Low	55.7	Low	144 Å²	144	122.1 Å²	122.1	63%	0.626	55%	0.546	S	S	*	.	H	α-helix	trans	-65.9	-41.1	175.1	-168.4	177	-179.8	-179.1	0	111.9	Y935 D936 R942 A943	Y935-K939 PolarHBondContact O-N 3.32Å; D936-K939 PolarHBondContact O-N 3.31Å; K939-R942 PolarHBondContact O-N 2.92Å; K939-A943 PolarHBondContact O-N 3.3Å; K939-A943 VanDerWaalsContact O-N 3.13Å
940	R	58.8	Low	55.7	Low	181 Å²	181	119.6 Å²	119.6	68%	0.683	55%	0.545	S	S	*	.	H	α-helix	trans	-63.8	-44.2	174.7	-83.3	-177	-178.2	178.3	1.6	113	D936 D937 R942 A943 E944	D936-R940 PolarHBondContact O-N 3.25Å; D936-R940 VanDerWaalsContact O-N 3.08Å; D937-R940 PolarHBondContact O-N 3.45Å; R940-R942 VanDerWaalsContact C-N 3.33Å; R940-R942 PolarHBondContact O-N 2.94Å; R940-A943 PolarHBondContact O-N 3.25Å; R940-E944 PolarHBondContact O-N 3.43Å
941	Q	57.3	Low	55.7	Low	111 Å²	111	124.2 Å²	124.2	52%	0.519	57%	0.567	S	S	.	*	H	α-helix	trans	-67.3	-32.5	179	-76.7	-171.7	-7.1	0	0	113.4	D937 R945	D937-Q941 PolarHBondContact O-N 3.35Å; D937-Q941 VanDerWaalsContact O-N 3.09Å; Q941-R945 WeakPolarHBondContact O-CG 3.05Å; Q941-R945 PolarHBondContact O-N 2.99Å
942	R	55.5	Low	55.6	Low	187 Å²	187	129.3 Å²	129.3	71%	0.706	59%	0.59	S	S	*	*	H	α-helix	trans	-68.8	-42.5	175.2	-153.4	173.7	-167.2	163	2.2	111.2	V938 K939 R940 E944 R945 E946	V938-R942 PolarHBondContact O-N 3.04Å; V938-R942 VanDerWaalsContact O-N 3.14Å; K939-R942 PolarHBondContact O-N 2.92Å; R940-R942 VanDerWaalsContact C-N 3.33Å; R940-R942 PolarHBondContact O-N 2.94Å; R942-E944 PolarHBondContact O-N 3.31Å; R942-R945 PolarHBondContact O-N 3.3Å; R942-E946 PolarHBondContact O-N 3.3Å
943	A	55.1	Low	55.4	Low	43 Å²	43	127.7 Å²	127.7	36%	0.355	59%	0.588	S	S	.	*	H	α-helix	trans	-65.4	-35	174.4	0	0	0	0	0	113.1	K939 R940 K947	K939-A943 PolarHBondContact O-N 3.3Å; K939-A943 VanDerWaalsContact O-N 3.13Å; R940-A943 PolarHBondContact O-N 3.25Å; A943-K947 WeakPolarHBondContact O-CB 3.46Å; A943-K947 VanDerWaalsContact O-CG 3.31Å; A943-K947 WeakPolarHBondContact O-CG 3.26Å; A943-K947 PolarHBondContact O-N 3.43Å; A943-K947 VanDerWaalsContact O-N 3.12Å
944	E	62	Low	55	Low	137 Å²	137	134.8 Å²	134.8	64%	0.64	61%	0.61	S	S	*	*	H	α-helix	trans	-70.7	-35.8	173.8	-78.8	-174	166.8	0	0	112.9	R940 R942 K947 R948	R940-E944 PolarHBondContact O-N 3.43Å; R942-E944 PolarHBondContact O-N 3.31Å; E944-K947 PolarHBondContact O-N 2.81Å; E944-R948 WeakPolarHBondContact O-CB 3.39Å; E944-R948 PolarHBondContact O-N 3.15Å
945	R	54.5	Low	54.5	Low	191 Å²	191	139.6 Å²	139.6	72%	0.721	62%	0.624	S	S	*	*	H	α-helix	trans	-70.3	-39.3	175.8	-77.9	-177.4	-179.4	-164.7	0.9	112.6	Q941 R942 R948 W949	Q941-R945 WeakPolarHBondContact O-CG 3.05Å; Q941-R945 PolarHBondContact O-N 2.99Å; R942-R945 PolarHBondContact O-N 3.3Å; R945-R948 PolarHBondContact O-N 3.05Å; R945-W949 WeakPolarHBondContact O-CB 3.27Å; R945-W949 PolarHBondContact O-N 3.49Å
946	E	56.7	Low	54.2	Low	125 Å²	125	138.8 Å²	138.8	58%	0.584	63%	0.627	S	S	*	*	H	α-helix	trans	-63.5	-40	172.1	-82.7	173.8	164.6	0	0	111.8	R942 R948 W949 N950	R942-E946 PolarHBondContact O-N 3.3Å; E946-R948 VanDerWaalsContact C-N 3.34Å; E946-R948 PolarHBondContact O-N 3.44Å; E946-W949 PolarHBondContact O-N 3.27Å; E946-N950 WeakPolarHBondContact O-CB 3.45Å; E946-N950 PolarHBondContact O-N 3.24Å
947	K	58.3	Low	53.1	Low	154 Å²	154	139.9 Å²	139.9	67%	0.67	64%	0.638	S	S	*	*	H	α-helix	trans	-64.3	-36.4	173.2	-76.8	177.8	-179.4	-176.6	0	112.9	A943 E944 N951	A943-K947 WeakPolarHBondContact O-CB 3.46Å; A943-K947 VanDerWaalsContact O-CG 3.31Å; A943-K947 WeakPolarHBondContact O-CG 3.26Å; A943-K947 PolarHBondContact O-N 3.43Å; A943-K947 VanDerWaalsContact O-N 3.12Å; E944-K947 PolarHBondContact O-N 2.81Å; K947-N951 WeakPolarHBondContact O-CB 3.48Å; K947-N951 PolarHBondContact O-N 2.87Å
948	R	57	Low	52.4	Low	186 Å²	186	143.1 Å²	143.1	70%	0.702	66%	0.662	S	S	*	*	H	α-helix	trans	-70.2	-43.1	178.1	-159.6	178.7	-138.4	-148.5	0.9	111.7	E944 R945 E946 N951 E952	E944-R948 WeakPolarHBondContact O-CB 3.39Å; E944-R948 PolarHBondContact O-N 3.15Å; R945-R948 PolarHBondContact O-N 3.05Å; E946-R948 VanDerWaalsContact C-N 3.34Å; E946-R948 PolarHBondContact O-N 3.44Å; R948-N951 PolarHBondContact O-N 3.47Å; R948-N951 VanDerWaalsContact O-N 3.16Å; R948-E952 PolarHBondContact O-N 3.27Å
949	W	49.9	Very low	51	Low	186 Å²	186	144.1 Å²	144.1	71%	0.705	68%	0.679	S	S	*	*	H	α-helix	trans	-61.2	-43.5	175.5	-172.4	-99.4	0	0	0	112.1	R945 E946 N951 E952 S953	R945-W949 WeakPolarHBondContact O-CB 3.27Å; R945-W949 PolarHBondContact O-N 3.49Å; E946-W949 PolarHBondContact O-N 3.27Å; W949-N951 VanDerWaalsContact C-N 3.27Å; W949-N951 PolarHBondContact O-N 2.85Å; W949-E952 PolarHBondContact O-N 3.37Å; W949-S953 PolarHBondContact O-N 2.9Å
950	N	53.8	Low	49.9	Very low	103 Å²	103	142.2 Å²	142.2	55%	0.551	69%	0.69	S	S	*	*	H	α-helix	trans	-70.7	-18.3	176.4	-72.3	-6.4	0	0	0	114	E946	E946-N950 WeakPolarHBondContact O-CB 3.45Å; E946-N950 PolarHBondContact O-N 3.24Å
951	N	54.9	Low	48.5	Very low	116 Å²	116	138.2 Å²	138.2	62%	0.62	70%	0.697	S	S	*	*	H	α-helix	trans	-87.9	-30	174.8	-121	2.4	0	0	0	112.2	K947 R948 W949	K947-N951 WeakPolarHBondContact O-CB 3.48Å; K947-N951 PolarHBondContact O-N 2.87Å; R948-N951 PolarHBondContact O-N 3.47Å; R948-N951 VanDerWaalsContact O-N 3.16Å; W949-N951 VanDerWaalsContact C-N 3.27Å; W949-N951 PolarHBondContact O-N 2.85Å
952	E	52.5	Low	47.1	Very low	130 Å²	130	140.7 Å²	140.7	61%	0.607	71%	0.713	S	S	*	*	H	α-helix	trans	-76	-37.5	175.3	-126.9	154.3	-166.5	0	0	110.7	R948 W949 R954 K955	R948-E952 PolarHBondContact O-N 3.27Å; W949-E952 PolarHBondContact O-N 3.37Å; E952-R954 PolarHBondContact O-N 3.33Å; E952-K955 PolarHBondContact O-N 3.46Å
953	S	48.6	Very low	45.8	Very low	85 Å²	85	136.3 Å²	136.3	59%	0.594	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	-7.6	175.4	93.7	0	0	0	0	114.7	W949	W949-S953 PolarHBondContact O-N 2.9Å
954	R	47.4	Very low	44.6	Very low	212 Å²	212	137.9 Å²	137.9	80%	0.8	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.6	-3	178.5	-132.6	178	-168	-167.1	2.7	113.3	E952	E952-R954 PolarHBondContact O-N 3.33Å
955	K	48.1	Very low	43	Very low	187 Å²	187	138 Å²	138	81%	0.813	74%	0.743	S	S	*	*	S	Bend	trans	-101.5	1.1	-176	-98.9	-177	175.2	-175.4	0	115.2	E952	E952-K955 PolarHBondContact O-N 3.46Å
956	E	43.4	Very low	41.7	Very low	179 Å²	179	138.8 Å²	138.8	84%	0.836	75%	0.752	S	S	*	*			trans	-123.3	82.6	178.4	-70.2	-176.4	171.6	0	0	111.7
957	T	32.6	Very low	40.7	Very low	129 Å²	129	142 Å²	142	79%	0.791	76%	0.764	S	S	*	*			trans	-141.1	124.9	154.2	41.8	0	0	0	0	107.7
958	P	42.5	Very low	39.1	Very low	136 Å²	136	146.2 Å²	146.2	88%	0.883	78%	0.775	S	S	*	*			trans	-92.7	137.6	-174.9	34.3	-29.8	0	0	0	112.1
959	A	29.1	Very low	37.7	Very low	104 Å²	104	144 Å²	144	86%	0.86	78%	0.782	S	S	*	*			trans	-128.7	138.5	159	0	0	0	0	0	108.6
960	A	29.6	Very low	36.5	Very low	104 Å²	104	143.2 Å²	143.2	86%	0.86	79%	0.786	S	S	*	*			trans	-62.6	151.6	-162.6	0	0	0	0	0	116.4
961	A	29.2	Very low	35.2	Very low	98 Å²	98	147.9 Å²	147.9	81%	0.81	80%	0.802	S	S	*	*				157.6	126.7	114.9	0	0	0	0	0	113
962	D	28.2	Very low	33.8	Very low	163 Å²	163	147.1 Å²	147.1	87%	0.872	81%	0.806	S	S	*	*			trans	77.4	132	137.2	-127.1	-3	0	0	0	124.9
963	A	27.7	Very low	32.8	Very low	94 Å²	94	149.4 Å²	149.4	78%	0.777	82%	0.821	S	S	*	*			trans	19.4	137.3	160.9	0	0	0	0	0	123.9
964	G	29.7	Very low	31.9	Very low	77 Å²	77	153.7 Å²	153.7	79%	0.794	83%	0.831	S	S	*	*			trans	145.6	77.9	143.3	0	0	0	0	0	117.8
965	D	29.7	Very low	31.1	Very low	140 Å²	140	150.2 Å²	150.2	75%	0.749	83%	0.834	S	S	*	*			trans	6.2	123	152.5	-151.4	5.8	0	0	0	120.5
966	F	27.6	Very low	30.3	Very low	207 Å²	207	148.6 Å²	148.6	91%	0.908	83%	0.833	S	S	*	*				-168.7	124.3	127.6	-116.8	-83.1	0	0	0	112
967	K	33.9	Very low	29.7	Very low	192 Å²	192	147.5 Å²	147.5	84%	0.835	83%	0.833	S	S	*	*			trans	-56.9	130.9	176.8	-74	167.8	174.7	168.7	0	114.4
968	R	25.6	Very low	29.8	Very low	243 Å²	243	146.8 Å²	146.8	92%	0.917	83%	0.829	S	S	*	*			trans	-157.8	125.7	135.5	-147	171.1	-76.4	-178.7	-3.5	111.6
969	V	28.2	Very low	29.4	Very low	139 Å²	139	150.4 Å²	150.4	84%	0.842	83%	0.825	S	S	*	*			trans	-69.3	125.4	-171.7	175.9	0	0	0	0	111.3
970	H	25	Very low	29.6	Very low	170 Å²	170	156.5 Å²	156.5	79%	0.787	83%	0.826	S	S	*	*			trans	-105.9	124.6	172	-155.7	-74.2	0	0	0	108.4	S972	H970-S972 PolarHBondContact O-N 2.86Å
971	F	24.6	Very low	29.9	Very low	201 Å²	201	158.8 Å²	158.8	88%	0.882	82%	0.823	S	S	*	*			trans	-71.4	117.6	167.3	-113.8	-98.4	0	0	0	107.8
972	S	26.8	Very low	30.2	Very low	100 Å²	100	160.6 Å²	160.6	70%	0.699	82%	0.818	S	S	*	*			trans	-109.2	118.1	171.7	69.1	0	0	0	0	110.1	H970 E974	H970-S972 PolarHBondContact O-N 2.86Å; S972-E974 PolarHBondContact O-N 2.97Å
973	L	31.1	Very low	30.4	Very low	178 Å²	178	156.3 Å²	156.3	93%	0.932	81%	0.805	S	S	*	*			trans	-83.8	88.9	170.1	-167.7	91.2	0	0	0	108.3
974	E	30.4	Very low	30.7	Very low	174 Å²	174	163.1 Å²	163.1	81%	0.813	81%	0.811	S	S	*	*			trans	-166.9	95.8	165.8	-116.9	172.7	-167.5	0	0	110.1	S972	S972-E974 PolarHBondContact O-N 2.97Å
975	T	29.4	Very low	30.9	Very low	139 Å²	139	166.9 Å²	166.9	85%	0.853	81%	0.812	S	S	*	*			trans	178.7	100.6	154.6	20.7	0	0	0	0	108.7
976	L	31.5	Very low	31	Very low	153 Å²	153	164.1 Å²	164.1	80%	0.801	81%	0.809	S	S	*	*			trans	173.1	73.5	143.7	-95.3	154.4	0	0	0	109.1	T978	L976-T978 HydrophobicContact CD2-CG2 3.85Å
977	N	30.5	Very low	31.4	Very low	157 Å²	157	160.9 Å²	160.9	84%	0.84	81%	0.805	S	S	*	*			trans	-105.3	75.8	162.5	-136.1	-5.6	0	0	0	106.8	R979	N977-R979 PolarHBondContact O-N 3.32Å
978	T	34.9	Very low	31.1	Very low	113 Å²	113	157 Å²	157	69%	0.693	80%	0.802	S	S	*	*			trans	-75.6	66.8	174.1	30	0	0	0	0	110.3	L976	L976-T978 HydrophobicContact CD2-CG2 3.85Å
979	R	33.7	Very low	31.2	Very low	213 Å²	213	154.7 Å²	154.7	80%	0.804	80%	0.802	S	S	*	*			trans	-132.2	22.5	170.9	-105.3	-174.2	-178.1	-175.6	1.2	114	N977	N977-R979 PolarHBondContact O-N 3.32Å
980	R	34.3	Very low	31.3	Very low	231 Å²	231	152.5 Å²	152.5	87%	0.872	80%	0.799	S	S	*	*	S	Bend	trans	-124.4	8.5	174.9	-86.6	-175.5	176.9	172.5	-0.8	116.3
981	L	35.3	Very low	31.5	Very low	152 Å²	152	154.7 Å²	154.7	80%	0.796	81%	0.806	S	S	*	*	S	Bend	trans	-104.8	-17.2	168.9	-117.5	145.6	0	0	0	113.4
982	L	35.7	Very low	31.7	Very low	137 Å²	137	149 Å²	149	72%	0.717	81%	0.805	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	-3.6	175.9	-71.2	170.7	0	0	0	114.2
983	A	33.4	Very low	31.7	Very low	73 Å²	73	148.5 Å²	148.5	60%	0.603	81%	0.806	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	8.2	178.5	0	0	0	0	0	113.9
984	R	33.1	Very low	31.5	Very low	237 Å²	237	146.3 Å²	146.3	89%	0.894	80%	0.801	S	S	*	*	S	Bend	trans	-115.3	5.9	170.7	-88.2	-173	176.7	171.9	-1.1	114.3
985	L	34.9	Very low	32.3	Very low	155 Å²	155	143.5 Å²	143.5	81%	0.812	80%	0.797	S	S	*	*	S	Bend	trans	-119.9	-1.2	175	-75.8	167.8	0	0	0	114
986	A	31	Very low	33.2	Very low	83 Å²	83	142.1 Å²	142.1	69%	0.686	79%	0.79	S	S	*	*	S	Bend	trans	-120.1	32.4	-178.2	0	0	0	0	0	113.2
987	V	35.7	Very low	33.1	Very low	138 Å²	138	142.1 Å²	142.1	84%	0.836	79%	0.791	S	S	*	*	S	Bend	trans	-137.2	77.6	164.6	-177.1	0	0	0	0	107.7
988	S	28.5	Very low	33.9	Very low	110 Å²	110	140.3 Å²	140.3	77%	0.769	79%	0.788	S	S	*	*	S	Bend	trans	172.2	84.4	148.4	177.6	0	0	0	0	107.7
989	E	27.9	Very low	34	Very low	195 Å²	195	138.2 Å²	138.2	91%	0.911	79%	0.789	S	S	*	*			trans	175.8	89.5	138.3	-99.6	173.2	177.8	0	0	109.9
990	A	29	Very low	33.9	Very low	94 Å²	94	135.1 Å²	135.1	78%	0.777	79%	0.794	S	S	*	*			trans	-135.9	94.4	148.9	0	0	0	0	0	105.9
991	K	29	Very low	34.2	Very low	215 Å²	215	128.6 Å²	128.6	94%	0.935	79%	0.79	S	S	*	*			trans	172.3	127.1	146.8	-98.9	166.9	-177.4	-175.3	0	111.9
992	G	28.8	Very low	34.8	Very low	83 Å²	83	127.1 Å²	127.1	86%	0.856	79%	0.789	S	S	*	*			trans	111.9	105.7	140.4	0	0	0	0	0	116.2
993	A	27.4	Very low	35.2	Very low	88 Å²	88	126 Å²	126	73%	0.727	79%	0.79	S	S	*	*			trans	-86.5	138.5	172.5	0	0	0	0	0	112.8
994	T	26.8	Very low	36.6	Very low	133 Å²	133	129 Å²	129	82%	0.816	80%	0.795	S	S	*	*			trans	61.2	160.6	144.1	55.7	0	0	0	0	122
995	P	47	Very low	37.8	Very low	115 Å²	115	122.8 Å²	122.8	75%	0.747	79%	0.786	S	S	*	*			cis	-135.6	-154.1	-38.8	37	-16.2	0	0	0	111.5
996	P	48.3	Very low	38.7	Very low	109 Å²	109	119 Å²	119	71%	0.708	78%	0.777	S	S	*	*				-123	169	-58.2	34	-15.9	0	0	0	116.5
997	N	30.2	Very low	39.7	Very low	153 Å²	153	120.2 Å²	120.2	82%	0.818	77%	0.772	S	S	*	*			trans	66.6	164.2	152.2	-83.1	2.6	0	0	0	122.2
998	P	46.3	Very low	40.8	Very low	119 Å²	119	119.3 Å²	119.3	77%	0.773	76%	0.762	S	S	*	*				-135.6	158.5	-53.2	37.1	-19.2	0	0	0	114.1
999	G	36.7	Very low	42.5	Very low	70 Å²	70	117 Å²	117	72%	0.722	75%	0.75	S	S	*	*			trans	107.6	117.3	150	0	0	0	0	0	119
1000	T	31.7	Very low	44.4	Very low	147 Å²	147	110.3 Å²	110.3	90%	0.902	73%	0.728	S	S	*	*			trans	-174.2	125.5	131.1	8.9	0	0	0	0	113.6
1001	A	41	Very low	45.9	Very low	95 Å²	95	110.5 Å²	110.5	79%	0.785	72%	0.715	S	S	*	*			trans	35.6	145	151.7	0	0	0	0	0	124.9
1002	P	49.3	Very low	48.1	Very low	120 Å²	120	104.8 Å²	104.8	78%	0.779	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-85.5	160.1	179	36.2	-33.9	0	0	0	114
1003	P	44.1	Very low	50.5	Low	113 Å²	113	107.1 Å²	107.1	73%	0.734	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-83.8	158.5	-177.5	34.1	-33	0	0	0	113.3
1004	L	62.8	Low	52.5	Low	136 Å²	136	108.7 Å²	108.7	71%	0.712	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-68.2	150.5	-172	-82	105.6	0	0	0	114.5	A1006	L1004-A1006 PolarHBondContact O-N 2.98Å; L1004-A1006 VanDerWaalsContact O-N 3.07Å
1005	P	56.5	Low	54.9	Low	108 Å²	108	105.8 Å²	105.8	70%	0.701	65%	0.651	S	S	*	*	H	α-helix	trans	-67	-8.3	-172.2	23.7	-33.4	0	0	0	116.5
1006	A	55.3	Low	56.5	Low	75 Å²	75	104 Å²	104	62%	0.62	64%	0.635	S	S	*	*	H	α-helix	trans	-75	-34.7	-178.9	0	0	0	0	0	113.2	L1004 L1008 A1010	L1004-A1006 PolarHBondContact O-N 2.98Å; L1004-A1006 VanDerWaalsContact O-N 3.07Å; A1006-L1008 VanDerWaalsContact C-N 3.34Å; A1006-A1010 PolarHBondContact O-N 3.19Å
1007	D	52.2	Low	58.1	Low	109 Å²	109	104.4 Å²	104.4	58%	0.583	63%	0.628	S	S	*	*	H	α-helix	trans	-74.7	-28.5	-179.3	-66.8	-27.4	0	0	0	112	A1010 L1011	D1007-A1010 PolarHBondContact O-N 3.47Å; D1007-L1011 PolarHBondContact O-N 3.03Å; D1007-L1011 VanDerWaalsContact O-N 3.08Å
1008	L	58	Low	59.9	Low	118 Å²	118	103.5 Å²	103.5	62%	0.618	62%	0.62	S	S	*	*	H	α-helix	trans	-69.9	-35.4	178.8	-134.6	136	0	0	0	111.5	A1006 Q1012	A1006-L1008 VanDerWaalsContact C-N 3.34Å; L1008-Q1012 WeakPolarHBondContact O-CB 3.42Å; L1008-Q1012 PolarHBondContact O-N 3.5Å
1009	A	64.5	Low	61.3	Low	63 Å²	63	104.6 Å²	104.6	52%	0.521	61%	0.609	S	S	.	*	H	α-helix	trans	-69.4	-39.3	175.9	0	0	0	0	0	112.3	Q1012 Q1013	A1009-Q1012 PolarHBondContact O-N 3.33Å; A1009-Q1013 WeakPolarHBondContact O-CB 3.49Å; A1009-Q1013 PolarHBondContact O-N 3.46Å
1010	A	67.2	Low	63.6	Low	54 Å²	54	106.3 Å²	106.3	45%	0.446	60%	0.598	S	S	.	*	H	α-helix	trans	-67	-39.4	176.6	0	0	0	0	0	112.1	A1006 D1007 Q1013 Q1014	A1006-A1010 PolarHBondContact O-N 3.19Å; D1007-A1010 PolarHBondContact O-N 3.47Å; A1010-Q1013 PolarHBondContact O-N 3.14Å; A1010-Q1014 PolarHBondContact O-N 3.03Å; A1010-Q1014 VanDerWaalsContact O-N 3.11Å
1011	L	61.8	Low	65.7	Low	98 Å²	98	106.4 Å²	106.4	51%	0.513	59%	0.586	S	S	.	*	H	α-helix	trans	-66.2	-41.6	173.8	-86	159.2	0	0	0	112.1	D1007 Q1013 Q1014 I1015	D1007-L1011 PolarHBondContact O-N 3.03Å; D1007-L1011 VanDerWaalsContact O-N 3.08Å; L1011-Q1013 VanDerWaalsContact C-N 3.31Å; L1011-Q1013 PolarHBondContact O-N 2.88Å; L1011-Q1014 PolarHBondContact O-N 3.39Å; L1011-I1015 VanDerWaalsContact O-CG1 3.32Å; L1011-I1015 WeakPolarHBondContact O-CG1 3.34Å; L1011-I1015 PolarHBondContact O-N 3.49Å
1012	Q	74.4	Confident	67	Low	95 Å²	95	107.1 Å²	107.1	44%	0.444	58%	0.576	S	S	.	*	H	α-helix	trans	-62.1	-41.3	176.8	-158.2	70.3	6	0	0	111.3	L1008 A1009 Q1014 I1015 D1016	L1008-Q1012 WeakPolarHBondContact O-CB 3.42Å; L1008-Q1012 PolarHBondContact O-N 3.5Å; A1009-Q1012 PolarHBondContact O-N 3.33Å; Q1012-Q1014 VanDerWaalsContact C-N 3.34Å; Q1012-Q1014 PolarHBondContact O-N 2.89Å; Q1012-I1015 PolarHBondContact O-N 3.43Å; Q1012-D1016 PolarHBondContact O-N 3.33Å
1013	Q	78.8	Confident	68.4	Low	131 Å²	131	108.7 Å²	108.7	61%	0.612	57%	0.566	S	S	*	*	H	α-helix	trans	-65.8	-34.9	177.3	-159.8	177.1	10.7	0	0	112.7	A1009 A1010 L1011 Q1017	A1009-Q1013 WeakPolarHBondContact O-CB 3.49Å; A1009-Q1013 PolarHBondContact O-N 3.46Å; A1010-Q1013 PolarHBondContact O-N 3.14Å; L1011-Q1013 VanDerWaalsContact C-N 3.31Å; L1011-Q1013 PolarHBondContact O-N 2.88Å; Q1013-Q1017 PolarHBondContact O-N 3.5Å; Q1013-Q1017 VanDerWaalsContact O-N 3.12Å
1014	Q	69.3	Low	70.2	Confident	122 Å²	122	107.5 Å²	107.5	57%	0.57	56%	0.557	S	S	*	*	H	α-helix	trans	-69.4	-38.2	172.7	-79.9	-168.8	-28.2	0	0	112.7	A1010 L1011 Q1012 Q1017 M1018	A1010-Q1014 PolarHBondContact O-N 3.03Å; A1010-Q1014 VanDerWaalsContact O-N 3.11Å; L1011-Q1014 PolarHBondContact O-N 3.39Å; Q1012-Q1014 VanDerWaalsContact C-N 3.34Å; Q1012-Q1014 PolarHBondContact O-N 2.89Å; Q1014-Q1017 PolarHBondContact O-N 3.01Å; Q1014-M1018 WeakPolarHBondContact O-CG 3.39Å; Q1014-M1018 PolarHBondContact O-N 2.77Å
1015	I	77.1	Confident	70.5	Confident	71 Å²	71	103.7 Å²	103.7	36%	0.364	55%	0.546	S	S	.	.	H	α-helix	trans	-64.9	-42.1	177	-70.5	167	0	0	0	110.4	L1011 Q1012 M1018 R1019	L1011-I1015 VanDerWaalsContact O-CG1 3.32Å; L1011-I1015 WeakPolarHBondContact O-CG1 3.34Å; L1011-I1015 PolarHBondContact O-N 3.49Å; Q1012-I1015 PolarHBondContact O-N 3.43Å; I1015-M1018 PolarHBondContact O-N 3.27Å; I1015-R1019 PolarHBondContact O-N 3.12Å
1016	D	80	Confident	71.3	Confident	78 Å²	78	103.2 Å²	103.2	42%	0.417	54%	0.536	S	S	.	.	H	α-helix	trans	-68.2	-38.8	178.8	-70.7	-28.7	0	0	0	111.9	Q1012 M1018 R1019 E1020	Q1012-D1016 PolarHBondContact O-N 3.33Å; D1016-M1018 VanDerWaalsContact C-N 3.32Å; D1016-M1018 PolarHBondContact O-N 3.34Å; D1016-R1019 PolarHBondContact O-N 3.5Å; D1016-E1020 PolarHBondContact O-N 3.43Å
1017	Q	83.4	Confident	72.2	Confident	117 Å²	117	102.4 Å²	102.4	55%	0.547	53%	0.53	S	S	.	.	H	α-helix	trans	-62.1	-37	171.6	-81.5	-173.5	-2.3	0	0	113	Q1013 Q1014 K1021	Q1013-Q1017 PolarHBondContact O-N 3.5Å; Q1013-Q1017 VanDerWaalsContact O-N 3.12Å; Q1014-Q1017 PolarHBondContact O-N 3.01Å; Q1017-K1021 WeakPolarHBondContact O-CG 3.32Å; Q1017-K1021 PolarHBondContact O-N 3.45Å
1018	M	67.5	Low	73.2	Confident	135 Å²	135	106 Å²	106	67%	0.665	54%	0.535	S	S	*	.	H	α-helix	trans	-72	-37.5	176.1	-73.9	-148.2	-71.1	0	0	112.4	Q1014 I1015 D1016 E1020 K1021 L1022	Q1014-M1018 WeakPolarHBondContact O-CG 3.39Å; Q1014-M1018 PolarHBondContact O-N 2.77Å; I1015-M1018 PolarHBondContact O-N 3.27Å; D1016-M1018 VanDerWaalsContact C-N 3.32Å; D1016-M1018 PolarHBondContact O-N 3.34Å; M1018-E1020 VanDerWaalsContact C-N 3.31Å; M1018-E1020 PolarHBondContact O-N 3.29Å; M1018-K1021 PolarHBondContact O-N 3.19Å; M1018-L1022 WeakPolarHBondContact O-CB 3.36Å; M1018-L1022 PolarHBondContact O-N 3.01Å
1019	R	75	Confident	74	Confident	142 Å²	142	107.6 Å²	107.6	54%	0.536	53%	0.533	S	S	.	.	H	α-helix	trans	-61.6	-39.6	173.2	-85.7	179.4	168.4	170.2	-3.2	112.1	I1015 D1016 L1022 R1023	I1015-R1019 PolarHBondContact O-N 3.12Å; D1016-R1019 PolarHBondContact O-N 3.5Å; R1019-L1022 PolarHBondContact O-N 3.05Å; R1019-R1023 WeakPolarHBondContact O-CG 3.47Å; R1019-R1023 PolarHBondContact O-N 3.4Å
1020	E	85.3	Confident	74.3	Confident	106 Å²	106	107 Å²	107	50%	0.495	53%	0.528	S	S	.	.	H	α-helix	trans	-69	-39.5	178.9	-150.2	65.8	-169.6	0	0	112.1	D1016 M1018 L1022 R1023 T1024	D1016-E1020 PolarHBondContact O-N 3.43Å; M1018-E1020 VanDerWaalsContact C-N 3.31Å; M1018-E1020 PolarHBondContact O-N 3.29Å; E1020-L1022 VanDerWaalsContact C-N 3.29Å; E1020-L1022 PolarHBondContact O-N 2.93Å; E1020-R1023 PolarHBondContact O-N 2.97Å; E1020-R1023 IonicContact OE2-NH1 3.93Å; E1020-R1023 PolarHBondContact OE2-NH1 2.89Å; E1020-T1024 WeakPolarHBondContact O-CG2 3.46Å; E1020-T1024 PolarHBondContact O-N 3.18Å; E1020-T1024 PolarHBondContact O-OG1 3.37Å
1021	K	76.4	Confident	74.6	Confident	149 Å²	149	111 Å²	111	65%	0.648	54%	0.537	S	S	*	.	H	α-helix	trans	-62.5	-35.9	171.2	-75.2	178.5	179.7	174.4	0	112.4	Q1017 M1018 T1024 A1025	Q1017-K1021 WeakPolarHBondContact O-CG 3.32Å; Q1017-K1021 PolarHBondContact O-N 3.45Å; M1018-K1021 PolarHBondContact O-N 3.19Å; K1021-T1024 WeakPolarHBondContact CA-OG1 3.42Å; K1021-T1024 PolarHBondContact O-OG1 3.36Å; K1021-A1025 WeakPolarHBondContact O-CB 2.83Å; K1021-A1025 PolarHBondContact O-N 3.42Å; K1021-A1025 VanDerWaalsContact O-N 3.12Å
1022	L	69.2	Low	75.1	Confident	109 Å²	109	110.9 Å²	110.9	57%	0.571	54%	0.536	S	S	*	.	H	α-helix	trans	-70.5	-42.2	177.1	-169.3	69.7	0	0	0	111.8	M1018 R1019 E1020 A1025 L1026	M1018-L1022 WeakPolarHBondContact O-CB 3.36Å; M1018-L1022 PolarHBondContact O-N 3.01Å; R1019-L1022 PolarHBondContact O-N 3.05Å; E1020-L1022 VanDerWaalsContact C-N 3.29Å; E1020-L1022 PolarHBondContact O-N 2.93Å; L1022-A1025 PolarHBondContact O-N 3.13Å; L1022-L1026 HydrophobicContact CG-CD1 4.29Å; L1022-L1026 WeakPolarHBondContact O-CG 3.2Å; L1022-L1026 PolarHBondContact O-N 2.66Å
1023	R	77	Confident	74.7	Confident	153 Å²	153	111.5 Å²	111.5	58%	0.577	54%	0.539	S	S	*	.	H	α-helix	trans	-61.5	-44.5	176.4	-75.3	179.8	-177.1	138.2	-3.8	112.1	R1019 E1020 A1025 L1026 A1027	R1019-R1023 WeakPolarHBondContact O-CG 3.47Å; R1019-R1023 PolarHBondContact O-N 3.4Å; E1020-R1023 PolarHBondContact O-N 2.97Å; E1020-R1023 IonicContact OE2-NH1 3.93Å; E1020-R1023 PolarHBondContact OE2-NH1 2.89Å; R1023-A1025 VanDerWaalsContact C-N 3.35Å; R1023-A1025 PolarHBondContact O-N 3.03Å; R1023-L1026 PolarHBondContact O-N 2.88Å; R1023-A1027 WeakPolarHBondContact O-CB 3.14Å; R1023-A1027 PolarHBondContact O-N 3.37Å
1024	T	81.9	Confident	74.2	Confident	89 Å²	89	109.7 Å²	109.7	55%	0.546	54%	0.537	S	S	.	.	H	α-helix	trans	-65.1	-37.2	177.5	50.5	0	0	0	0	112.3	E1020 K1021 R1028	E1020-T1024 WeakPolarHBondContact O-CG2 3.46Å; E1020-T1024 PolarHBondContact O-N 3.18Å; E1020-T1024 PolarHBondContact O-OG1 3.37Å; K1021-T1024 WeakPolarHBondContact CA-OG1 3.42Å; K1021-T1024 PolarHBondContact O-OG1 3.36Å; T1024-R1028 PolarHBondContact O-N 3.2Å; T1024-R1028 VanDerWaalsContact O-N 3.1Å
1025	A	70.5	Confident	74	Confident	56 Å²	56	107.1 Å²	107.1	46%	0.463	53%	0.533	S	S	.	.	H	α-helix	trans	-66.9	-40.8	174.3	0	0	0	0	0	112.8	K1021 L1022 R1023 R1028 R1029	K1021-A1025 WeakPolarHBondContact O-CB 2.83Å; K1021-A1025 PolarHBondContact O-N 3.42Å; K1021-A1025 VanDerWaalsContact O-N 3.12Å; L1022-A1025 PolarHBondContact O-N 3.13Å; R1023-A1025 VanDerWaalsContact C-N 3.35Å; R1023-A1025 PolarHBondContact O-N 3.03Å; A1025-R1028 PolarHBondContact O-N 3.46Å; A1025-R1029 PolarHBondContact O-N 2.93Å
1026	L	71.8	Confident	73	Confident	97 Å²	97	108.7 Å²	108.7	51%	0.508	54%	0.541	S	S	.	.	H	α-helix	trans	-67.9	-38.9	176.8	-72.2	172.7	0	0	0	112.2	L1022 R1023 R1028 R1029 A1030	L1022-L1026 HydrophobicContact CG-CD1 4.29Å; L1022-L1026 WeakPolarHBondContact O-CG 3.2Å; L1022-L1026 PolarHBondContact O-N 2.66Å; R1023-L1026 PolarHBondContact O-N 2.88Å; L1026-R1028 PolarHBondContact O-N 3.28Å; L1026-R1029 PolarHBondContact O-N 3.4Å; L1026-A1030 PolarHBondContact O-N 3.35Å
1027	A	75.6	Confident	71.9	Confident	59 Å²	59	107.3 Å²	107.3	49%	0.488	54%	0.541	S	S	.	.	H	α-helix	trans	-61	-43.6	173.5	0	0	0	0	0	111.6	R1023 R1029 A1030 E1031	R1023-A1027 WeakPolarHBondContact O-CB 3.14Å; R1023-A1027 PolarHBondContact O-N 3.37Å; A1027-R1029 VanDerWaalsContact C-N 3.31Å; A1027-R1029 PolarHBondContact O-N 3.03Å; A1027-A1030 PolarHBondContact O-N 3.48Å; A1027-E1031 PolarHBondContact O-N 2.82Å
1028	R	73.4	Confident	70.6	Confident	184 Å²	184	109.4 Å²	109.4	69%	0.694	55%	0.548	S	S	*	.	H	α-helix	trans	-62.2	-36.9	175.4	-123.3	176.4	-177.8	171.2	0.6	112.8	T1024 A1025 L1026 E1031 I1032	T1024-R1028 PolarHBondContact O-N 3.2Å; T1024-R1028 VanDerWaalsContact O-N 3.1Å; A1025-R1028 PolarHBondContact O-N 3.46Å; L1026-R1028 PolarHBondContact O-N 3.28Å; R1028-E1031 PolarHBondContact O-N 3.47Å; R1028-I1032 WeakPolarHBondContact O-CD1 3.42Å; R1028-I1032 VanDerWaalsContact O-CG1 3.24Å; R1028-I1032 WeakPolarHBondContact O-CG1 3.41Å; R1028-I1032 PolarHBondContact O-N 2.86Å
1029	R	73.3	Confident	69.8	Low	152 Å²	152	106 Å²	106	57%	0.574	54%	0.537	S	S	*	.	H	α-helix	trans	-65.7	-40.7	175.5	-177.7	179.5	171.2	-177.8	-0.9	111.7	A1025 L1026 A1027 I1032 Q1033	A1025-R1029 PolarHBondContact O-N 2.93Å; L1026-R1029 PolarHBondContact O-N 3.4Å; A1027-R1029 VanDerWaalsContact C-N 3.31Å; A1027-R1029 PolarHBondContact O-N 3.03Å; R1029-I1032 PolarHBondContact O-N 3.34Å; R1029-Q1033 WeakPolarHBondContact O-CG 3.45Å; R1029-Q1033 PolarHBondContact O-N 3.34Å
1030	A	71.3	Confident	68.5	Low	49 Å²	49	102 Å²	102	41%	0.405	53%	0.531	S	S	.	.	H	α-helix	trans	-66	-40.3	176.6	0	0	0	0	0	112.2	L1026 A1027 I1032 Q1033 T1034	L1026-A1030 PolarHBondContact O-N 3.35Å; A1027-A1030 PolarHBondContact O-N 3.48Å; A1030-I1032 PolarHBondContact O-N 2.95Å; A1030-Q1033 PolarHBondContact O-N 3.13Å; A1030-T1034 WeakPolarHBondContact O-CG2 3.47Å; A1030-T1034 PolarHBondContact O-N 3.3Å; A1030-T1034 PolarHBondContact O-OG1 3.26Å
1031	E	74.5	Confident	66.7	Low	138 Å²	138	102.2 Å²	102.2	65%	0.645	54%	0.536	S	S	*	.	H	α-helix	trans	-60.3	-42.6	171.6	-104.5	179.8	165.7	0	0	112.2	A1027 R1028 T1034 S1035	A1027-E1031 PolarHBondContact O-N 2.82Å; R1028-E1031 PolarHBondContact O-N 3.47Å; E1031-T1034 WeakPolarHBondContact CA-OG1 3.33Å; E1031-T1034 PolarHBondContact O-OG1 3.05Å; E1031-S1035 WeakPolarHBondContact O-CB 3.08Å; E1031-S1035 PolarHBondContact O-N 3.08Å
1032	I	71.8	Confident	65.3	Low	96 Å²	96	101.1 Å²	101.1	49%	0.492	54%	0.536	S	S	.	.	H	α-helix	trans	-67.3	-41.5	178	-67.8	165.8	0	0	0	110.8	R1028 R1029 A1030 S1035 L1036	R1028-I1032 WeakPolarHBondContact O-CD1 3.42Å; R1028-I1032 VanDerWaalsContact O-CG1 3.24Å; R1028-I1032 WeakPolarHBondContact O-CG1 3.41Å; R1028-I1032 PolarHBondContact O-N 2.86Å; R1029-I1032 PolarHBondContact O-N 3.34Å; A1030-I1032 PolarHBondContact O-N 2.95Å; I1032-S1035 PolarHBondContact O-N 3.47Å; I1032-S1035 PolarHBondContact O-OG 3.5Å; I1032-L1036 HydrophobicContact CG2-CD1 3.87Å; I1032-L1036 WeakPolarHBondContact O-CG 3.36Å; I1032-L1036 PolarHBondContact O-N 2.94Å
1033	Q	65.1	Low	64.1	Low	109 Å²	109	105.1 Å²	105.1	51%	0.509	54%	0.544	S	S	.	.	H	α-helix	trans	-65.5	-40.3	178.6	-77.7	-179.5	-44.2	0	0	112.6	R1029 A1030 S1035 L1036 A1037	R1029-Q1033 WeakPolarHBondContact O-CG 3.45Å; R1029-Q1033 PolarHBondContact O-N 3.34Å; A1030-Q1033 PolarHBondContact O-N 3.13Å; Q1033-S1035 VanDerWaalsContact C-N 3.35Å; Q1033-L1036 PolarHBondContact O-N 3.01Å; Q1033-A1037 WeakPolarHBondContact O-CB 3.29Å; Q1033-A1037 PolarHBondContact O-N 3.3Å
1034	T	69.9	Low	62.4	Low	92 Å²	92	101 Å²	101	56%	0.564	54%	0.539	S	S	*	.	H	α-helix	trans	-67.4	-35.8	174.7	52.4	0	0	0	0	112	A1030 E1031 K1038	A1030-T1034 WeakPolarHBondContact O-CG2 3.47Å; A1030-T1034 PolarHBondContact O-N 3.3Å; A1030-T1034 PolarHBondContact O-OG1 3.26Å; E1031-T1034 WeakPolarHBondContact CA-OG1 3.33Å; E1031-T1034 PolarHBondContact O-OG1 3.05Å; T1034-K1038 PolarHBondContact O-N 3.29Å; T1034-K1038 VanDerWaalsContact O-N 3.11Å
1035	S	63.2	Low	60.7	Low	68 Å²	68	101 Å²	101	48%	0.476	54%	0.538	S	S	.	.	H	α-helix	trans	-67.7	-36.4	174.9	78.4	0	0	0	0	113.1	E1031 I1032 Q1033 S1039	E1031-S1035 WeakPolarHBondContact O-CB 3.08Å; E1031-S1035 PolarHBondContact O-N 3.08Å; I1032-S1035 PolarHBondContact O-N 3.47Å; I1032-S1035 PolarHBondContact O-OG 3.5Å; Q1033-S1035 VanDerWaalsContact C-N 3.35Å; S1035-S1039 PolarHBondContact O-N 3.47Å
1036	L	57.5	Low	59.3	Low	105 Å²	105	108.1 Å²	108.1	55%	0.55	55%	0.553	S	S	.	*	H	α-helix	trans	-70	-41.4	175.6	-77.1	163.7	0	0	0	111.8	I1032 Q1033 K1038 S1039 S1040	I1032-L1036 HydrophobicContact CG2-CD1 3.87Å; I1032-L1036 WeakPolarHBondContact O-CG 3.36Å; I1032-L1036 PolarHBondContact O-N 2.94Å; Q1033-L1036 PolarHBondContact O-N 3.01Å; L1036-K1038 PolarHBondContact O-N 3.27Å; L1036-S1039 WeakPolarHBondContact O-CB 3.31Å; L1036-S1039 PolarHBondContact O-N 3.44Å; L1036-S1039 VanDerWaalsContact O-N 3.09Å; L1036-S1039 PolarHBondContact O-OG 3.09Å; L1036-S1040 PolarHBondContact O-N 3.46Å; L1036-S1040 VanDerWaalsContact O-N 3.09Å
1037	A	56.4	Low	58	Low	49 Å²	49	108.9 Å²	108.9	41%	0.405	56%	0.556	S	S	.	*	H	α-helix	trans	-62.4	-39.9	175.6	0	0	0	0	0	112.4	Q1033 S1039 S1040 D1041	Q1033-A1037 WeakPolarHBondContact O-CB 3.29Å; Q1033-A1037 PolarHBondContact O-N 3.3Å; A1037-S1039 PolarHBondContact O-N 3.05Å; A1037-S1040 WeakPolarHBondContact CA-OG 3.5Å; A1037-S1040 PolarHBondContact O-N 3.46Å; A1037-S1040 PolarHBondContact O-OG 2.85Å; A1037-D1041 PolarHBondContact O-N 3.26Å
1038	K	56.6	Low	56.4	Low	161 Å²	161	112.4 Å²	112.4	70%	0.7	57%	0.566	S	S	*	*	H	α-helix	trans	-62.9	-31.9	173.2	-118.3	174.8	-179.4	174.5	0	112.6	T1034 L1036	T1034-K1038 PolarHBondContact O-N 3.29Å; T1034-K1038 VanDerWaalsContact O-N 3.11Å; L1036-K1038 PolarHBondContact O-N 3.27Å
1039	S	50.7	Low	54.9	Low	62 Å²	62	109.2 Å²	109.2	43%	0.434	56%	0.563	S	S	.	*	H	α-helix	trans	-77.5	-28.7	179	81.5	0	0	0	0	113.6	S1035 L1036 A1037 R1043	S1035-S1039 PolarHBondContact O-N 3.47Å; L1036-S1039 WeakPolarHBondContact O-CB 3.31Å; L1036-S1039 PolarHBondContact O-N 3.44Å; L1036-S1039 VanDerWaalsContact O-N 3.09Å; L1036-S1039 PolarHBondContact O-OG 3.09Å; A1037-S1039 PolarHBondContact O-N 3.05Å; S1039-R1043 PolarHBondContact O-N 3.49Å
1040	S	46.9	Very low	53.3	Low	58 Å²	58	106.3 Å²	106.3	41%	0.406	57%	0.566	S	S	.	*	H	α-helix	trans	-74.1	-38.6	176.9	51.3	0	0	0	0	112.4	L1036 A1037 L1042 R1043 S1044	L1036-S1040 PolarHBondContact O-N 3.46Å; L1036-S1040 VanDerWaalsContact O-N 3.09Å; A1037-S1040 WeakPolarHBondContact CA-OG 3.5Å; A1037-S1040 PolarHBondContact O-N 3.46Å; A1037-S1040 PolarHBondContact O-OG 2.85Å; S1040-L1042 VanDerWaalsContact C-N 3.34Å; S1040-L1042 PolarHBondContact O-N 3.4Å; S1040-R1043 PolarHBondContact O-N 2.95Å; S1040-R1043 VanDerWaalsContact O-N 3.15Å; S1040-S1044 PolarHBondContact O-N 3.47Å; S1040-S1044 PolarHBondContact O-OG 2.98Å
1041	D	47.4	Very low	51.8	Low	112 Å²	112	108.7 Å²	108.7	60%	0.599	58%	0.579	S	S	*	*	H	α-helix	trans	-65.8	-37.5	177.9	-73.7	-17.4	0	0	0	112.1	A1037 R1043 S1044 V1045	A1037-D1041 PolarHBondContact O-N 3.26Å; D1041-R1043 VanDerWaalsContact C-N 3.29Å; D1041-R1043 PolarHBondContact O-N 3.06Å; D1041-S1044 PolarHBondContact O-N 3.18Å; D1041-V1045 WeakPolarHBondContact O-CG2 3.47Å; D1041-V1045 PolarHBondContact O-N 2.95Å; D1041-V1045 VanDerWaalsContact O-N 3.12Å
1042	L	48.4	Very low	50	Low	126 Å²	126	110.7 Å²	110.7	66%	0.66	59%	0.585	S	S	*	*	H	α-helix	trans	-67.7	-24.5	174.7	-91.1	151.1	0	0	0	113.5	S1040	S1040-L1042 VanDerWaalsContact C-N 3.34Å; S1040-L1042 PolarHBondContact O-N 3.4Å
1043	R	42.9	Very low	48.6	Very low	193 Å²	193	112 Å²	112	73%	0.728	60%	0.598	S	S	*	*	H	α-helix	trans	-81	-40.8	173	-101.5	-176.7	-167.7	-168.9	4.3	112.2	S1039 S1040 D1041 V1045 R1046 I1047	S1039-R1043 PolarHBondContact O-N 3.49Å; S1040-R1043 PolarHBondContact O-N 2.95Å; S1040-R1043 VanDerWaalsContact O-N 3.15Å; D1041-R1043 VanDerWaalsContact C-N 3.29Å; D1041-R1043 PolarHBondContact O-N 3.06Å; R1043-V1045 VanDerWaalsContact C-N 3.35Å; R1043-V1045 PolarHBondContact O-N 3.25Å; R1043-R1046 PolarHBondContact O-N 3.01Å; R1043-I1047 WeakPolarHBondContact O-CG1 3.47Å; R1043-I1047 PolarHBondContact O-N 3.12Å; R1043-I1047 VanDerWaalsContact O-N 3.15Å
1044	S	41	Very low	47.5	Very low	67 Å²	67	112.9 Å²	112.9	47%	0.469	61%	0.61	S	S	.	*	H	α-helix	trans	-64.9	-36.9	178	-68.7	0	0	0	0	112.4	S1040 D1041 R1046 I1047 L1048	S1040-S1044 PolarHBondContact O-N 3.47Å; S1040-S1044 PolarHBondContact O-OG 2.98Å; D1041-S1044 PolarHBondContact O-N 3.18Å; S1044-R1046 PolarHBondContact O-N 3.16Å; S1044-I1047 PolarHBondContact O-N 3.01Å; S1044-L1048 PolarHBondContact O-N 3.46Å; S1044-L1048 VanDerWaalsContact O-N 3.12Å
1045	V	46.5	Very low	46	Very low	89 Å²	89	117.3 Å²	117.3	54%	0.539	65%	0.645	S	S	.	*	H	α-helix	trans	-68.8	-31	175.3	175.6	0	0	0	0	112.5	D1041 R1043 N1049	D1041-V1045 WeakPolarHBondContact O-CG2 3.47Å; D1041-V1045 PolarHBondContact O-N 2.95Å; D1041-V1045 VanDerWaalsContact O-N 3.12Å; R1043-V1045 VanDerWaalsContact C-N 3.35Å; R1043-V1045 PolarHBondContact O-N 3.25Å; V1045-N1049 PolarHBondContact O-N 2.75Å
1046	R	41.4	Very low	45.1	Very low	205 Å²	205	119.8 Å²	119.8	77%	0.774	65%	0.653	S	S	*	*	H	α-helix	trans	-73	-32.2	174.3	-97.4	-176.5	-170.4	172.6	4.7	113.4	R1043 S1044 S1050	R1043-R1046 PolarHBondContact O-N 3.01Å; S1044-R1046 PolarHBondContact O-N 3.16Å; R1046-S1050 PolarHBondContact O-N 2.99Å
1047	I	44.9	Very low	44.5	Very low	112 Å²	112	120.5 Å²	120.5	57%	0.574	66%	0.659	S	S	*	*	H	α-helix	trans	-76.3	-38.8	179.5	-64	167.7	0	0	0	110.3	R1043 S1044 N1049 S1050	R1043-I1047 WeakPolarHBondContact O-CG1 3.47Å; R1043-I1047 PolarHBondContact O-N 3.12Å; R1043-I1047 VanDerWaalsContact O-N 3.15Å; S1044-I1047 PolarHBondContact O-N 3.01Å; I1047-N1049 PolarHBondContact O-N 3.48Å; I1047-S1050 PolarHBondContact O-N 2.91Å
1048	L	41.9	Very low	43.8	Very low	133 Å²	133	124.5 Å²	124.5	70%	0.696	67%	0.673	S	S	*	*	H	α-helix	trans	-65	-34.2	175.2	-100.8	118.3	0	0	0	113.7	S1044 S1050	S1044-L1048 PolarHBondContact O-N 3.46Å; S1044-L1048 VanDerWaalsContact O-N 3.12Å; L1048-S1050 VanDerWaalsContact C-N 3.31Å; L1048-S1050 PolarHBondContact O-N 3.14Å
1049	N	40.6	Very low	43.1	Very low	117 Å²	117	122.4 Å²	122.4	63%	0.626	67%	0.671	S	S	*	*	H	α-helix	trans	-76.3	-15.6	176.8	-79.3	-14.9	0	0	0	113.8	V1045 I1047	V1045-N1049 PolarHBondContact O-N 2.75Å; I1047-N1049 PolarHBondContact O-N 3.48Å
1050	S	41.1	Very low	42.6	Very low	92 Å²	92	126.1 Å²	126.1	64%	0.643	69%	0.686	S	S	*	*	H	α-helix	trans	-88.5	-18.6	178.2	-148.2	0	0	0	0	113.3	R1046 I1047 L1048	R1046-S1050 PolarHBondContact O-N 2.99Å; I1047-S1050 PolarHBondContact O-N 2.91Å; L1048-S1050 VanDerWaalsContact C-N 3.31Å; L1048-S1050 PolarHBondContact O-N 3.14Å
1051	C	38.2	Very low	42.3	Very low	98 Å²	98	130.7 Å²	130.7	66%	0.662	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-5.5	176.2	-77.4	0	0	0	0	114.2
1052	K	37.7	Very low	42	Very low	181 Å²	181	132 Å²	132	79%	0.787	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	7	-178.7	-131.2	176.2	-175.1	177.8	0	115
1053	V	42.3	Very low	41.5	Very low	124 Å²	124	132.5 Å²	132.5	75%	0.752	72%	0.717	S	S	*	*	S	Bend	trans	-114.1	9	179.7	-175.2	0	0	0	0	112.3
1054	T	42.8	Very low	41.3	Very low	126 Å²	126	127.4 Å²	127.4	77%	0.773	72%	0.716	S	S	*	*			trans	-134.3	77.6	168.2	41.2	0	0	0	0	110.1
1055	S	37.7	Very low	41.4	Very low	185 Å²	185	132.9 Å²	132.9	100%	1.294	74%	0.738	S	S	*	*			trans	-141.2	0	153.5	68.1	0	0	0	0	108

Retrieved 1,055 of 1,055 residues in 388 ms (Link to these results)

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