A0A077Z9A7_TRITR Loading...

Nicotinic acetylcholine receptor non alpha

AlphaFold DB , UniProt , Accession A0A077Z9A7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 946 aa.

						>A0A077Z9A7_TRITR|A0A077Z9A7
MHSFLFLTTAAALTIVGSAQYDEDKIYSHIFQDYNSVVLPDPIDNKSSRVVVAFGLSMVLLVNVSWIDPGLRWNPAEFNMVTEIRAPVHKLWQPDIVLLNNSADGNYDVSFYSNAKVESDGTVLWVPPAIYKSACRMDVQHFPFDEQTCLLVFGSSAYTNGEVQFAWYKQRNFIQLEDFSFSSIWDVVDVPGSLSEFDSKITFYVKIRRKPLFYTVILILPTVMMAYLSVFVFYLPAGASEKITLSVNLLLALVVFMLLVSKILPCNSNTMPFLAKYLLITFVLDVAAIITTIAVLNVYFRPPSASRLPSWARNLFLKQFPRLLLMRTPRALLRQRRRLHRGRQLVSAAPMNNGHMQRENRAEHSASQEMTTTPVVIRSTNLHISKSDERRFSEETLPACNHLLNEALTSADQIFNHYERMYAEEMRREEWTFVSLILDRFLLFIFFGITLGGTFNVFAYVPNLFDRVDQLNCSEDEDRLMVDLFRGYNSLVLPLSNANSTPLLLHFGLQLVLLINLDEKNQIMHTNVWLTLKWYDFQMRWNPVNYGEIRQIRVATDKVWRPDIVLFNNADGNYEVSFHSNVVIDNEGNMLWVPPAIYKSSCIIDVEYFPFDEQVCTLLFGSWTYNEQEIILSFNDGVEGVDLQDYSYSSIWDIIEAPAVLTRQKSRMEFRIRVRRKSLFYTVVLIIPTVLMAFLSMMVFYLPACAGEKITLTLNVLLSLVVFLLLVSKILPPTSSTIPLMAKYLLLTFLLNIITILVTVLIINVFFRGPTTHRMPQWVRHTFLDFLPKMLMMKRPKRVSKEPHYGVMDTFHRHKPVRTTTGQSSKFSDSTEPPAVPMRSVIDHRNSDGFTYHSLANQYPLSREACKAIEAIEYIAEHLRTDEEYQSIREDWKYVAMVIDRLLLYIFFGVTLGGTVGILLSAPNVFEFVDQQEVVNRLLLFYRGES
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.4	Very low	39.9	Very low	232 Å²	232	145.4 Å²	145.4	100%	1.143	80%	0.795	S	S	*	*				0	144.6	0	-99.2	167.3	149.3	0	0	108.5
2	H	34	Very low	40.3	Very low	164 Å²	164	138.5 Å²	138.5	76%	0.759	77%	0.773	S	S	*	*			trans	39.3	86	168.8	-65	-71	0	0	0	118.7
3	S	32	Very low	40.5	Very low	119 Å²	119	139 Å²	139	83%	0.832	77%	0.771	S	S	*	*			trans	-56.3	139.3	149.5	-32	0	0	0	0	110.7
4	F	42	Very low	40.8	Very low	180 Å²	180	136.8 Å²	136.8	79%	0.789	76%	0.764	S	S	*	*			trans	-146	141.3	157.8	-108.4	-84.4	0	0	0	110.4
5	L	40	Very low	41.2	Very low	159 Å²	159	135.4 Å²	135.4	83%	0.832	75%	0.752	S	S	*	*			trans	61	93.6	165.1	-69	156.2	0	0	0	118.7
6	F	38.5	Very low	41.5	Very low	196 Å²	196	132.6 Å²	132.6	86%	0.86	74%	0.74	S	S	*	*			trans	-59.7	174.5	140.7	-90.3	-108.9	0	0	0	111.6
7	L	38	Very low	41.8	Very low	164 Å²	164	127.3 Å²	127.3	86%	0.859	72%	0.722	S	S	*	*			trans	91.3	59	166.2	-59	164.1	0	0	0	118.4
8	T	44	Very low	42.5	Very low	130 Å²	130	123.5 Å²	123.5	80%	0.798	71%	0.705	S	S	*	*			trans	-145.4	137.2	142.3	30.2	0	0	0	0	113
9	T	41.7	Very low	43.2	Very low	108 Å²	108	119.7 Å²	119.7	66%	0.663	69%	0.69	S	S	*	*			trans	49.1	106.8	151.1	57.3	0	0	0	0	119.9	A11	T9-A11 PolarHBondContact O-N 3Å
10	A	43.6	Very low	44	Very low	94 Å²	94	119.6 Å²	119.6	78%	0.777	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	18.8	161.8	0	0	0	0	0	114.5
11	A	48.5	Very low	44.9	Very low	53 Å²	53	121.8 Å²	121.8	44%	0.438	68%	0.681	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.8	-14.4	-176.4	0	0	0	0	0	113.9	T9 L13 T14	T9-A11 PolarHBondContact O-N 3Å; A11-L13 VanDerWaalsContact C-N 3.29Å; A11-L13 PolarHBondContact O-N 3.05Å; A11-T14 PolarHBondContact O-OG1 2.8Å
12	A	45.2	Very low	46.5	Very low	63 Å²	63	111.6 Å²	111.6	52%	0.521	63%	0.631	S	S	.	*	H	α-helix	trans	-65.5	-32.4	177.9	0	0	0	0	0	112.8	T14 I15 V16	A12-T14 VanDerWaalsContact C-N 3.27Å; A12-T14 PolarHBondContact O-N 3.34Å; A12-I15 PolarHBondContact O-N 3.08Å; A12-I15 VanDerWaalsContact O-N 3.1Å; A12-V16 PolarHBondContact O-N 3.41Å; A12-V16 VanDerWaalsContact O-N 3.09Å
13	L	42.5	Very low	48.3	Very low	145 Å²	145	107.6 Å²	107.6	76%	0.759	61%	0.613	S	S	*	*	H	α-helix	trans	-62.7	-28.8	-177	-94	153.8	0	0	0	113.8	A11	A11-L13 VanDerWaalsContact C-N 3.29Å; A11-L13 PolarHBondContact O-N 3.05Å
14	T	45	Very low	50.5	Low	108 Å²	108	106.7 Å²	106.7	66%	0.663	60%	0.599	S	S	*	*	H	α-helix	trans	-82.4	-23.4	175.3	41.8	0	0	0	0	113.7	A11 A12	A11-T14 PolarHBondContact O-OG1 2.8Å; A12-T14 VanDerWaalsContact C-N 3.27Å; A12-T14 PolarHBondContact O-N 3.34Å
15	I	47	Very low	52.3	Low	116 Å²	116	102.3 Å²	102.3	60%	0.595	58%	0.58	S	S	*	*	H	α-helix	trans	-83.8	-35.9	179.7	-61	174.6	0	0	0	110.9	A12 G17 S18 A19	A12-I15 PolarHBondContact O-N 3.08Å; A12-I15 VanDerWaalsContact O-N 3.1Å; I15-G17 PolarHBondContact O-N 2.61Å; I15-S18 PolarHBondContact O-N 3.15Å; I15-S18 PolarHBondContact O-OG 3.07Å; I15-A19 PolarHBondContact O-N 2.95Å
16	V	46.4	Very low	54.3	Low	91 Å²	91	94.7 Å²	94.7	55%	0.552	54%	0.54	S	S	*	.	H	α-helix	trans	-61.4	-37.2	169.5	176.2	0	0	0	0	110.7	A12 S18 Q20	A12-V16 PolarHBondContact O-N 3.41Å; A12-V16 VanDerWaalsContact O-N 3.09Å; V16-S18 PolarHBondContact O-N 3.34Å; V16-Q20 PolarHBondContact O-N 3.45Å
17	G	45.9	Very low	56.4	Low	42 Å²	42	87.9 Å²	87.9	43%	0.433	51%	0.509	S	S	.	.	H	α-helix	trans	-64.1	-34	178.3	0	0	0	0	0	115	I15 Y21	I15-G17 PolarHBondContact O-N 2.61Å; G17-Y21 WeakPolarHBondContact O-CB 3.22Å; G17-Y21 PolarHBondContact O-N 3.25Å
18	S	54.2	Low	58.5	Low	59 Å²	59	83.6 Å²	83.6	41%	0.413	49%	0.492	S	S	.	.	H	α-helix	trans	-75.2	-46.8	177.1	54.3	0	0	0	0	112.2	I15 V16 Q20 Y21 D22	I15-S18 PolarHBondContact O-N 3.15Å; I15-S18 PolarHBondContact O-OG 3.07Å; V16-S18 PolarHBondContact O-N 3.34Å; S18-Q20 VanDerWaalsContact C-N 3.32Å; S18-Q20 PolarHBondContact O-N 3.06Å; S18-Y21 PolarHBondContact O-N 2.88Å; S18-Y21 VanDerWaalsContact O-N 3.15Å; S18-D22 PolarHBondContact O-N 3.05Å
19	A	56.4	Low	60.3	Low	52 Å²	52	82.5 Å²	82.5	43%	0.43	48%	0.478	S	S	.	.	H	α-helix	trans	-59.8	-42.1	-178.5	0	0	0	0	0	112.3	I15 D22 E23	I15-A19 PolarHBondContact O-N 2.95Å; A19-D22 PolarHBondContact O-N 2.99Å; A19-E23 PolarHBondContact O-N 3.08Å
20	Q	59.2	Low	62.2	Low	116 Å²	116	78 Å²	78	54%	0.542	45%	0.45	S	S	.	.	H	α-helix	trans	-72.9	-30.7	178.6	-168.3	166.1	-7.4	0	0	112.9	V16 S18 E23 D24	V16-Q20 PolarHBondContact O-N 3.45Å; S18-Q20 VanDerWaalsContact C-N 3.32Å; S18-Q20 PolarHBondContact O-N 3.06Å; Q20-E23 PolarHBondContact O-N 3.38Å; Q20-D24 PolarHBondContact O-N 2.86Å
21	Y	62.5	Low	64.1	Low	166 Å²	166	75.6 Å²	75.6	65%	0.651	42%	0.422	S	S	*	.	H	α-helix	trans	-67.1	-37.4	172.4	-179	-98.2	0	0	0	112.3	G17 S18 K25	G17-Y21 WeakPolarHBondContact O-CB 3.22Å; G17-Y21 PolarHBondContact O-N 3.25Å; S18-Y21 PolarHBondContact O-N 2.88Å; S18-Y21 VanDerWaalsContact O-N 3.15Å; Y21-K25 WeakPolarHBondContact O-CB 3.04Å; Y21-K25 PolarHBondContact O-N 3.4Å
22	D	70.6	Confident	65.6	Low	18 Å²	18	80.1 Å²	80.1	10%	0.096	43%	0.434	C	S	.	.	H	α-helix	trans	-68.9	-41	174.8	-67.6	-44	0	0	0	111.7	S18 A19 K25 I26 N79	S18-D22 PolarHBondContact O-N 3.05Å; A19-D22 PolarHBondContact O-N 2.99Å; D22-K25 WeakPolarHBondContact O-CB 3.31Å; D22-K25 PolarHBondContact O-N 3.42Å; D22-I26 WeakPolarHBondContact O-CG1 3.45Å; D22-I26 PolarHBondContact O-N 3.44Å; D22-N79 VanDerWaalsContact CG-ND2 3.32Å; D22-N79 PolarHBondContact OD1-ND2 3.29Å; D22-N79 PolarHBondContact OD2-ND2 2.9Å
23	E	72.2	Confident	67	Low	81 Å²	81	83.8 Å²	83.8	38%	0.379	45%	0.445	S	S	.	.	H	α-helix	trans	-59.7	-50.4	171.7	-77.3	-171.5	-170.6	0	0	112	A19 Q20 K25 I26 Y27	A19-E23 PolarHBondContact O-N 3.08Å; Q20-E23 PolarHBondContact O-N 3.38Å; E23-K25 PolarHBondContact O-N 3.17Å; E23-I26 PolarHBondContact O-N 3.33Å; E23-I26 VanDerWaalsContact O-N 3.14Å; E23-Y27 WeakPolarHBondContact O-CB 3.46Å; E23-Y27 WeakPolarHBondContact O-CD2 3.41Å; E23-Y27 PolarHBondContact O-N 3.24Å
24	D	77.2	Confident	68.9	Low	100 Å²	100	78.9 Å²	78.9	54%	0.535	42%	0.417	S	S	.	.	H	α-helix	trans	-57.2	-36.4	177.1	-83	-22.4	0	0	0	111.7	Q20 Y27 S28	Q20-D24 PolarHBondContact O-N 2.86Å; D24-Y27 WeakPolarHBondContact O-CB 3.3Å; D24-S28 WeakPolarHBondContact O-CB 3.45Å; D24-S28 PolarHBondContact O-N 3.03Å
25	K	80.5	Confident	70.4	Confident	87 Å²	87	77.2 Å²	77.2	38%	0.378	40%	0.404	S	S	.	.	H	α-helix	trans	-67.8	-45.5	176	-169.4	-161.9	165.4	-150	0	111.8	Y21 D22 E23 Y27 S28 H29 E77 F78	Y21-K25 WeakPolarHBondContact O-CB 3.04Å; Y21-K25 PolarHBondContact O-N 3.4Å; D22-K25 WeakPolarHBondContact O-CB 3.31Å; D22-K25 PolarHBondContact O-N 3.42Å; E23-K25 PolarHBondContact O-N 3.17Å; K25-Y27 VanDerWaalsContact C-N 3.33Å; K25-S28 PolarHBondContact O-N 3.5Å; K25-S28 PolarHBondContact O-OG 3.34Å; K25-H29 PolarHBondContact O-N 3.47Å; K25-H29 VanDerWaalsContact O-N 3.08Å; K25-E77 PolarHBondContact NZ-O 3.48Å; K25-F78 HydrophobicContact CB-CD1 4.48Å; K25-F78 HydrophobicContact CB-CE1 4.45Å; K25-F78 HydrophobicContact CD-CD1 3.84Å; K25-F78 HydrophobicContact CD-CE1 3.78Å; K25-F78 HydrophobicContact CG-CD1 4.25Å; K25-F78 HydrophobicContact CG-CE1 3.91Å
26	I	81.6	Confident	72	Confident	0 Å²	0	73.8 Å²	73.8	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-58.9	-47.3	173.9	-63.7	164	0	0	0	109.9	D22 E23 S28 H29 I30 W73 F78 V81 I84	D22-I26 WeakPolarHBondContact O-CG1 3.45Å; D22-I26 PolarHBondContact O-N 3.44Å; E23-I26 PolarHBondContact O-N 3.33Å; E23-I26 VanDerWaalsContact O-N 3.14Å; I26-S28 VanDerWaalsContact C-N 3.32Å; I26-S28 PolarHBondContact O-N 3.38Å; I26-H29 PolarHBondContact O-N 3.18Å; I26-H29 VanDerWaalsContact O-N 3.08Å; I26-I30 HydrophobicContact CG2-CD1 3.54Å; I26-I30 HydrophobicContact CG2-CG1 4.22Å; I26-I30 PolarHBondContact O-N 3.22Å; I26-W73 HydrophobicContact CG2-CD2 4.02Å; I26-W73 HydrophobicContact CG2-CE3 4.27Å; I26-W73 HydrophobicContact CG2-CG 4.29Å; I26-F78 HydrophobicContact CB-CD1 4.35Å; I26-F78 HydrophobicContact CD1-CB 3.83Å; I26-F78 HydrophobicContact CD1-CD1 4.33Å; I26-F78 HydrophobicContact CD1-CG 4.16Å; I26-F78 HydrophobicContact CG1-CB 3.74Å; I26-F78 HydrophobicContact CG1-CD1 3.3Å; I26-F78 HydrophobicContact CG1-CD2 4.23Å; I26-F78 HydrophobicContact CG1-CE1 3.9Å; I26-F78 HydrophobicContact CG1-CG 3.5Å; I26-V81 HydrophobicContact CD1-CB 3.87Å; I26-V81 HydrophobicContact CD1-CG1 3.61Å; I26-I84 HydrophobicContact CB-CG2 4.49Å; I26-I84 HydrophobicContact CD1-CG2 3.9Å; I26-I84 HydrophobicContact CG2-CD1 3.95Å; I26-I84 HydrophobicContact CG2-CG2 4.16Å
27	Y	82.6	Confident	73.3	Confident	52 Å²	52	72.4 Å²	72.4	20%	0.204	38%	0.382	C	S	.	.	H	α-helix	trans	-54	-46.8	175.4	-101.3	-81	0	0	0	112.3	E23 D24 K25 H29 F31 R85 A86 P87	E23-Y27 WeakPolarHBondContact O-CB 3.46Å; E23-Y27 WeakPolarHBondContact O-CD2 3.41Å; E23-Y27 PolarHBondContact O-N 3.24Å; D24-Y27 WeakPolarHBondContact O-CB 3.3Å; K25-Y27 VanDerWaalsContact C-N 3.33Å; Y27-H29 VanDerWaalsContact C-N 3.27Å; Y27-H29 PolarHBondContact O-N 3.41Å; Y27-F31 AromaticContact CD1-CD2 3.54Å; Y27-F31 HydrophobicContact CD1-CD2 3.54Å; Y27-F31 AromaticContact CD1-CE2 3.57Å; Y27-F31 HydrophobicContact CD1-CE2 3.57Å; Y27-F31 HydrophobicContact CE1-CD2 4.16Å; Y27-F31 AromaticContact CE1-CE2 3.79Å; Y27-F31 HydrophobicContact CE1-CE2 3.79Å; Y27-F31 HydrophobicContact CG-CD2 4.38Å; Y27-F31 HydrophobicContact CG-CE2 4.46Å; Y27-F31 WeakPolarHBondContact O-CB 3.32Å; Y27-F31 WeakPolarHBondContact O-CD2 3.38Å; Y27-F31 PolarHBondContact O-N 2.95Å; Y27-F31 VanDerWaalsContact O-N 3.13Å; Y27-R85 PolarHBondContact OH-O 3.27Å; Y27-A86 WeakPolarHBondContact OH-CA 3.44Å; Y27-P87 VanDerWaalsContact OH-CD 3.27Å; Y27-P87 WeakPolarHBondContact OH-CD 3.41Å
28	S	81.6	Confident	74.6	Confident	74 Å²	74	71.3 Å²	71.3	52%	0.517	37%	0.366	S	S	.	.	H	α-helix	trans	-66.4	-28.7	178.9	73.2	0	0	0	0	113.4	D24 K25 I26	D24-S28 WeakPolarHBondContact O-CB 3.45Å; D24-S28 PolarHBondContact O-N 3.03Å; K25-S28 PolarHBondContact O-N 3.5Å; K25-S28 PolarHBondContact O-OG 3.34Å; I26-S28 VanDerWaalsContact C-N 3.32Å; I26-S28 PolarHBondContact O-N 3.38Å
29	H	82.9	Confident	75.4	Confident	108 Å²	108	69.1 Å²	69.1	50%	0.5	35%	0.35	S	S	.	.	H	α-helix	trans	-78.7	-46.5	-179.9	-179	31.6	0	0	0	112.2	K25 I26 Y27 F78	K25-H29 PolarHBondContact O-N 3.47Å; K25-H29 VanDerWaalsContact O-N 3.08Å; I26-H29 PolarHBondContact O-N 3.18Å; I26-H29 VanDerWaalsContact O-N 3.08Å; Y27-H29 VanDerWaalsContact C-N 3.27Å; Y27-H29 PolarHBondContact O-N 3.41Å; H29-F78 HydrophobicContact CB-CZ 4.33Å; H29-F78 AromaticContact CD2-CZ 3.64Å
30	I	81.4	Confident	76.3	Confident	13 Å²	13	66.9 Å²	66.9	7%	0.067	33%	0.331	C	S	.	.	H	α-helix	trans	-73.2	-50.7	-176.5	-63.1	175.2	0	0	0	110.8	I26 Q32 Y34 L71 W73 I84	I26-I30 HydrophobicContact CG2-CD1 3.54Å; I26-I30 HydrophobicContact CG2-CG1 4.22Å; I26-I30 PolarHBondContact O-N 3.22Å; I30-Q32 PolarHBondContact O-N 2.92Å; I30-Y34 VanDerWaalsContact O-CB 3.27Å; I30-Y34 WeakPolarHBondContact O-CB 3.39Å; I30-L71 HydrophobicContact CG2-CD2 3.49Å; I30-L71 VanDerWaalsContact CG2-CD2 3.49Å; I30-W73 HydrophobicContact CD1-CD2 4.28Å; I30-W73 HydrophobicContact CD1-CE3 3.52Å; I30-W73 HydrophobicContact CD1-CZ3 4.03Å; I30-I84 HydrophobicContact CD1-CD1 4.23Å
31	F	83.6	Confident	76.7	Confident	44 Å²	44	63.2 Å²	63.2	19%	0.193	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	14.9	-170.9	-65.4	-75.8	0	0	0	114.8	Y27 Y34 L71 A86 K90 L91	Y27-F31 AromaticContact CD1-CD2 3.54Å; Y27-F31 HydrophobicContact CD1-CD2 3.54Å; Y27-F31 AromaticContact CD1-CE2 3.57Å; Y27-F31 HydrophobicContact CD1-CE2 3.57Å; Y27-F31 HydrophobicContact CE1-CD2 4.16Å; Y27-F31 AromaticContact CE1-CE2 3.79Å; Y27-F31 HydrophobicContact CE1-CE2 3.79Å; Y27-F31 HydrophobicContact CG-CD2 4.38Å; Y27-F31 HydrophobicContact CG-CE2 4.46Å; Y27-F31 WeakPolarHBondContact O-CB 3.32Å; Y27-F31 WeakPolarHBondContact O-CD2 3.38Å; Y27-F31 PolarHBondContact O-N 2.95Å; Y27-F31 VanDerWaalsContact O-N 3.13Å; F31-Y34 HydrophobicContact CD1-CD1 4.17Å; F31-Y34 HydrophobicContact CE1-CD1 4.24Å; F31-L71 HydrophobicContact CE1-CD2 4.49Å; F31-A86 HydrophobicContact CE2-CB 4.43Å; F31-A86 HydrophobicContact CZ-CB 3.98Å; F31-K90 HydrophobicContact CD1-CB 4.27Å; F31-K90 HydrophobicContact CE1-CB 3.89Å; F31-K90 WeakPolarHBondContact CE1-O 3.21Å; F31-L91 HydrophobicContact CE1-CD2 3.87Å; F31-L91 HydrophobicContact CZ-CD2 3.77Å
32	Q	79.4	Confident	76.6	Confident	147 Å²	147	56.6 Å²	56.6	69%	0.687	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-46.8	175.2	-174.6	175.6	-51.5	0	0	111.9	I30	I30-Q32 PolarHBondContact O-N 2.92Å
33	D	74.4	Confident	75.9	Confident	141 Å²	141	61 Å²	61	75%	0.754	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.6	-5.4	-175.9	-59.4	-53.7	0	0	0	113.1
34	Y	82.3	Confident	75	Confident	42 Å²	42	63.8 Å²	63.8	17%	0.165	33%	0.332	C	S	.	.			trans	-69.7	128.5	178.9	178.8	-91	0	0	0	113.1	I30 F31 D68 L71 K90 W92	I30-Y34 VanDerWaalsContact O-CB 3.27Å; I30-Y34 WeakPolarHBondContact O-CB 3.39Å; F31-Y34 HydrophobicContact CD1-CD1 4.17Å; F31-Y34 HydrophobicContact CE1-CD1 4.24Å; Y34-D68 VanDerWaalsContact CE2-OD2 3.27Å; Y34-D68 WeakPolarHBondContact CE2-OD2 3.48Å; Y34-D68 PolarHBondContact OH-OD2 3.15Å; Y34-L71 HydrophobicContact CD1-CD2 4.42Å; Y34-L71 HydrophobicContact CD2-CD2 3.69Å; Y34-L71 HydrophobicContact CD2-CG 4.33Å; Y34-L71 HydrophobicContact CE1-CD2 4.23Å; Y34-L71 HydrophobicContact CE2-CD2 3.46Å; Y34-L71 VanDerWaalsContact CE2-CD2 3.46Å; Y34-L71 HydrophobicContact CE2-CG 3.76Å; Y34-L71 HydrophobicContact CG-CD2 4.16Å; Y34-K90 WeakPolarHBondContact CE1-O 3.21Å; Y34-W92 PolarHBondContact OH-N 2.91Å
35	N	77.7	Confident	73.9	Confident	72 Å²	72	65.1 Å²	65.1	39%	0.385	34%	0.34	S	S	.	.			trans	-108.1	105.1	-179.7	-176.6	1.9	0	0	0	111.8	V37 V38	N35-V37 PolarHBondContact O-N 3.33Å; N35-V37 VanDerWaalsContact O-N 3.07Å; N35-V37 PolarHBondContact OD1-N 3.48Å; N35-V38 HydrophobicContact CB-CG2 4.03Å; N35-V38 VanDerWaalsContact ND2-CG2 3.3Å; N35-V38 WeakPolarHBondContact ND2-CG2 3.49Å; N35-V38 WeakPolarHBondContact O-CB 3.38Å; N35-V38 PolarHBondContact O-N 3.17Å
36	S	79.2	Confident	72.2	Confident	44 Å²	44	66.5 Å²	66.5	31%	0.308	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-0.3	-177.2	63.9	0	0	0	0	116	K90 W92	S36-K90 WeakPolarHBondContact CB-O 3.26Å; S36-W92 WeakPolarHBondContact O-CA 3.43Å
37	V	74.7	Confident	70.8	Confident	63 Å²	63	69.6 Å²	69.6	38%	0.382	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-13.8	175.9	-171.9	0	0	0	0	111.7	N35	N35-V37 PolarHBondContact O-N 3.33Å; N35-V37 VanDerWaalsContact O-N 3.07Å; N35-V37 PolarHBondContact OD1-N 3.48Å
38	V	73.2	Confident	69.8	Low	18 Å²	18	68.3 Å²	68.3	11%	0.109	37%	0.366	C	S	.	.	S	Bend	trans	-90.7	138.7	-171.7	164.3	0	0	0	0	111.5	N35 P40 W92 D478	N35-V38 HydrophobicContact CB-CG2 4.03Å; N35-V38 VanDerWaalsContact ND2-CG2 3.3Å; N35-V38 WeakPolarHBondContact ND2-CG2 3.49Å; N35-V38 WeakPolarHBondContact O-CB 3.38Å; N35-V38 PolarHBondContact O-N 3.17Å; V38-P40 WeakPolarHBondContact O-CD 3.18Å; V38-W92 WeakPolarHBondContact O-CB 3.38Å; V38-W92 VanDerWaalsContact O-CG 3.26Å; V38-D478 HydrophobicContact CG1-CB 3.55Å; V38-D478 VanDerWaalsContact CG1-CG 3.42Å; V38-D478 WeakPolarHBondContact CG1-OD1 3.41Å; V38-D478 WeakPolarHBondContact CG2-OD1 3.49Å
39	L	71.3	Confident	69.3	Low	13 Å²	13	67.2 Å²	67.2	7%	0.068	35%	0.35	C	S	.	.			trans	-63.7	123.4	170.5	-175.7	68.2	0	0	0	109.2	D41 V50 W92 Y158 E162 V163	L39-D41 PolarHBondContact O-N 3.28Å; L39-V50 HydrophobicContact CD1-CB 4.24Å; L39-V50 HydrophobicContact CD1-CG2 3.52Å; L39-V50 HydrophobicContact CD2-CG2 4.25Å; L39-V50 HydrophobicContact CG-CG2 3.67Å; L39-W92 HydrophobicContact CD1-CH2 3.93Å; L39-W92 HydrophobicContact CD1-CZ2 3.42Å; L39-W92 VanDerWaalsContact CD1-CZ2 3.42Å; L39-Y158 HydrophobicContact CD1-CE1 4.2Å; L39-E162 HydrophobicContact CD2-CB 4.23Å; L39-V163 HydrophobicContact CD1-CG2 4Å
40	P	75.2	Confident	69.1	Low	5 Å²	5	62.3 Å²	62.3	3%	0.032	33%	0.328	C	S	.	.			trans	-65.7	107.2	-176.1	-25.9	35.7	0	0	0	112.6	V38 P42 V50 D68 W92	V38-P40 WeakPolarHBondContact O-CD 3.18Å; P40-P42 VanDerWaalsContact O-CD 3.25Å; P40-P42 WeakPolarHBondContact O-CD 3.4Å; P40-V50 VanDerWaalsContact O-CG2 3.31Å; P40-V50 WeakPolarHBondContact O-CG2 3.21Å; P40-D68 HydrophobicContact CB-CB 3.91Å; P40-D68 HydrophobicContact CG-CB 4.14Å; P40-D68 WeakPolarHBondContact CG-OD2 3.29Å; P40-W92 VanDerWaalsContact CD-CE3 3.43Å; P40-W92 HydrophobicContact CG-CB 4.02Å; P40-W92 HydrophobicContact CG-CD2 3.83Å; P40-W92 HydrophobicContact CG-CE3 3.6Å; P40-W92 HydrophobicContact CG-CG 4.04Å; P40-W92 HydrophobicContact CG-CZ3 4.25Å
41	D	67.5	Low	69.1	Low	39 Å²	39	64.3 Å²	64.3	21%	0.209	34%	0.341	C	S	.	.			trans	-76.1	111.4	-177.7	-88.5	-23.9	0	0	0	111	L39 I43 P69 E475	L39-D41 PolarHBondContact O-N 3.28Å; D41-I43 PolarHBondContact O-N 3.4Å; D41-P69 WeakPolarHBondContact O-CG 3.49Å; D41-E475 HydrophobicContact CB-CG 3.63Å; D41-E475 VanDerWaalsContact CG-CG 3.46Å; D41-E475 WeakPolarHBondContact OD1-CA 3.41Å; D41-E475 WeakPolarHBondContact OD1-CG 3.46Å
42	P	60.3	Low	69.2	Low	27 Å²	27	62.2 Å²	62.2	18%	0.175	33%	0.332	C	S	.	.			trans	-90.2	103.2	-170.5	34.9	-30.2	0	0	0	111.9	P40 D44 S48 P69	P40-P42 VanDerWaalsContact O-CD 3.25Å; P40-P42 WeakPolarHBondContact O-CD 3.4Å; P42-D44 VanDerWaalsContact C-N 3.35Å; P42-D44 PolarHBondContact O-N 3.07Å; P42-S48 VanDerWaalsContact CD-O 3.32Å; P42-S48 WeakPolarHBondContact CD-O 3.18Å; P42-S48 WeakPolarHBondContact CG-O 3.26Å; P42-S48 WeakPolarHBondContact O-CB 3.31Å; P42-S48 PolarHBondContact O-OG 3.35Å; P42-P69 HydrophobicContact CB-CG 4.41Å
43	I	55.9	Low	69.6	Low	112 Å²	112	56.1 Å²	56.1	57%	0.574	31%	0.306	S	S	*	.	S	Bend	trans	-48.3	84.3	178.2	-47.6	170.3	0	0	0	113	D41 P69	D41-I43 PolarHBondContact O-N 3.4Å; I43-P69 HydrophobicContact CD1-CB 3.7Å; I43-P69 HydrophobicContact CD1-CG 4.45Å; I43-P69 HydrophobicContact CG1-CB 3.96Å; I43-P69 HydrophobicContact CG1-CG 4.18Å
44	D	53.6	Low	70.3	Confident	138 Å²	138	49.4 Å²	49.4	74%	0.738	27%	0.27	S	S	*	.	S	Bend	trans	-176.8	106.8	142.2	-105.2	-26.9	0	0	0	110.2	P42	P42-D44 VanDerWaalsContact C-N 3.35Å; P42-D44 PolarHBondContact O-N 3.07Å
45	N	52.3	Low	70.4	Confident	128 Å²	128	47.5 Å²	47.5	68%	0.684	26%	0.264	S	S	*	.	S	Bend	trans	70.2	147.7	179.8	-151	15.8	0	0	0	114.6	S47 S48	N45-S47 PolarHBondContact O-N 3.48Å; N45-S48 PolarHBondContact O-OG 3.3Å
46	K	46.4	Very low	70.6	Confident	116 Å²	116	44.7 Å²	44.7	50%	0.504	25%	0.248	S	C	.	.	S	Bend	trans	-72.7	34.4	177.8	-68.4	-171	145.5	-66.3	0	113.8	S474 E475 D476	K46-S474 VanDerWaalsContact C-OG 3.29Å; K46-E475 PolarHBondContact NZ-O 3.06Å; K46-D476 IonicContact NZ-OD1 2.8Å; K46-D476 PolarHBondContact NZ-OD1 2.96Å; K46-D476 IonicContact NZ-OD2 2.67Å; K46-D476 PolarHBondContact NZ-OD2 3.04Å
47	S	51.3	Low	70.7	Confident	66 Å²	66	43.2 Å²	43.2	46%	0.462	24%	0.238	S	C	.	.			trans	-158.4	71.1	169.3	53.6	0	0	0	0	111.1	N45 C473 S474	N45-S47 PolarHBondContact O-N 3.48Å; S47-C473 VanDerWaalsContact C-SG 3.53Å; S47-C473 WeakPolarHBondContact O-CB 3.22Å; S47-C473 PolarHBondContact O-SG 3.46Å; S47-S474 VanDerWaalsContact C-OG 3.31Å; S47-S474 WeakPolarHBondContact CA-OG 3.38Å; S47-S474 PolarHBondContact N-OG 2.68Å
48	S	60.9	Low	70.8	Confident	24 Å²	24	42.9 Å²	42.9	17%	0.168	23%	0.233	C	C	.	.			trans	-130.3	90.4	162.8	49	0	0	0	0	115.5	P42 N45 C473 S474	P42-S48 VanDerWaalsContact CD-O 3.32Å; P42-S48 WeakPolarHBondContact CD-O 3.18Å; P42-S48 WeakPolarHBondContact CG-O 3.26Å; P42-S48 WeakPolarHBondContact O-CB 3.31Å; P42-S48 PolarHBondContact O-OG 3.35Å; N45-S48 PolarHBondContact O-OG 3.3Å; S48-C473 WeakPolarHBondContact CA-SG 3.47Å; S48-C473 VanDerWaalsContact N-CB 3.31Å; S48-S474 VanDerWaalsContact CA-CB 3.48Å; S48-S474 PolarHBondContact N-OG 2.98Å; S48-S474 WeakPolarHBondContact O-CB 3.32Å
49	R	71.9	Confident	70.8	Confident	52 Å²	52	44.6 Å²	44.6	20%	0.196	24%	0.243	C	C	.	.			trans	-73	162	-171.3	-102.5	166.3	-121.9	147.5	4.5	110.9	V51 N160 G161 E162 N472 C473 S474	R49-V51 PolarHBondContact O-N 3.36Å; R49-N160 WeakPolarHBondContact CD-O 3.47Å; R49-N160 PolarHBondContact NE-O 3.19Å; R49-N160 PolarHBondContact NH1-O 3.42Å; R49-G161 WeakPolarHBondContact CD-O 3.45Å; R49-G161 WeakPolarHBondContact CG-O 3.43Å; R49-G161 PolarHBondContact NE-O 3.23Å; R49-G161 VanDerWaalsContact NE-O 3.11Å; R49-E162 WeakPolarHBondContact CG-O 3.23Å; R49-N472 HydrophobicContact CB-CB 3.85Å; R49-N472 VanDerWaalsContact CB-ND2 3.29Å; R49-N472 WeakPolarHBondContact CB-ND2 3.36Å; R49-N472 WeakPolarHBondContact CB-OD1 3.38Å; R49-N472 WeakPolarHBondContact CD-OD1 3.28Å; R49-N472 PolarHBondContact NH1-O 3.29Å; R49-N472 VanDerWaalsContact NH1-O 3.17Å; R49-N472 PolarHBondContact NH2-O 2.68Å; R49-N472 PolarHBondContact O-ND2 3.01Å; R49-C473 VanDerWaalsContact CB-CA 3.4Å; R49-C473 HydrophobicContact CB-CB 4.49Å; R49-C473 VanDerWaalsContact CZ-O 3.31Å; R49-C473 VanDerWaalsContact N-CA 3.28Å; R49-C473 PolarHBondContact NE-O 2.92Å; R49-C473 PolarHBondContact NH2-O 3.29Å; R49-S474 VanDerWaalsContact N-CB 3.28Å
50	V	78.8	Confident	70.8	Confident	5 Å²	5	48.2 Å²	48.2	3%	0.03	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	124.1	171.5	-173.6	0	0	0	0	110.4	L39 P40 V52 W66 W92 E162 V163 Q164 N472	L39-V50 HydrophobicContact CD1-CB 4.24Å; L39-V50 HydrophobicContact CD1-CG2 3.52Å; L39-V50 HydrophobicContact CD2-CG2 4.25Å; L39-V50 HydrophobicContact CG-CG2 3.67Å; P40-V50 VanDerWaalsContact O-CG2 3.31Å; P40-V50 WeakPolarHBondContact O-CG2 3.21Å; V50-V52 HydrophobicContact CG1-CG2 4.1Å; V50-W66 HydrophobicContact CG1-CB 4.47Å; V50-W92 HydrophobicContact CG1-CH2 3.91Å; V50-W92 HydrophobicContact CG1-CZ3 3.94Å; V50-E162 PolarHBondContact N-O 3.2Å; V50-V163 HydrophobicContact CB-CG2 4.41Å; V50-Q164 PolarHBondContact O-N 3.49Å; V50-N472 PolarHBondContact O-ND2 2.99Å
51	V	81.2	Confident	70.8	Confident	55 Å²	55	51.4 Å²	51.4	33%	0.333	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	98.1	-177.5	178.2	0	0	0	0	108.2	R49 A53 W66 A166 L471 N472	R49-V51 PolarHBondContact O-N 3.36Å; V51-A53 PolarHBondContact O-N 3.1Å; V51-W66 VanDerWaalsContact O-CA 3.29Å; V51-W66 WeakPolarHBondContact O-CA 3.29Å; V51-W66 WeakPolarHBondContact O-CB 3.42Å; V51-A166 HydrophobicContact CG1-CB 4.04Å; V51-L471 HydrophobicContact CB-CD2 3.99Å; V51-L471 HydrophobicContact CG1-CD2 3.59Å; V51-L471 HydrophobicContact CG2-CD2 3.67Å; V51-N472 WeakPolarHBondContact CG2-ND2 3.44Å
52	V	86.4	Confident	71.5	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	86.1	177.4	-178.5	0	0	0	0	109	V50 F54 V64 S65 W92 P94 I96 V163 Q164 F165 A166	V50-V52 HydrophobicContact CG1-CG2 4.1Å; V52-F54 PolarHBondContact O-N 3.34Å; V52-F54 VanDerWaalsContact O-N 3.11Å; V52-V64 HydrophobicContact CG1-CG1 3.97Å; V52-S65 CarbonylContact C-O 3.56Å; V52-W92 HydrophobicContact CG2-CH2 4.5Å; V52-P94 HydrophobicContact CG1-CB 4.08Å; V52-P94 HydrophobicContact CG1-CG 3.88Å; V52-P94 HydrophobicContact CG2-CB 3.8Å; V52-P94 HydrophobicContact CG2-CG 4.17Å; V52-I96 HydrophobicContact CG1-CD1 3.99Å; V52-V163 HydrophobicContact CB-CG1 4.31Å; V52-V163 HydrophobicContact CG2-CG1 3.65Å; V52-Q164 PolarHBondContact N-O 3.18Å; V52-F165 HydrophobicContact CB-CD1 4.46Å; V52-F165 HydrophobicContact CG1-CD1 4.16Å; V52-F165 HydrophobicContact CG1-CE1 4.14Å; V52-F165 CarbonylContact O-C 3.57Å; V52-F165 VanDerWaalsContact O-CA 3.31Å; V52-F165 WeakPolarHBondContact O-CA 3.39Å; V52-A166 PolarHBondContact O-N 3.11Å
53	A	88.1	Confident	72.8	Confident	18 Å²	18	49.2 Å²	49.2	15%	0.149	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	104.3	175.3	0	0	0	0	0	110.5	V51 S65 A166	V51-A53 PolarHBondContact O-N 3.1Å; A53-S65 WeakPolarHBondContact CA-O 3.31Å; A53-S65 WeakPolarHBondContact CB-O 3.36Å; A53-S65 PolarHBondContact N-O 3.42Å; A53-S65 PolarHBondContact O-N 3.31Å; A53-A166 CarbonylContact C-O 3.51Å; A53-A166 WeakPolarHBondContact CA-O 3.36Å; A53-A166 HydrophobicContact CB-CB 4.24Å
54	F	87.6	Confident	74.3	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	142.1	-176.9	-171.5	-94.4	0	0	0	111.1	V52 L56 V62 N63 V64 I96 F153 F165 A166 Y168 I201 F203	V52-F54 PolarHBondContact O-N 3.34Å; V52-F54 VanDerWaalsContact O-N 3.11Å; F54-L56 HydrophobicContact CE1-CD1 4.35Å; F54-L56 HydrophobicContact CZ-CD1 4.24Å; F54-V62 HydrophobicContact CD2-CG1 3.94Å; F54-V62 HydrophobicContact CE1-CG1 4.43Å; F54-V62 HydrophobicContact CE2-CG1 3.2Å; F54-V62 HydrophobicContact CZ-CG1 3.52Å; F54-N63 CarbonylContact C-O 3.58Å; F54-N63 WeakPolarHBondContact CA-O 3.39Å; F54-V64 HydrophobicContact CD2-CG2 4.11Å; F54-V64 HydrophobicContact CE2-CG2 4.29Å; F54-I96 HydrophobicContact CD2-CD1 3.67Å; F54-I96 HydrophobicContact CD2-CG2 4.16Å; F54-I96 HydrophobicContact CE2-CD1 3.91Å; F54-I96 HydrophobicContact CE2-CG2 3.67Å; F54-I96 HydrophobicContact CZ-CG2 4.24Å; F54-F153 AromaticContact CE1-CD2 3.69Å; F54-F153 HydrophobicContact CE1-CD2 3.69Å; F54-F153 AromaticContact CE1-CE2 3.93Å; F54-F153 HydrophobicContact CE1-CE2 3.93Å; F54-F153 HydrophobicContact CE1-CG 4.14Å; F54-F153 HydrophobicContact CZ-CD1 4.22Å; F54-F153 AromaticContact CZ-CD2 3.92Å; F54-F153 HydrophobicContact CZ-CD2 3.92Å; F54-F153 HydrophobicContact CZ-CE1 4.35Å; F54-F153 HydrophobicContact CZ-CE2 4.06Å; F54-F153 AromaticContact CZ-CG 4Å; F54-F153 HydrophobicContact CZ-CG 4Å; F54-F153 HydrophobicContact CZ-CZ 4.27Å; F54-F165 HydrophobicContact CB-CD1 4.08Å; F54-A166 PolarHBondContact N-O 2.89Å; F54-Y168 WeakPolarHBondContact O-CB 3.1Å; F54-Y168 PolarHBondContact O-N 3.04Å; F54-I201 HydrophobicContact CB-CD1 4.2Å; F54-I201 HydrophobicContact CD1-CD1 4.22Å; F54-I201 HydrophobicContact CD1-CG2 4.12Å; F54-F203 AromaticContact CD1-CE2 3.71Å; F54-F203 HydrophobicContact CD1-CE2 3.71Å; F54-F203 AromaticContact CD1-CZ 3.88Å; F54-F203 HydrophobicContact CD1-CZ 3.88Å; F54-F203 AromaticContact CE1-CE2 3.59Å; F54-F203 HydrophobicContact CE1-CE2 3.59Å; F54-F203 HydrophobicContact CE1-CZ 4.04Å
55	G	85.3	Confident	76.1	Confident	3 Å²	3	38.2 Å²	38.2	3%	0.031	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	121	173.2	0	0	0	0	0	111.9	N63	G55-N63 PolarHBondContact N-O 3.39Å; G55-N63 WeakPolarHBondContact O-CB 3.15Å; G55-N63 PolarHBondContact O-N 2.96Å; G55-N63 PolarHBondContact O-ND2 3.19Å
56	L	82.3	Confident	77.9	Confident	12 Å²	12	32.3 Å²	32.3	6%	0.063	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	145.6	-179.8	-156.8	84.8	0	0	0	111.3	F54 V62 Y131 L151 F153 I174 Q175 F203	F54-L56 HydrophobicContact CE1-CD1 4.35Å; F54-L56 HydrophobicContact CZ-CD1 4.24Å; L56-V62 HydrophobicContact CD1-CG2 4.22Å; L56-Y131 HydrophobicContact CD1-CD2 3.98Å; L56-Y131 HydrophobicContact CD1-CE2 3.84Å; L56-L151 HydrophobicContact CD2-CD1 3.64Å; L56-F153 HydrophobicContact CD1-CE2 4.16Å; L56-F153 HydrophobicContact CD1-CZ 4Å; L56-I174 HydrophobicContact CB-CG1 4.32Å; L56-I174 HydrophobicContact CB-CG2 4.08Å; L56-I174 HydrophobicContact CD2-CD1 3.86Å; L56-I174 HydrophobicContact CD2-CG1 4.13Å; L56-I174 HydrophobicContact CD2-CG2 4.01Å; L56-I174 HydrophobicContact CG-CG2 4.33Å; L56-I174 WeakPolarHBondContact O-CG2 3.47Å; L56-Q175 PolarHBondContact O-N 3.1Å; L56-F203 HydrophobicContact CB-CE1 4.31Å; L56-F203 HydrophobicContact CB-CZ 4.25Å
57	S	80.9	Confident	79.9	Confident	13 Å²	13	30.1 Å²	30.1	9%	0.091	17%	0.171	C	C	.	.	B	Isolated β-bridge	trans	-114.4	147.9	159.8	170.3	0	0	0	0	110.1	V59 L61 Q175	S57-V59 PolarHBondContact O-N 2.91Å; S57-V59 VanDerWaalsContact O-N 3.15Å; S57-V59 PolarHBondContact OG-N 3.11Å; S57-L61 WeakPolarHBondContact CB-O 3.24Å; S57-L61 PolarHBondContact N-O 3.17Å; S57-Q175 WeakPolarHBondContact CA-O 3.27Å; S57-Q175 PolarHBondContact OG-O 3.35Å
58	M	76.4	Confident	81.6	Confident	56 Å²	56	27.2 Å²	27.2	28%	0.276	15%	0.15	S	C	.	.	S	Bend	trans	-70	-2.6	174.4	-66.2	-66.9	-94	0	0	113.5	L60 I174 Q175 L176 F179 V187 V205	M58-L60 VanDerWaalsContact C-N 3.3Å; M58-L60 PolarHBondContact O-N 2.9Å; M58-I174 HydrophobicContact CG-CG2 3.64Å; M58-I174 HydrophobicContact SD-CD1 4.22Å; M58-I174 HydrophobicContact SD-CG2 3.87Å; M58-Q175 PolarHBondContact N-O 2.98Å; M58-Q175 VanDerWaalsContact N-O 3.12Å; M58-L176 HydrophobicContact CB-CD2 4.45Å; M58-L176 HydrophobicContact CG-CD2 3.73Å; M58-F179 HydrophobicContact CB-CB 4.3Å; M58-F179 HydrophobicContact CB-CD2 3.46Å; M58-F179 VanDerWaalsContact CB-CD2 3.46Å; M58-F179 HydrophobicContact CB-CE2 4.15Å; M58-F179 HydrophobicContact CB-CG 4.18Å; M58-F179 HydrophobicContact CE-CE2 4.1Å; M58-F179 HydrophobicContact CG-CD2 4.08Å; M58-F179 HydrophobicContact CG-CE2 4.49Å; M58-V187 HydrophobicContact CE-CG2 4.02Å; M58-V205 HydrophobicContact CE-CG1 4.39Å
59	V	74.2	Confident	82.7	Confident	54 Å²	54	26.8 Å²	26.8	33%	0.327	15%	0.147	S	C	.	.	S	Bend	trans	-97.4	34	-176.9	-161.9	0	0	0	0	111.4	S57 L61 E177 D178	S57-V59 PolarHBondContact O-N 2.91Å; S57-V59 VanDerWaalsContact O-N 3.15Å; S57-V59 PolarHBondContact OG-N 3.11Å; V59-L61 PolarHBondContact O-N 2.91Å; V59-E177 VanDerWaalsContact CG2-O 3.31Å; V59-E177 WeakPolarHBondContact CG2-O 3.34Å; V59-D178 HydrophobicContact CG1-CB 4.43Å; V59-D178 HydrophobicContact CG2-CB 3.84Å; V59-D178 VanDerWaalsContact CG2-O 3.26Å; V59-D178 WeakPolarHBondContact CG2-O 3.5Å
60	L	71	Confident	83.2	Confident	90 Å²	90	26.5 Å²	26.5	47%	0.471	16%	0.16	S	C	.	.	S	Bend	trans	61.8	-2.2	-174.5	-50.2	179.8	0	0	0	115.6	M58 P128 A129 I130	M58-L60 VanDerWaalsContact C-N 3.3Å; M58-L60 PolarHBondContact O-N 2.9Å; L60-P128 CarbonylContact O-C 3.59Å; L60-P128 WeakPolarHBondContact O-CA 3.32Å; L60-A129 PolarHBondContact O-N 3.45Å; L60-I130 HydrophobicContact CD1-CD1 4.44Å; L60-I130 HydrophobicContact CD1-CG1 4.06Å; L60-I130 HydrophobicContact CD2-CG1 4.07Å
61	L	75.6	Confident	83.5	Confident	71 Å²	71	26.3 Å²	26.3	37%	0.372	16%	0.159	S	C	.	.	B	Isolated β-bridge	trans	-87.7	132.1	180	-62.5	-178.8	0	0	0	111.4	S57 V59 V126 P128	S57-L61 WeakPolarHBondContact CB-O 3.24Å; S57-L61 PolarHBondContact N-O 3.17Å; V59-L61 PolarHBondContact O-N 2.91Å; L61-V126 HydrophobicContact CB-CG1 4.17Å; L61-V126 HydrophobicContact CD1-CG1 4.49Å; L61-V126 HydrophobicContact CD2-CG1 4.34Å; L61-P128 HydrophobicContact CD2-CB 4.28Å
62	V	81.5	Confident	83.8	Confident	1 Å²	1	29.2 Å²	29.2	1%	0.006	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	128.9	171.3	-168.8	0	0	0	0	107.8	F54 L56 V64 V126 P127 A129 Y131	F54-V62 HydrophobicContact CD2-CG1 3.94Å; F54-V62 HydrophobicContact CE1-CG1 4.43Å; F54-V62 HydrophobicContact CE2-CG1 3.2Å; F54-V62 HydrophobicContact CZ-CG1 3.52Å; L56-V62 HydrophobicContact CD1-CG2 4.22Å; V62-V64 HydrophobicContact CB-CG2 4.46Å; V62-V64 HydrophobicContact CG1-CG2 3.72Å; V62-V126 VanDerWaalsContact O-CA 3.24Å; V62-V126 WeakPolarHBondContact O-CA 3.35Å; V62-V126 WeakPolarHBondContact O-CG1 3.2Å; V62-P127 HydrophobicContact CB-CG 4.2Å; V62-P127 PolarHBondContact N-O 3.37Å; V62-P127 VanDerWaalsContact N-O 3.15Å; V62-P127 WeakPolarHBondContact O-CD 3.34Å; V62-A129 HydrophobicContact CG2-CB 4.02Å; V62-Y131 HydrophobicContact CG2-CE2 3.61Å
63	N	86.8	Confident	83.9	Confident	20 Å²	20	30 Å²	30	11%	0.107	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	117	167	-60.7	-94.3	0	0	0	107.9	F54 G55 Y168	F54-N63 CarbonylContact C-O 3.58Å; F54-N63 WeakPolarHBondContact CA-O 3.39Å; G55-N63 PolarHBondContact N-O 3.39Å; G55-N63 WeakPolarHBondContact O-CB 3.15Å; G55-N63 PolarHBondContact O-N 2.96Å; G55-N63 PolarHBondContact O-ND2 3.19Å; N63-Y168 HydrophobicContact CB-CD1 3.36Å; N63-Y168 HydrophobicContact CB-CD2 4.25Å; N63-Y168 HydrophobicContact CB-CE1 3.42Å; N63-Y168 VanDerWaalsContact CB-CE1 3.42Å; N63-Y168 HydrophobicContact CB-CE2 4.34Å; N63-Y168 HydrophobicContact CB-CG 3.77Å; N63-Y168 WeakPolarHBondContact OD1-CE1 3.31Å
64	V	88.6	Confident	83.8	Confident	2 Å²	2	32.8 Å²	32.8	1%	0.012	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	124.1	171.5	-167.5	0	0	0	0	107.5	V52 F54 V62 W66 P94 I96 W125	V52-V64 HydrophobicContact CG1-CG1 3.97Å; F54-V64 HydrophobicContact CD2-CG2 4.11Å; F54-V64 HydrophobicContact CE2-CG2 4.29Å; V62-V64 HydrophobicContact CB-CG2 4.46Å; V62-V64 HydrophobicContact CG1-CG2 3.72Å; V64-W66 HydrophobicContact CB-CZ3 4.27Å; V64-W66 HydrophobicContact CG1-CE3 3.94Å; V64-W66 HydrophobicContact CG1-CZ3 3.83Å; V64-P94 HydrophobicContact CG1-CG 3.88Å; V64-I96 HydrophobicContact CG1-CD1 3.65Å; V64-I96 HydrophobicContact CG2-CD1 3.97Å; V64-W125 HydrophobicContact CB-CE3 4.36Å; V64-W125 HydrophobicContact CG2-CE3 4.32Å; V64-W125 PolarHBondContact N-O 2.66Å; V64-W125 PolarHBondContact O-N 2.91Å
65	S	90.7	Very high	83.7	Confident	17 Å²	17	34.1 Å²	34.1	12%	0.119	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	138.6	178	-176.6	0	0	0	0	111	V52 A53 V123	V52-S65 CarbonylContact C-O 3.56Å; A53-S65 WeakPolarHBondContact CA-O 3.31Å; A53-S65 WeakPolarHBondContact CB-O 3.36Å; A53-S65 PolarHBondContact N-O 3.42Å; A53-S65 PolarHBondContact O-N 3.31Å; S65-V123 WeakPolarHBondContact CA-O 3.42Å; S65-V123 VanDerWaalsContact CB-O 3.3Å; S65-V123 WeakPolarHBondContact CB-O 3.46Å; S65-V123 PolarHBondContact OG-O 3.35Å
66	W	90.3	Very high	83.7	Confident	3 Å²	3	37.4 Å²	37.4	1%	0.011	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	165.6	177.4	63	98.7	0	0	0	109.1	V50 V51 V64 W92 P94 V123 W125	V50-W66 HydrophobicContact CG1-CB 4.47Å; V51-W66 VanDerWaalsContact O-CA 3.29Å; V51-W66 WeakPolarHBondContact O-CA 3.29Å; V51-W66 WeakPolarHBondContact O-CB 3.42Å; V64-W66 HydrophobicContact CB-CZ3 4.27Å; V64-W66 HydrophobicContact CG1-CE3 3.94Å; V64-W66 HydrophobicContact CG1-CZ3 3.83Å; W66-W92 HydrophobicContact CD2-CZ3 4.5Å; W66-W92 HydrophobicContact CG-CZ3 4.24Å; W66-W92 WeakPolarHBondContact CZ2-O 3.49Å; W66-W92 AromaticContact NE1-CE3 3.8Å; W66-P94 HydrophobicContact CE3-CG 4.3Å; W66-P94 HydrophobicContact CZ3-CG 4.43Å; W66-V123 HydrophobicContact CD2-CB 4Å; W66-V123 HydrophobicContact CD2-CG1 4.42Å; W66-V123 HydrophobicContact CE3-CB 4.42Å; W66-V123 HydrophobicContact CG-CB 4.49Å; W66-V123 HydrophobicContact CH2-CB 4.28Å; W66-V123 HydrophobicContact CH2-CG1 3.64Å; W66-V123 HydrophobicContact CZ2-CB 3.82Å; W66-V123 HydrophobicContact CZ2-CG1 3.46Å; W66-V123 VanDerWaalsContact CZ2-CG1 3.46Å; W66-V123 HydrophobicContact CZ2-CG2 4.18Å; W66-V123 HydrophobicContact CZ3-CG1 4.18Å; W66-V123 PolarHBondContact N-O 3.43Å; W66-V123 PolarHBondContact O-N 3.41Å; W66-W125 HydrophobicContact CH2-CB 3.95Å; W66-W125 HydrophobicContact CZ3-CB 3.9Å
67	I	87.8	Confident	83.7	Confident	71 Å²	71	42.1 Å²	42.1	36%	0.364	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	125.2	175.1	-58	175	0	0	0	107.5
68	D	87.2	Confident	83.8	Confident	4 Å²	4	41.9 Å²	41.9	2%	0.021	23%	0.234	C	C	.	.			trans	-122.5	103.5	178.5	-178.1	-24	0	0	0	108.5	Y34 P40 G70 L71 G121 V123	Y34-D68 VanDerWaalsContact CE2-OD2 3.27Å; Y34-D68 WeakPolarHBondContact CE2-OD2 3.48Å; Y34-D68 PolarHBondContact OH-OD2 3.15Å; P40-D68 HydrophobicContact CB-CB 3.91Å; P40-D68 HydrophobicContact CG-CB 4.14Å; P40-D68 WeakPolarHBondContact CG-OD2 3.29Å; D68-G70 PolarHBondContact O-N 3.32Å; D68-G70 WeakPolarHBondContact OD1-CA 3.44Å; D68-G70 PolarHBondContact OD1-N 2.94Å; D68-L71 HydrophobicContact CB-CD1 3.84Å; D68-L71 HydrophobicContact CB-CG 4.06Å; D68-L71 PolarHBondContact O-N 3.09Å; D68-L71 VanDerWaalsContact O-N 3.12Å; D68-G121 PolarHBondContact N-O 2.94Å; D68-G121 VanDerWaalsContact O-CA 3.26Å; D68-G121 WeakPolarHBondContact O-CA 3.44Å; D68-V123 HydrophobicContact CB-CG2 4.31Å
69	P	83.8	Confident	83.9	Confident	15 Å²	15	45 Å²	45	10%	0.097	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-66.6	-19.8	-178.4	-19.5	31.4	0	0	0	114.2	D41 P42 I43 L71 R72	D41-P69 WeakPolarHBondContact O-CG 3.49Å; P42-P69 HydrophobicContact CB-CG 4.41Å; I43-P69 HydrophobicContact CD1-CB 3.7Å; I43-P69 HydrophobicContact CD1-CG 4.45Å; I43-P69 HydrophobicContact CG1-CB 3.96Å; I43-P69 HydrophobicContact CG1-CG 4.18Å; P69-L71 PolarHBondContact O-N 3.43Å; P69-R72 WeakPolarHBondContact O-CB 3.37Å; P69-R72 PolarHBondContact O-N 3.05Å
70	G	82.8	Confident	84.3	Confident	47 Å²	47	48.7 Å²	48.7	49%	0.485	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-66.7	-14.9	174.2	0	0	0	0	0	112.9	D68	D68-G70 PolarHBondContact O-N 3.32Å; D68-G70 WeakPolarHBondContact OD1-CA 3.44Å; D68-G70 PolarHBondContact OD1-N 2.94Å
71	L	86	Confident	84.8	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.005	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-101.6	12.6	176.6	-55.5	176.7	0	0	0	113.5	I30 F31 Y34 D68 P69 W73 L91 V117 V123	I30-L71 HydrophobicContact CG2-CD2 3.49Å; I30-L71 VanDerWaalsContact CG2-CD2 3.49Å; F31-L71 HydrophobicContact CE1-CD2 4.49Å; Y34-L71 HydrophobicContact CD1-CD2 4.42Å; Y34-L71 HydrophobicContact CD2-CD2 3.69Å; Y34-L71 HydrophobicContact CD2-CG 4.33Å; Y34-L71 HydrophobicContact CE1-CD2 4.23Å; Y34-L71 HydrophobicContact CE2-CD2 3.46Å; Y34-L71 VanDerWaalsContact CE2-CD2 3.46Å; Y34-L71 HydrophobicContact CE2-CG 3.76Å; Y34-L71 HydrophobicContact CG-CD2 4.16Å; D68-L71 HydrophobicContact CB-CD1 3.84Å; D68-L71 HydrophobicContact CB-CG 4.06Å; D68-L71 PolarHBondContact O-N 3.09Å; D68-L71 VanDerWaalsContact O-N 3.12Å; P69-L71 PolarHBondContact O-N 3.43Å; L71-W73 VanDerWaalsContact O-CE3 3.22Å; L71-W73 WeakPolarHBondContact O-CZ3 3.23Å; L71-L91 HydrophobicContact CD1-CD2 3.76Å; L71-L91 HydrophobicContact CD2-CD2 4.04Å; L71-V117 HydrophobicContact CB-CG1 3.92Å; L71-V117 HydrophobicContact CD1-CG1 4.06Å; L71-V117 HydrophobicContact CD1-CG2 4.47Å; L71-V123 HydrophobicContact CD1-CG2 3.47Å; L71-V123 VanDerWaalsContact CD1-CG2 3.47Å
72	R	86.8	Confident	85.4	Confident	116 Å²	116	46 Å²	46	44%	0.438	26%	0.257	S	S	.	.			trans	-76	138.4	178.4	-77.6	172.6	174.1	171.9	-0.2	112.4	P69 D120	P69-R72 WeakPolarHBondContact O-CB 3.37Å; P69-R72 PolarHBondContact O-N 3.05Å; R72-D120 VanDerWaalsContact CG-C 3.47Å; R72-D120 WeakPolarHBondContact CG-O 3.44Å; R72-D120 PolarHBondContact NE-O 3.12Å; R72-D120 PolarHBondContact NH2-O 3.26Å
73	W	88	Confident	85.7	Confident	15 Å²	15	49.7 Å²	49.7	6%	0.057	27%	0.274	C	S	.	.			trans	-140.7	156	166.8	72.7	94.4	0	0	0	111.4	I26 I30 L71 P75 F78 V81 I84 V117 S119	I26-W73 HydrophobicContact CG2-CD2 4.02Å; I26-W73 HydrophobicContact CG2-CE3 4.27Å; I26-W73 HydrophobicContact CG2-CG 4.29Å; I30-W73 HydrophobicContact CD1-CD2 4.28Å; I30-W73 HydrophobicContact CD1-CE3 3.52Å; I30-W73 HydrophobicContact CD1-CZ3 4.03Å; L71-W73 VanDerWaalsContact O-CE3 3.22Å; L71-W73 WeakPolarHBondContact O-CZ3 3.23Å; W73-P75 WeakPolarHBondContact O-CD 3.4Å; W73-F78 HydrophobicContact CB-CE2 4.32Å; W73-F78 AromaticContact CD1-CD2 3.84Å; W73-V81 PolarHBondContact NE1-O 3.21Å; W73-I84 HydrophobicContact CH2-CB 4.45Å; W73-I84 HydrophobicContact CH2-CD1 4.29Å; W73-I84 HydrophobicContact CH2-CG1 3.84Å; W73-I84 HydrophobicContact CH2-CG2 4.16Å; W73-I84 HydrophobicContact CZ2-CG2 4.06Å; W73-I84 HydrophobicContact CZ3-CD1 4.26Å; W73-I84 HydrophobicContact CZ3-CG1 4.22Å; W73-V117 HydrophobicContact CH2-CG1 4.49Å; W73-V117 HydrophobicContact CZ3-CG1 3.96Å; W73-S119 PolarHBondContact N-O 2.81Å; W73-S119 VanDerWaalsContact O-O 3.13Å
74	N	87	Confident	85.8	Confident	78 Å²	78	48.9 Å²	48.9	42%	0.417	27%	0.27	S	S	.	.			trans	-85	114.5	175.4	177.9	9.2	0	0	0	110.4	A76 E77 F78	N74-A76 PolarHBondContact O-N 3.21Å; N74-A76 WeakPolarHBondContact OD1-CB 3.07Å; N74-A76 PolarHBondContact OD1-N 3.38Å; N74-E77 HydrophobicContact CB-CG 4.35Å; N74-E77 WeakPolarHBondContact CB-OE1 3.2Å; N74-E77 PolarHBondContact ND2-OE1 3.04Å; N74-E77 PolarHBondContact O-N 3.41Å; N74-F78 WeakPolarHBondContact O-CD2 3.45Å
75	P	85.7	Confident	85.7	Confident	28 Å²	28	56.6 Å²	56.6	18%	0.182	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-57.8	-27.4	-178.7	-26.7	36.5	0	0	0	113.9	W73 E77 F78 M80 T82 S119	W73-P75 WeakPolarHBondContact O-CD 3.4Å; P75-E77 PolarHBondContact O-N 2.92Å; P75-F78 CarbonylContact O-C 3.56Å; P75-F78 PolarHBondContact O-N 2.97Å; P75-M80 VanDerWaalsContact O-CA 3.28Å; P75-M80 WeakPolarHBondContact O-CA 3.29Å; P75-M80 PolarHBondContact O-N 3.01Å; P75-T82 HydrophobicContact CB-CG2 4.2Å; P75-T82 HydrophobicContact CG-CG2 4.12Å; P75-S119 WeakPolarHBondContact CG-OG 3.49Å
76	A	84.8	Confident	85.6	Confident	71 Å²	71	55.8 Å²	55.8	59%	0.587	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-65.8	-18.9	179.6	0	0	0	0	0	113.8	N74	N74-A76 PolarHBondContact O-N 3.21Å; N74-A76 WeakPolarHBondContact OD1-CB 3.07Å; N74-A76 PolarHBondContact OD1-N 3.38Å
77	E	82.6	Confident	85.4	Confident	112 Å²	112	56.8 Å²	56.8	52%	0.523	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-92.9	-7.4	179.8	-68.8	169.1	-133.9	0	0	113.3	K25 N74 P75	K25-E77 PolarHBondContact NZ-O 3.48Å; N74-E77 HydrophobicContact CB-CG 4.35Å; N74-E77 WeakPolarHBondContact CB-OE1 3.2Å; N74-E77 PolarHBondContact ND2-OE1 3.04Å; N74-E77 PolarHBondContact O-N 3.41Å; P75-E77 PolarHBondContact O-N 2.92Å
78	F	82.5	Confident	85.2	Confident	7 Å²	7	53.4 Å²	53.4	3%	0.031	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-138.4	53.1	-174.7	-55	-92.1	0	0	0	110.6	K25 I26 H29 W73 N74 P75 M80 V81	K25-F78 HydrophobicContact CB-CD1 4.48Å; K25-F78 HydrophobicContact CB-CE1 4.45Å; K25-F78 HydrophobicContact CD-CD1 3.84Å; K25-F78 HydrophobicContact CD-CE1 3.78Å; K25-F78 HydrophobicContact CG-CD1 4.25Å; K25-F78 HydrophobicContact CG-CE1 3.91Å; I26-F78 HydrophobicContact CB-CD1 4.35Å; I26-F78 HydrophobicContact CD1-CB 3.83Å; I26-F78 HydrophobicContact CD1-CD1 4.33Å; I26-F78 HydrophobicContact CD1-CG 4.16Å; I26-F78 HydrophobicContact CG1-CB 3.74Å; I26-F78 HydrophobicContact CG1-CD1 3.3Å; I26-F78 HydrophobicContact CG1-CD2 4.23Å; I26-F78 HydrophobicContact CG1-CE1 3.9Å; I26-F78 HydrophobicContact CG1-CG 3.5Å; H29-F78 HydrophobicContact CB-CZ 4.33Å; H29-F78 AromaticContact CD2-CZ 3.64Å; W73-F78 HydrophobicContact CB-CE2 4.32Å; W73-F78 AromaticContact CD1-CD2 3.84Å; N74-F78 WeakPolarHBondContact O-CD2 3.45Å; P75-F78 CarbonylContact O-C 3.56Å; P75-F78 PolarHBondContact O-N 2.97Å; F78-M80 PolarHBondContact O-N 2.91Å; F78-V81 WeakPolarHBondContact O-CB 3.38Å; F78-V81 WeakPolarHBondContact O-CG2 3.33Å; F78-V81 PolarHBondContact O-N 3.28Å
79	N	79	Confident	85	Confident	121 Å²	121	59.6 Å²	59.6	65%	0.647	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	34.1	172.5	-71.5	-27.3	0	0	0	115.9	D22 V81	D22-N79 VanDerWaalsContact CG-ND2 3.32Å; D22-N79 PolarHBondContact OD1-ND2 3.29Å; D22-N79 PolarHBondContact OD2-ND2 2.9Å; N79-V81 VanDerWaalsContact C-N 3.28Å; N79-V81 PolarHBondContact O-N 2.99Å
80	M	82	Confident	85	Confident	132 Å²	132	63.6 Å²	63.6	65%	0.65	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.1	23.7	-177.6	-55.2	-63.6	-63.5	0	0	114.8	P75 F78 T82	P75-M80 VanDerWaalsContact O-CA 3.28Å; P75-M80 WeakPolarHBondContact O-CA 3.29Å; P75-M80 PolarHBondContact O-N 3.01Å; F78-M80 PolarHBondContact O-N 2.91Å; M80-T82 PolarHBondContact O-N 3.28Å
81	V	82.1	Confident	85.2	Confident	31 Å²	31	61.6 Å²	61.6	19%	0.188	31%	0.305	C	S	.	.			trans	-68.7	111.6	169.2	176.1	0	0	0	0	109.3	I26 W73 F78 N79 E83 I84	I26-V81 HydrophobicContact CD1-CB 3.87Å; I26-V81 HydrophobicContact CD1-CG1 3.61Å; W73-V81 PolarHBondContact NE1-O 3.21Å; F78-V81 WeakPolarHBondContact O-CB 3.38Å; F78-V81 WeakPolarHBondContact O-CG2 3.33Å; F78-V81 PolarHBondContact O-N 3.28Å; N79-V81 VanDerWaalsContact C-N 3.28Å; N79-V81 PolarHBondContact O-N 2.99Å; V81-E83 VanDerWaalsContact CG1-O 3.29Å; V81-E83 WeakPolarHBondContact CG1-O 3.26Å; V81-I84 HydrophobicContact CG1-CG2 4.14Å
82	T	86.7	Confident	85.2	Confident	74 Å²	74	61.8 Å²	61.8	45%	0.454	31%	0.306	S	S	.	.			trans	-99.8	-10.4	-179.6	55.1	0	0	0	0	113.9	P75 M80 E118 S119	P75-T82 HydrophobicContact CB-CG2 4.2Å; P75-T82 HydrophobicContact CG-CG2 4.12Å; M80-T82 PolarHBondContact O-N 3.28Å; T82-E118 WeakPolarHBondContact O-CA 3.4Å; T82-S119 PolarHBondContact O-N 2.84Å
83	E	88.4	Confident	85	Confident	78 Å²	78	60.6 Å²	60.6	36%	0.364	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	143.7	178.5	61.8	177.6	-102	0	0	111.7	V81 K116 V117	V81-E83 VanDerWaalsContact CG1-O 3.29Å; V81-E83 WeakPolarHBondContact CG1-O 3.26Å; E83-K116 WeakPolarHBondContact OE1-CE 3.3Å; E83-K116 IonicContact OE1-NZ 3.33Å; E83-K116 WeakPolarHBondContact OE2-CE 3.33Å; E83-K116 IonicContact OE2-NZ 3.59Å; E83-K116 PolarHBondContact OE2-NZ 2.89Å; E83-V117 WeakPolarHBondContact CA-O 3.46Å
84	I	88.8	Confident	84.7	Confident	3 Å²	3	60.3 Å²	60.3	2%	0.015	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	167.7	168.5	66.4	174.5	0	0	0	109.8	I26 I30 W73 V81 V117	I26-I84 HydrophobicContact CB-CG2 4.49Å; I26-I84 HydrophobicContact CD1-CG2 3.9Å; I26-I84 HydrophobicContact CG2-CD1 3.95Å; I26-I84 HydrophobicContact CG2-CG2 4.16Å; I30-I84 HydrophobicContact CD1-CD1 4.23Å; W73-I84 HydrophobicContact CH2-CB 4.45Å; W73-I84 HydrophobicContact CH2-CD1 4.29Å; W73-I84 HydrophobicContact CH2-CG1 3.84Å; W73-I84 HydrophobicContact CH2-CG2 4.16Å; W73-I84 HydrophobicContact CZ2-CG2 4.06Å; W73-I84 HydrophobicContact CZ3-CD1 4.26Å; W73-I84 HydrophobicContact CZ3-CG1 4.22Å; V81-I84 HydrophobicContact CG1-CG2 4.14Å; I84-V117 HydrophobicContact CG1-CB 3.93Å; I84-V117 PolarHBondContact N-O 3.41Å; I84-V117 PolarHBondContact O-N 2.88Å
85	R	87.4	Confident	84.3	Confident	164 Å²	164	58.2 Å²	58.2	62%	0.619	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.7	106.7	174.5	-65.6	-179.2	-171.9	148.7	7.9	110.9	Y27 N114 A115	Y27-R85 PolarHBondContact OH-O 3.27Å; R85-N114 HydrophobicContact CB-CB 4.5Å; R85-A115 CarbonylContact C-O 3.57Å; R85-A115 WeakPolarHBondContact CA-O 3.26Å
86	A	87.1	Confident	84.1	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	142.3	-177.8	0	0	0	0	0	112.2	Y27 F31 V88 L91 N114 A115 V117	Y27-A86 WeakPolarHBondContact OH-CA 3.44Å; F31-A86 HydrophobicContact CE2-CB 4.43Å; F31-A86 HydrophobicContact CZ-CB 3.98Å; A86-V88 PolarHBondContact O-N 3.37Å; A86-L91 HydrophobicContact CB-CD1 4.18Å; A86-L91 HydrophobicContact CB-CD2 4.06Å; A86-L91 HydrophobicContact CB-CG 4.31Å; A86-N114 CarbonylContact O-C 3.5Å; A86-N114 VanDerWaalsContact O-CA 3.29Å; A86-N114 WeakPolarHBondContact O-CA 3.45Å; A86-N114 WeakPolarHBondContact O-CB 3.31Å; A86-A115 PolarHBondContact N-O 3.36Å; A86-A115 PolarHBondContact O-N 3.06Å; A86-V117 HydrophobicContact CB-CG2 3.97Å
87	P	87.1	Confident	83.7	Confident	24 Å²	24	55.3 Å²	55.3	16%	0.156	27%	0.267	C	S	.	.			trans	-70.1	125.1	171.6	30	-34.1	0	0	0	109.7	Y27 H89 K90	Y27-P87 VanDerWaalsContact OH-CD 3.27Å; Y27-P87 WeakPolarHBondContact OH-CD 3.41Å; P87-H89 PolarHBondContact O-N 2.96Å; P87-K90 HydrophobicContact CG-CB 4.48Å; P87-K90 HydrophobicContact CG-CD 4.1Å; P87-K90 HydrophobicContact CG-CG 4.16Å; P87-K90 PolarHBondContact O-N 2.83Å
88	V	83.3	Confident	83.7	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.006	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-58.5	-29	-168.3	66.3	0	0	0	0	114.3	A86 K90 L91 Y112 W125	A86-V88 PolarHBondContact O-N 3.37Å; V88-K90 PolarHBondContact O-N 3.07Å; V88-L91 PolarHBondContact O-N 3.06Å; V88-Y112 HydrophobicContact CG1-CD1 3.9Å; V88-W125 HydrophobicContact CG1-CZ2 4.05Å; V88-W125 HydrophobicContact CG2-CD2 3.94Å; V88-W125 HydrophobicContact CG2-CG 4.14Å; V88-W125 HydrophobicContact CG2-CZ2 4.15Å
89	H	82.1	Confident	83.4	Confident	134 Å²	134	52.2 Å²	52.2	62%	0.62	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-66.5	-5.2	176.8	67.9	-107.1	0	0	0	114.9	P87	P87-H89 PolarHBondContact O-N 2.96Å
90	K	84.3	Confident	83.5	Confident	98 Å²	98	48 Å²	48	43%	0.426	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-102	-3.9	170.4	-68.9	-165.7	174.9	-169.5	0	113.6	F31 Y34 S36 P87 V88	F31-K90 HydrophobicContact CD1-CB 4.27Å; F31-K90 HydrophobicContact CE1-CB 3.89Å; F31-K90 WeakPolarHBondContact CE1-O 3.21Å; Y34-K90 WeakPolarHBondContact CE1-O 3.21Å; S36-K90 WeakPolarHBondContact CB-O 3.26Å; P87-K90 HydrophobicContact CG-CB 4.48Å; P87-K90 HydrophobicContact CG-CD 4.1Å; P87-K90 HydrophobicContact CG-CG 4.16Å; P87-K90 PolarHBondContact O-N 2.83Å; V88-K90 PolarHBondContact O-N 3.07Å
91	L	86.6	Confident	83.1	Confident	5 Å²	5	42.2 Å²	42.2	3%	0.026	20%	0.204	C	C	.	.	S	Bend	trans	-103.3	155.1	177.7	-55.5	179.4	0	0	0	109	F31 L71 A86 V88 A115 V117 V123	F31-L91 HydrophobicContact CE1-CD2 3.87Å; F31-L91 HydrophobicContact CZ-CD2 3.77Å; L71-L91 HydrophobicContact CD1-CD2 3.76Å; L71-L91 HydrophobicContact CD2-CD2 4.04Å; A86-L91 HydrophobicContact CB-CD1 4.18Å; A86-L91 HydrophobicContact CB-CD2 4.06Å; A86-L91 HydrophobicContact CB-CG 4.31Å; V88-L91 PolarHBondContact O-N 3.06Å; L91-A115 HydrophobicContact CD1-CB 3.67Å; L91-V117 HydrophobicContact CD1-CG2 4.24Å; L91-V117 HydrophobicContact CD2-CG2 4.5Å; L91-V123 HydrophobicContact CD1-CG1 3.95Å
92	W	87.4	Confident	82.4	Confident	6 Å²	6	41.9 Å²	41.9	2%	0.023	20%	0.203	C	C	.	.			trans	-61.1	143.6	157.6	177.4	86.8	0	0	0	109.3	Y34 S36 V38 L39 P40 V50 V52 W66 P94 Y158	Y34-W92 PolarHBondContact OH-N 2.91Å; S36-W92 WeakPolarHBondContact O-CA 3.43Å; V38-W92 WeakPolarHBondContact O-CB 3.38Å; V38-W92 VanDerWaalsContact O-CG 3.26Å; L39-W92 HydrophobicContact CD1-CH2 3.93Å; L39-W92 HydrophobicContact CD1-CZ2 3.42Å; L39-W92 VanDerWaalsContact CD1-CZ2 3.42Å; P40-W92 VanDerWaalsContact CD-CE3 3.43Å; P40-W92 HydrophobicContact CG-CB 4.02Å; P40-W92 HydrophobicContact CG-CD2 3.83Å; P40-W92 HydrophobicContact CG-CE3 3.6Å; P40-W92 HydrophobicContact CG-CG 4.04Å; P40-W92 HydrophobicContact CG-CZ3 4.25Å; V50-W92 HydrophobicContact CG1-CH2 3.91Å; V50-W92 HydrophobicContact CG1-CZ3 3.94Å; V52-W92 HydrophobicContact CG2-CH2 4.5Å; W66-W92 HydrophobicContact CD2-CZ3 4.5Å; W66-W92 HydrophobicContact CG-CZ3 4.24Å; W66-W92 WeakPolarHBondContact CZ2-O 3.49Å; W66-W92 AromaticContact NE1-CE3 3.8Å; W92-P94 HydrophobicContact CH2-CB 3.61Å; W92-P94 HydrophobicContact CH2-CG 4.37Å; W92-P94 HydrophobicContact CZ2-CB 4.28Å; W92-P94 HydrophobicContact CZ3-CB 3.95Å; W92-P94 HydrophobicContact CZ3-CG 4.2Å; W92-Y158 AromaticContact CZ2-CE2 3.9Å; W92-Y158 HydrophobicContact CZ2-CE2 3.9Å; W92-Y158 PolarHBondContact NE1-OH 3.4Å
93	Q	82.6	Confident	81.1	Confident	91 Å²	91	39.4 Å²	39.4	43%	0.425	19%	0.19	S	C	.	.			trans	-131.3	132.1	178	60.1	179.6	13.6	0	0	109.7
94	P	82.4	Confident	79.7	Confident	9 Å²	9	40.4 Å²	40.4	6%	0.058	20%	0.197	C	C	.	.			trans	-67.7	140.1	173.4	27.5	-33.2	0	0	0	110.4	V52 V64 W66 W92 I96	V52-P94 HydrophobicContact CG1-CB 4.08Å; V52-P94 HydrophobicContact CG1-CG 3.88Å; V52-P94 HydrophobicContact CG2-CB 3.8Å; V52-P94 HydrophobicContact CG2-CG 4.17Å; V64-P94 HydrophobicContact CG1-CG 3.88Å; W66-P94 HydrophobicContact CE3-CG 4.3Å; W66-P94 HydrophobicContact CZ3-CG 4.43Å; W92-P94 HydrophobicContact CH2-CB 3.61Å; W92-P94 HydrophobicContact CH2-CG 4.37Å; W92-P94 HydrophobicContact CZ2-CB 4.28Å; W92-P94 HydrophobicContact CZ3-CB 3.95Å; W92-P94 HydrophobicContact CZ3-CG 4.2Å; P94-I96 HydrophobicContact CB-CD1 4.49Å; P94-I96 HydrophobicContact CB-CG1 4.25Å; P94-I96 HydrophobicContact CG-CD1 4.08Å; P94-I96 HydrophobicContact CG-CG1 4.29Å; P94-I96 PolarHBondContact O-N 2.97Å
95	D	78	Confident	77.9	Confident	33 Å²	33	41 Å²	41	18%	0.176	20%	0.204	C	C	.	.			trans	-78.2	119.7	170.3	78.2	-56.3	0	0	0	109.8	S155 S156 A157 Y158	D95-S155 WeakPolarHBondContact OD1-CB 3.01Å; D95-S155 PolarHBondContact OD1-OG 3.26Å; D95-S155 PolarHBondContact OD2-OG 2.99Å; D95-S156 PolarHBondContact OD2-N 3.06Å; D95-A157 HydrophobicContact CB-CB 4.41Å; D95-A157 WeakPolarHBondContact OD2-CB 2.99Å; D95-A157 PolarHBondContact OD2-N 3.5Å; D95-Y158 VanDerWaalsContact OD1-CD2 3.24Å; D95-Y158 WeakPolarHBondContact OD1-CD2 3.5Å
96	I	80.6	Confident	76.4	Confident	32 Å²	32	38.1 Å²	38.1	16%	0.164	20%	0.201	C	C	.	.			trans	-123.2	91.5	-178.3	-48.6	-175.3	0	0	0	108.3	V52 F54 V64 P94 F153 F165	V52-I96 HydrophobicContact CG1-CD1 3.99Å; F54-I96 HydrophobicContact CD2-CD1 3.67Å; F54-I96 HydrophobicContact CD2-CG2 4.16Å; F54-I96 HydrophobicContact CE2-CD1 3.91Å; F54-I96 HydrophobicContact CE2-CG2 3.67Å; F54-I96 HydrophobicContact CZ-CG2 4.24Å; V64-I96 HydrophobicContact CG1-CD1 3.65Å; V64-I96 HydrophobicContact CG2-CD1 3.97Å; P94-I96 HydrophobicContact CB-CD1 4.49Å; P94-I96 HydrophobicContact CB-CG1 4.25Å; P94-I96 HydrophobicContact CG-CD1 4.08Å; P94-I96 HydrophobicContact CG-CG1 4.29Å; P94-I96 PolarHBondContact O-N 2.97Å; I96-F153 HydrophobicContact CG2-CB 3.98Å; I96-F153 HydrophobicContact CG2-CD1 4.13Å; I96-F153 HydrophobicContact CG2-CG 4.35Å; I96-F165 HydrophobicContact CB-CE1 4.42Å; I96-F165 HydrophobicContact CD1-CE1 4Å; I96-F165 HydrophobicContact CG1-CE1 3.89Å; I96-F165 HydrophobicContact CG1-CZ 4.29Å; I96-F165 HydrophobicContact CG2-CE1 3.87Å; I96-F165 HydrophobicContact CG2-CZ 4.29Å
97	V	77.8	Confident	75	Confident	6 Å²	6	41.4 Å²	41.4	4%	0.036	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	130.6	-173.1	-167.3	0	0	0	0	109.5	L99 Y107 F153 G154 F578	V97-L99 HydrophobicContact CB-CD2 4.24Å; V97-L99 HydrophobicContact CG1-CD2 4.37Å; V97-L99 PolarHBondContact O-N 3.4Å; V97-L99 VanDerWaalsContact O-N 3.09Å; V97-Y107 HydrophobicContact CG1-CE1 4.23Å; V97-F153 WeakPolarHBondContact O-CA 3.38Å; V97-G154 PolarHBondContact N-O 3.14Å; V97-G154 PolarHBondContact O-N 2.69Å; V97-F578 HydrophobicContact CB-CZ 4.48Å; V97-F578 HydrophobicContact CG1-CD1 4.4Å; V97-F578 HydrophobicContact CG1-CE1 4.13Å; V97-F578 HydrophobicContact CG1-CZ 4.24Å; V97-F578 HydrophobicContact CG2-CE1 3.63Å; V97-F578 HydrophobicContact CG2-CE2 4.32Å; V97-F578 HydrophobicContact CG2-CZ 3.45Å; V97-F578 VanDerWaalsContact CG2-CZ 3.45Å
98	L	80.7	Confident	73.4	Confident	4 Å²	4	44.7 Å²	44.7	2%	0.021	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	94.6	167.4	-178.9	67.9	0	0	0	108.5	N100 N101 Y131 L151 F153	L98-N100 WeakPolarHBondContact CD1-OD1 3.37Å; L98-N100 PolarHBondContact O-N 2.78Å; L98-N100 VanDerWaalsContact O-N 3.15Å; L98-N101 HydrophobicContact CD2-CB 4.35Å; L98-N101 PolarHBondContact O-N 3.37Å; L98-N101 VanDerWaalsContact O-N 3.11Å; L98-Y131 HydrophobicContact CB-CD1 4.45Å; L98-Y131 HydrophobicContact CD2-CD1 4.37Å; L98-L151 HydrophobicContact CD1-CB 4.28Å; L98-L151 HydrophobicContact CD1-CD2 4.17Å; L98-F153 HydrophobicContact CB-CD1 4.31Å; L98-F153 HydrophobicContact CB-CE1 4.18Å; L98-F153 HydrophobicContact CD1-CD1 4.2Å; L98-F153 HydrophobicContact CD1-CE1 3.89Å; L98-F153 HydrophobicContact CD1-CZ 4.17Å
99	L	77.1	Confident	72	Confident	51 Å²	51	46.7 Å²	46.7	27%	0.267	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-24.8	-173.8	-60.8	-178.4	0	0	0	112.8	V97 V152 K200	V97-L99 HydrophobicContact CB-CD2 4.24Å; V97-L99 HydrophobicContact CG1-CD2 4.37Å; V97-L99 PolarHBondContact O-N 3.4Å; V97-L99 VanDerWaalsContact O-N 3.09Å; L99-V152 HydrophobicContact CB-CB 4.49Å; L99-V152 HydrophobicContact CB-CG1 4.31Å; L99-V152 HydrophobicContact CD1-CG1 4.16Å; L99-V152 PolarHBondContact N-O 3.36Å; L99-K200 HydrophobicContact CD1-CD 3.73Å; L99-K200 HydrophobicContact CD1-CG 3.86Å
100	N	80.8	Confident	70.7	Confident	31 Å²	31	43.9 Å²	43.9	17%	0.166	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.6	44.9	173.6	73.5	-48.4	0	0	0	113.1	L98 S133 A134 L150 V152	L98-N100 WeakPolarHBondContact CD1-OD1 3.37Å; L98-N100 PolarHBondContact O-N 2.78Å; L98-N100 VanDerWaalsContact O-N 3.15Å; N100-S133 CarbonylContact O-C 3.52Å; N100-S133 VanDerWaalsContact O-CA 3.26Å; N100-S133 WeakPolarHBondContact O-CA 3.44Å; N100-A134 PolarHBondContact ND2-O 2.98Å; N100-A134 VanDerWaalsContact ND2-O 3.16Å; N100-A134 PolarHBondContact O-N 3.11Å; N100-L150 PolarHBondContact ND2-O 3.44Å; N100-V152 PolarHBondContact OD1-N 3.37Å
101	N	73.7	Confident	69.6	Low	12 Å²	12	46 Å²	46	6%	0.064	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-58.6	152.9	175.3	-164.1	12.5	0	0	0	112.8	L98 Y107 K132	L98-N101 HydrophobicContact CD2-CB 4.35Å; L98-N101 PolarHBondContact O-N 3.37Å; L98-N101 VanDerWaalsContact O-N 3.11Å; N101-Y107 HydrophobicContact CB-CE1 4.29Å; N101-Y107 VanDerWaalsContact ND2-CE1 3.35Å; N101-Y107 WeakPolarHBondContact ND2-CE1 3.46Å; N101-Y107 WeakPolarHBondContact ND2-CE2 3.44Å; N101-Y107 PolarHBondContact ND2-OH 2.97Å; N101-K132 PolarHBondContact OD1-O 2.95Å
102	S	68	Low	68.7	Low	24 Å²	24	53 Å²	53	17%	0.168	28%	0.275	C	S	.	.			trans	-91.7	171.1	177.6	71.4	0	0	0	0	112.8	D104 K132 I597	S102-D104 PolarHBondContact O-N 3.41Å; S102-K132 WeakPolarHBondContact CB-O 3.46Å; S102-K132 PolarHBondContact N-O 3.07Å; S102-K132 WeakPolarHBondContact OG-CB 3.49Å; S102-K132 PolarHBondContact OG-O 2.83Å; S102-I597 WeakPolarHBondContact O-CD1 3.48Å
103	A	58.1	Low	68.1	Low	22 Å²	22	53.6 Å²	53.6	18%	0.182	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-7.6	-167.4	0	0	0	0	0	117.4	G105 I515 I597	A103-G105 VanDerWaalsContact C-N 3.32Å; A103-G105 PolarHBondContact O-N 2.91Å; A103-I515 HydrophobicContact CB-CD1 3.67Å; A103-I515 HydrophobicContact CB-CG2 4.03Å; A103-I597 HydrophobicContact CB-CG2 4.46Å
104	D	59	Low	68.3	Low	98 Å²	98	53.8 Å²	53.8	52%	0.524	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-6	-173.1	-76.3	-3.6	0	0	0	113.8	S102 N106 K132	S102-D104 PolarHBondContact O-N 3.41Å; D104-N106 PolarHBondContact O-N 3.41Å; D104-N106 PolarHBondContact O-OD1 3.13Å; D104-K132 HydrophobicContact CB-CD 4.08Å; D104-K132 IonicContact OD2-NZ 3.52Å; D104-K132 PolarHBondContact OD2-NZ 2.85Å
105	G	52.9	Low	68.6	Low	16 Å²	16	53.4 Å²	53.4	17%	0.165	28%	0.281	C	S	.	.			trans	73.1	-32	166.2	0	0	0	0	0	117.5	A103 Y107	A103-G105 VanDerWaalsContact C-N 3.32Å; A103-G105 PolarHBondContact O-N 2.91Å; G105-Y107 WeakPolarHBondContact O-CD2 3.46Å; G105-Y107 WeakPolarHBondContact O-CE2 3.43Å; G105-Y107 PolarHBondContact O-N 2.96Å
106	N	55.5	Low	69.2	Low	103 Å²	103	54.1 Å²	54.1	55%	0.551	28%	0.283	S	S	*	.			trans	-71.2	115.1	-176.5	-76.2	47	0	0	0	112.8	D104 D108	D104-N106 PolarHBondContact O-N 3.41Å; D104-N106 PolarHBondContact O-OD1 3.13Å; N106-D108 WeakPolarHBondContact CB-OD2 3.27Å; N106-D108 PolarHBondContact ND2-OD2 2.93Å; N106-D108 PolarHBondContact O-N 2.89Å
107	Y	56.6	Low	69.7	Low	69 Å²	69	52.6 Å²	52.6	27%	0.271	28%	0.275	S	S	.	.			trans	-89.3	43.4	169.7	-66.3	-97.1	0	0	0	111.4	V97 N101 G105 V109 S577 F578	V97-Y107 HydrophobicContact CG1-CE1 4.23Å; N101-Y107 HydrophobicContact CB-CE1 4.29Å; N101-Y107 VanDerWaalsContact ND2-CE1 3.35Å; N101-Y107 WeakPolarHBondContact ND2-CE1 3.46Å; N101-Y107 WeakPolarHBondContact ND2-CE2 3.44Å; N101-Y107 PolarHBondContact ND2-OH 2.97Å; G105-Y107 WeakPolarHBondContact O-CD2 3.46Å; G105-Y107 WeakPolarHBondContact O-CE2 3.43Å; G105-Y107 PolarHBondContact O-N 2.96Å; Y107-V109 PolarHBondContact O-N 3.36Å; Y107-S577 WeakPolarHBondContact CD2-O 2.76Å; Y107-S577 VanDerWaalsContact CE2-O 3.28Å; Y107-S577 WeakPolarHBondContact CE2-O 3.39Å; Y107-F578 AromaticContact CD1-CD2 3.92Å; Y107-F578 HydrophobicContact CD1-CD2 3.92Å; Y107-F578 HydrophobicContact CD1-CE2 4.37Å; Y107-F578 HydrophobicContact CD2-CB 4.25Å; Y107-F578 AromaticContact CD2-CD2 3.98Å; Y107-F578 HydrophobicContact CD2-CD2 3.98Å; Y107-F578 HydrophobicContact CE1-CD2 4Å; Y107-F578 HydrophobicContact CE1-CG 4.41Å; Y107-F578 HydrophobicContact CE2-CB 3.66Å; Y107-F578 HydrophobicContact CE2-CD2 4.08Å; Y107-F578 HydrophobicContact CE2-CG 4.25Å; Y107-F578 AromaticContact CG-CD2 3.91Å; Y107-F578 HydrophobicContact CG-CD2 3.91Å
108	D	53	Low	70.3	Confident	94 Å²	94	55.7 Å²	55.7	50%	0.503	29%	0.289	S	S	.	.			trans	-74.3	94.4	-169.4	-67.8	-22.6	0	0	0	112.4	N106 S110	N106-D108 WeakPolarHBondContact CB-OD2 3.27Å; N106-D108 PolarHBondContact ND2-OD2 2.93Å; N106-D108 PolarHBondContact O-N 2.89Å; D108-S110 PolarHBondContact O-N 2.96Å
109	V	54.4	Low	70.7	Confident	42 Å²	42	56.7 Å²	56.7	26%	0.255	30%	0.297	S	S	.	.	B	Isolated β-bridge	trans	-65.5	89.8	151.5	178.8	0	0	0	0	106.9	Y107 F111 W125 P127	Y107-V109 PolarHBondContact O-N 3.36Å; V109-F111 PolarHBondContact O-N 2.9Å; V109-W125 HydrophobicContact CG1-CZ2 4.44Å; V109-P127 HydrophobicContact CG1-CB 3.78Å
110	S	54.8	Low	71.2	Confident	76 Å²	76	57.9 Å²	57.9	53%	0.531	30%	0.303	S	S	.	.			trans	-59.2	-17.4	-164.2	62	0	0	0	0	115.7	D108 P128	D108-S110 PolarHBondContact O-N 2.96Å; S110-P128 PolarHBondContact N-O 3.31Å; S110-P128 PolarHBondContact OG-O 2.92Å
111	F	61.3	Low	71.5	Confident	141 Å²	141	56.4 Å²	56.4	62%	0.618	30%	0.295	S	S	*	.	S	Bend	trans	-155	123.7	177.2	-177.1	-97.1	0	0	0	110.3	V109 S113 P128	V109-F111 PolarHBondContact O-N 2.9Å; F111-S113 PolarHBondContact O-N 3.05Å; F111-P128 HydrophobicContact CB-CG 3.8Å; F111-P128 WeakPolarHBondContact O-CD 3.44Å
112	Y	67.2	Low	72.2	Confident	153 Å²	153	57.1 Å²	57.1	60%	0.6	30%	0.3	S	S	*	.			trans	-74.1	90.6	172.3	-68.3	-83.7	0	0	0	110.2	V88	V88-Y112 HydrophobicContact CG1-CD1 3.9Å
113	S	75.8	Confident	73.3	Confident	18 Å²	18	56 Å²	56	13%	0.126	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-64.9	140.5	170.2	53.7	0	0	0	0	111.1	F111 A115 W125 V126 P127	F111-S113 PolarHBondContact O-N 3.05Å; S113-A115 PolarHBondContact O-N 3.46Å; S113-W125 PolarHBondContact O-NE1 3.38Å; S113-W125 PolarHBondContact OG-NE1 3.39Å; S113-V126 PolarHBondContact OG-O 2.99Å; S113-P127 WeakPolarHBondContact OG-CA 3.49Å
114	N	86.2	Confident	74.9	Confident	95 Å²	95	56.8 Å²	56.8	51%	0.508	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-58.2	137.3	164.5	-69.6	4.1	0	0	0	109.4	R85 A86	R85-N114 HydrophobicContact CB-CB 4.5Å; A86-N114 CarbonylContact O-C 3.5Å; A86-N114 VanDerWaalsContact O-CA 3.29Å; A86-N114 WeakPolarHBondContact O-CA 3.45Å; A86-N114 WeakPolarHBondContact O-CB 3.31Å
115	A	88.7	Confident	76.4	Confident	1 Å²	1	53 Å²	53	1%	0.008	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	148.1	170	0	0	0	0	0	109.8	R85 A86 L91 S113 V123 L124 W125	R85-A115 CarbonylContact C-O 3.57Å; R85-A115 WeakPolarHBondContact CA-O 3.26Å; A86-A115 PolarHBondContact N-O 3.36Å; A86-A115 PolarHBondContact O-N 3.06Å; L91-A115 HydrophobicContact CD1-CB 3.67Å; S113-A115 PolarHBondContact O-N 3.46Å; A115-V123 HydrophobicContact CB-CG1 3.79Å; A115-L124 WeakPolarHBondContact CA-O 3.36Å; A115-W125 HydrophobicContact CB-CB 3.98Å; A115-W125 HydrophobicContact CB-CG 4.32Å
116	K	90.6	Very high	78	Confident	48 Å²	48	54.4 Å²	54.4	21%	0.209	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	136.4	161.6	-170.8	-168.2	-174.5	-173.9	0	107.7	E83 E118 V123 L124	E83-K116 WeakPolarHBondContact OE1-CE 3.3Å; E83-K116 IonicContact OE1-NZ 3.33Å; E83-K116 WeakPolarHBondContact OE2-CE 3.33Å; E83-K116 IonicContact OE2-NZ 3.59Å; E83-K116 PolarHBondContact OE2-NZ 2.89Å; K116-E118 HydrophobicContact CD-CG 4.13Å; K116-E118 VanDerWaalsContact CE-OE1 3.24Å; K116-E118 WeakPolarHBondContact CE-OE1 3.16Å; K116-E118 HydrophobicContact CG-CG 4.49Å; K116-E118 IonicContact NZ-OE1 3.62Å; K116-E118 PolarHBondContact NZ-OE1 3.33Å; K116-V123 WeakPolarHBondContact O-CA 3.19Å; K116-L124 HydrophobicContact CB-CB 4.38Å; K116-L124 PolarHBondContact N-O 2.8Å; K116-L124 PolarHBondContact O-N 2.95Å
117	V	91	Very high	79.2	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.006	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	132.2	168.4	-170.2	0	0	0	0	107.2	L71 W73 E83 I84 A86 L91 V123	L71-V117 HydrophobicContact CB-CG1 3.92Å; L71-V117 HydrophobicContact CD1-CG1 4.06Å; L71-V117 HydrophobicContact CD1-CG2 4.47Å; W73-V117 HydrophobicContact CH2-CG1 4.49Å; W73-V117 HydrophobicContact CZ3-CG1 3.96Å; E83-V117 WeakPolarHBondContact CA-O 3.46Å; I84-V117 HydrophobicContact CG1-CB 3.93Å; I84-V117 PolarHBondContact N-O 3.41Å; I84-V117 PolarHBondContact O-N 2.88Å; A86-V117 HydrophobicContact CB-CG2 3.97Å; L91-V117 HydrophobicContact CD1-CG2 4.24Å; L91-V117 HydrophobicContact CD2-CG2 4.5Å; V117-V123 HydrophobicContact CG1-CG2 4.4Å; V117-V123 HydrophobicContact CG2-CG2 4.43Å
118	E	90.7	Very high	80.2	Confident	71 Å²	71	47.8 Å²	47.8	33%	0.332	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	154.1	175.5	-61	-171.5	179.4	0	0	110.3	T82 K116 D120 G121 T122	T82-E118 WeakPolarHBondContact O-CA 3.4Å; K116-E118 HydrophobicContact CD-CG 4.13Å; K116-E118 VanDerWaalsContact CE-OE1 3.24Å; K116-E118 WeakPolarHBondContact CE-OE1 3.16Å; K116-E118 HydrophobicContact CG-CG 4.49Å; K116-E118 IonicContact NZ-OE1 3.62Å; K116-E118 PolarHBondContact NZ-OE1 3.33Å; E118-D120 PolarHBondContact O-N 2.84Å; E118-G121 PolarHBondContact O-N 2.97Å; E118-T122 PolarHBondContact N-O 2.97Å
119	S	88.8	Confident	81.1	Confident	25 Å²	25	43.5 Å²	43.5	18%	0.175	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-16.9	-168.4	52.5	0	0	0	0	115.6	W73 P75 T82	W73-S119 PolarHBondContact N-O 2.81Å; W73-S119 VanDerWaalsContact O-O 3.13Å; P75-S119 WeakPolarHBondContact CG-OG 3.49Å; T82-S119 PolarHBondContact O-N 2.84Å
120	D	87.9	Confident	82	Confident	76 Å²	76	46 Å²	46	41%	0.406	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	1.3	173.9	71.9	-26.9	0	0	0	113.7	R72 E118 T122	R72-D120 VanDerWaalsContact CG-C 3.47Å; R72-D120 WeakPolarHBondContact CG-O 3.44Å; R72-D120 PolarHBondContact NE-O 3.12Å; R72-D120 PolarHBondContact NH2-O 3.26Å; E118-D120 PolarHBondContact O-N 2.84Å; D120-T122 VanDerWaalsContact CG-OG1 3.26Å; D120-T122 WeakPolarHBondContact OD1-CB 3.19Å; D120-T122 PolarHBondContact OD1-N 2.77Å; D120-T122 PolarHBondContact OD1-OG1 3.5Å; D120-T122 PolarHBondContact OD2-OG1 3.49Å
121	G	86.6	Confident	83	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.224	C	C	.	.	S	Bend	trans	87.5	2.6	-174.9	0	0	0	0	0	113.8	D68 E118 V123	D68-G121 PolarHBondContact N-O 2.94Å; D68-G121 VanDerWaalsContact O-CA 3.26Å; D68-G121 WeakPolarHBondContact O-CA 3.44Å; E118-G121 PolarHBondContact O-N 2.97Å; G121-V123 PolarHBondContact O-N 2.93Å
122	T	89.8	Confident	83.7	Confident	26 Å²	26	43.3 Å²	43.3	16%	0.16	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	115.7	176.9	-64.4	0	0	0	0	110.1	E118 D120	E118-T122 PolarHBondContact N-O 2.97Å; D120-T122 VanDerWaalsContact CG-OG1 3.26Å; D120-T122 WeakPolarHBondContact OD1-CB 3.19Å; D120-T122 PolarHBondContact OD1-N 2.77Å; D120-T122 PolarHBondContact OD1-OG1 3.5Å; D120-T122 PolarHBondContact OD2-OG1 3.49Å
123	V	91.2	Very high	84.2	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	136.9	171	-171.4	0	0	0	0	109.3	S65 W66 D68 L71 L91 A115 K116 V117 G121	S65-V123 WeakPolarHBondContact CA-O 3.42Å; S65-V123 VanDerWaalsContact CB-O 3.3Å; S65-V123 WeakPolarHBondContact CB-O 3.46Å; S65-V123 PolarHBondContact OG-O 3.35Å; W66-V123 HydrophobicContact CD2-CB 4Å; W66-V123 HydrophobicContact CD2-CG1 4.42Å; W66-V123 HydrophobicContact CE3-CB 4.42Å; W66-V123 HydrophobicContact CG-CB 4.49Å; W66-V123 HydrophobicContact CH2-CB 4.28Å; W66-V123 HydrophobicContact CH2-CG1 3.64Å; W66-V123 HydrophobicContact CZ2-CB 3.82Å; W66-V123 HydrophobicContact CZ2-CG1 3.46Å; W66-V123 VanDerWaalsContact CZ2-CG1 3.46Å; W66-V123 HydrophobicContact CZ2-CG2 4.18Å; W66-V123 HydrophobicContact CZ3-CG1 4.18Å; W66-V123 PolarHBondContact N-O 3.43Å; W66-V123 PolarHBondContact O-N 3.41Å; D68-V123 HydrophobicContact CB-CG2 4.31Å; L71-V123 HydrophobicContact CD1-CG2 3.47Å; L71-V123 VanDerWaalsContact CD1-CG2 3.47Å; L91-V123 HydrophobicContact CD1-CG1 3.95Å; A115-V123 HydrophobicContact CB-CG1 3.79Å; K116-V123 WeakPolarHBondContact O-CA 3.19Å; V117-V123 HydrophobicContact CG1-CG2 4.4Å; V117-V123 HydrophobicContact CG2-CG2 4.43Å; G121-V123 PolarHBondContact O-N 2.93Å
124	L	91.3	Very high	84.2	Confident	40 Å²	40	38.4 Å²	38.4	21%	0.209	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	108.4	168.9	173.6	63	0	0	0	109.1	A115 K116 V126 Y168	A115-L124 WeakPolarHBondContact CA-O 3.36Å; K116-L124 HydrophobicContact CB-CB 4.38Å; K116-L124 PolarHBondContact N-O 2.8Å; K116-L124 PolarHBondContact O-N 2.95Å; L124-V126 HydrophobicContact CD1-CG2 3.94Å; L124-V126 HydrophobicContact CG-CG2 3.97Å; L124-Y168 HydrophobicContact CD1-CE2 3.92Å
125	W	89.5	Confident	83.8	Confident	19 Å²	19	35.7 Å²	35.7	7%	0.072	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	129.5	174.7	-174.5	48.7	0	0	0	109.6	V64 W66 V88 V109 S113 A115 P127	V64-W125 HydrophobicContact CB-CE3 4.36Å; V64-W125 HydrophobicContact CG2-CE3 4.32Å; V64-W125 PolarHBondContact N-O 2.66Å; V64-W125 PolarHBondContact O-N 2.91Å; W66-W125 HydrophobicContact CH2-CB 3.95Å; W66-W125 HydrophobicContact CZ3-CB 3.9Å; V88-W125 HydrophobicContact CG1-CZ2 4.05Å; V88-W125 HydrophobicContact CG2-CD2 3.94Å; V88-W125 HydrophobicContact CG2-CG 4.14Å; V88-W125 HydrophobicContact CG2-CZ2 4.15Å; V109-W125 HydrophobicContact CG1-CZ2 4.44Å; S113-W125 PolarHBondContact O-NE1 3.38Å; S113-W125 PolarHBondContact OG-NE1 3.39Å; A115-W125 HydrophobicContact CB-CB 3.98Å; A115-W125 HydrophobicContact CB-CG 4.32Å; W125-P127 VanDerWaalsContact C-CD 3.44Å; W125-P127 HydrophobicContact CD2-CB 4.29Å; W125-P127 HydrophobicContact CD2-CG 3.83Å; W125-P127 HydrophobicContact CE3-CG 3.86Å; W125-P127 HydrophobicContact CH2-CB 4.1Å; W125-P127 HydrophobicContact CH2-CG 3.93Å; W125-P127 HydrophobicContact CZ2-CB 3.67Å; W125-P127 HydrophobicContact CZ2-CG 3.89Å; W125-P127 HydrophobicContact CZ3-CG 3.91Å; W125-P127 WeakPolarHBondContact O-CD 3.23Å
126	V	86.2	Confident	83.1	Confident	45 Å²	45	45.4 Å²	45.4	27%	0.273	23%	0.228	S	C	.	.			trans	-124.8	69.4	-177.3	-166.7	0	0	0	0	111.5	L61 V62 S113 L124	L61-V126 HydrophobicContact CB-CG1 4.17Å; L61-V126 HydrophobicContact CD1-CG1 4.49Å; L61-V126 HydrophobicContact CD2-CG1 4.34Å; V62-V126 VanDerWaalsContact O-CA 3.24Å; V62-V126 WeakPolarHBondContact O-CA 3.35Å; V62-V126 WeakPolarHBondContact O-CG1 3.2Å; S113-V126 PolarHBondContact OG-O 2.99Å; L124-V126 HydrophobicContact CD1-CG2 3.94Å; L124-V126 HydrophobicContact CG-CG2 3.97Å
127	P	82.3	Confident	82.2	Confident	3 Å²	3	46 Å²	46	2%	0.019	23%	0.232	C	C	.	.			trans	-72.6	141	-177.7	28.5	-34.1	0	0	0	112.6	V62 V109 S113 W125	V62-P127 HydrophobicContact CB-CG 4.2Å; V62-P127 PolarHBondContact N-O 3.37Å; V62-P127 VanDerWaalsContact N-O 3.15Å; V62-P127 WeakPolarHBondContact O-CD 3.34Å; V109-P127 HydrophobicContact CG1-CB 3.78Å; S113-P127 WeakPolarHBondContact OG-CA 3.49Å; W125-P127 VanDerWaalsContact C-CD 3.44Å; W125-P127 HydrophobicContact CD2-CB 4.29Å; W125-P127 HydrophobicContact CD2-CG 3.83Å; W125-P127 HydrophobicContact CE3-CG 3.86Å; W125-P127 HydrophobicContact CH2-CB 4.1Å; W125-P127 HydrophobicContact CH2-CG 3.93Å; W125-P127 HydrophobicContact CZ2-CB 3.67Å; W125-P127 HydrophobicContact CZ2-CG 3.89Å; W125-P127 HydrophobicContact CZ3-CG 3.91Å; W125-P127 WeakPolarHBondContact O-CD 3.23Å
128	P	77.2	Confident	81.4	Confident	29 Å²	29	49 Å²	49	19%	0.188	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	-81	112.9	165.2	32.2	-33.4	0	0	0	111.1	L60 L61 S110 F111	L60-P128 CarbonylContact O-C 3.59Å; L60-P128 WeakPolarHBondContact O-CA 3.32Å; L61-P128 HydrophobicContact CD2-CB 4.28Å; S110-P128 PolarHBondContact N-O 3.31Å; S110-P128 PolarHBondContact OG-O 2.92Å; F111-P128 HydrophobicContact CB-CG 3.8Å; F111-P128 WeakPolarHBondContact O-CD 3.44Å
129	A	71.2	Confident	80.7	Confident	4 Å²	4	45.7 Å²	45.7	3%	0.033	23%	0.233	C	C	.	.	B	Isolated β-bridge	trans	-127.6	142.9	-177.2	0	0	0	0	0	112.1	L60 V62 Y131	L60-A129 PolarHBondContact O-N 3.45Å; V62-A129 HydrophobicContact CG2-CB 4.02Å; A129-Y131 HydrophobicContact CB-CD2 4.48Å; A129-Y131 HydrophobicContact CB-CE1 4.28Å; A129-Y131 HydrophobicContact CB-CE2 3.94Å
130	I	74.5	Confident	80.1	Confident	96 Å²	96	47.1 Å²	47.1	49%	0.492	24%	0.237	S	C	.	.			trans	-109.4	93.4	175.7	-55.5	176.9	0	0	0	108.9	L60	L60-I130 HydrophobicContact CD1-CD1 4.44Å; L60-I130 HydrophobicContact CD1-CG1 4.06Å; L60-I130 HydrophobicContact CD2-CG1 4.07Å
131	Y	74.8	Confident	79.5	Confident	70 Å²	70	46 Å²	46	28%	0.275	23%	0.229	S	C	.	.			trans	-81.4	133.4	176.6	-63.3	-58.7	0	0	0	112.2	L56 V62 L98 A129 F153	L56-Y131 HydrophobicContact CD1-CD2 3.98Å; L56-Y131 HydrophobicContact CD1-CE2 3.84Å; V62-Y131 HydrophobicContact CG2-CE2 3.61Å; L98-Y131 HydrophobicContact CB-CD1 4.45Å; L98-Y131 HydrophobicContact CD2-CD1 4.37Å; A129-Y131 HydrophobicContact CB-CD2 4.48Å; A129-Y131 HydrophobicContact CB-CE1 4.28Å; A129-Y131 HydrophobicContact CB-CE2 3.94Å; Y131-F153 AromaticContact CD1-CE1 3.87Å; Y131-F153 HydrophobicContact CD1-CE1 3.87Å; Y131-F153 HydrophobicContact CD1-CZ 4.41Å; Y131-F153 AromaticContact CD2-CE1 3.81Å; Y131-F153 HydrophobicContact CD2-CE1 3.81Å; Y131-F153 AromaticContact CD2-CZ 3.61Å; Y131-F153 HydrophobicContact CD2-CZ 3.61Å; Y131-F153 AromaticContact CE1-CE1 3.73Å; Y131-F153 HydrophobicContact CE1-CE1 3.73Å; Y131-F153 AromaticContact CE2-CE1 3.65Å; Y131-F153 HydrophobicContact CE2-CE1 3.65Å; Y131-F153 AromaticContact CE2-CZ 3.71Å; Y131-F153 HydrophobicContact CE2-CZ 3.71Å; Y131-F153 AromaticContact CG-CE1 3.91Å; Y131-F153 HydrophobicContact CG-CE1 3.91Å; Y131-F153 AromaticContact CG-CZ 3.98Å; Y131-F153 HydrophobicContact CG-CZ 3.98Å; Y131-F153 AromaticContact CZ-CE1 3.62Å
132	K	76.2	Confident	79	Confident	90 Å²	90	46.3 Å²	46.3	39%	0.391	23%	0.231	S	C	.	.			trans	-124.3	100.3	174.9	-57.7	175	-179	174.1	0	109.7	N101 S102 D104	N101-K132 PolarHBondContact OD1-O 2.95Å; S102-K132 WeakPolarHBondContact CB-O 3.46Å; S102-K132 PolarHBondContact N-O 3.07Å; S102-K132 WeakPolarHBondContact OG-CB 3.49Å; S102-K132 PolarHBondContact OG-O 2.83Å; D104-K132 HydrophobicContact CB-CD 4.08Å; D104-K132 IonicContact OD2-NZ 3.52Å; D104-K132 PolarHBondContact OD2-NZ 2.85Å
133	S	78.7	Confident	78.3	Confident	29 Å²	29	45.1 Å²	45.1	20%	0.203	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-91.1	149.1	-179.6	58.8	0	0	0	0	114.1	N100 C135 L150 L151	N100-S133 CarbonylContact O-C 3.52Å; N100-S133 VanDerWaalsContact O-CA 3.26Å; N100-S133 WeakPolarHBondContact O-CA 3.44Å; S133-C135 PolarHBondContact O-N 2.91Å; S133-L150 WeakPolarHBondContact CB-O 3.3Å; S133-L150 PolarHBondContact OG-O 2.95Å; S133-L151 WeakPolarHBondContact OG-CD2 3.42Å
134	A	75.5	Confident	77.7	Confident	38 Å²	38	47.2 Å²	47.2	31%	0.314	23%	0.233	S	C	.	.			trans	-67.4	124.3	161.9	0	0	0	0	0	110.2	N100	N100-A134 PolarHBondContact ND2-O 2.98Å; N100-A134 VanDerWaalsContact ND2-O 3.16Å; N100-A134 PolarHBondContact O-N 3.11Å
135	C	77.8	Confident	77	Confident	39 Å²	39	45.4 Å²	45.4	26%	0.264	22%	0.223	S	C	.	.			trans	-130.7	131.6	-178.1	178.1	0	0	0	0	111.1	S133 M137 C149	S133-C135 PolarHBondContact O-N 2.91Å; C135-M137 PolarHBondContact O-N 3.24Å; C135-C149 HydrophobicContact CB-CB 3.68Å; C135-C149 WeakPolarHBondContact CB-SG 3.32Å; C135-C149 WeakPolarHBondContact SG-CA 3.5Å; C135-C149 WeakPolarHBondContact SG-CB 3.3Å; C135-C149 CovalentContact SG-SG 2.04Å; C135-C149 PolarHBondContact SG-SG 2.99Å
136	R	72.7	Confident	76.7	Confident	204 Å²	204	46.9 Å²	46.9	77%	0.77	23%	0.231	S	C	*	.			trans	-82.2	102.6	177.2	177.7	176.4	168.5	162.2	-3.4	110
137	M	73.3	Confident	76.7	Confident	61 Å²	61	44.9 Å²	44.9	30%	0.3	22%	0.219	S	C	.	.			trans	-79.1	119.7	179.8	-58.6	-70.9	-74.8	0	0	111.8	C135 Q147 W185 N267	C135-M137 PolarHBondContact O-N 3.24Å; M137-Q147 HydrophobicContact CE-CG 3.7Å; M137-Q147 HydrophobicContact SD-CB 4.28Å; M137-Q147 HydrophobicContact SD-CG 3.89Å; M137-W185 HydrophobicContact CE-CH2 4.02Å; M137-W185 HydrophobicContact CE-CZ2 4.28Å; M137-N267 PolarHBondContact O-ND2 3.31Å; M137-N267 VanDerWaalsContact O-ND2 3.12Å
138	D	73.9	Confident	76.8	Confident	64 Å²	64	48.1 Å²	48.1	34%	0.342	24%	0.238	S	C	.	.			trans	-90.2	112.1	164.3	179.6	25.8	0	0	0	110.1	Q140 Q147 T270	D138-Q140 VanDerWaalsContact OD1-CB 3.26Å; D138-Q140 WeakPolarHBondContact OD1-CB 3.41Å; D138-Q140 PolarHBondContact OD1-N 3.12Å; D138-Q147 PolarHBondContact O-NE2 3.11Å; D138-T270 PolarHBondContact OD1-OG1 3.42Å; D138-T270 VanDerWaalsContact OD1-OG1 3.11Å
139	V	76.4	Confident	77.3	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.006	24%	0.235	C	C	.	.			trans	-94	1.4	179.7	-64.8	0	0	0	0	113.2	H141 F142 P265 N267 P272	V139-H141 PolarHBondContact O-N 3.04Å; V139-F142 VanDerWaalsContact O-CB 3.27Å; V139-F142 WeakPolarHBondContact O-CB 3.46Å; V139-F142 PolarHBondContact O-N 3.36Å; V139-P265 HydrophobicContact CG1-CG 3.78Å; V139-N267 HydrophobicContact CG2-CB 3.97Å; V139-P272 HydrophobicContact CG2-CB 4.4Å; V139-P272 HydrophobicContact CG2-CG 4.38Å; V139-P272 WeakPolarHBondContact O-CB 3.26Å
140	Q	75.5	Confident	77.9	Confident	55 Å²	55	50.5 Å²	50.5	26%	0.257	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46.6	-46.4	-173.8	177.4	168.6	-67.1	0	0	112.9	D138 F273	D138-Q140 VanDerWaalsContact OD1-CB 3.26Å; D138-Q140 WeakPolarHBondContact OD1-CB 3.41Å; D138-Q140 PolarHBondContact OD1-N 3.12Å; Q140-F273 HydrophobicContact CG-CD2 4.1Å; Q140-F273 HydrophobicContact CG-CE2 3.74Å; Q140-F273 HydrophobicContact CG-CZ 4.5Å; Q140-F273 WeakPolarHBondContact O-CD2 3.28Å; Q140-F273 PolarHBondContact O-N 3.28Å
141	H	75.6	Confident	78.4	Confident	54 Å²	54	46.7 Å²	46.7	25%	0.25	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	9.6	-175.1	-56.6	100	0	0	0	114.8	V139 F144 F273	V139-H141 PolarHBondContact O-N 3.04Å; H141-F144 CarbonylContact O-C 3.54Å; H141-F144 WeakPolarHBondContact O-CA 3.08Å; H141-F144 PolarHBondContact O-N 2.81Å; H141-F273 AromaticContact CD2-CD2 3.94Å; H141-F273 AromaticContact CD2-CE2 3.62Å; H141-F273 AromaticContact NE2-CE2 3.73Å
142	F	76	Confident	79	Confident	6 Å²	6	44.6 Å²	44.6	3%	0.026	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.4	133	-178.8	177.3	-82.2	0	0	0	112.5	V139 D145 Y214 I263 L264 L274	V139-F142 VanDerWaalsContact O-CB 3.27Å; V139-F142 WeakPolarHBondContact O-CB 3.46Å; V139-F142 PolarHBondContact O-N 3.36Å; F142-D145 WeakPolarHBondContact CA-OD1 3.37Å; F142-Y214 HydrophobicContact CE1-CD1 4.42Å; F142-Y214 AromaticContact CZ-CD1 3.78Å; F142-Y214 HydrophobicContact CZ-CD1 3.78Å; F142-Y214 AromaticContact CZ-CE1 3.91Å; F142-Y214 HydrophobicContact CZ-CE1 3.91Å; F142-Y214 HydrophobicContact CZ-CG 4.21Å; F142-I263 HydrophobicContact CZ-CG2 4.02Å; F142-L264 HydrophobicContact CB-CD2 4.13Å; F142-L264 HydrophobicContact CD1-CD2 3.55Å; F142-L264 HydrophobicContact CD2-CD2 3.85Å; F142-L264 HydrophobicContact CE1-CD2 3.83Å; F142-L264 HydrophobicContact CE2-CD2 4.09Å; F142-L264 HydrophobicContact CG-CD2 3.56Å; F142-L264 HydrophobicContact CZ-CD2 4.09Å; F142-L274 HydrophobicContact CD1-CD2 3.83Å; F142-L274 HydrophobicContact CE1-CD2 3.74Å
143	P	74.7	Confident	79.5	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.006	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	cis	-96.2	17	8	40.1	-38.1	0	0	0	114.5	D145 P211 Y214 I219	P143-D145 VanDerWaalsContact C-N 3.27Å; P143-D145 WeakPolarHBondContact CA-OD1 3.09Å; P143-P211 HydrophobicContact CG-CB 4.44Å; P143-Y214 HydrophobicContact CB-CD2 4.04Å; P143-Y214 HydrophobicContact CB-CG 3.95Å; P143-I219 HydrophobicContact CG-CD1 3.86Å
144	F	78.4	Confident	79.8	Confident	44 Å²	44	39 Å²	39	19%	0.193	20%	0.196	C	C	.	.	S	Bend	trans	-95.6	26.8	176.5	-50.3	-76.7	0	0	0	111.4	H141 P211 I219 V457 F458	H141-F144 CarbonylContact O-C 3.54Å; H141-F144 WeakPolarHBondContact O-CA 3.08Å; H141-F144 PolarHBondContact O-N 2.81Å; F144-P211 HydrophobicContact CD1-CB 3.56Å; F144-P211 HydrophobicContact CD1-CG 3.97Å; F144-P211 HydrophobicContact CE1-CB 3.56Å; F144-P211 HydrophobicContact CE1-CG 4.02Å; F144-I219 HydrophobicContact CE2-CD1 4.06Å; F144-I219 HydrophobicContact CZ-CD1 4.21Å; F144-V457 HydrophobicContact CE2-CG1 4.14Å; F144-V457 VanDerWaalsContact CE2-O 3.27Å; F144-V457 WeakPolarHBondContact CE2-O 3.32Å; F144-F458 HydrophobicContact CZ-CD1 4.09Å; F144-F458 HydrophobicContact CZ-CE1 4.09Å
145	D	77.7	Confident	80	Confident	2 Å²	2	38 Å²	38	1%	0.011	19%	0.188	C	C	.	.			trans	-79.8	139.4	-173	53.7	-63.9	0	0	0	113.4	F142 P143 Q147 R209	F142-D145 WeakPolarHBondContact CA-OD1 3.37Å; P143-D145 VanDerWaalsContact C-N 3.27Å; P143-D145 WeakPolarHBondContact CA-OD1 3.09Å; D145-Q147 PolarHBondContact OD2-NE2 3.07Å; D145-R209 PolarHBondContact O-N 3.11Å; D145-R209 IonicContact OD1-CZ 3.46Å; D145-R209 IonicContact OD1-NE 2.66Å; D145-R209 PolarHBondContact OD1-NE 3.45Å; D145-R209 IonicContact OD1-NH2 2.7Å; D145-R209 IonicContact OD2-CZ 2.69Å; D145-R209 IonicContact OD2-NE 3.71Å; D145-R209 PolarHBondContact OD2-NE 2.92Å; D145-R209 IonicContact OD2-NH2 3.76Å; D145-R209 PolarHBondContact OD2-NH2 3.31Å
146	E	82.5	Confident	79.8	Confident	49 Å²	49	38.3 Å²	38.3	23%	0.229	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	130.3	167.8	-66.9	-176.3	-169.5	0	0	108.8	K206 I207 R208 N463	E146-K206 WeakPolarHBondContact OE2-CE 3.38Å; E146-K206 IonicContact OE2-NZ 3.38Å; E146-K206 PolarHBondContact OE2-NZ 3.49Å; E146-I207 CarbonylContact C-O 3.58Å; E146-I207 VanDerWaalsContact CA-O 3.31Å; E146-I207 WeakPolarHBondContact CA-O 3.41Å; E146-R208 HydrophobicContact CG-CB 3.95Å; E146-R208 HydrophobicContact CG-CG 3.87Å; E146-R208 IonicContact OE1-CZ 3.11Å; E146-R208 IonicContact OE1-NE 3.76Å; E146-R208 PolarHBondContact OE1-NE 3.06Å; E146-R208 IonicContact OE1-NH2 3.48Å; E146-R208 PolarHBondContact OE1-NH2 3.24Å; E146-N463 PolarHBondContact OE1-OD1 3.38Å
147	Q	85.9	Confident	79.8	Confident	4 Å²	4	28.6 Å²	28.6	2%	0.019	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	138.2	-178.4	-50.7	-63.4	-16.7	0	0	108.5	M137 D138 D145 W185 K206 I207	M137-Q147 HydrophobicContact CE-CG 3.7Å; M137-Q147 HydrophobicContact SD-CB 4.28Å; M137-Q147 HydrophobicContact SD-CG 3.89Å; D138-Q147 PolarHBondContact O-NE2 3.11Å; D145-Q147 PolarHBondContact OD2-NE2 3.07Å; Q147-W185 HydrophobicContact CG-CH2 3.87Å; Q147-W185 HydrophobicContact CG-CZ3 3.89Å; Q147-K206 CarbonylContact O-C 3.55Å; Q147-K206 WeakPolarHBondContact O-CA 3.42Å; Q147-I207 HydrophobicContact CB-CD1 4.44Å; Q147-I207 HydrophobicContact CB-CG1 3.91Å; Q147-I207 PolarHBondContact N-O 3.42Å; Q147-I207 PolarHBondContact O-N 2.81Å
148	T	84.6	Confident	79.9	Confident	71 Å²	71	27 Å²	27	44%	0.436	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	98.8	173.5	-52.8	0	0	0	0	108.2	Y204	T148-Y204 HydrophobicContact CG2-CD1 4.11Å
149	C	86.5	Confident	79.9	Confident	18 Å²	18	25.9 Å²	25.9	12%	0.122	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	133.7	179.4	-63.5	0	0	0	0	110.3	C135 Y204 V205	C135-C149 HydrophobicContact CB-CB 3.68Å; C135-C149 WeakPolarHBondContact CB-SG 3.32Å; C135-C149 WeakPolarHBondContact SG-CA 3.5Å; C135-C149 WeakPolarHBondContact SG-CB 3.3Å; C135-C149 CovalentContact SG-SG 2.04Å; C135-C149 PolarHBondContact SG-SG 2.99Å; C149-Y204 CarbonylContact O-C 3.45Å; C149-V205 HydrophobicContact CB-CB 4.47Å; C149-V205 PolarHBondContact N-O 3.47Å; C149-V205 PolarHBondContact O-N 3.32Å
150	L	85.6	Confident	79.6	Confident	64 Å²	64	29.2 Å²	29.2	34%	0.335	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	140.6	177.3	-53.1	-176.4	0	0	0	110	N100 S133 V152 T202 F203 Y204	N100-L150 PolarHBondContact ND2-O 3.44Å; S133-L150 WeakPolarHBondContact CB-O 3.3Å; S133-L150 PolarHBondContact OG-O 2.95Å; L150-V152 HydrophobicContact CB-CG2 4.03Å; L150-V152 HydrophobicContact CD1-CG2 4.49Å; L150-T202 HydrophobicContact CB-CG2 4.39Å; L150-T202 HydrophobicContact CD2-CG2 4.25Å; L150-F203 CarbonylContact C-O 3.59Å; L150-F203 WeakPolarHBondContact CA-O 3.28Å; L150-Y204 HydrophobicContact CD2-CD1 3.27Å; L150-Y204 HydrophobicContact CD2-CE1 3.44Å; L150-Y204 VanDerWaalsContact CD2-CE1 3.44Å; L150-Y204 HydrophobicContact CD2-CG 3.94Å
151	L	84.7	Confident	79.4	Confident	17 Å²	17	28 Å²	28	9%	0.089	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	97.1	159.6	-60.1	175	0	0	0	106.4	L56 L98 S133 F153 I174 T202 F203 V205	L56-L151 HydrophobicContact CD2-CD1 3.64Å; L98-L151 HydrophobicContact CD1-CB 4.28Å; L98-L151 HydrophobicContact CD1-CD2 4.17Å; S133-L151 WeakPolarHBondContact OG-CD2 3.42Å; L151-F153 HydrophobicContact CB-CD2 4.32Å; L151-F153 HydrophobicContact CB-CE2 3.66Å; L151-F153 HydrophobicContact CB-CZ 4.15Å; L151-F153 HydrophobicContact CD1-CE2 4.33Å; L151-F153 PolarHBondContact O-N 2.85Å; L151-I174 HydrophobicContact CD1-CD1 4.35Å; L151-T202 WeakPolarHBondContact O-CA 3.43Å; L151-F203 HydrophobicContact CB-CB 4.29Å; L151-F203 PolarHBondContact N-O 3.13Å; L151-F203 PolarHBondContact O-N 3.11Å; L151-V205 HydrophobicContact CD1-CG2 3.69Å; L151-V205 HydrophobicContact CG-CG2 3.92Å
152	V	86.8	Confident	79.5	Confident	26 Å²	26	27.3 Å²	27.3	16%	0.158	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	97.9	179.4	-172.9	0	0	0	0	107.7	L99 N100 L150 K200 T202	L99-V152 HydrophobicContact CB-CB 4.49Å; L99-V152 HydrophobicContact CB-CG1 4.31Å; L99-V152 HydrophobicContact CD1-CG1 4.16Å; L99-V152 PolarHBondContact N-O 3.36Å; N100-V152 PolarHBondContact OD1-N 3.37Å; L150-V152 HydrophobicContact CB-CG2 4.03Å; L150-V152 HydrophobicContact CD1-CG2 4.49Å; V152-K200 HydrophobicContact CG1-CB 4.34Å; V152-K200 HydrophobicContact CG1-CD 4.4Å; V152-T202 HydrophobicContact CG2-CG2 4.05Å
153	F	87	Confident	79.6	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	140.5	169.8	-58.1	-79.1	0	0	0	109.5	F54 L56 I96 V97 L98 Y131 L151 K200 I201 F203	F54-F153 AromaticContact CE1-CD2 3.69Å; F54-F153 HydrophobicContact CE1-CD2 3.69Å; F54-F153 AromaticContact CE1-CE2 3.93Å; F54-F153 HydrophobicContact CE1-CE2 3.93Å; F54-F153 HydrophobicContact CE1-CG 4.14Å; F54-F153 HydrophobicContact CZ-CD1 4.22Å; F54-F153 AromaticContact CZ-CD2 3.92Å; F54-F153 HydrophobicContact CZ-CD2 3.92Å; F54-F153 HydrophobicContact CZ-CE1 4.35Å; F54-F153 HydrophobicContact CZ-CE2 4.06Å; F54-F153 AromaticContact CZ-CG 4Å; F54-F153 HydrophobicContact CZ-CG 4Å; F54-F153 HydrophobicContact CZ-CZ 4.27Å; L56-F153 HydrophobicContact CD1-CE2 4.16Å; L56-F153 HydrophobicContact CD1-CZ 4Å; I96-F153 HydrophobicContact CG2-CB 3.98Å; I96-F153 HydrophobicContact CG2-CD1 4.13Å; I96-F153 HydrophobicContact CG2-CG 4.35Å; V97-F153 WeakPolarHBondContact O-CA 3.38Å; L98-F153 HydrophobicContact CB-CD1 4.31Å; L98-F153 HydrophobicContact CB-CE1 4.18Å; L98-F153 HydrophobicContact CD1-CD1 4.2Å; L98-F153 HydrophobicContact CD1-CE1 3.89Å; L98-F153 HydrophobicContact CD1-CZ 4.17Å; Y131-F153 AromaticContact CD1-CE1 3.87Å; Y131-F153 HydrophobicContact CD1-CE1 3.87Å; Y131-F153 HydrophobicContact CD1-CZ 4.41Å; Y131-F153 AromaticContact CD2-CE1 3.81Å; Y131-F153 HydrophobicContact CD2-CE1 3.81Å; Y131-F153 AromaticContact CD2-CZ 3.61Å; Y131-F153 HydrophobicContact CD2-CZ 3.61Å; Y131-F153 AromaticContact CE1-CE1 3.73Å; Y131-F153 HydrophobicContact CE1-CE1 3.73Å; Y131-F153 AromaticContact CE2-CE1 3.65Å; Y131-F153 HydrophobicContact CE2-CE1 3.65Å; Y131-F153 AromaticContact CE2-CZ 3.71Å; Y131-F153 HydrophobicContact CE2-CZ 3.71Å; Y131-F153 AromaticContact CG-CE1 3.91Å; Y131-F153 HydrophobicContact CG-CE1 3.91Å; Y131-F153 AromaticContact CG-CZ 3.98Å; Y131-F153 HydrophobicContact CG-CZ 3.98Å; Y131-F153 AromaticContact CZ-CE1 3.62Å; L151-F153 HydrophobicContact CB-CD2 4.32Å; L151-F153 HydrophobicContact CB-CE2 3.66Å; L151-F153 HydrophobicContact CB-CZ 4.15Å; L151-F153 HydrophobicContact CD1-CE2 4.33Å; L151-F153 PolarHBondContact O-N 2.85Å; F153-K200 CarbonylContact O-C 3.59Å; F153-K200 WeakPolarHBondContact O-CA 3.3Å; F153-I201 HydrophobicContact CB-CG2 3.76Å; F153-I201 PolarHBondContact N-O 3.14Å; F153-I201 PolarHBondContact O-N 3.21Å; F153-F203 AromaticContact CD2-CD2 3.93Å; F153-F203 HydrophobicContact CD2-CD2 3.93Å; F153-F203 HydrophobicContact CD2-CE2 4.06Å; F153-F203 HydrophobicContact CE2-CD2 4Å; F153-F203 HydrophobicContact CE2-CE2 4.31Å
154	G	84.8	Confident	80	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	170.2	171.6	0	0	0	0	0	109.8	V97	V97-G154 PolarHBondContact N-O 3.14Å; V97-G154 PolarHBondContact O-N 2.69Å
155	S	80.5	Confident	80.4	Confident	19 Å²	19	25.5 Å²	25.5	13%	0.133	15%	0.149	C	C	.	.			trans	-78.3	139.1	165.5	176.9	0	0	0	0	109.1	D95 A157 Y158	D95-S155 WeakPolarHBondContact OD1-CB 3.01Å; D95-S155 PolarHBondContact OD1-OG 3.26Å; D95-S155 PolarHBondContact OD2-OG 2.99Å; S155-A157 PolarHBondContact OG-N 2.88Å; S155-A157 VanDerWaalsContact OG-N 3.09Å; S155-Y158 WeakPolarHBondContact OG-CB 3.46Å; S155-Y158 PolarHBondContact OG-N 2.64Å
156	S	72.9	Confident	80.8	Confident	44 Å²	44	26 Å²	26	31%	0.308	15%	0.153	S	C	.	.	S	Bend	trans	-94.1	-18.3	163.8	-176.3	0	0	0	0	111.3	D95 S580	D95-S156 PolarHBondContact OD2-N 3.06Å; S156-S580 VanDerWaalsContact OG-CB 3.28Å; S156-S580 WeakPolarHBondContact OG-CB 3.25Å
157	A	73	Confident	81.1	Confident	1 Å²	1	24.3 Å²	24.3	1%	0.008	15%	0.145	C	C	.	.	S	Bend	trans	-103.8	-16.2	-172.6	0	0	0	0	0	115	D95 S155 R553 N581	D95-A157 HydrophobicContact CB-CB 4.41Å; D95-A157 WeakPolarHBondContact OD2-CB 2.99Å; D95-A157 PolarHBondContact OD2-N 3.5Å; S155-A157 PolarHBondContact OG-N 2.88Å; S155-A157 VanDerWaalsContact OG-N 3.09Å; A157-R553 WeakPolarHBondContact O-CB 3.19Å; A157-R553 WeakPolarHBondContact O-CD 3.43Å; A157-R553 WeakPolarHBondContact O-CG 3.3Å; A157-R553 PolarHBondContact O-NH1 2.89Å; A157-N581 HydrophobicContact CB-CB 3.63Å; A157-N581 VanDerWaalsContact CB-CG 3.5Å; A157-N581 WeakPolarHBondContact CB-ND2 3.37Å
158	Y	75	Confident	81.1	Confident	28 Å²	28	25.1 Å²	25.1	11%	0.11	15%	0.148	C	C	.	.			trans	-127.8	152.1	-175.4	-63.6	-68.3	0	0	0	112.1	L39 W92 D95 S155 E162 V163 R553	L39-Y158 HydrophobicContact CD1-CE1 4.2Å; W92-Y158 AromaticContact CZ2-CE2 3.9Å; W92-Y158 HydrophobicContact CZ2-CE2 3.9Å; W92-Y158 PolarHBondContact NE1-OH 3.4Å; D95-Y158 VanDerWaalsContact OD1-CD2 3.24Å; D95-Y158 WeakPolarHBondContact OD1-CD2 3.5Å; S155-Y158 WeakPolarHBondContact OG-CB 3.46Å; S155-Y158 PolarHBondContact OG-N 2.64Å; Y158-E162 WeakPolarHBondContact CA-OE2 3.39Å; Y158-E162 HydrophobicContact CD1-CB 4.14Å; Y158-V163 HydrophobicContact CD1-CG2 4.38Å; Y158-V163 HydrophobicContact CD2-CG2 3.83Å; Y158-V163 HydrophobicContact CG-CG2 3.72Å; Y158-R553 VanDerWaalsContact C-NH1 3.35Å; Y158-R553 VanDerWaalsContact CA-NH1 3.33Å
159	T	74.1	Confident	81.1	Confident	40 Å²	40	28.9 Å²	28.9	25%	0.245	16%	0.158	C	C	.	.			trans	-84.5	167.8	174.1	70.7	0	0	0	0	112.4	G161 E162 V163	T159-G161 PolarHBondContact O-N 2.66Å; T159-G161 VanDerWaalsContact O-N 3.13Å; T159-G161 WeakPolarHBondContact OG1-CA 3.26Å; T159-G161 PolarHBondContact OG1-N 3.23Å; T159-E162 WeakPolarHBondContact CB-OE1 3.34Å; T159-E162 WeakPolarHBondContact CG2-OE1 3.28Å; T159-E162 PolarHBondContact N-OE2 3.5Å; T159-E162 PolarHBondContact O-N 3.06Å; T159-E162 VanDerWaalsContact O-N 3.09Å; T159-E162 PolarHBondContact OG1-N 3.01Å; T159-E162 PolarHBondContact OG1-OE1 3.07Å; T159-V163 PolarHBondContact O-N 3.36Å; T159-V163 VanDerWaalsContact O-N 3.07Å
160	N	70.1	Confident	80.8	Confident	71 Å²	71	36.1 Å²	36.1	38%	0.38	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-13.5	162.5	66.6	-4.9	0	0	0	114.1	R49 F197 S199	R49-N160 WeakPolarHBondContact CD-O 3.47Å; R49-N160 PolarHBondContact NE-O 3.19Å; R49-N160 PolarHBondContact NH1-O 3.42Å; N160-F197 PolarHBondContact ND2-O 3.18Å; N160-S199 WeakPolarHBondContact CA-OG 3.39Å
161	G	72	Confident	80.6	Confident	28 Å²	28	36.6 Å²	36.6	29%	0.289	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-20.6	174.2	0	0	0	0	0	114.5	R49 T159	R49-G161 WeakPolarHBondContact CD-O 3.45Å; R49-G161 WeakPolarHBondContact CG-O 3.43Å; R49-G161 PolarHBondContact NE-O 3.23Å; R49-G161 VanDerWaalsContact NE-O 3.11Å; T159-G161 PolarHBondContact O-N 2.66Å; T159-G161 VanDerWaalsContact O-N 3.13Å; T159-G161 WeakPolarHBondContact OG1-CA 3.26Å; T159-G161 PolarHBondContact OG1-N 3.23Å
162	E	76.6	Confident	80.7	Confident	41 Å²	41	36.5 Å²	36.5	19%	0.192	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.8	-44.8	-175.7	-68.4	129.9	-129	0	0	112.6	L39 R49 V50 Y158 T159 R553	L39-E162 HydrophobicContact CD2-CB 4.23Å; R49-E162 WeakPolarHBondContact CG-O 3.23Å; V50-E162 PolarHBondContact N-O 3.2Å; Y158-E162 WeakPolarHBondContact CA-OE2 3.39Å; Y158-E162 HydrophobicContact CD1-CB 4.14Å; T159-E162 WeakPolarHBondContact CB-OE1 3.34Å; T159-E162 WeakPolarHBondContact CG2-OE1 3.28Å; T159-E162 PolarHBondContact N-OE2 3.5Å; T159-E162 PolarHBondContact O-N 3.06Å; T159-E162 VanDerWaalsContact O-N 3.09Å; T159-E162 PolarHBondContact OG1-N 3.01Å; T159-E162 PolarHBondContact OG1-OE1 3.07Å; E162-R553 WeakPolarHBondContact OE2-CD 3.47Å; E162-R553 IonicContact OE2-CZ 2.73Å; E162-R553 IonicContact OE2-NE 3.69Å
163	V	78.7	Confident	80.6	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.012	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	136.6	-176.1	176.8	0	0	0	0	110.1	L39 V50 V52 Y158 T159 S199	L39-V163 HydrophobicContact CD1-CG2 4Å; V50-V163 HydrophobicContact CB-CG2 4.41Å; V52-V163 HydrophobicContact CB-CG1 4.31Å; V52-V163 HydrophobicContact CG2-CG1 3.65Å; Y158-V163 HydrophobicContact CD1-CG2 4.38Å; Y158-V163 HydrophobicContact CD2-CG2 3.83Å; Y158-V163 HydrophobicContact CG-CG2 3.72Å; T159-V163 PolarHBondContact O-N 3.36Å; T159-V163 VanDerWaalsContact O-N 3.07Å; V163-S199 WeakPolarHBondContact O-CB 3.21Å; V163-S199 PolarHBondContact O-OG 3.14Å
164	Q	83.4	Confident	80.4	Confident	9 Å²	9	38.4 Å²	38.4	4%	0.042	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	137.4	164.2	-164.9	177.8	-9.1	0	0	111	V50 V52 A166 L471 N472	V50-Q164 PolarHBondContact O-N 3.49Å; V52-Q164 PolarHBondContact N-O 3.18Å; Q164-A166 PolarHBondContact O-N 3.02Å; Q164-L471 HydrophobicContact CB-CD1 4.05Å; Q164-L471 HydrophobicContact CB-CG 4.2Å; Q164-L471 HydrophobicContact CG-CD1 3.72Å; Q164-L471 HydrophobicContact CG-CG 4.26Å; Q164-N472 WeakPolarHBondContact CB-OD1 3.48Å; Q164-N472 PolarHBondContact OE1-OD1 3.11Å
165	F	85.9	Confident	80.2	Confident	1 Å²	1	39.4 Å²	39.4	0%	0.004	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	125.4	171.1	-67	-88.3	0	0	0	109.8	V52 F54 I96 L194 S199 I201 L471	V52-F165 HydrophobicContact CB-CD1 4.46Å; V52-F165 HydrophobicContact CG1-CD1 4.16Å; V52-F165 HydrophobicContact CG1-CE1 4.14Å; V52-F165 CarbonylContact O-C 3.57Å; V52-F165 VanDerWaalsContact O-CA 3.31Å; V52-F165 WeakPolarHBondContact O-CA 3.39Å; F54-F165 HydrophobicContact CB-CD1 4.08Å; I96-F165 HydrophobicContact CB-CE1 4.42Å; I96-F165 HydrophobicContact CD1-CE1 4Å; I96-F165 HydrophobicContact CG1-CE1 3.89Å; I96-F165 HydrophobicContact CG1-CZ 4.29Å; I96-F165 HydrophobicContact CG2-CE1 3.87Å; I96-F165 HydrophobicContact CG2-CZ 4.29Å; F165-L194 HydrophobicContact CB-CD1 3.86Å; F165-L194 VanDerWaalsContact O-CD1 3.28Å; F165-L194 WeakPolarHBondContact O-CD1 3.12Å; F165-L194 WeakPolarHBondContact O-CD2 3.39Å; F165-S199 WeakPolarHBondContact CD2-O 3.48Å; F165-S199 VanDerWaalsContact CE2-O 3.25Å; F165-S199 WeakPolarHBondContact CE2-O 3.39Å; F165-I201 HydrophobicContact CB-CB 3.9Å; F165-I201 HydrophobicContact CB-CD1 4.23Å; F165-I201 HydrophobicContact CB-CG2 3.99Å; F165-I201 HydrophobicContact CD1-CG2 3.83Å; F165-I201 HydrophobicContact CD2-CG2 4.5Å; F165-I201 HydrophobicContact CE1-CG2 4.49Å; F165-I201 HydrophobicContact CG-CB 4.22Å; F165-I201 HydrophobicContact CG-CG2 3.83Å; F165-L471 WeakPolarHBondContact O-CD1 3.18Å
166	A	86.7	Confident	80.2	Confident	12 Å²	12	42 Å²	42	10%	0.099	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	168.1	169.2	0	0	0	0	0	109.8	V51 V52 A53 F54 Q164 L471	V51-A166 HydrophobicContact CG1-CB 4.04Å; V52-A166 PolarHBondContact O-N 3.11Å; A53-A166 CarbonylContact C-O 3.51Å; A53-A166 WeakPolarHBondContact CA-O 3.36Å; A53-A166 HydrophobicContact CB-CB 4.24Å; F54-A166 PolarHBondContact N-O 2.89Å; Q164-A166 PolarHBondContact O-N 3.02Å; A166-L471 HydrophobicContact CB-CD1 3.64Å; A166-L471 HydrophobicContact CB-CD2 3.97Å; A166-L471 HydrophobicContact CB-CG 4.49Å
167	W	88.1	Confident	80.1	Confident	15 Å²	15	45.4 Å²	45.4	6%	0.057	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	117.5	177.4	-62.8	93.5	0	0	0	111	K169 Q170 N172 L194 I201 F203 D469	W167-K169 PolarHBondContact O-N 3.1Å; W167-K169 VanDerWaalsContact O-N 3.09Å; W167-Q170 PolarHBondContact O-N 3.03Å; W167-N172 HydrophobicContact CD2-CB 3.85Å; W167-N172 VanDerWaalsContact CE3-CA 3.48Å; W167-N172 HydrophobicContact CE3-CB 3.93Å; W167-N172 HydrophobicContact CG-CB 4.35Å; W167-N172 HydrophobicContact CH2-CB 4.46Å; W167-N172 HydrophobicContact CZ2-CB 4.35Å; W167-N172 HydrophobicContact CZ3-CB 4.22Å; W167-L194 HydrophobicContact CZ2-CB 3.74Å; W167-I201 HydrophobicContact CD2-CD1 3.98Å; W167-I201 HydrophobicContact CE3-CD1 3.71Å; W167-I201 HydrophobicContact CE3-CG1 4.34Å; W167-I201 HydrophobicContact CH2-CD1 3.8Å; W167-I201 HydrophobicContact CH2-CG1 3.47Å; W167-I201 VanDerWaalsContact CH2-CG1 3.47Å; W167-I201 HydrophobicContact CZ2-CD1 4.09Å; W167-I201 HydrophobicContact CZ2-CG1 3.82Å; W167-I201 HydrophobicContact CZ3-CD1 3.63Å; W167-I201 HydrophobicContact CZ3-CG1 3.79Å; W167-F203 HydrophobicContact CE3-CE1 4.44Å; W167-F203 HydrophobicContact CE3-CZ 4.36Å; W167-F203 HydrophobicContact CH2-CE1 4.45Å; W167-F203 HydrophobicContact CH2-CZ 4.44Å; W167-F203 HydrophobicContact CZ3-CD1 4.27Å; W167-F203 AromaticContact CZ3-CE1 3.58Å; W167-F203 HydrophobicContact CZ3-CE1 3.58Å; W167-F203 HydrophobicContact CZ3-CE2 4.35Å; W167-F203 AromaticContact CZ3-CZ 3.62Å; W167-F203 HydrophobicContact CZ3-CZ 3.62Å; W167-D469 VanDerWaalsContact CB-OD2 3.25Å; W167-D469 WeakPolarHBondContact CB-OD2 3.21Å; W167-D469 VanDerWaalsContact CD1-CB 3.44Å; W167-D469 HydrophobicContact CG-CB 4.24Å; W167-D469 VanDerWaalsContact CG-CG 3.48Å; W167-D469 PolarHBondContact NE1-OD1 2.86Å
168	Y	85.7	Confident	79.8	Confident	21 Å²	21	52.5 Å²	52.5	8%	0.082	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-59.5	116.9	-179.7	178.4	-113.2	0	0	0	111.1	F54 N63 L124 Q170 R171	F54-Y168 WeakPolarHBondContact O-CB 3.1Å; F54-Y168 PolarHBondContact O-N 3.04Å; N63-Y168 HydrophobicContact CB-CD1 3.36Å; N63-Y168 HydrophobicContact CB-CD2 4.25Å; N63-Y168 HydrophobicContact CB-CE1 3.42Å; N63-Y168 VanDerWaalsContact CB-CE1 3.42Å; N63-Y168 HydrophobicContact CB-CE2 4.34Å; N63-Y168 HydrophobicContact CB-CG 3.77Å; N63-Y168 WeakPolarHBondContact OD1-CE1 3.31Å; L124-Y168 HydrophobicContact CD1-CE2 3.92Å; Y168-Q170 VanDerWaalsContact C-N 3.28Å; Y168-Q170 PolarHBondContact O-N 3.31Å; Y168-R171 PolarHBondContact O-N 3.28Å
169	K	84.4	Confident	79.8	Confident	149 Å²	149	53.3 Å²	53.3	65%	0.648	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	57.6	33	-175.6	-59.7	176.5	175.1	168.7	0	114.3	W167 R171	W167-K169 PolarHBondContact O-N 3.1Å; W167-K169 VanDerWaalsContact O-N 3.09Å; K169-R171 PolarHBondContact O-N 3.14Å
170	Q	80.2	Confident	79.8	Confident	170 Å²	170	56.2 Å²	56.2	79%	0.794	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	55.2	35.4	179.9	-60.1	176.7	-21.9	0	0	112.7	W167 Y168	W167-Q170 PolarHBondContact O-N 3.03Å; Y168-Q170 VanDerWaalsContact C-N 3.28Å; Y168-Q170 PolarHBondContact O-N 3.31Å
171	R	82.8	Confident	79.9	Confident	75 Å²	75	61 Å²	61	28%	0.283	30%	0.303	S	S	.	.			trans	-110.2	108.8	175.8	-71.3	-179.9	171.1	-164.7	-6.7	109.5	Y168 K169 F173 E177	Y168-R171 PolarHBondContact O-N 3.28Å; K169-R171 PolarHBondContact O-N 3.14Å; R171-F173 VanDerWaalsContact C-N 3.35Å; R171-F173 HydrophobicContact CB-CE1 4.1Å; R171-F173 HydrophobicContact CB-CE2 4.49Å; R171-F173 HydrophobicContact CB-CZ 4.05Å; R171-F173 HydrophobicContact CG-CE1 4.15Å; R171-F173 HydrophobicContact CG-CE2 4.49Å; R171-F173 HydrophobicContact CG-CZ 3.82Å; R171-F173 PolarHBondContact O-N 2.78Å; R171-E177 IonicContact CZ-OE1 2.66Å; R171-E177 VanDerWaalsContact CZ-OE1 3.27Å; R171-E177 IonicContact NH1-OE1 3.71Å; R171-E177 PolarHBondContact NH1-OE1 3.49Å; R171-E177 IonicContact NH2-OE1 2.68Å; R171-E177 PolarHBondContact NH2-OE1 3.22Å
172	N	85.4	Confident	80.1	Confident	15 Å²	15	61.9 Å²	61.9	8%	0.08	30%	0.304	C	S	.	.			trans	-101.4	38.5	-177.7	52.5	25.9	0	0	0	113.2	W167 G192 R467 V468 D469	W167-N172 HydrophobicContact CD2-CB 3.85Å; W167-N172 VanDerWaalsContact CE3-CA 3.48Å; W167-N172 HydrophobicContact CE3-CB 3.93Å; W167-N172 HydrophobicContact CG-CB 4.35Å; W167-N172 HydrophobicContact CH2-CB 4.46Å; W167-N172 HydrophobicContact CZ2-CB 4.35Å; W167-N172 HydrophobicContact CZ3-CB 4.22Å; N172-G192 VanDerWaalsContact O-CA 3.24Å; N172-G192 WeakPolarHBondContact O-CA 3.41Å; N172-G192 PolarHBondContact O-N 3.35Å; N172-R467 PolarHBondContact ND2-O 3.08Å; N172-V468 WeakPolarHBondContact ND2-CA 3.16Å; N172-V468 PolarHBondContact ND2-N 2.82Å; N172-V468 VanDerWaalsContact ND2-N 3.15Å; N172-D469 WeakPolarHBondContact CB-OD1 3.17Å; N172-D469 PolarHBondContact ND2-OD1 3.07Å
173	F	85.6	Confident	79.9	Confident	66 Å²	66	65.1 Å²	65.1	29%	0.289	33%	0.331	S	S	.	.	B	Isolated β-bridge	trans	-145	153.3	175.2	51.9	-92.8	0	0	0	108.1	R171 Q175 V190	R171-F173 VanDerWaalsContact C-N 3.35Å; R171-F173 HydrophobicContact CB-CE1 4.1Å; R171-F173 HydrophobicContact CB-CE2 4.49Å; R171-F173 HydrophobicContact CB-CZ 4.05Å; R171-F173 HydrophobicContact CG-CE1 4.15Å; R171-F173 HydrophobicContact CG-CE2 4.49Å; R171-F173 HydrophobicContact CG-CZ 3.82Å; R171-F173 PolarHBondContact O-N 2.78Å; F173-Q175 PolarHBondContact O-N 3.28Å; F173-V190 WeakPolarHBondContact CA-O 3.41Å; F173-V190 HydrophobicContact CB-CG2 4.45Å
174	I	81.8	Confident	80	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	35%	0.35	C	S	.	.			trans	-65.4	131	174.6	-55.4	174	0	0	0	108.7	L56 M58 L151 L176 V190 F203 V205	L56-I174 HydrophobicContact CB-CG1 4.32Å; L56-I174 HydrophobicContact CB-CG2 4.08Å; L56-I174 HydrophobicContact CD2-CD1 3.86Å; L56-I174 HydrophobicContact CD2-CG1 4.13Å; L56-I174 HydrophobicContact CD2-CG2 4.01Å; L56-I174 HydrophobicContact CG-CG2 4.33Å; L56-I174 WeakPolarHBondContact O-CG2 3.47Å; M58-I174 HydrophobicContact CG-CG2 3.64Å; M58-I174 HydrophobicContact SD-CD1 4.22Å; M58-I174 HydrophobicContact SD-CG2 3.87Å; L151-I174 HydrophobicContact CD1-CD1 4.35Å; I174-L176 PolarHBondContact O-N 2.98Å; I174-V190 HydrophobicContact CB-CB 3.88Å; I174-V190 HydrophobicContact CB-CG1 4.3Å; I174-V190 HydrophobicContact CB-CG2 3.95Å; I174-V190 HydrophobicContact CD1-CB 4.02Å; I174-V190 HydrophobicContact CD1-CG1 4.02Å; I174-V190 HydrophobicContact CG1-CB 3.97Å; I174-V190 HydrophobicContact CG1-CG1 4.44Å; I174-V190 PolarHBondContact N-O 2.74Å; I174-F203 HydrophobicContact CD1-CB 3.98Å; I174-F203 HydrophobicContact CD1-CD1 4.29Å; I174-F203 HydrophobicContact CD1-CG 4.4Å; I174-F203 HydrophobicContact CG1-CB 4.04Å; I174-F203 HydrophobicContact CG1-CD1 3.42Å; I174-F203 VanDerWaalsContact CG1-CD1 3.42Å; I174-F203 HydrophobicContact CG1-CE1 4.13Å; I174-F203 HydrophobicContact CG1-CG 3.99Å; I174-V205 HydrophobicContact CD1-CG2 3.63Å
175	Q	81.9	Confident	80	Confident	21 Å²	21	70.9 Å²	70.9	10%	0.098	36%	0.357	C	S	.	.	B	Isolated β-bridge	trans	-67.9	121.7	178.2	-60.3	-176.1	0.4	0	0	109.9	L56 S57 M58 F173	L56-Q175 PolarHBondContact O-N 3.1Å; S57-Q175 WeakPolarHBondContact CA-O 3.27Å; S57-Q175 PolarHBondContact OG-O 3.35Å; M58-Q175 PolarHBondContact N-O 2.98Å; M58-Q175 VanDerWaalsContact N-O 3.12Å; F173-Q175 PolarHBondContact O-N 3.28Å
176	L	79.6	Confident	79.8	Confident	72 Å²	72	73.8 Å²	73.8	38%	0.377	37%	0.373	S	S	.	.			trans	-99	6.7	178.4	-70.2	162.4	0	0	0	112.4	M58 I174 D178 F179 V190	M58-L176 HydrophobicContact CB-CD2 4.45Å; M58-L176 HydrophobicContact CG-CD2 3.73Å; I174-L176 PolarHBondContact O-N 2.98Å; L176-D178 PolarHBondContact O-N 2.85Å; L176-F179 HydrophobicContact CB-CB 4.29Å; L176-F179 HydrophobicContact CD2-CB 3.93Å; L176-F179 HydrophobicContact CD2-CD1 3.82Å; L176-F179 HydrophobicContact CD2-CD2 4.36Å; L176-F179 HydrophobicContact CD2-CE1 4.43Å; L176-F179 HydrophobicContact CD2-CG 3.77Å; L176-F179 VanDerWaalsContact O-CB 3.26Å; L176-F179 WeakPolarHBondContact O-CB 3.38Å; L176-F179 PolarHBondContact O-N 2.75Å; L176-F179 VanDerWaalsContact O-N 3.12Å; L176-V190 HydrophobicContact CD1-CG2 4.04Å; L176-V190 HydrophobicContact CG-CG2 4.46Å
177	E	70.2	Confident	79.7	Confident	116 Å²	116	74.9 Å²	74.9	54%	0.542	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	130.5	167.7	-67.3	171.2	-144.2	0	0	108.5	V59 R171 F179	V59-E177 VanDerWaalsContact CG2-O 3.31Å; V59-E177 WeakPolarHBondContact CG2-O 3.34Å; R171-E177 IonicContact CZ-OE1 2.66Å; R171-E177 VanDerWaalsContact CZ-OE1 3.27Å; R171-E177 IonicContact NH1-OE1 3.71Å; R171-E177 PolarHBondContact NH1-OE1 3.49Å; R171-E177 IonicContact NH2-OE1 2.68Å; R171-E177 PolarHBondContact NH2-OE1 3.22Å; E177-F179 PolarHBondContact O-N 2.7Å
178	D	67.7	Low	79.5	Confident	151 Å²	151	74.8 Å²	74.8	81%	0.807	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.4	13.5	-170.1	-64.5	-31	0	0	0	117.5	V59 L176 S180	V59-D178 HydrophobicContact CG1-CB 4.43Å; V59-D178 HydrophobicContact CG2-CB 3.84Å; V59-D178 VanDerWaalsContact CG2-O 3.26Å; V59-D178 WeakPolarHBondContact CG2-O 3.5Å; L176-D178 PolarHBondContact O-N 2.85Å; D178-S180 PolarHBondContact O-N 3.02Å
179	F	74.6	Confident	79.4	Confident	44 Å²	44	73.9 Å²	73.9	19%	0.193	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-61.6	125.6	177.1	172.4	-117.9	0	0	0	113.4	M58 L176 E177 F181 V187	M58-F179 HydrophobicContact CB-CB 4.3Å; M58-F179 HydrophobicContact CB-CD2 3.46Å; M58-F179 VanDerWaalsContact CB-CD2 3.46Å; M58-F179 HydrophobicContact CB-CE2 4.15Å; M58-F179 HydrophobicContact CB-CG 4.18Å; M58-F179 HydrophobicContact CE-CE2 4.1Å; M58-F179 HydrophobicContact CG-CD2 4.08Å; M58-F179 HydrophobicContact CG-CE2 4.49Å; L176-F179 HydrophobicContact CB-CB 4.29Å; L176-F179 HydrophobicContact CD2-CB 3.93Å; L176-F179 HydrophobicContact CD2-CD1 3.82Å; L176-F179 HydrophobicContact CD2-CD2 4.36Å; L176-F179 HydrophobicContact CD2-CE1 4.43Å; L176-F179 HydrophobicContact CD2-CG 3.77Å; L176-F179 VanDerWaalsContact O-CB 3.26Å; L176-F179 WeakPolarHBondContact O-CB 3.38Å; L176-F179 PolarHBondContact O-N 2.75Å; L176-F179 VanDerWaalsContact O-N 3.12Å; E177-F179 PolarHBondContact O-N 2.7Å; F179-F181 HydrophobicContact CE1-CD1 4.1Å; F179-V187 HydrophobicContact CE1-CG2 3.81Å; F179-V187 HydrophobicContact CE2-CG2 4.35Å; F179-V187 HydrophobicContact CZ-CG2 3.56Å
180	S	73.7	Confident	79.5	Confident	102 Å²	102	66.9 Å²	66.9	71%	0.713	35%	0.346	S	S	*	.	P	Polyproline II helix	trans	-87.8	119.8	173.3	63.7	0	0	0	0	112.1	D178 S182	D178-S180 PolarHBondContact O-N 3.02Å; S180-S182 PolarHBondContact O-N 3.16Å
181	F	72.1	Confident	79.9	Confident	172 Å²	172	59.6 Å²	59.6	75%	0.754	31%	0.313	S	S	*	.	P	Polyproline II helix	trans	-62.2	125.4	-178.6	-68	-82.2	0	0	0	112.7	F179	F179-F181 HydrophobicContact CE1-CD1 4.1Å
182	S	76.9	Confident	80	Confident	46 Å²	46	56 Å²	56	32%	0.322	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-67.8	142.8	171.6	-178.5	0	0	0	0	111.8	S180 I184 W185 K210	S180-S182 PolarHBondContact O-N 3.16Å; S182-I184 VanDerWaalsContact C-N 3.28Å; S182-I184 PolarHBondContact O-N 3.34Å; S182-I184 PolarHBondContact OG-N 3.18Å; S182-W185 WeakPolarHBondContact CB-O 3.47Å; S182-W185 PolarHBondContact OG-N 3.46Å; S182-K210 PolarHBondContact O-NZ 2.64Å
183	S	73.1	Confident	80	Confident	108 Å²	108	56.3 Å²	56.3	76%	0.755	30%	0.303	S	S	*	.	S	Bend	trans	-73.6	-16.1	172.6	54.1	0	0	0	0	113.8
184	I	80.5	Confident	79.8	Confident	78 Å²	78	53.6 Å²	53.6	40%	0.4	29%	0.292	S	S	.	.	S	Bend	trans	-109.5	-32.8	-173.5	-56.7	174.3	0	0	0	112	S182 K210	S182-I184 VanDerWaalsContact C-N 3.28Å; S182-I184 PolarHBondContact O-N 3.34Å; S182-I184 PolarHBondContact OG-N 3.18Å; I184-K210 WeakPolarHBondContact O-CB 3.29Å; I184-K210 PolarHBondContact O-N 3.39Å
185	W	83.7	Confident	79.5	Confident	54 Å²	54	55.7 Å²	55.7	21%	0.205	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	145.5	-174.9	-60.8	94.9	0	0	0	111.3	M137 Q147 S182 I207 R208 R209 K210	M137-W185 HydrophobicContact CE-CH2 4.02Å; M137-W185 HydrophobicContact CE-CZ2 4.28Å; Q147-W185 HydrophobicContact CG-CH2 3.87Å; Q147-W185 HydrophobicContact CG-CZ3 3.89Å; S182-W185 WeakPolarHBondContact CB-O 3.47Å; S182-W185 PolarHBondContact OG-N 3.46Å; W185-I207 HydrophobicContact CD2-CD1 3.84Å; W185-I207 HydrophobicContact CD2-CG1 4.34Å; W185-I207 HydrophobicContact CE3-CB 3.96Å; W185-I207 HydrophobicContact CE3-CD1 3.68Å; W185-I207 HydrophobicContact CE3-CG1 3.7Å; W185-I207 HydrophobicContact CG-CD1 4.35Å; W185-I207 HydrophobicContact CH2-CD1 4.44Å; W185-I207 HydrophobicContact CZ3-CD1 4.01Å; W185-I207 HydrophobicContact CZ3-CG1 3.97Å; W185-R208 CarbonylContact C-O 3.58Å; W185-R208 WeakPolarHBondContact CA-O 3.46Å; W185-R209 HydrophobicContact CE3-CB 4.04Å; W185-R209 VanDerWaalsContact CE3-N 3.33Å; W185-R209 HydrophobicContact CH2-CB 4.19Å; W185-R209 VanDerWaalsContact CH2-NH2 3.31Å; W185-R209 HydrophobicContact CZ3-CB 3.76Å; W185-K210 WeakPolarHBondContact O-CE 3.31Å; W185-K210 PolarHBondContact O-NZ 2.85Å
186	D	81.7	Confident	78.7	Confident	62 Å²	62	60.2 Å²	60.2	33%	0.332	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	137.5	157.5	-72.2	-52.7	0	0	0	108.7	V188 I207 R208 K210	D186-V188 PolarHBondContact O-N 3.47Å; D186-I207 CarbonylContact O-C 3.53Å; D186-I207 WeakPolarHBondContact O-CA 3.48Å; D186-R208 PolarHBondContact N-O 3.44Å; D186-R208 PolarHBondContact O-N 3.34Å; D186-K210 WeakPolarHBondContact OD1-CE 3.42Å; D186-K210 IonicContact OD1-NZ 2.84Å; D186-K210 PolarHBondContact OD1-NZ 3.01Å; D186-K210 WeakPolarHBondContact OD2-CE 3.42Å; D186-K210 WeakPolarHBondContact OD2-CG 3.44Å; D186-K210 IonicContact OD2-NZ 3.88Å
187	V	84.2	Confident	78.1	Confident	36 Å²	36	64.7 Å²	64.7	22%	0.218	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	124.4	163.2	176.9	0	0	0	0	106.8	M58 F179 V190	M58-V187 HydrophobicContact CE-CG2 4.02Å; F179-V187 HydrophobicContact CE1-CG2 3.81Å; F179-V187 HydrophobicContact CE2-CG2 4.35Å; F179-V187 HydrophobicContact CZ-CG2 3.56Å; V187-V190 HydrophobicContact CG1-CG1 3.64Å
188	V	83.2	Confident	77.8	Confident	13 Å²	13	62.9 Å²	62.9	8%	0.079	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	-52.9	175.3	164.4	0	0	0	0	109.4	D186 K206 R208 N463	D186-V188 PolarHBondContact O-N 3.47Å; V188-K206 HydrophobicContact CB-CB 4.05Å; V188-K206 HydrophobicContact CB-CD 4.18Å; V188-K206 HydrophobicContact CB-CG 3.84Å; V188-K206 WeakPolarHBondContact CB-O 3.44Å; V188-K206 HydrophobicContact CG1-CB 4.23Å; V188-K206 HydrophobicContact CG1-CD 3.59Å; V188-K206 HydrophobicContact CG1-CG 3.85Å; V188-K206 HydrophobicContact CG2-CG 4.3Å; V188-K206 PolarHBondContact N-O 2.82Å; V188-R208 HydrophobicContact CG2-CB 3.64Å; V188-N463 HydrophobicContact CG1-CB 3.98Å; V188-N463 WeakPolarHBondContact CG1-OD1 3.26Å; V188-N463 VanDerWaalsContact CG2-OD1 3.28Å; V188-N463 WeakPolarHBondContact CG2-OD1 3.33Å
189	D	83.4	Confident	78.2	Confident	2 Å²	2	55.9 Å²	55.9	1%	0.011	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.8	149.9	-160.4	-178.6	13.5	0	0	0	106.9	P191 K206 L464 F465	D189-P191 VanDerWaalsContact CG-CD 3.41Å; D189-P191 VanDerWaalsContact CG-CG 3.44Å; D189-P191 WeakPolarHBondContact OD1-CD 3.36Å; D189-P191 WeakPolarHBondContact OD1-CG 3.48Å; D189-P191 VanDerWaalsContact OD2-CG 3.25Å; D189-P191 WeakPolarHBondContact OD2-CG 3.48Å; D189-K206 HydrophobicContact CB-CB 4.21Å; D189-K206 PolarHBondContact N-O 3.44Å; D189-K206 WeakPolarHBondContact O-CB 3.06Å; D189-K206 PolarHBondContact O-N 2.82Å; D189-L464 HydrophobicContact CB-CB 4.42Å; D189-L464 WeakPolarHBondContact OD2-CB 3.31Å; D189-L464 WeakPolarHBondContact OD2-CD2 3.16Å; D189-L464 VanDerWaalsContact OD2-CG 3.28Å; D189-L464 WeakPolarHBondContact OD2-CG 3.36Å; D189-F465 VanDerWaalsContact OD1-CD1 3.24Å; D189-F465 WeakPolarHBondContact OD1-CD1 3.35Å; D189-F465 WeakPolarHBondContact OD1-CE1 3.24Å; D189-F465 WeakPolarHBondContact OD2-CA 3.4Å; D189-F465 PolarHBondContact OD2-N 3.17Å
190	V	87.5	Confident	78.7	Confident	1 Å²	1	57 Å²	57	1%	0.006	31%	0.306	C	S	.	.			trans	-138.1	52.5	-178.9	-74.6	0	0	0	0	113.7	F173 I174 L176 V187 Y204	F173-V190 WeakPolarHBondContact CA-O 3.41Å; F173-V190 HydrophobicContact CB-CG2 4.45Å; I174-V190 HydrophobicContact CB-CB 3.88Å; I174-V190 HydrophobicContact CB-CG1 4.3Å; I174-V190 HydrophobicContact CB-CG2 3.95Å; I174-V190 HydrophobicContact CD1-CB 4.02Å; I174-V190 HydrophobicContact CD1-CG1 4.02Å; I174-V190 HydrophobicContact CG1-CB 3.97Å; I174-V190 HydrophobicContact CG1-CG1 4.44Å; I174-V190 PolarHBondContact N-O 2.74Å; L176-V190 HydrophobicContact CD1-CG2 4.04Å; L176-V190 HydrophobicContact CG-CG2 4.46Å; V187-V190 HydrophobicContact CG1-CG1 3.64Å; V190-Y204 WeakPolarHBondContact CA-O 3.37Å
191	P	88.5	Confident	79.3	Confident	17 Å²	17	52.1 Å²	52.1	11%	0.11	27%	0.272	C	S	.	.	B	Isolated β-bridge	trans	-65.5	154.2	-172.3	-21.2	34.4	0	0	0	114	D189 F203 Y204	D189-P191 VanDerWaalsContact CG-CD 3.41Å; D189-P191 VanDerWaalsContact CG-CG 3.44Å; D189-P191 WeakPolarHBondContact OD1-CD 3.36Å; D189-P191 WeakPolarHBondContact OD1-CG 3.48Å; D189-P191 VanDerWaalsContact OD2-CG 3.25Å; D189-P191 WeakPolarHBondContact OD2-CG 3.48Å; P191-F203 CarbonylContact O-C 3.47Å; P191-F203 WeakPolarHBondContact O-CA 3.34Å; P191-Y204 WeakPolarHBondContact CD-O 3.43Å; P191-Y204 PolarHBondContact O-N 2.72Å
192	G	85.1	Confident	80	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.01	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	148.7	168.2	0	0	0	0	0	113.1	N172 T202	N172-G192 VanDerWaalsContact O-CA 3.24Å; N172-G192 WeakPolarHBondContact O-CA 3.41Å; N172-G192 PolarHBondContact O-N 3.35Å; G192-T202 CarbonylContact C-O 3.51Å; G192-T202 WeakPolarHBondContact CA-O 3.4Å
193	S	84.9	Confident	80.5	Confident	20 Å²	20	42.6 Å²	42.6	14%	0.14	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	133.9	163.7	-173.1	0	0	0	0	109.6	T202 R467	S193-T202 PolarHBondContact N-O 3.11Å; S193-T202 PolarHBondContact O-N 2.99Å; S193-R467 PolarHBondContact OG-NH1 2.89Å
194	L	81.9	Confident	81.1	Confident	10 Å²	10	41 Å²	41	5%	0.052	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	127.4	177.3	-178.9	63.6	0	0	0	108.5	F165 W167 I201 Q470	F165-L194 HydrophobicContact CB-CD1 3.86Å; F165-L194 VanDerWaalsContact O-CD1 3.28Å; F165-L194 WeakPolarHBondContact O-CD1 3.12Å; F165-L194 WeakPolarHBondContact O-CD2 3.39Å; W167-L194 HydrophobicContact CZ2-CB 3.74Å; L194-I201 HydrophobicContact CD1-CB 3.93Å; L194-I201 HydrophobicContact CD1-CG1 4.21Å; L194-Q470 HydrophobicContact CD2-CB 3.98Å; L194-Q470 HydrophobicContact CD2-CG 4.27Å; L194-Q470 PolarHBondContact O-NE2 2.75Å
195	S	75.8	Confident	81.4	Confident	44 Å²	44	38.1 Å²	38.1	31%	0.308	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	109.1	-179.7	-169.5	0	0	0	0	110.6	F197 D198 S199 K200	S195-F197 VanDerWaalsContact C-N 3.27Å; S195-F197 PolarHBondContact O-N 3.34Å; S195-D198 PolarHBondContact O-N 2.86Å; S195-S199 PolarHBondContact O-N 3.29Å; S195-K200 PolarHBondContact N-O 3.14Å
196	E	64.9	Low	81.5	Confident	116 Å²	116	36.7 Å²	36.7	54%	0.542	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-38.5	-178.5	-68.5	175.8	-169.6	0	0	112.7	D198 Q470	E196-D198 VanDerWaalsContact C-N 3.35Å; E196-D198 PolarHBondContact O-N 2.96Å; E196-Q470 HydrophobicContact CG-CG 4.06Å; E196-Q470 WeakPolarHBondContact OE1-CG 3.25Å; E196-Q470 PolarHBondContact OE1-NE2 3.26Å
197	F	66.2	Low	81.8	Confident	165 Å²	165	35.1 Å²	35.1	72%	0.724	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-22.5	-176.3	-64.7	-76.9	0	0	0	113.6	N160 S195	N160-F197 PolarHBondContact ND2-O 3.18Å; S195-F197 VanDerWaalsContact C-N 3.27Å; S195-F197 PolarHBondContact O-N 3.34Å
198	D	64.8	Low	81.8	Confident	79 Å²	79	35.8 Å²	35.8	42%	0.422	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.6	-11.4	-162.7	-86.2	40.2	0	0	0	114.4	S195 E196 K200	S195-D198 PolarHBondContact O-N 2.86Å; E196-D198 VanDerWaalsContact C-N 3.35Å; E196-D198 PolarHBondContact O-N 2.96Å; D198-K200 HydrophobicContact CB-CB 4.2Å; D198-K200 HydrophobicContact CB-CD 3.75Å; D198-K200 HydrophobicContact CB-CG 3.95Å; D198-K200 PolarHBondContact O-N 2.9Å; D198-K200 WeakPolarHBondContact OD2-CE 3.28Å; D198-K200 IonicContact OD2-NZ 2.81Å; D198-K200 PolarHBondContact OD2-NZ 3.02Å
199	S	75.6	Confident	81.9	Confident	4 Å²	4	36.1 Å²	36.1	3%	0.028	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	46.7	48.5	-164.6	-85.4	0	0	0	0	113	N160 V163 F165 S195	N160-S199 WeakPolarHBondContact CA-OG 3.39Å; V163-S199 WeakPolarHBondContact O-CB 3.21Å; V163-S199 PolarHBondContact O-OG 3.14Å; F165-S199 WeakPolarHBondContact CD2-O 3.48Å; F165-S199 VanDerWaalsContact CE2-O 3.25Å; F165-S199 WeakPolarHBondContact CE2-O 3.39Å; S195-S199 PolarHBondContact O-N 3.29Å
200	K	84.5	Confident	81.8	Confident	66 Å²	66	38.7 Å²	38.7	29%	0.287	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	126.6	175.6	-68.3	168.1	-160.6	162.3	0	110.2	L99 V152 F153 S195 D198	L99-K200 HydrophobicContact CD1-CD 3.73Å; L99-K200 HydrophobicContact CD1-CG 3.86Å; V152-K200 HydrophobicContact CG1-CB 4.34Å; V152-K200 HydrophobicContact CG1-CD 4.4Å; F153-K200 CarbonylContact O-C 3.59Å; F153-K200 WeakPolarHBondContact O-CA 3.3Å; S195-K200 PolarHBondContact N-O 3.14Å; D198-K200 HydrophobicContact CB-CB 4.2Å; D198-K200 HydrophobicContact CB-CD 3.75Å; D198-K200 HydrophobicContact CB-CG 3.95Å; D198-K200 PolarHBondContact O-N 2.9Å; D198-K200 WeakPolarHBondContact OD2-CE 3.28Å; D198-K200 IonicContact OD2-NZ 2.81Å; D198-K200 PolarHBondContact OD2-NZ 3.02Å
201	I	86.4	Confident	81.5	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	113.3	174.9	-167.3	171.2	0	0	0	108.8	F54 F153 F165 W167 L194 F203	F54-I201 HydrophobicContact CB-CD1 4.2Å; F54-I201 HydrophobicContact CD1-CD1 4.22Å; F54-I201 HydrophobicContact CD1-CG2 4.12Å; F153-I201 HydrophobicContact CB-CG2 3.76Å; F153-I201 PolarHBondContact N-O 3.14Å; F153-I201 PolarHBondContact O-N 3.21Å; F165-I201 HydrophobicContact CB-CB 3.9Å; F165-I201 HydrophobicContact CB-CD1 4.23Å; F165-I201 HydrophobicContact CB-CG2 3.99Å; F165-I201 HydrophobicContact CD1-CG2 3.83Å; F165-I201 HydrophobicContact CD2-CG2 4.5Å; F165-I201 HydrophobicContact CE1-CG2 4.49Å; F165-I201 HydrophobicContact CG-CB 4.22Å; F165-I201 HydrophobicContact CG-CG2 3.83Å; W167-I201 HydrophobicContact CD2-CD1 3.98Å; W167-I201 HydrophobicContact CE3-CD1 3.71Å; W167-I201 HydrophobicContact CE3-CG1 4.34Å; W167-I201 HydrophobicContact CH2-CD1 3.8Å; W167-I201 HydrophobicContact CH2-CG1 3.47Å; W167-I201 VanDerWaalsContact CH2-CG1 3.47Å; W167-I201 HydrophobicContact CZ2-CD1 4.09Å; W167-I201 HydrophobicContact CZ2-CG1 3.82Å; W167-I201 HydrophobicContact CZ3-CD1 3.63Å; W167-I201 HydrophobicContact CZ3-CG1 3.79Å; L194-I201 HydrophobicContact CD1-CB 3.93Å; L194-I201 HydrophobicContact CD1-CG1 4.21Å; I201-F203 HydrophobicContact CD1-CE2 4.21Å; I201-F203 HydrophobicContact CD1-CZ 4.2Å; I201-F203 HydrophobicContact CG1-CE2 3.99Å; I201-F203 HydrophobicContact CG1-CZ 4.37Å; I201-F203 HydrophobicContact CG2-CE2 4.44Å
202	T	87.6	Confident	80.9	Confident	19 Å²	19	46 Å²	46	12%	0.117	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	120.2	-173.2	-58.4	0	0	0	0	110.2	L150 L151 V152 G192 S193 Y204	L150-T202 HydrophobicContact CB-CG2 4.39Å; L150-T202 HydrophobicContact CD2-CG2 4.25Å; L151-T202 WeakPolarHBondContact O-CA 3.43Å; V152-T202 HydrophobicContact CG2-CG2 4.05Å; G192-T202 CarbonylContact C-O 3.51Å; G192-T202 WeakPolarHBondContact CA-O 3.4Å; S193-T202 PolarHBondContact N-O 3.11Å; S193-T202 PolarHBondContact O-N 2.99Å; T202-Y204 HydrophobicContact CG2-CD2 4.12Å; T202-Y204 HydrophobicContact CG2-CE2 3.64Å
203	F	87	Confident	80.8	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	136.5	169	-59	-101.1	0	0	0	110.1	F54 L56 L150 L151 F153 W167 I174 P191 I201	F54-F203 AromaticContact CD1-CE2 3.71Å; F54-F203 HydrophobicContact CD1-CE2 3.71Å; F54-F203 AromaticContact CD1-CZ 3.88Å; F54-F203 HydrophobicContact CD1-CZ 3.88Å; F54-F203 AromaticContact CE1-CE2 3.59Å; F54-F203 HydrophobicContact CE1-CE2 3.59Å; F54-F203 HydrophobicContact CE1-CZ 4.04Å; L56-F203 HydrophobicContact CB-CE1 4.31Å; L56-F203 HydrophobicContact CB-CZ 4.25Å; L150-F203 CarbonylContact C-O 3.59Å; L150-F203 WeakPolarHBondContact CA-O 3.28Å; L151-F203 HydrophobicContact CB-CB 4.29Å; L151-F203 PolarHBondContact N-O 3.13Å; L151-F203 PolarHBondContact O-N 3.11Å; F153-F203 AromaticContact CD2-CD2 3.93Å; F153-F203 HydrophobicContact CD2-CD2 3.93Å; F153-F203 HydrophobicContact CD2-CE2 4.06Å; F153-F203 HydrophobicContact CE2-CD2 4Å; F153-F203 HydrophobicContact CE2-CE2 4.31Å; W167-F203 HydrophobicContact CE3-CE1 4.44Å; W167-F203 HydrophobicContact CE3-CZ 4.36Å; W167-F203 HydrophobicContact CH2-CE1 4.45Å; W167-F203 HydrophobicContact CH2-CZ 4.44Å; W167-F203 HydrophobicContact CZ3-CD1 4.27Å; W167-F203 AromaticContact CZ3-CE1 3.58Å; W167-F203 HydrophobicContact CZ3-CE1 3.58Å; W167-F203 HydrophobicContact CZ3-CE2 4.35Å; W167-F203 AromaticContact CZ3-CZ 3.62Å; W167-F203 HydrophobicContact CZ3-CZ 3.62Å; I174-F203 HydrophobicContact CD1-CB 3.98Å; I174-F203 HydrophobicContact CD1-CD1 4.29Å; I174-F203 HydrophobicContact CD1-CG 4.4Å; I174-F203 HydrophobicContact CG1-CB 4.04Å; I174-F203 HydrophobicContact CG1-CD1 3.42Å; I174-F203 VanDerWaalsContact CG1-CD1 3.42Å; I174-F203 HydrophobicContact CG1-CE1 4.13Å; I174-F203 HydrophobicContact CG1-CG 3.99Å; P191-F203 CarbonylContact O-C 3.47Å; P191-F203 WeakPolarHBondContact O-CA 3.34Å; I201-F203 HydrophobicContact CD1-CE2 4.21Å; I201-F203 HydrophobicContact CD1-CZ 4.2Å; I201-F203 HydrophobicContact CG1-CE2 3.99Å; I201-F203 HydrophobicContact CG1-CZ 4.37Å; I201-F203 HydrophobicContact CG2-CE2 4.44Å
204	Y	86.9	Confident	80.6	Confident	73 Å²	73	52.7 Å²	52.7	29%	0.286	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	85.5	-177.6	-67.3	-104.7	0	0	0	108.7	T148 C149 L150 V190 P191 T202 K206	T148-Y204 HydrophobicContact CG2-CD1 4.11Å; C149-Y204 CarbonylContact O-C 3.45Å; L150-Y204 HydrophobicContact CD2-CD1 3.27Å; L150-Y204 HydrophobicContact CD2-CE1 3.44Å; L150-Y204 VanDerWaalsContact CD2-CE1 3.44Å; L150-Y204 HydrophobicContact CD2-CG 3.94Å; V190-Y204 WeakPolarHBondContact CA-O 3.37Å; P191-Y204 WeakPolarHBondContact CD-O 3.43Å; P191-Y204 PolarHBondContact O-N 2.72Å; T202-Y204 HydrophobicContact CG2-CD2 4.12Å; T202-Y204 HydrophobicContact CG2-CE2 3.64Å; Y204-K206 PolarHBondContact O-N 2.79Å
205	V	85.7	Confident	80.3	Confident	19 Å²	19	53.6 Å²	53.6	12%	0.115	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	92.3	177.9	-170.2	0	0	0	0	108.9	M58 C149 L151 I174 I207	M58-V205 HydrophobicContact CE-CG1 4.39Å; C149-V205 HydrophobicContact CB-CB 4.47Å; C149-V205 PolarHBondContact N-O 3.47Å; C149-V205 PolarHBondContact O-N 3.32Å; L151-V205 HydrophobicContact CD1-CG2 3.69Å; L151-V205 HydrophobicContact CG-CG2 3.92Å; I174-V205 HydrophobicContact CD1-CG2 3.63Å; V205-I207 HydrophobicContact CG1-CG2 4.07Å
206	K	87.1	Confident	80.5	Confident	23 Å²	23	55.3 Å²	55.3	10%	0.1	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	125.6	175.9	-164.8	177.4	170	-157.5	0	109.7	E146 Q147 V188 D189 Y204 L464	E146-K206 WeakPolarHBondContact OE2-CE 3.38Å; E146-K206 IonicContact OE2-NZ 3.38Å; E146-K206 PolarHBondContact OE2-NZ 3.49Å; Q147-K206 CarbonylContact O-C 3.55Å; Q147-K206 WeakPolarHBondContact O-CA 3.42Å; V188-K206 HydrophobicContact CB-CB 4.05Å; V188-K206 HydrophobicContact CB-CD 4.18Å; V188-K206 HydrophobicContact CB-CG 3.84Å; V188-K206 WeakPolarHBondContact CB-O 3.44Å; V188-K206 HydrophobicContact CG1-CB 4.23Å; V188-K206 HydrophobicContact CG1-CD 3.59Å; V188-K206 HydrophobicContact CG1-CG 3.85Å; V188-K206 HydrophobicContact CG2-CG 4.3Å; V188-K206 PolarHBondContact N-O 2.82Å; D189-K206 HydrophobicContact CB-CB 4.21Å; D189-K206 PolarHBondContact N-O 3.44Å; D189-K206 WeakPolarHBondContact O-CB 3.06Å; D189-K206 PolarHBondContact O-N 2.82Å; Y204-K206 PolarHBondContact O-N 2.79Å; K206-L464 HydrophobicContact CD-CB 4.45Å; K206-L464 HydrophobicContact CD-CD2 3.76Å
207	I	86.3	Confident	81.3	Confident	30 Å²	30	54 Å²	54	15%	0.154	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	146	-177.3	58.5	179	0	0	0	111.1	E146 Q147 W185 D186 V205	E146-I207 CarbonylContact C-O 3.58Å; E146-I207 VanDerWaalsContact CA-O 3.31Å; E146-I207 WeakPolarHBondContact CA-O 3.41Å; Q147-I207 HydrophobicContact CB-CD1 4.44Å; Q147-I207 HydrophobicContact CB-CG1 3.91Å; Q147-I207 PolarHBondContact N-O 3.42Å; Q147-I207 PolarHBondContact O-N 2.81Å; W185-I207 HydrophobicContact CD2-CD1 3.84Å; W185-I207 HydrophobicContact CD2-CG1 4.34Å; W185-I207 HydrophobicContact CE3-CB 3.96Å; W185-I207 HydrophobicContact CE3-CD1 3.68Å; W185-I207 HydrophobicContact CE3-CG1 3.7Å; W185-I207 HydrophobicContact CG-CD1 4.35Å; W185-I207 HydrophobicContact CH2-CD1 4.44Å; W185-I207 HydrophobicContact CZ3-CD1 4.01Å; W185-I207 HydrophobicContact CZ3-CG1 3.97Å; D186-I207 CarbonylContact O-C 3.53Å; D186-I207 WeakPolarHBondContact O-CA 3.48Å; V205-I207 HydrophobicContact CG1-CG2 4.07Å
208	R	84.8	Confident	82	Confident	49 Å²	49	46.4 Å²	46.4	19%	0.185	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	135.9	173.6	-176	-170	-71.6	134.8	-4.8	109.4	E146 W185 D186 V188 N463	E146-R208 HydrophobicContact CG-CB 3.95Å; E146-R208 HydrophobicContact CG-CG 3.87Å; E146-R208 IonicContact OE1-CZ 3.11Å; E146-R208 IonicContact OE1-NE 3.76Å; E146-R208 PolarHBondContact OE1-NE 3.06Å; E146-R208 IonicContact OE1-NH2 3.48Å; E146-R208 PolarHBondContact OE1-NH2 3.24Å; W185-R208 CarbonylContact C-O 3.58Å; W185-R208 WeakPolarHBondContact CA-O 3.46Å; D186-R208 PolarHBondContact N-O 3.44Å; D186-R208 PolarHBondContact O-N 3.34Å; V188-R208 HydrophobicContact CG2-CB 3.64Å; R208-N463 VanDerWaalsContact CZ-OD1 3.25Å; R208-N463 PolarHBondContact NH2-OD1 3.01Å
209	R	86.1	Confident	82.8	Confident	21 Å²	21	42.9 Å²	42.9	8%	0.079	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	138.6	173	-168	-176.3	-54.6	-85.2	-5.4	110.8	D145 W185 P211 Y214	D145-R209 PolarHBondContact O-N 3.11Å; D145-R209 IonicContact OD1-CZ 3.46Å; D145-R209 IonicContact OD1-NE 2.66Å; D145-R209 PolarHBondContact OD1-NE 3.45Å; D145-R209 IonicContact OD1-NH2 2.7Å; D145-R209 IonicContact OD2-CZ 2.69Å; D145-R209 IonicContact OD2-NE 3.71Å; D145-R209 PolarHBondContact OD2-NE 2.92Å; D145-R209 IonicContact OD2-NH2 3.76Å; D145-R209 PolarHBondContact OD2-NH2 3.31Å; W185-R209 HydrophobicContact CE3-CB 4.04Å; W185-R209 VanDerWaalsContact CE3-N 3.33Å; W185-R209 HydrophobicContact CH2-CB 4.19Å; W185-R209 VanDerWaalsContact CH2-NH2 3.31Å; W185-R209 HydrophobicContact CZ3-CB 3.76Å; R209-P211 WeakPolarHBondContact O-CD 3.35Å; R209-Y214 HydrophobicContact CG-CD2 4.46Å; R209-Y214 HydrophobicContact CG-CE2 4.12Å
210	K	81	Confident	83.1	Confident	55 Å²	55	46.8 Å²	46.8	24%	0.239	23%	0.23	C	C	.	.			trans	-73.5	107.8	168.4	-72.7	170.8	177.6	166.2	0	108.6	S182 I184 W185 D186 L212	S182-K210 PolarHBondContact O-NZ 2.64Å; I184-K210 WeakPolarHBondContact O-CB 3.29Å; I184-K210 PolarHBondContact O-N 3.39Å; W185-K210 WeakPolarHBondContact O-CE 3.31Å; W185-K210 PolarHBondContact O-NZ 2.85Å; D186-K210 WeakPolarHBondContact OD1-CE 3.42Å; D186-K210 IonicContact OD1-NZ 2.84Å; D186-K210 PolarHBondContact OD1-NZ 3.01Å; D186-K210 WeakPolarHBondContact OD2-CE 3.42Å; D186-K210 WeakPolarHBondContact OD2-CG 3.44Å; D186-K210 IonicContact OD2-NZ 3.88Å; K210-L212 PolarHBondContact O-N 3.46Å
211	P	80.9	Confident	83.2	Confident	43 Å²	43	45.5 Å²	45.5	28%	0.279	23%	0.228	S	C	.	.			trans	-74.9	-28.5	-167.4	30.1	-35.5	0	0	0	112.4	P143 F144 R209 F213 Y214 T215	P143-P211 HydrophobicContact CG-CB 4.44Å; F144-P211 HydrophobicContact CD1-CB 3.56Å; F144-P211 HydrophobicContact CD1-CG 3.97Å; F144-P211 HydrophobicContact CE1-CB 3.56Å; F144-P211 HydrophobicContact CE1-CG 4.02Å; R209-P211 WeakPolarHBondContact O-CD 3.35Å; P211-F213 VanDerWaalsContact C-N 3.33Å; P211-F213 PolarHBondContact O-N 2.95Å; P211-F213 VanDerWaalsContact O-N 3.1Å; P211-Y214 CarbonylContact O-C 3.58Å; P211-Y214 WeakPolarHBondContact O-CA 3.16Å; P211-Y214 PolarHBondContact O-N 3.21Å; P211-T215 PolarHBondContact O-N 3.41Å; P211-T215 PolarHBondContact O-OG1 3.15Å; P211-T215 VanDerWaalsContact O-OG1 3.08Å
212	L	76.2	Confident	83.1	Confident	128 Å²	128	45.5 Å²	45.5	67%	0.67	23%	0.228	S	C	*	.	H	α-helix	trans	-47.2	-47.3	-166.1	-172.2	155.4	0	0	0	114.2	K210 Y214 T215 V216	K210-L212 PolarHBondContact O-N 3.46Å; L212-Y214 PolarHBondContact O-N 2.97Å; L212-T215 PolarHBondContact O-N 3.32Å; L212-V216 HydrophobicContact CD2-CG2 4.28Å; L212-V216 HydrophobicContact CG-CG2 4.48Å; L212-V216 WeakPolarHBondContact O-CB 3.45Å; L212-V216 WeakPolarHBondContact O-CG2 3.36Å; L212-V216 PolarHBondContact O-N 3.36Å
213	F	81.4	Confident	83	Confident	124 Å²	124	45.7 Å²	45.7	54%	0.544	23%	0.23	S	C	.	.	H	α-helix	trans	-56.8	-50.9	178.1	177.9	-91.5	0	0	0	111.6	P211 I217	P211-F213 VanDerWaalsContact C-N 3.33Å; P211-F213 PolarHBondContact O-N 2.95Å; P211-F213 VanDerWaalsContact O-N 3.1Å; F213-I217 HydrophobicContact CD1-CD1 4.4Å; F213-I217 HydrophobicContact CD2-CD1 3.65Å; F213-I217 HydrophobicContact CE1-CD1 4.18Å; F213-I217 HydrophobicContact CE2-CD1 3.39Å; F213-I217 HydrophobicContact CG-CD1 4.16Å; F213-I217 HydrophobicContact CZ-CD1 3.68Å; F213-I217 VanDerWaalsContact O-CB 3.31Å; F213-I217 WeakPolarHBondContact O-CB 3.49Å; F213-I217 WeakPolarHBondContact O-CG1 3.44Å; F213-I217 PolarHBondContact O-N 2.76Å
214	Y	81.7	Confident	83	Confident	38 Å²	38	51 Å²	51	15%	0.149	26%	0.256	C	S	.	.	H	α-helix	trans	-72.2	-35.5	179.2	-56.9	-81.4	0	0	0	112	F142 P143 R209 P211 L212 L218 I219 I263	F142-Y214 HydrophobicContact CE1-CD1 4.42Å; F142-Y214 AromaticContact CZ-CD1 3.78Å; F142-Y214 HydrophobicContact CZ-CD1 3.78Å; F142-Y214 AromaticContact CZ-CE1 3.91Å; F142-Y214 HydrophobicContact CZ-CE1 3.91Å; F142-Y214 HydrophobicContact CZ-CG 4.21Å; P143-Y214 HydrophobicContact CB-CD2 4.04Å; P143-Y214 HydrophobicContact CB-CG 3.95Å; R209-Y214 HydrophobicContact CG-CD2 4.46Å; R209-Y214 HydrophobicContact CG-CE2 4.12Å; P211-Y214 CarbonylContact O-C 3.58Å; P211-Y214 WeakPolarHBondContact O-CA 3.16Å; P211-Y214 PolarHBondContact O-N 3.21Å; L212-Y214 PolarHBondContact O-N 2.97Å; Y214-L218 WeakPolarHBondContact O-CA 3.26Å; Y214-L218 VanDerWaalsContact O-CB 3.24Å; Y214-L218 WeakPolarHBondContact O-CB 3.49Å; Y214-L218 PolarHBondContact O-N 3.38Å; Y214-I219 PolarHBondContact O-N 3.37Å; Y214-I263 HydrophobicContact CD1-CG2 4.5Å; Y214-I263 HydrophobicContact CE1-CG2 3.87Å
215	T	75.8	Confident	83	Confident	30 Å²	30	48.6 Å²	48.6	18%	0.184	25%	0.247	C	C	.	.	I	π-helix	trans	-63.6	-42.1	176.1	-50.1	0	0	0	0	111.5	P211 L212 I219 L220 F458	P211-T215 PolarHBondContact O-N 3.41Å; P211-T215 PolarHBondContact O-OG1 3.15Å; P211-T215 VanDerWaalsContact O-OG1 3.08Å; L212-T215 PolarHBondContact O-N 3.32Å; T215-I219 HydrophobicContact CG2-CB 4.5Å; T215-I219 HydrophobicContact CG2-CD1 4.48Å; T215-L220 WeakPolarHBondContact O-CB 3.23Å; T215-L220 PolarHBondContact O-N 3.22Å; T215-F458 HydrophobicContact CG2-CE1 4.21Å; T215-F458 HydrophobicContact CG2-CZ 4.41Å
216	V	79.1	Confident	83	Confident	80 Å²	80	47.8 Å²	47.8	49%	0.485	24%	0.242	S	C	.	.	I	π-helix	trans	-80.4	-37.8	-177.9	175.2	0	0	0	0	112.7	L212 P221	L212-V216 HydrophobicContact CD2-CG2 4.28Å; L212-V216 HydrophobicContact CG-CG2 4.48Å; L212-V216 WeakPolarHBondContact O-CB 3.45Å; L212-V216 WeakPolarHBondContact O-CG2 3.36Å; L212-V216 PolarHBondContact O-N 3.36Å; V216-P221 WeakPolarHBondContact O-CD 3.28Å
217	I	82.1	Confident	83.1	Confident	87 Å²	87	49.2 Å²	49.2	45%	0.446	25%	0.248	S	C	.	.	I	π-helix	trans	-91.3	-26.4	-174.8	-64	171.3	0	0	0	112.7	F213 P221	F213-I217 HydrophobicContact CD1-CD1 4.4Å; F213-I217 HydrophobicContact CD2-CD1 3.65Å; F213-I217 HydrophobicContact CE1-CD1 4.18Å; F213-I217 HydrophobicContact CE2-CD1 3.39Å; F213-I217 HydrophobicContact CG-CD1 4.16Å; F213-I217 HydrophobicContact CZ-CD1 3.68Å; F213-I217 VanDerWaalsContact O-CB 3.31Å; F213-I217 WeakPolarHBondContact O-CB 3.49Å; F213-I217 WeakPolarHBondContact O-CG1 3.44Å; F213-I217 PolarHBondContact O-N 2.76Å; I217-P221 WeakPolarHBondContact O-CG 3.43Å
218	L	80.6	Confident	83.3	Confident	6 Å²	6	51.6 Å²	51.6	3%	0.031	26%	0.26	C	S	.	.	I	π-helix	trans	-119.7	-48.8	-171.7	-171.1	53.5	0	0	0	113.4	Y214 T222 F256 V260 L274	Y214-L218 WeakPolarHBondContact O-CA 3.26Å; Y214-L218 VanDerWaalsContact O-CB 3.24Å; Y214-L218 WeakPolarHBondContact O-CB 3.49Å; Y214-L218 PolarHBondContact O-N 3.38Å; L218-T222 WeakPolarHBondContact O-CB 3.34Å; L218-T222 WeakPolarHBondContact O-CG2 3.07Å; L218-T222 PolarHBondContact O-N 2.93Å; L218-T222 PolarHBondContact O-OG1 3.49Å; L218-F256 HydrophobicContact CD1-CD1 3.75Å; L218-F256 HydrophobicContact CD1-CE1 4.28Å; L218-V260 HydrophobicContact CD1-CG2 3.74Å; L218-V260 HydrophobicContact CD2-CG2 3.94Å; L218-V260 HydrophobicContact CG-CG2 4.28Å; L218-L274 HydrophobicContact CD2-CD2 3.7Å; L218-L274 HydrophobicContact CG-CD2 4.17Å
219	I	81.3	Confident	83.3	Confident	5 Å²	5	49.6 Å²	49.6	3%	0.026	25%	0.254	C	S	.	.	I	π-helix	trans	-72.1	-51.5	178.8	-58.4	176.9	0	0	0	110.6	P143 F144 Y214 T215 T222 V223 L274 V457 F458	P143-I219 HydrophobicContact CG-CD1 3.86Å; F144-I219 HydrophobicContact CE2-CD1 4.06Å; F144-I219 HydrophobicContact CZ-CD1 4.21Å; Y214-I219 PolarHBondContact O-N 3.37Å; T215-I219 HydrophobicContact CG2-CB 4.5Å; T215-I219 HydrophobicContact CG2-CD1 4.48Å; I219-T222 PolarHBondContact O-N 3.37Å; I219-T222 PolarHBondContact O-OG1 3.43Å; I219-V223 HydrophobicContact CG2-CG2 3.93Å; I219-V223 WeakPolarHBondContact O-CB 3.47Å; I219-V223 VanDerWaalsContact O-CG2 3.28Å; I219-V223 WeakPolarHBondContact O-CG2 3.39Å; I219-V223 PolarHBondContact O-N 2.93Å; I219-L274 HydrophobicContact CG1-CD1 4.25Å; I219-V457 HydrophobicContact CD1-CG1 4.1Å; I219-V457 HydrophobicContact CG2-CG1 4.43Å; I219-F458 HydrophobicContact CG2-CZ 4.24Å
220	L	82.2	Confident	83.4	Confident	87 Å²	87	48.8 Å²	48.8	46%	0.455	25%	0.251	S	S	.	.	H	α-helix	trans	-58.8	-47.2	-175.4	176.5	64.9	0	0	0	113.1	T215 T222 V223 M224	T215-L220 WeakPolarHBondContact O-CB 3.23Å; T215-L220 PolarHBondContact O-N 3.22Å; L220-T222 PolarHBondContact O-N 3.34Å; L220-V223 PolarHBondContact O-N 2.93Å; L220-M224 HydrophobicContact CD1-CG 4.22Å; L220-M224 HydrophobicContact CD1-SD 4.13Å; L220-M224 HydrophobicContact CG-SD 4.13Å; L220-M224 WeakPolarHBondContact O-CB 3.48Å; L220-M224 VanDerWaalsContact O-CG 3.28Å; L220-M224 WeakPolarHBondContact O-CG 3.32Å; L220-M224 PolarHBondContact O-N 3.28Å
221	P	86.7	Confident	83.6	Confident	38 Å²	38	51.8 Å²	51.8	25%	0.247	27%	0.265	C	S	.	.	H	α-helix	trans	-67.5	-34.1	178.3	-24.3	38.4	0	0	0	113.1	V216 I217 M224 M225 F256	V216-P221 WeakPolarHBondContact O-CD 3.28Å; I217-P221 WeakPolarHBondContact O-CG 3.43Å; P221-M224 PolarHBondContact O-N 3.34Å; P221-M225 WeakPolarHBondContact O-CG 3.4Å; P221-M225 PolarHBondContact O-N 3.4Å; P221-F256 HydrophobicContact CB-CE1 4.32Å; P221-F256 HydrophobicContact CB-CZ 3.87Å
222	T	84.9	Confident	83.9	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-72.8	-36.9	178.9	57.1	0	0	0	0	111.7	L218 I219 L220 M225 A226 F256 L278	L218-T222 WeakPolarHBondContact O-CB 3.34Å; L218-T222 WeakPolarHBondContact O-CG2 3.07Å; L218-T222 PolarHBondContact O-N 2.93Å; L218-T222 PolarHBondContact O-OG1 3.49Å; I219-T222 PolarHBondContact O-N 3.37Å; I219-T222 PolarHBondContact O-OG1 3.43Å; L220-T222 PolarHBondContact O-N 3.34Å; T222-M225 HydrophobicContact CG2-CE 3.81Å; T222-M225 PolarHBondContact O-N 2.83Å; T222-A226 WeakPolarHBondContact O-CB 3.38Å; T222-A226 PolarHBondContact O-N 3.31Å; T222-F256 HydrophobicContact CG2-CB 4.21Å; T222-F256 HydrophobicContact CG2-CD1 3.93Å; T222-F256 HydrophobicContact CG2-CE1 4.43Å; T222-F256 HydrophobicContact CG2-CG 4Å; T222-L278 HydrophobicContact CG2-CD2 3.65Å
223	V	85.3	Confident	84.3	Confident	24 Å²	24	43.7 Å²	43.7	15%	0.145	22%	0.219	C	C	.	.	H	α-helix	trans	-62	-44.1	167.4	173.3	0	0	0	0	111.3	I219 L220 M225 A226 Y227 Y277 T454	I219-V223 HydrophobicContact CG2-CG2 3.93Å; I219-V223 WeakPolarHBondContact O-CB 3.47Å; I219-V223 VanDerWaalsContact O-CG2 3.28Å; I219-V223 WeakPolarHBondContact O-CG2 3.39Å; I219-V223 PolarHBondContact O-N 2.93Å; L220-V223 PolarHBondContact O-N 2.93Å; V223-M225 PolarHBondContact O-N 3.21Å; V223-A226 PolarHBondContact O-N 3.16Å; V223-Y227 HydrophobicContact CG1-CD2 3.87Å; V223-Y227 HydrophobicContact CG1-CE2 3.74Å; V223-Y227 VanDerWaalsContact O-CD2 3.29Å; V223-Y227 WeakPolarHBondContact O-CD2 3.39Å; V223-Y227 PolarHBondContact O-N 3.36Å; V223-Y277 HydrophobicContact CG2-CE1 4.12Å; V223-T454 HydrophobicContact CG1-CG2 3.92Å; V223-T454 HydrophobicContact CG2-CG2 4.15Å
224	M	86.9	Confident	84.5	Confident	112 Å²	112	44.6 Å²	44.6	55%	0.552	22%	0.22	S	C	*	.	H	α-helix	trans	-62.6	-42.7	176.9	-73.4	177.6	72.6	0	0	112.2	L220 P221 Y227 L228	L220-M224 HydrophobicContact CD1-CG 4.22Å; L220-M224 HydrophobicContact CD1-SD 4.13Å; L220-M224 HydrophobicContact CG-SD 4.13Å; L220-M224 WeakPolarHBondContact O-CB 3.48Å; L220-M224 VanDerWaalsContact O-CG 3.28Å; L220-M224 WeakPolarHBondContact O-CG 3.32Å; L220-M224 PolarHBondContact O-N 3.28Å; P221-M224 PolarHBondContact O-N 3.34Å; M224-Y227 PolarHBondContact O-N 3Å; M224-L228 WeakPolarHBondContact O-CG 3.17Å; M224-L228 PolarHBondContact O-N 3.4Å
225	M	87.1	Confident	84.6	Confident	21 Å²	21	45.7 Å²	45.7	10%	0.103	23%	0.229	C	C	.	.	H	α-helix	trans	-61.8	-41.5	172.7	-70.9	-172.6	-57.7	0	0	112.1	P221 T222 V223 Y227 L228 S229 L249 A252 L253 F256	P221-M225 WeakPolarHBondContact O-CG 3.4Å; P221-M225 PolarHBondContact O-N 3.4Å; T222-M225 HydrophobicContact CG2-CE 3.81Å; T222-M225 PolarHBondContact O-N 2.83Å; V223-M225 PolarHBondContact O-N 3.21Å; M225-Y227 PolarHBondContact O-N 3.44Å; M225-L228 PolarHBondContact O-N 3.45Å; M225-L228 VanDerWaalsContact O-N 3.09Å; M225-S229 PolarHBondContact O-N 2.88Å; M225-L249 HydrophobicContact CB-CD2 4.31Å; M225-L249 HydrophobicContact CG-CD2 4.19Å; M225-A252 HydrophobicContact SD-CB 3.73Å; M225-L253 HydrophobicContact CE-CD1 4.04Å; M225-F256 HydrophobicContact CE-CB 4.44Å; M225-F256 HydrophobicContact CE-CD2 3.3Å; M225-F256 HydrophobicContact CE-CE2 3.64Å; M225-F256 HydrophobicContact CE-CG 3.97Å; M225-F256 HydrophobicContact SD-CD2 3.98Å; M225-F256 HydrophobicContact SD-CE2 3.99Å
226	A	86.3	Confident	84.9	Confident	2 Å²	2	48.1 Å²	48.1	2%	0.017	25%	0.245	C	C	.	.	H	α-helix	trans	-65.4	-23.8	177.7	0	0	0	0	0	113.6	T222 V223 S229 V230 Y277 T281 T450	T222-A226 WeakPolarHBondContact O-CB 3.38Å; T222-A226 PolarHBondContact O-N 3.31Å; V223-A226 PolarHBondContact O-N 3.16Å; A226-S229 PolarHBondContact O-OG 3.24Å; A226-V230 WeakPolarHBondContact O-CG2 3.28Å; A226-Y277 WeakPolarHBondContact CB-OH 3.49Å; A226-T281 HydrophobicContact CB-CG2 3.7Å; A226-T450 HydrophobicContact CB-CG2 3.99Å; A226-T450 WeakPolarHBondContact O-CG2 3.19Å; A226-T450 PolarHBondContact O-OG1 2.89Å
227	Y	89	Confident	84.7	Confident	53 Å²	53	44.6 Å²	44.6	21%	0.208	22%	0.224	C	C	.	.	H	α-helix	trans	-85.8	-34.5	167.7	-78.3	-69.3	0	0	0	112.5	V223 M224 M225 S229 V230 F231 F447 T450 T454	V223-Y227 HydrophobicContact CG1-CD2 3.87Å; V223-Y227 HydrophobicContact CG1-CE2 3.74Å; V223-Y227 VanDerWaalsContact O-CD2 3.29Å; V223-Y227 WeakPolarHBondContact O-CD2 3.39Å; V223-Y227 PolarHBondContact O-N 3.36Å; M224-Y227 PolarHBondContact O-N 3Å; M225-Y227 PolarHBondContact O-N 3.44Å; Y227-S229 VanDerWaalsContact C-N 3.34Å; Y227-S229 PolarHBondContact O-N 3.19Å; Y227-V230 WeakPolarHBondContact O-CB 3.12Å; Y227-V230 PolarHBondContact O-N 3.14Å; Y227-F231 WeakPolarHBondContact O-CD2 3.19Å; Y227-F231 PolarHBondContact O-N 3.17Å; Y227-F447 HydrophobicContact CD1-CD2 4.38Å; Y227-F447 HydrophobicContact CD1-CE2 4.19Å; Y227-F447 HydrophobicContact CE1-CD2 4.16Å; Y227-F447 AromaticContact CE1-CE2 3.79Å; Y227-F447 HydrophobicContact CE1-CE2 3.79Å; Y227-T450 HydrophobicContact CD1-CG2 3.98Å; Y227-T450 HydrophobicContact CD2-CG2 4.3Å; Y227-T450 HydrophobicContact CE1-CG2 3.8Å; Y227-T450 HydrophobicContact CE2-CG2 4.13Å; Y227-T450 HydrophobicContact CG-CG2 4.22Å; Y227-T454 HydrophobicContact CE2-CG2 4.18Å
228	L	89.3	Confident	84.3	Confident	80 Å²	80	41.9 Å²	41.9	42%	0.419	22%	0.217	S	C	.	.	H	α-helix	trans	-62.6	-36.9	175.4	-74.8	170.1	0	0	0	112.7	M224 M225 V230 F231 V232 L249	M224-L228 WeakPolarHBondContact O-CG 3.17Å; M224-L228 PolarHBondContact O-N 3.4Å; M225-L228 PolarHBondContact O-N 3.45Å; M225-L228 VanDerWaalsContact O-N 3.09Å; L228-V230 VanDerWaalsContact C-N 3.34Å; L228-V230 PolarHBondContact O-N 3.2Å; L228-F231 PolarHBondContact O-N 3.25Å; L228-F231 VanDerWaalsContact O-N 3.13Å; L228-V232 PolarHBondContact O-N 3.28Å; L228-L249 HydrophobicContact CB-CD1 3.92Å; L228-L249 HydrophobicContact CB-CD2 3.89Å; L228-L249 HydrophobicContact CD1-CD2 4.17Å
229	S	86.4	Confident	84.3	Confident	7 Å²	7	42.9 Å²	42.9	5%	0.049	23%	0.227	C	C	.	.	H	α-helix	trans	-65.2	-36.2	174.2	61	0	0	0	0	111.9	M225 A226 Y227 F231 V232	M225-S229 PolarHBondContact O-N 2.88Å; A226-S229 PolarHBondContact O-OG 3.24Å; Y227-S229 VanDerWaalsContact C-N 3.34Å; Y227-S229 PolarHBondContact O-N 3.19Å; S229-F231 VanDerWaalsContact C-N 3.33Å; S229-F231 PolarHBondContact O-N 3.24Å; S229-V232 VanDerWaalsContact O-CB 3.31Å; S229-V232 WeakPolarHBondContact O-CB 3.33Å; S229-V232 WeakPolarHBondContact O-CG2 3.42Å; S229-V232 PolarHBondContact O-N 3.13Å
230	V	87	Confident	84	Confident	5 Å²	5	44.8 Å²	44.8	3%	0.03	24%	0.241	C	C	.	.	H	α-helix	trans	-63.4	-38.9	170.4	-177.5	0	0	0	0	111.3	A226 Y227 L228 V232 F233 L443 F446 F447 T450	A226-V230 WeakPolarHBondContact O-CG2 3.28Å; Y227-V230 WeakPolarHBondContact O-CB 3.12Å; Y227-V230 PolarHBondContact O-N 3.14Å; L228-V230 VanDerWaalsContact C-N 3.34Å; L228-V230 PolarHBondContact O-N 3.2Å; V230-V232 PolarHBondContact O-N 3.48Å; V230-F233 PolarHBondContact O-N 3.02Å; V230-L443 HydrophobicContact CG1-CG 4.47Å; V230-F446 HydrophobicContact CG2-CB 4.16Å; V230-F447 HydrophobicContact CG1-CB 3.8Å; V230-F447 HydrophobicContact CG1-CD2 4.2Å; V230-T450 WeakPolarHBondContact CG2-OG1 3.04Å
231	F	86.1	Confident	84	Confident	118 Å²	118	45.7 Å²	45.7	52%	0.518	24%	0.242	S	C	.	.	H	α-helix	trans	-67.4	-15.5	177.3	-76.8	-65.2	0	0	0	114.1	Y227 L228 S229 F233 Y234	Y227-F231 WeakPolarHBondContact O-CD2 3.19Å; Y227-F231 PolarHBondContact O-N 3.17Å; L228-F231 PolarHBondContact O-N 3.25Å; L228-F231 VanDerWaalsContact O-N 3.13Å; S229-F231 VanDerWaalsContact C-N 3.33Å; S229-F231 PolarHBondContact O-N 3.24Å; F231-F233 PolarHBondContact O-N 3.27Å; F231-Y234 VanDerWaalsContact O-CB 3.3Å; F231-Y234 WeakPolarHBondContact O-CB 3.39Å; F231-Y234 PolarHBondContact O-N 3.39Å
232	V	86	Confident	83.9	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-56.9	-36.6	169.9	-180	0	0	0	0	111	L228 S229 V230 Y234 L235 K242 L245 L249	L228-V232 PolarHBondContact O-N 3.28Å; S229-V232 VanDerWaalsContact O-CB 3.31Å; S229-V232 WeakPolarHBondContact O-CB 3.33Å; S229-V232 WeakPolarHBondContact O-CG2 3.42Å; S229-V232 PolarHBondContact O-N 3.13Å; V230-V232 PolarHBondContact O-N 3.48Å; V232-Y234 VanDerWaalsContact C-N 3.27Å; V232-Y234 PolarHBondContact O-N 2.74Å; V232-L235 PolarHBondContact O-N 2.74Å; V232-K242 HydrophobicContact CG1-CB 4.08Å; V232-K242 HydrophobicContact CG1-CG 4.21Å; V232-K242 WeakPolarHBondContact O-CE 3.28Å; V232-K242 PolarHBondContact O-NZ 3.44Å; V232-L245 HydrophobicContact CG2-CD2 4.01Å; V232-L245 HydrophobicContact CG2-CG 4.09Å; V232-L249 HydrophobicContact CG2-CD1 4.35Å
233	F	85.9	Confident	83.9	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-14.2	175.2	-60.9	-69.6	0	0	0	114.1	V230 F231 A288 T291 L442 L443 F446	V230-F233 PolarHBondContact O-N 3.02Å; F231-F233 PolarHBondContact O-N 3.27Å; F233-A288 HydrophobicContact CE2-CB 3.96Å; F233-A288 HydrophobicContact CZ-CB 3.9Å; F233-T291 WeakPolarHBondContact CZ-OG1 3.4Å; F233-L442 HydrophobicContact CD1-CB 3.81Å; F233-L442 HydrophobicContact CD1-CD1 4.27Å; F233-L442 HydrophobicContact CE1-CB 3.74Å; F233-L442 HydrophobicContact CE1-CD1 3.8Å; F233-L442 HydrophobicContact CE1-CG 4.37Å; F233-L442 HydrophobicContact CG-CB 4.26Å; F233-L442 HydrophobicContact CZ-CB 4.13Å; F233-L443 HydrophobicContact CB-CB 3.74Å; F233-L443 HydrophobicContact CB-CD1 4.38Å; F233-L443 HydrophobicContact CB-CG 4.24Å; F233-F446 HydrophobicContact CD2-CB 4.45Å; F233-F446 HydrophobicContact CD2-CD2 4.12Å; F233-F446 HydrophobicContact CD2-CG 4.46Å; F233-F446 HydrophobicContact CE2-CB 4.13Å; F233-F446 HydrophobicContact CE2-CD1 4.41Å; F233-F446 AromaticContact CE2-CD2 3.26Å; F233-F446 HydrophobicContact CE2-CD2 3.26Å; F233-F446 AromaticContact CE2-CE2 3.68Å; F233-F446 HydrophobicContact CE2-CE2 3.68Å; F233-F446 AromaticContact CE2-CG 3.69Å; F233-F446 HydrophobicContact CE2-CG 3.69Å; F233-F446 HydrophobicContact CE2-CZ 4.42Å; F233-F446 AromaticContact CZ-CD2 3.56Å; F233-F446 HydrophobicContact CZ-CD2 3.56Å; F233-F446 AromaticContact CZ-CE2 3.49Å; F233-F446 HydrophobicContact CZ-CE2 3.49Å; F233-F446 VanDerWaalsContact CZ-CE2 3.49Å; F233-F446 HydrophobicContact CZ-CG 4.37Å; F233-F446 HydrophobicContact CZ-CZ 4.25Å
234	Y	84.9	Confident	83.9	Confident	143 Å²	143	44.1 Å²	44.1	56%	0.561	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-30.2	175.7	-173.1	-85.2	0	0	0	112.3	F231 V232 R440 L443	F231-Y234 VanDerWaalsContact O-CB 3.3Å; F231-Y234 WeakPolarHBondContact O-CB 3.39Å; F231-Y234 PolarHBondContact O-N 3.39Å; V232-Y234 VanDerWaalsContact C-N 3.27Å; V232-Y234 PolarHBondContact O-N 2.74Å; Y234-R440 PolarHBondContact O-NH2 3.22Å; Y234-L443 HydrophobicContact CD2-CD1 4.19Å
235	L	84	Confident	83.9	Confident	62 Å²	62	41.9 Å²	41.9	33%	0.325	22%	0.222	S	C	.	.	S	Bend	trans	-60.9	154.1	173.2	-71.1	166	0	0	0	111.2	V232 K242 L245	V232-L235 PolarHBondContact O-N 2.74Å; L235-K242 VanDerWaalsContact C-CE 3.43Å; L235-K242 HydrophobicContact CB-CD 4.5Å; L235-K242 HydrophobicContact CB-CG 4.06Å; L235-K242 HydrophobicContact CD1-CG 4.28Å; L235-K242 WeakPolarHBondContact O-CE 3.24Å; L235-K242 PolarHBondContact O-NZ 3.32Å; L235-L245 HydrophobicContact CD1-CD2 4.01Å
236	P	81	Confident	83.9	Confident	81 Å²	81	40.9 Å²	40.9	53%	0.526	22%	0.217	S	C	.	.			trans	-69.5	142.1	179.7	28.7	-34.4	0	0	0	112.1	G238 A239 K242	P236-G238 PolarHBondContact O-N 3.14Å; P236-A239 HydrophobicContact CG-CB 4.22Å; P236-A239 WeakPolarHBondContact O-CB 3.36Å; P236-A239 PolarHBondContact O-N 3.37Å; P236-K242 VanDerWaalsContact O-CE 3.3Å; P236-K242 WeakPolarHBondContact O-CE 3.49Å
237	A	74.7	Confident	83.8	Confident	5 Å²	5	41 Å²	41	4%	0.041	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.9	-27	-175.5	0	0	0	0	0	116.1	V295 L296 Y299 D439	A237-V295 HydrophobicContact CB-CG1 4.27Å; A237-L296 VanDerWaalsContact O-CD2 3.25Å; A237-L296 WeakPolarHBondContact O-CD2 3.46Å; A237-Y299 HydrophobicContact CB-CD2 3.71Å; A237-Y299 HydrophobicContact CB-CE2 4.25Å; A237-Y299 HydrophobicContact CB-CG 4.43Å; A237-D439 WeakPolarHBondContact CA-OD2 3.26Å; A237-D439 VanDerWaalsContact CB-OD2 3.23Å; A237-D439 WeakPolarHBondContact CB-OD2 3.5Å; A237-D439 PolarHBondContact N-OD2 3.08Å
238	G	73.9	Confident	83.7	Confident	30 Å²	30	42.3 Å²	42.3	31%	0.309	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	2.2	-179.3	0	0	0	0	0	115.9	P236 Y299	P236-G238 PolarHBondContact O-N 3.14Å; G238-Y299 VanDerWaalsContact CA-CZ 3.48Å
239	A	82.4	Confident	83.8	Confident	28 Å²	28	39.2 Å²	39.2	23%	0.231	21%	0.212	C	C	.	.			trans	-78.3	119.4	177.7	0	0	0	0	0	111.2	P236 E241 K242	P236-A239 HydrophobicContact CG-CB 4.22Å; P236-A239 WeakPolarHBondContact O-CB 3.36Å; P236-A239 PolarHBondContact O-N 3.37Å; A239-E241 VanDerWaalsContact C-N 3.29Å; A239-E241 PolarHBondContact O-N 3.2Å; A239-K242 HydrophobicContact CB-CG 4.45Å; A239-K242 PolarHBondContact O-N 3.04Å
240	S	73.2	Confident	83.9	Confident	45 Å²	45	39 Å²	39	32%	0.315	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.6	-48.8	172.4	43.1	0	0	0	0	111.8	K242 I243 E708	S240-K242 PolarHBondContact O-N 3.31Å; S240-I243 PolarHBondContact O-N 3.02Å; S240-E708 WeakPolarHBondContact CB-OE1 3.5Å; S240-E708 WeakPolarHBondContact O-CG 3.4Å
241	E	82.2	Confident	83.9	Confident	106 Å²	106	40.6 Å²	40.6	50%	0.495	22%	0.218	S	C	.	.	H	α-helix	trans	-58.5	-10.6	-174.5	-50.6	-43.6	127.7	0	0	115.3	A239 I243 T244 L245	A239-E241 VanDerWaalsContact C-N 3.29Å; A239-E241 PolarHBondContact O-N 3.2Å; E241-I243 VanDerWaalsContact C-N 3.34Å; E241-I243 PolarHBondContact O-N 3.23Å; E241-T244 PolarHBondContact O-N 3.4Å; E241-T244 PolarHBondContact OE2-OG1 2.88Å; E241-L245 VanDerWaalsContact O-CB 3.28Å; E241-L245 WeakPolarHBondContact O-CB 3.46Å; E241-L245 PolarHBondContact O-N 2.59Å
242	K	85.9	Confident	84	Confident	1 Å²	1	36.7 Å²	36.7	0%	0.004	21%	0.208	C	C	.	.	H	α-helix	trans	-55.3	-47.6	171.9	-80.4	-165.9	167.2	-160.8	0	112.3	V232 L235 P236 A239 S240 S246 T292 D439	V232-K242 HydrophobicContact CG1-CB 4.08Å; V232-K242 HydrophobicContact CG1-CG 4.21Å; V232-K242 WeakPolarHBondContact O-CE 3.28Å; V232-K242 PolarHBondContact O-NZ 3.44Å; L235-K242 VanDerWaalsContact C-CE 3.43Å; L235-K242 HydrophobicContact CB-CD 4.5Å; L235-K242 HydrophobicContact CB-CG 4.06Å; L235-K242 HydrophobicContact CD1-CG 4.28Å; L235-K242 WeakPolarHBondContact O-CE 3.24Å; L235-K242 PolarHBondContact O-NZ 3.32Å; P236-K242 VanDerWaalsContact O-CE 3.3Å; P236-K242 WeakPolarHBondContact O-CE 3.49Å; A239-K242 HydrophobicContact CB-CG 4.45Å; A239-K242 PolarHBondContact O-N 3.04Å; S240-K242 PolarHBondContact O-N 3.31Å; K242-S246 PolarHBondContact O-N 2.8Å; K242-S246 VanDerWaalsContact O-N 3.11Å; K242-T292 HydrophobicContact CB-CG2 3.98Å; K242-T292 HydrophobicContact CD-CG2 4.27Å; K242-D439 IonicContact NZ-OD1 3.28Å; K242-D439 PolarHBondContact NZ-OD1 3.49Å; K242-D439 IonicContact NZ-OD2 3.21Å; K242-D439 PolarHBondContact NZ-OD2 3.09Å
243	I	84.2	Confident	84	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-69.8	-46.9	-179.8	-69.5	179.2	0	0	0	109.3	S240 E241 L245 S246 V247 T292 I293 L296 L702 E708 L712	S240-I243 PolarHBondContact O-N 3.02Å; E241-I243 VanDerWaalsContact C-N 3.34Å; E241-I243 PolarHBondContact O-N 3.23Å; I243-L245 VanDerWaalsContact C-N 3.29Å; I243-L245 PolarHBondContact O-N 2.81Å; I243-S246 PolarHBondContact O-N 3.48Å; I243-V247 HydrophobicContact CG2-CG2 3.87Å; I243-V247 WeakPolarHBondContact O-CB 3.36Å; I243-V247 VanDerWaalsContact O-CG2 3.23Å; I243-V247 WeakPolarHBondContact O-CG2 3.35Å; I243-V247 PolarHBondContact O-N 3.13Å; I243-T292 HydrophobicContact CG1-CG2 4.14Å; I243-I293 HydrophobicContact CD1-CG1 4.18Å; I243-L296 HydrophobicContact CD1-CD1 3.46Å; I243-L296 VanDerWaalsContact CD1-CD1 3.46Å; I243-L296 HydrophobicContact CG1-CD1 3.76Å; I243-L702 HydrophobicContact CD1-CD1 3.62Å; I243-L702 HydrophobicContact CD1-CD2 3.8Å; I243-L702 HydrophobicContact CD1-CG 4.41Å; I243-E708 HydrophobicContact CB-CB 4.2Å; I243-E708 HydrophobicContact CB-CG 4.25Å; I243-E708 HydrophobicContact CD1-CB 4.02Å; I243-E708 HydrophobicContact CG2-CB 4.3Å; I243-L712 HydrophobicContact CG2-CB 4.09Å; I243-L712 HydrophobicContact CG2-CD1 4.11Å
244	T	85.6	Confident	84	Confident	26 Å²	26	36.8 Å²	36.8	16%	0.16	21%	0.208	C	C	.	.	H	α-helix	trans	-51.9	-47.7	176.9	-41	0	0	0	0	111.7	E241 N248 E708 T711	E241-T244 PolarHBondContact O-N 3.4Å; E241-T244 PolarHBondContact OE2-OG1 2.88Å; T244-N248 VanDerWaalsContact O-CB 3.24Å; T244-N248 WeakPolarHBondContact O-CB 3.37Å; T244-N248 PolarHBondContact O-N 3.21Å; T244-N248 PolarHBondContact O-ND2 2.9Å; T244-E708 PolarHBondContact OG1-OE2 2.87Å; T244-T711 HydrophobicContact CG2-CG2 4.37Å
245	L	87.9	Confident	84	Confident	66 Å²	66	33.9 Å²	33.9	35%	0.346	21%	0.205	S	C	.	.	H	α-helix	trans	-64.9	-52.1	178.7	179.3	59.2	0	0	0	112.4	V232 L235 E241 I243 V247 N248 L249	V232-L245 HydrophobicContact CG2-CD2 4.01Å; V232-L245 HydrophobicContact CG2-CG 4.09Å; L235-L245 HydrophobicContact CD1-CD2 4.01Å; E241-L245 VanDerWaalsContact O-CB 3.28Å; E241-L245 WeakPolarHBondContact O-CB 3.46Å; E241-L245 PolarHBondContact O-N 2.59Å; I243-L245 VanDerWaalsContact C-N 3.29Å; I243-L245 PolarHBondContact O-N 2.81Å; L245-V247 VanDerWaalsContact C-N 3.35Å; L245-V247 PolarHBondContact O-N 3.44Å; L245-N248 PolarHBondContact O-N 3.48Å; L245-L249 HydrophobicContact CD1-CD1 4.3Å; L245-L249 HydrophobicContact CD1-CG 4.42Å; L245-L249 HydrophobicContact CG-CD1 4.23Å; L245-L249 WeakPolarHBondContact O-CG 3.42Å; L245-L249 PolarHBondContact O-N 2.97Å
246	S	85.6	Confident	83.9	Confident	0 Å²	0	33 Å²	33	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-64.6	-38.3	-177.7	-147.5	0	0	0	0	112	K242 I243 L249 L250 D285	K242-S246 PolarHBondContact O-N 2.8Å; K242-S246 VanDerWaalsContact O-N 3.11Å; I243-S246 PolarHBondContact O-N 3.48Å; S246-L249 PolarHBondContact O-N 2.89Å; S246-L250 PolarHBondContact O-N 3.48Å; S246-D285 PolarHBondContact OG-OD1 3.33Å
247	V	84.7	Confident	83.9	Confident	5 Å²	5	29.8 Å²	29.8	3%	0.03	18%	0.177	C	C	.	.	H	α-helix	trans	-74.2	-30.4	178.7	-175.4	0	0	0	0	111.8	I243 L245 L250 L251 I289 L712 N715	I243-V247 HydrophobicContact CG2-CG2 3.87Å; I243-V247 WeakPolarHBondContact O-CB 3.36Å; I243-V247 VanDerWaalsContact O-CG2 3.23Å; I243-V247 WeakPolarHBondContact O-CG2 3.35Å; I243-V247 PolarHBondContact O-N 3.13Å; L245-V247 VanDerWaalsContact C-N 3.35Å; L245-V247 PolarHBondContact O-N 3.44Å; V247-L250 PolarHBondContact O-N 3.05Å; V247-L251 PolarHBondContact O-N 3.22Å; V247-I289 HydrophobicContact CG2-CD1 3.91Å; V247-I289 HydrophobicContact CG2-CG1 4.16Å; V247-I289 HydrophobicContact CG2-CG2 4.39Å; V247-L712 HydrophobicContact CG2-CD1 3.61Å; V247-N715 HydrophobicContact CG1-CB 3.41Å; V247-N715 VanDerWaalsContact CG1-CB 3.41Å
248	N	87.9	Confident	84	Confident	79 Å²	79	31.2 Å²	31.2	42%	0.422	18%	0.184	S	C	.	.	H	α-helix	trans	-70.4	-35.1	171.6	-72.8	-11.7	0	0	0	112.1	T244 L245 L251 A252 N715	T244-N248 VanDerWaalsContact O-CB 3.24Å; T244-N248 WeakPolarHBondContact O-CB 3.37Å; T244-N248 PolarHBondContact O-N 3.21Å; T244-N248 PolarHBondContact O-ND2 2.9Å; L245-N248 PolarHBondContact O-N 3.48Å; N248-L251 PolarHBondContact O-N 2.99Å; N248-A252 WeakPolarHBondContact O-CB 2.76Å; N248-A252 PolarHBondContact O-N 3.43Å; N248-N715 PolarHBondContact OD1-ND2 3.21Å
249	L	90	Very high	84.3	Confident	16 Å²	16	33.3 Å²	33.3	8%	0.084	19%	0.187	C	C	.	.	H	α-helix	trans	-63	-43.5	169.9	-71.5	167.5	0	0	0	111	M225 L228 V232 L245 S246 L251 A252 L253	M225-L249 HydrophobicContact CB-CD2 4.31Å; M225-L249 HydrophobicContact CG-CD2 4.19Å; L228-L249 HydrophobicContact CB-CD1 3.92Å; L228-L249 HydrophobicContact CB-CD2 3.89Å; L228-L249 HydrophobicContact CD1-CD2 4.17Å; V232-L249 HydrophobicContact CG2-CD1 4.35Å; L245-L249 HydrophobicContact CD1-CD1 4.3Å; L245-L249 HydrophobicContact CD1-CG 4.42Å; L245-L249 HydrophobicContact CG-CD1 4.23Å; L245-L249 WeakPolarHBondContact O-CG 3.42Å; L245-L249 PolarHBondContact O-N 2.97Å; S246-L249 PolarHBondContact O-N 2.89Å; L249-L251 PolarHBondContact O-N 3.06Å; L249-A252 PolarHBondContact O-N 3.4Å; L249-L253 WeakPolarHBondContact O-CB 3.39Å; L249-L253 PolarHBondContact O-N 3.42Å
250	L	88.3	Confident	84.1	Confident	3 Å²	3	32.3 Å²	32.3	2%	0.016	18%	0.178	C	C	.	.	H	α-helix	trans	-60.5	-45.2	176.2	-171.3	69.6	0	0	0	111.6	S246 V247 A252 L253 V254 F282 D285 V286 I289 M692 L695	S246-L250 PolarHBondContact O-N 3.48Å; V247-L250 PolarHBondContact O-N 3.05Å; L250-A252 PolarHBondContact O-N 3.09Å; L250-L253 PolarHBondContact O-N 3.21Å; L250-V254 WeakPolarHBondContact O-CG2 3.23Å; L250-V254 PolarHBondContact O-N 3.3Å; L250-F282 HydrophobicContact CD1-CD2 3.69Å; L250-F282 HydrophobicContact CD1-CE2 3.46Å; L250-F282 VanDerWaalsContact CD1-CE2 3.46Å; L250-F282 HydrophobicContact CD1-CG 4.34Å; L250-F282 HydrophobicContact CD1-CZ 3.92Å; L250-F282 HydrophobicContact CG-CE2 4.16Å; L250-D285 VanDerWaalsContact CA-OD2 3.22Å; L250-D285 WeakPolarHBondContact CA-OD2 3.23Å; L250-D285 WeakPolarHBondContact CB-OD2 3.25Å; L250-D285 HydrophobicContact CD1-CB 4.22Å; L250-D285 PolarHBondContact N-OD2 2.86Å; L250-V286 HydrophobicContact CD1-CG2 3.81Å; L250-V286 HydrophobicContact CD2-CG2 4.3Å; L250-I289 HydrophobicContact CB-CD1 4.14Å; L250-I289 HydrophobicContact CD2-CD1 3.69Å; L250-I289 HydrophobicContact CG-CD1 4.43Å; L250-M692 HydrophobicContact CD2-CE 3.78Å; L250-M692 HydrophobicContact CD2-SD 3.66Å; L250-M692 HydrophobicContact CG-SD 4.46Å; L250-L695 HydrophobicContact CD2-CD1 3.59Å
251	L	86.9	Confident	84.1	Confident	37 Å²	37	31.4 Å²	31.4	19%	0.194	17%	0.172	C	C	.	.	H	α-helix	trans	-63	-40.8	176.6	-177.4	64	0	0	0	112	V247 N248 L249 V254 V255 L718	V247-L251 PolarHBondContact O-N 3.22Å; N248-L251 PolarHBondContact O-N 2.99Å; L249-L251 PolarHBondContact O-N 3.06Å; L251-V254 PolarHBondContact O-N 3.46Å; L251-V255 WeakPolarHBondContact O-CG2 3.33Å; L251-V255 PolarHBondContact O-N 3.34Å; L251-V255 VanDerWaalsContact O-N 3.16Å; L251-L718 HydrophobicContact CD1-CG 4.47Å; L251-L718 HydrophobicContact CD2-CD2 3.75Å; L251-L718 HydrophobicContact CD2-CG 4.35Å
252	A	88	Confident	83.7	Confident	36 Å²	36	34 Å²	34	30%	0.298	18%	0.182	S	C	.	.	H	α-helix	trans	-62.4	-43.5	173.7	0	0	0	0	0	111.3	M225 N248 L249 L250 V254 V255 F256	M225-A252 HydrophobicContact SD-CB 3.73Å; N248-A252 WeakPolarHBondContact O-CB 2.76Å; N248-A252 PolarHBondContact O-N 3.43Å; L249-A252 PolarHBondContact O-N 3.4Å; L250-A252 PolarHBondContact O-N 3.09Å; A252-V254 PolarHBondContact O-N 3.32Å; A252-V255 WeakPolarHBondContact O-CB 3.37Å; A252-V255 PolarHBondContact O-N 2.97Å; A252-V255 VanDerWaalsContact O-N 3.08Å; A252-F256 WeakPolarHBondContact O-CD2 3.47Å; A252-F256 PolarHBondContact O-N 3.14Å
253	L	87.2	Confident	83.2	Confident	3 Å²	3	37.2 Å²	37.2	2%	0.016	20%	0.198	C	C	.	.	H	α-helix	trans	-65.2	-35.3	178.1	-172.8	63.4	0	0	0	112.7	M225 L249 L250 V255 F256 M257 L278 T281 F282	M225-L253 HydrophobicContact CE-CD1 4.04Å; L249-L253 WeakPolarHBondContact O-CB 3.39Å; L249-L253 PolarHBondContact O-N 3.42Å; L250-L253 PolarHBondContact O-N 3.21Å; L253-V255 VanDerWaalsContact C-N 3.35Å; L253-F256 PolarHBondContact O-N 3.01Å; L253-M257 WeakPolarHBondContact O-CG 3.37Å; L253-M257 PolarHBondContact O-N 2.87Å; L253-L278 HydrophobicContact CD1-CD2 3.79Å; L253-T281 HydrophobicContact CD1-CG2 4.31Å; L253-T281 HydrophobicContact CD2-CG2 3.82Å; L253-F282 VanDerWaalsContact CD2-CA 3.48Å; L253-F282 HydrophobicContact CD2-CB 3.83Å; L253-F282 HydrophobicContact CD2-CD2 4.17Å; L253-F282 HydrophobicContact CD2-CG 4.47Å; L253-F282 HydrophobicContact CG-CD2 4.46Å
254	V	85	Confident	82.7	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-58	-47.2	168.4	171.4	0	0	0	0	110.4	L250 L251 A252 F256 M257 L258 F282 V722 F723	L250-V254 WeakPolarHBondContact O-CG2 3.23Å; L250-V254 PolarHBondContact O-N 3.3Å; L251-V254 PolarHBondContact O-N 3.46Å; A252-V254 PolarHBondContact O-N 3.32Å; V254-F256 VanDerWaalsContact C-N 3.33Å; V254-F256 PolarHBondContact O-N 3.4Å; V254-M257 WeakPolarHBondContact O-CB 3.41Å; V254-M257 PolarHBondContact O-N 3.21Å; V254-M257 VanDerWaalsContact O-N 3.15Å; V254-L258 WeakPolarHBondContact O-CG 3.41Å; V254-L258 PolarHBondContact O-N 2.64Å; V254-F282 HydrophobicContact CG2-CE2 3.76Å; V254-V722 HydrophobicContact CG1-CG1 3.77Å; V254-F723 HydrophobicContact CB-CE2 4.48Å; V254-F723 HydrophobicContact CB-CZ 4.35Å; V254-F723 HydrophobicContact CG1-CD2 4.35Å; V254-F723 HydrophobicContact CG1-CE1 4.18Å; V254-F723 HydrophobicContact CG1-CE2 3.83Å; V254-F723 HydrophobicContact CG1-CZ 3.73Å; V254-F723 HydrophobicContact CG2-CE2 3.71Å; V254-F723 HydrophobicContact CG2-CZ 3.73Å
255	V	84.8	Confident	81.8	Confident	82 Å²	82	39.8 Å²	39.8	50%	0.497	22%	0.215	S	C	.	.	H	α-helix	trans	-63.2	-37.5	178.2	175	0	0	0	0	111.9	L251 A252 L253 L258 L259	L251-V255 WeakPolarHBondContact O-CG2 3.33Å; L251-V255 PolarHBondContact O-N 3.34Å; L251-V255 VanDerWaalsContact O-N 3.16Å; A252-V255 WeakPolarHBondContact O-CB 3.37Å; A252-V255 PolarHBondContact O-N 2.97Å; A252-V255 VanDerWaalsContact O-N 3.08Å; L253-V255 VanDerWaalsContact C-N 3.35Å; V255-L258 PolarHBondContact O-N 2.93Å; V255-L259 PolarHBondContact O-N 3.42Å
256	F	83.3	Confident	80.7	Confident	44 Å²	44	38.7 Å²	38.7	19%	0.193	21%	0.212	C	C	.	.	H	α-helix	trans	-66.7	-36.9	172.6	-84.6	-80.2	0	0	0	112.9	L218 P221 T222 M225 A252 L253 V254 L258 L259 V260	L218-F256 HydrophobicContact CD1-CD1 3.75Å; L218-F256 HydrophobicContact CD1-CE1 4.28Å; P221-F256 HydrophobicContact CB-CE1 4.32Å; P221-F256 HydrophobicContact CB-CZ 3.87Å; T222-F256 HydrophobicContact CG2-CB 4.21Å; T222-F256 HydrophobicContact CG2-CD1 3.93Å; T222-F256 HydrophobicContact CG2-CE1 4.43Å; T222-F256 HydrophobicContact CG2-CG 4Å; M225-F256 HydrophobicContact CE-CB 4.44Å; M225-F256 HydrophobicContact CE-CD2 3.3Å; M225-F256 HydrophobicContact CE-CE2 3.64Å; M225-F256 HydrophobicContact CE-CG 3.97Å; M225-F256 HydrophobicContact SD-CD2 3.98Å; M225-F256 HydrophobicContact SD-CE2 3.99Å; A252-F256 WeakPolarHBondContact O-CD2 3.47Å; A252-F256 PolarHBondContact O-N 3.14Å; L253-F256 PolarHBondContact O-N 3.01Å; V254-F256 VanDerWaalsContact C-N 3.33Å; V254-F256 PolarHBondContact O-N 3.4Å; F256-L258 VanDerWaalsContact C-N 3.35Å; F256-L258 PolarHBondContact O-N 2.85Å; F256-L259 HydrophobicContact CD1-CD2 4.39Å; F256-L259 WeakPolarHBondContact O-CB 3.31Å; F256-L259 PolarHBondContact O-N 3.35Å; F256-V260 WeakPolarHBondContact O-CB 3.46Å; F256-V260 WeakPolarHBondContact O-CG2 3.41Å; F256-V260 PolarHBondContact O-N 3.42Å
257	M	79.5	Confident	79.7	Confident	12 Å²	12	39.6 Å²	39.6	6%	0.059	22%	0.217	C	C	.	.	H	α-helix	trans	-61.4	-41.2	170.9	-74	-79.2	-85.5	0	0	111.6	L253 V254 L259 V260 S261 L278	L253-M257 WeakPolarHBondContact O-CG 3.37Å; L253-M257 PolarHBondContact O-N 2.87Å; V254-M257 WeakPolarHBondContact O-CB 3.41Å; V254-M257 PolarHBondContact O-N 3.21Å; V254-M257 VanDerWaalsContact O-N 3.15Å; M257-L259 VanDerWaalsContact C-N 3.28Å; M257-L259 PolarHBondContact O-N 3.16Å; M257-V260 PolarHBondContact O-N 3.43Å; M257-S261 WeakPolarHBondContact O-CB 3.44Å; M257-S261 PolarHBondContact O-N 2.95Å; M257-S261 PolarHBondContact O-OG 3.32Å; M257-L278 HydrophobicContact SD-CB 3.61Å; M257-L278 HydrophobicContact SD-CD1 4.19Å; M257-L278 HydrophobicContact SD-CG 4.47Å
258	L	78.2	Confident	78.4	Confident	36 Å²	36	40.3 Å²	40.3	19%	0.188	22%	0.222	C	C	.	.	H	α-helix	trans	-66.1	-26.4	174.2	-60.8	-162.3	0	0	0	113.9	V254 V255 F256 S261 K262 V722 L726	V254-L258 WeakPolarHBondContact O-CG 3.41Å; V254-L258 PolarHBondContact O-N 2.64Å; V255-L258 PolarHBondContact O-N 2.93Å; F256-L258 VanDerWaalsContact C-N 3.35Å; F256-L258 PolarHBondContact O-N 2.85Å; L258-S261 PolarHBondContact O-OG 3.29Å; L258-K262 WeakPolarHBondContact O-CG 3.35Å; L258-V722 HydrophobicContact CD1-CG1 3.55Å; L258-V722 HydrophobicContact CG-CG1 4.46Å; L258-L726 HydrophobicContact CD2-CB 3.88Å; L258-L726 HydrophobicContact CD2-CD1 4.14Å; L258-L726 HydrophobicContact CD2-CD2 3.59Å; L258-L726 HydrophobicContact CD2-CG 4.05Å
259	L	79.7	Confident	77.2	Confident	73 Å²	73	40.2 Å²	40.2	38%	0.382	22%	0.222	S	C	.	.	H	α-helix	trans	-76.9	-43.9	174.8	-175	64.9	0	0	0	110.5	V255 F256 M257 K262 I263	V255-L259 PolarHBondContact O-N 3.42Å; F256-L259 HydrophobicContact CD1-CD2 4.39Å; F256-L259 WeakPolarHBondContact O-CB 3.31Å; F256-L259 PolarHBondContact O-N 3.35Å; M257-L259 VanDerWaalsContact C-N 3.28Å; M257-L259 PolarHBondContact O-N 3.16Å; L259-K262 PolarHBondContact O-N 2.9Å; L259-I263 HydrophobicContact CD1-CD1 4.08Å; L259-I263 HydrophobicContact CG-CD1 3.91Å; L259-I263 WeakPolarHBondContact O-CG1 3.47Å; L259-I263 PolarHBondContact O-N 3.5Å
260	V	77.5	Confident	76.1	Confident	7 Å²	7	41.3 Å²	41.3	4%	0.042	23%	0.229	C	C	.	.	H	α-helix	trans	-63.9	-42.2	178.6	171	0	0	0	0	111.4	L218 F256 M257 K262 I263 L264 L278	L218-V260 HydrophobicContact CD1-CG2 3.74Å; L218-V260 HydrophobicContact CD2-CG2 3.94Å; L218-V260 HydrophobicContact CG-CG2 4.28Å; F256-V260 WeakPolarHBondContact O-CB 3.46Å; F256-V260 WeakPolarHBondContact O-CG2 3.41Å; F256-V260 PolarHBondContact O-N 3.42Å; M257-V260 PolarHBondContact O-N 3.43Å; V260-K262 PolarHBondContact O-N 3.22Å; V260-I263 PolarHBondContact O-N 3.04Å; V260-I263 VanDerWaalsContact O-N 3.08Å; V260-L264 HydrophobicContact CG1-CD1 3.5Å; V260-L264 VanDerWaalsContact CG1-CD1 3.5Å; V260-L264 HydrophobicContact CG1-CG 4.18Å; V260-L264 PolarHBondContact O-N 3.09Å; V260-L278 HydrophobicContact CB-CD1 4.15Å; V260-L278 HydrophobicContact CG1-CD1 4.06Å; V260-L278 HydrophobicContact CG2-CD1 3.5Å; V260-L278 VanDerWaalsContact CG2-CD1 3.5Å
261	S	72.9	Confident	75.2	Confident	27 Å²	27	43 Å²	43	19%	0.189	24%	0.237	C	C	.	.	H	α-helix	trans	-68.4	-0.8	177.8	77.8	0	0	0	0	114.7	M257 L258	M257-S261 WeakPolarHBondContact O-CB 3.44Å; M257-S261 PolarHBondContact O-N 2.95Å; M257-S261 PolarHBondContact O-OG 3.32Å; L258-S261 PolarHBondContact O-OG 3.29Å
262	K	75.6	Confident	74.7	Confident	161 Å²	161	41.7 Å²	41.7	70%	0.7	23%	0.231	S	C	*	.	H	α-helix	trans	-108.7	-17.8	171.5	-70.5	179.3	174.5	-171.7	0	113.9	L258 L259 V260	L258-K262 WeakPolarHBondContact O-CG 3.35Å; L259-K262 PolarHBondContact O-N 2.9Å; V260-K262 PolarHBondContact O-N 3.22Å
263	I	75.6	Confident	74.2	Confident	67 Å²	67	42.7 Å²	42.7	34%	0.344	23%	0.229	S	C	.	.	H	α-helix	trans	-101.2	-34.5	-173.8	-67.4	171.6	0	0	0	110.8	F142 Y214 L259 V260	F142-I263 HydrophobicContact CZ-CG2 4.02Å; Y214-I263 HydrophobicContact CD1-CG2 4.5Å; Y214-I263 HydrophobicContact CE1-CG2 3.87Å; L259-I263 HydrophobicContact CD1-CD1 4.08Å; L259-I263 HydrophobicContact CG-CD1 3.91Å; L259-I263 WeakPolarHBondContact O-CG1 3.47Å; L259-I263 PolarHBondContact O-N 3.5Å; V260-I263 PolarHBondContact O-N 3.04Å; V260-I263 VanDerWaalsContact O-N 3.08Å
264	L	72.4	Confident	73.8	Confident	12 Å²	12	42.9 Å²	42.9	6%	0.063	23%	0.23	C	C	.	.	S	Bend	trans	-81.7	133	173.2	-69.4	174	0	0	0	110.4	F142 V260 P272	F142-L264 HydrophobicContact CB-CD2 4.13Å; F142-L264 HydrophobicContact CD1-CD2 3.55Å; F142-L264 HydrophobicContact CD2-CD2 3.85Å; F142-L264 HydrophobicContact CE1-CD2 3.83Å; F142-L264 HydrophobicContact CE2-CD2 4.09Å; F142-L264 HydrophobicContact CG-CD2 3.56Å; F142-L264 HydrophobicContact CZ-CD2 4.09Å; V260-L264 HydrophobicContact CG1-CD1 3.5Å; V260-L264 VanDerWaalsContact CG1-CD1 3.5Å; V260-L264 HydrophobicContact CG1-CG 4.18Å; V260-L264 PolarHBondContact O-N 3.09Å; L264-P272 HydrophobicContact CD1-CG 3.76Å
265	P	67	Low	73.4	Confident	69 Å²	69	43.4 Å²	43.4	45%	0.448	23%	0.234	S	C	.	.			trans	-67.8	148.7	167	31	-34.7	0	0	0	110.3	V139 N267	V139-P265 HydrophobicContact CG1-CG 3.78Å; P265-N267 PolarHBondContact O-N 2.9Å
266	C	63.9	Low	73.2	Confident	43 Å²	43	42.9 Å²	42.9	29%	0.291	23%	0.225	S	C	.	.			trans	-69.8	95.1	177.4	-64.1	0	0	0	0	110.7	I651	C266-I651 HydrophobicContact CB-CD1 3.89Å; C266-I651 HydrophobicContact CB-CG1 4.05Å; C266-I651 VanDerWaalsContact O-CG1 3.31Å; C266-I651 WeakPolarHBondContact O-CG1 3.21Å
267	N	65.4	Low	73.2	Confident	20 Å²	20	41.4 Å²	41.4	11%	0.107	22%	0.218	C	C	.	.			trans	-117.6	119	170.7	-177.6	-13.6	0	0	0	108.9	M137 V139 P265 N269	M137-N267 PolarHBondContact O-ND2 3.31Å; M137-N267 VanDerWaalsContact O-ND2 3.12Å; V139-N267 HydrophobicContact CG2-CB 3.97Å; P265-N267 PolarHBondContact O-N 2.9Å; N267-N269 WeakPolarHBondContact OD1-CB 3.4Å; N267-N269 PolarHBondContact OD1-N 3.28Å
268	S	58.6	Low	73.4	Confident	19 Å²	19	40.8 Å²	40.8	13%	0.133	22%	0.216	C	C	.	.			trans	-85.4	-22.3	179.4	58.3	0	0	0	0	114.6	S650 K677	S268-S650 PolarHBondContact N-O 2.84Å; S268-S650 VanDerWaalsContact N-O 3.08Å; S268-S650 PolarHBondContact OG-O 2.96Å; S268-K677 WeakPolarHBondContact OG-CD 3.48Å
269	N	62.6	Low	73.6	Confident	77 Å²	77	40.6 Å²	40.6	41%	0.412	21%	0.214	S	C	.	.	S	Bend	trans	-73.6	-35.2	-165.5	-63.4	-14	0	0	0	111.8	N267	N267-N269 WeakPolarHBondContact OD1-CB 3.4Å; N267-N269 PolarHBondContact OD1-N 3.28Å
270	T	67	Low	73.8	Confident	39 Å²	39	41 Å²	41	24%	0.239	22%	0.216	C	C	.	.	S	Bend	trans	-134.9	115.3	174.7	47.3	0	0	0	0	110	D138 P272	D138-T270 PolarHBondContact OD1-OG1 3.42Å; D138-T270 VanDerWaalsContact OD1-OG1 3.11Å; T270-P272 WeakPolarHBondContact O-CD 3.31Å
271	M	68.3	Low	74.2	Confident	39 Å²	39	41 Å²	41	19%	0.192	22%	0.216	C	C	.	.			trans	-71.9	123.7	175.4	-176.5	-170.2	179.8	0	0	110	A275 K276 V683	M271-A275 VanDerWaalsContact CE-C 3.42Å; M271-A275 HydrophobicContact CE-CB 3.65Å; M271-A275 HydrophobicContact CG-CB 4.46Å; M271-K276 HydrophobicContact CE-CG 3.99Å; M271-K276 HydrophobicContact CG-CG 4.02Å; M271-K276 WeakPolarHBondContact O-CE 3.24Å; M271-K276 PolarHBondContact O-NZ 3.47Å; M271-K276 HydrophobicContact SD-CG 3.62Å; M271-V683 HydrophobicContact CE-CG1 3.53Å; M271-V683 HydrophobicContact SD-CG1 4.35Å
272	P	76.9	Confident	74.9	Confident	10 Å²	10	39.7 Å²	39.7	7%	0.065	21%	0.207	C	C	.	.			trans	-66.3	145.1	-175.1	22.4	-30.4	0	0	0	112.9	V139 L264 T270 L274 A275 K276	V139-P272 HydrophobicContact CG2-CB 4.4Å; V139-P272 HydrophobicContact CG2-CG 4.38Å; V139-P272 WeakPolarHBondContact O-CB 3.26Å; L264-P272 HydrophobicContact CD1-CG 3.76Å; T270-P272 WeakPolarHBondContact O-CD 3.31Å; P272-L274 VanDerWaalsContact C-N 3.26Å; P272-L274 PolarHBondContact O-N 3.29Å; P272-A275 HydrophobicContact CG-CB 3.92Å; P272-A275 PolarHBondContact O-N 2.96Å; P272-K276 PolarHBondContact O-N 3.19Å; P272-K276 VanDerWaalsContact O-N 3.11Å
273	F	76.5	Confident	75.4	Confident	57 Å²	57	35.3 Å²	35.3	25%	0.25	19%	0.193	C	C	.	.	H	α-helix	trans	-57.7	-36.1	-177.9	-77.1	-65.7	0	0	0	113.2	Q140 H141 A275 K276 Y277	Q140-F273 HydrophobicContact CG-CD2 4.1Å; Q140-F273 HydrophobicContact CG-CE2 3.74Å; Q140-F273 HydrophobicContact CG-CZ 4.5Å; Q140-F273 WeakPolarHBondContact O-CD2 3.28Å; Q140-F273 PolarHBondContact O-N 3.28Å; H141-F273 AromaticContact CD2-CD2 3.94Å; H141-F273 AromaticContact CD2-CE2 3.62Å; H141-F273 AromaticContact NE2-CE2 3.73Å; F273-A275 PolarHBondContact O-N 3.49Å; F273-K276 HydrophobicContact CD1-CD 4.1Å; F273-K276 WeakPolarHBondContact O-CB 3.45Å; F273-K276 PolarHBondContact O-N 2.89Å; F273-Y277 WeakPolarHBondContact O-CB 3.01Å; F273-Y277 PolarHBondContact O-N 3.11Å
274	L	78.6	Confident	76	Confident	6 Å²	6	33.1 Å²	33.1	3%	0.031	18%	0.183	C	C	.	.	H	α-helix	trans	-59.4	-44.6	174	179	61.8	0	0	0	112.7	F142 L218 I219 P272 K276 Y277 L278	F142-L274 HydrophobicContact CD1-CD2 3.83Å; F142-L274 HydrophobicContact CE1-CD2 3.74Å; L218-L274 HydrophobicContact CD2-CD2 3.7Å; L218-L274 HydrophobicContact CG-CD2 4.17Å; I219-L274 HydrophobicContact CG1-CD1 4.25Å; P272-L274 VanDerWaalsContact C-N 3.26Å; P272-L274 PolarHBondContact O-N 3.29Å; L274-K276 VanDerWaalsContact C-N 3.35Å; L274-Y277 PolarHBondContact O-N 3.39Å; L274-L278 HydrophobicContact CD1-CD1 4.3Å; L274-L278 HydrophobicContact CD1-CG 4.48Å; L274-L278 HydrophobicContact CG-CD1 4.16Å; L274-L278 WeakPolarHBondContact O-CG 3.36Å; L274-L278 PolarHBondContact O-N 3.42Å
275	A	78.1	Confident	76.7	Confident	11 Å²	11	32.8 Å²	32.8	9%	0.091	18%	0.181	C	C	.	.	H	α-helix	trans	-68.9	-35.3	178.6	0	0	0	0	0	111.6	M271 P272 F273 L278 L279	M271-A275 VanDerWaalsContact CE-C 3.42Å; M271-A275 HydrophobicContact CE-CB 3.65Å; M271-A275 HydrophobicContact CG-CB 4.46Å; P272-A275 HydrophobicContact CG-CB 3.92Å; P272-A275 PolarHBondContact O-N 2.96Å; F273-A275 PolarHBondContact O-N 3.49Å; A275-L278 PolarHBondContact O-N 3.34Å; A275-L279 WeakPolarHBondContact O-CB 3.49Å; A275-L279 PolarHBondContact O-N 3.5Å
276	K	79.2	Confident	77.7	Confident	71 Å²	71	29.6 Å²	29.6	31%	0.309	16%	0.16	S	C	.	.	H	α-helix	trans	-61.5	-46	172.9	-69.4	167	173	148.4	0	110.5	M271 P272 F273 L274 L279 I280	M271-K276 HydrophobicContact CE-CG 3.99Å; M271-K276 HydrophobicContact CG-CG 4.02Å; M271-K276 WeakPolarHBondContact O-CE 3.24Å; M271-K276 PolarHBondContact O-NZ 3.47Å; M271-K276 HydrophobicContact SD-CG 3.62Å; P272-K276 PolarHBondContact O-N 3.19Å; P272-K276 VanDerWaalsContact O-N 3.11Å; F273-K276 HydrophobicContact CD1-CD 4.1Å; F273-K276 WeakPolarHBondContact O-CB 3.45Å; F273-K276 PolarHBondContact O-N 2.89Å; L274-K276 VanDerWaalsContact C-N 3.35Å; K276-L279 PolarHBondContact O-N 3.04Å; K276-I280 WeakPolarHBondContact O-CB 3.44Å; K276-I280 WeakPolarHBondContact O-CD1 3.44Å; K276-I280 VanDerWaalsContact O-CG1 3.26Å; K276-I280 WeakPolarHBondContact O-CG1 3.37Å; K276-I280 PolarHBondContact O-N 3.05Å
277	Y	83.1	Confident	78.8	Confident	13 Å²	13	29.1 Å²	29.1	5%	0.051	16%	0.159	C	C	.	.	H	α-helix	trans	-61.3	-43.4	177.2	-179.2	-101.7	0	0	0	112.4	V223 A226 F273 L274 I280 T281 T454 V457	V223-Y277 HydrophobicContact CG2-CE1 4.12Å; A226-Y277 WeakPolarHBondContact CB-OH 3.49Å; F273-Y277 WeakPolarHBondContact O-CB 3.01Å; F273-Y277 PolarHBondContact O-N 3.11Å; L274-Y277 PolarHBondContact O-N 3.39Å; Y277-I280 PolarHBondContact O-N 2.99Å; Y277-T281 WeakPolarHBondContact O-CB 3.48Å; Y277-T281 PolarHBondContact O-N 3.38Å; Y277-T281 PolarHBondContact O-OG1 3.44Å; Y277-T454 HydrophobicContact CE2-CG2 4.15Å; Y277-V457 HydrophobicContact CD2-CG2 4.38Å; Y277-V457 HydrophobicContact CG-CG2 4.5Å
278	L	84.3	Confident	79.8	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-66.5	-42.1	177.2	-70.6	166.9	0	0	0	112.8	T222 L253 M257 V260 L274 A275 T281 F282	T222-L278 HydrophobicContact CG2-CD2 3.65Å; L253-L278 HydrophobicContact CD1-CD2 3.79Å; M257-L278 HydrophobicContact SD-CB 3.61Å; M257-L278 HydrophobicContact SD-CD1 4.19Å; M257-L278 HydrophobicContact SD-CG 4.47Å; V260-L278 HydrophobicContact CB-CD1 4.15Å; V260-L278 HydrophobicContact CG1-CD1 4.06Å; V260-L278 HydrophobicContact CG2-CD1 3.5Å; V260-L278 VanDerWaalsContact CG2-CD1 3.5Å; L274-L278 HydrophobicContact CD1-CD1 4.3Å; L274-L278 HydrophobicContact CD1-CG 4.48Å; L274-L278 HydrophobicContact CG-CD1 4.16Å; L274-L278 WeakPolarHBondContact O-CG 3.36Å; L274-L278 PolarHBondContact O-N 3.42Å; A275-L278 PolarHBondContact O-N 3.34Å; L278-T281 PolarHBondContact O-N 3.23Å; L278-F282 WeakPolarHBondContact O-CB 3.4Å; L278-F282 PolarHBondContact O-N 3.26Å
279	L	82.5	Confident	81.2	Confident	31 Å²	31	27.4 Å²	27.4	16%	0.162	15%	0.148	C	C	.	.	H	α-helix	trans	-59.8	-47.1	174.1	-178.9	70.1	0	0	0	111.3	A275 K276 T281 F282 V283 V683 I687	A275-L279 WeakPolarHBondContact O-CB 3.49Å; A275-L279 PolarHBondContact O-N 3.5Å; K276-L279 PolarHBondContact O-N 3.04Å; L279-T281 VanDerWaalsContact C-N 3.32Å; L279-T281 PolarHBondContact O-N 2.85Å; L279-F282 PolarHBondContact O-N 3.42Å; L279-V283 WeakPolarHBondContact O-CG2 3.44Å; L279-V283 PolarHBondContact O-N 3.36Å; L279-V683 HydrophobicContact CB-CG1 4.44Å; L279-V683 HydrophobicContact CD1-CG1 3.93Å; L279-V683 HydrophobicContact CD2-CG1 3.67Å; L279-V683 HydrophobicContact CG-CG1 4.21Å; L279-I687 HydrophobicContact CD1-CG2 4.05Å
280	I	84.2	Confident	82.4	Confident	82 Å²	82	26.6 Å²	26.6	42%	0.421	14%	0.144	S	C	.	.	H	α-helix	trans	-60.5	-44.7	177.2	-70.2	164.7	0	0	0	110.1	K276 Y277 F282 V283 L284	K276-I280 WeakPolarHBondContact O-CB 3.44Å; K276-I280 WeakPolarHBondContact O-CD1 3.44Å; K276-I280 VanDerWaalsContact O-CG1 3.26Å; K276-I280 WeakPolarHBondContact O-CG1 3.37Å; K276-I280 PolarHBondContact O-N 3.05Å; Y277-I280 PolarHBondContact O-N 2.99Å; I280-F282 VanDerWaalsContact C-N 3.31Å; I280-F282 PolarHBondContact O-N 3.24Å; I280-V283 PolarHBondContact O-N 2.74Å; I280-L284 HydrophobicContact CG2-CD1 3.81Å; I280-L284 HydrophobicContact CG2-CG 4.38Å; I280-L284 WeakPolarHBondContact O-CB 3.44Å; I280-L284 WeakPolarHBondContact O-CG 3.31Å; I280-L284 PolarHBondContact O-N 2.89Å
281	T	85.7	Confident	83.3	Confident	6 Å²	6	26.5 Å²	26.5	4%	0.037	14%	0.143	C	C	.	.	H	α-helix	trans	-61.3	-39.3	176.8	-54.4	0	0	0	0	111.8	A226 L253 Y277 L278 L279 L284 D285	A226-T281 HydrophobicContact CB-CG2 3.7Å; L253-T281 HydrophobicContact CD1-CG2 4.31Å; L253-T281 HydrophobicContact CD2-CG2 3.82Å; Y277-T281 WeakPolarHBondContact O-CB 3.48Å; Y277-T281 PolarHBondContact O-N 3.38Å; Y277-T281 PolarHBondContact O-OG1 3.44Å; L278-T281 PolarHBondContact O-N 3.23Å; L279-T281 VanDerWaalsContact C-N 3.32Å; L279-T281 PolarHBondContact O-N 2.85Å; T281-L284 PolarHBondContact O-N 2.86Å; T281-D285 PolarHBondContact O-N 2.81Å
282	F	87	Confident	84.1	Confident	1 Å²	1	24.7 Å²	24.7	0%	0.004	13%	0.134	C	C	.	.	H	α-helix	trans	-67.7	-45.8	177.8	-174.9	-84.3	0	0	0	111.9	L250 L253 V254 L278 L279 I280 L284 D285 V286 P688 L691 M692	L250-F282 HydrophobicContact CD1-CD2 3.69Å; L250-F282 HydrophobicContact CD1-CE2 3.46Å; L250-F282 VanDerWaalsContact CD1-CE2 3.46Å; L250-F282 HydrophobicContact CD1-CG 4.34Å; L250-F282 HydrophobicContact CD1-CZ 3.92Å; L250-F282 HydrophobicContact CG-CE2 4.16Å; L253-F282 VanDerWaalsContact CD2-CA 3.48Å; L253-F282 HydrophobicContact CD2-CB 3.83Å; L253-F282 HydrophobicContact CD2-CD2 4.17Å; L253-F282 HydrophobicContact CD2-CG 4.47Å; L253-F282 HydrophobicContact CG-CD2 4.46Å; V254-F282 HydrophobicContact CG2-CE2 3.76Å; L278-F282 WeakPolarHBondContact O-CB 3.4Å; L278-F282 PolarHBondContact O-N 3.26Å; L279-F282 PolarHBondContact O-N 3.42Å; I280-F282 VanDerWaalsContact C-N 3.31Å; I280-F282 PolarHBondContact O-N 3.24Å; F282-L284 VanDerWaalsContact C-N 3.27Å; F282-L284 PolarHBondContact O-N 3.42Å; F282-D285 PolarHBondContact O-N 3.26Å; F282-V286 HydrophobicContact CD1-CG2 4Å; F282-V286 HydrophobicContact CE1-CG2 3.62Å; F282-V286 HydrophobicContact CZ-CG2 4.07Å; F282-V286 VanDerWaalsContact O-CG2 3.31Å; F282-V286 WeakPolarHBondContact O-CG2 3.37Å; F282-V286 PolarHBondContact O-N 3.46Å; F282-P688 HydrophobicContact CD1-CB 4.46Å; F282-P688 HydrophobicContact CE1-CB 3.82Å; F282-P688 HydrophobicContact CE1-CG 4.43Å; F282-P688 HydrophobicContact CE2-CB 4.29Å; F282-P688 HydrophobicContact CZ-CB 3.72Å; F282-L691 HydrophobicContact CD1-CD1 3.92Å; F282-L691 HydrophobicContact CE1-CB 4.02Å; F282-L691 HydrophobicContact CE1-CD1 3.77Å; F282-M692 HydrophobicContact CZ-SD 3.98Å
283	V	86.6	Confident	84.5	Confident	68 Å²	68	24.3 Å²	24.3	41%	0.412	13%	0.132	S	C	.	.	H	α-helix	trans	-61.1	-38.1	174.3	172.9	0	0	0	0	111	L279 I280 A287 L691	L279-V283 WeakPolarHBondContact O-CG2 3.44Å; L279-V283 PolarHBondContact O-N 3.36Å; I280-V283 PolarHBondContact O-N 2.74Å; V283-A287 VanDerWaalsContact O-CB 3.24Å; V283-A287 WeakPolarHBondContact O-CB 3.47Å; V283-A287 PolarHBondContact O-N 3.08Å; V283-L691 HydrophobicContact CG2-CD1 4.05Å
284	L	87.5	Confident	85	Confident	22 Å²	22	23.5 Å²	23.5	12%	0.115	14%	0.136	C	C	.	.	H	α-helix	trans	-66.9	-42.9	176.1	-72.7	168.2	0	0	0	112.6	I280 T281 F282 A287 A288 F446 I449	I280-L284 HydrophobicContact CG2-CD1 3.81Å; I280-L284 HydrophobicContact CG2-CG 4.38Å; I280-L284 WeakPolarHBondContact O-CB 3.44Å; I280-L284 WeakPolarHBondContact O-CG 3.31Å; I280-L284 PolarHBondContact O-N 2.89Å; T281-L284 PolarHBondContact O-N 2.86Å; F282-L284 VanDerWaalsContact C-N 3.27Å; F282-L284 PolarHBondContact O-N 3.42Å; L284-A287 CarbonylContact O-C 3.5Å; L284-A287 PolarHBondContact O-N 3.21Å; L284-A288 WeakPolarHBondContact O-CB 3.21Å; L284-A288 PolarHBondContact O-N 2.83Å; L284-F446 HydrophobicContact CB-CD1 4.38Å; L284-F446 HydrophobicContact CB-CE1 4.29Å; L284-F446 HydrophobicContact CD2-CD1 3.78Å; L284-F446 HydrophobicContact CD2-CE1 3.78Å; L284-F446 VanDerWaalsContact O-CE1 3.28Å; L284-F446 WeakPolarHBondContact O-CE1 3.33Å; L284-I449 HydrophobicContact CD1-CB 4.48Å; L284-I449 HydrophobicContact CD1-CG2 3.88Å; L284-I449 HydrophobicContact CD2-CB 4.27Å; L284-I449 HydrophobicContact CD2-CD1 3.99Å; L284-I449 HydrophobicContact CD2-CG2 3.96Å; L284-I449 HydrophobicContact CG-CG2 4.49Å
285	D	87.4	Confident	85.3	Confident	4 Å²	4	23.4 Å²	23.4	2%	0.021	14%	0.135	C	C	.	.	H	α-helix	trans	-71.8	-37.6	179.5	-162.7	22.2	0	0	0	111.9	S246 L250 T281 F282 A287 A288 I289	S246-D285 PolarHBondContact OG-OD1 3.33Å; L250-D285 VanDerWaalsContact CA-OD2 3.22Å; L250-D285 WeakPolarHBondContact CA-OD2 3.23Å; L250-D285 WeakPolarHBondContact CB-OD2 3.25Å; L250-D285 HydrophobicContact CD1-CB 4.22Å; L250-D285 PolarHBondContact N-OD2 2.86Å; T281-D285 PolarHBondContact O-N 2.81Å; F282-D285 PolarHBondContact O-N 3.26Å; D285-A287 VanDerWaalsContact C-N 3.33Å; D285-A287 PolarHBondContact O-N 2.97Å; D285-A288 WeakPolarHBondContact O-CB 3.49Å; D285-A288 PolarHBondContact O-N 3.46Å; D285-A288 VanDerWaalsContact O-N 3.12Å; D285-I289 WeakPolarHBondContact O-CG1 3.16Å; D285-I289 PolarHBondContact O-N 3.3Å
286	V	87.5	Confident	85.6	Confident	3 Å²	3	23.1 Å²	23.1	2%	0.018	13%	0.132	C	C	.	.	H	α-helix	trans	-58.9	-44.5	168.4	173.1	0	0	0	0	111.1	L250 F282 A288 I289 I290 L691 L695	L250-V286 HydrophobicContact CD1-CG2 3.81Å; L250-V286 HydrophobicContact CD2-CG2 4.3Å; F282-V286 HydrophobicContact CD1-CG2 4Å; F282-V286 HydrophobicContact CE1-CG2 3.62Å; F282-V286 HydrophobicContact CZ-CG2 4.07Å; F282-V286 VanDerWaalsContact O-CG2 3.31Å; F282-V286 WeakPolarHBondContact O-CG2 3.37Å; F282-V286 PolarHBondContact O-N 3.46Å; V286-A288 VanDerWaalsContact C-N 3.31Å; V286-A288 PolarHBondContact O-N 3.12Å; V286-I289 PolarHBondContact O-N 2.78Å; V286-I290 HydrophobicContact CG1-CD1 3.89Å; V286-I290 VanDerWaalsContact O-CG1 3.31Å; V286-I290 WeakPolarHBondContact O-CG1 3.41Å; V286-I290 PolarHBondContact O-N 3.45Å; V286-L691 HydrophobicContact CG1-CB 4.28Å; V286-L691 HydrophobicContact CG1-CD2 4.17Å; V286-L691 HydrophobicContact CG2-CB 4.26Å; V286-L695 HydrophobicContact CG1-CD1 4.16Å; V286-L695 HydrophobicContact CG1-CD2 4.11Å; V286-L695 HydrophobicContact CG1-CG 4.01Å; V286-L695 HydrophobicContact CG2-CD1 4.07Å
287	A	87.8	Confident	85.8	Confident	33 Å²	33	21.5 Å²	21.5	27%	0.273	13%	0.127	S	C	.	.	H	α-helix	trans	-66.5	-32.1	175	0	0	0	0	0	112.5	V283 L284 D285 I290 T291 F446	V283-A287 VanDerWaalsContact O-CB 3.24Å; V283-A287 WeakPolarHBondContact O-CB 3.47Å; V283-A287 PolarHBondContact O-N 3.08Å; L284-A287 CarbonylContact O-C 3.5Å; L284-A287 PolarHBondContact O-N 3.21Å; D285-A287 VanDerWaalsContact C-N 3.33Å; D285-A287 PolarHBondContact O-N 2.97Å; A287-I290 PolarHBondContact O-N 2.87Å; A287-T291 WeakPolarHBondContact O-CB 3.42Å; A287-T291 WeakPolarHBondContact O-CG2 3.43Å; A287-T291 PolarHBondContact O-N 3.12Å; A287-T291 PolarHBondContact O-OG1 3.37Å; A287-F446 HydrophobicContact CB-CE1 4.11Å; A287-F446 HydrophobicContact CB-CZ 3.93Å
288	A	87.3	Confident	85.8	Confident	1 Å²	1	22.2 Å²	22.2	1%	0.008	13%	0.132	C	C	.	.	H	α-helix	trans	-67.9	-41	175.3	0	0	0	0	0	111.5	F233 L284 D285 V286 T291 T292 F446	F233-A288 HydrophobicContact CE2-CB 3.96Å; F233-A288 HydrophobicContact CZ-CB 3.9Å; L284-A288 WeakPolarHBondContact O-CB 3.21Å; L284-A288 PolarHBondContact O-N 2.83Å; D285-A288 WeakPolarHBondContact O-CB 3.49Å; D285-A288 PolarHBondContact O-N 3.46Å; D285-A288 VanDerWaalsContact O-N 3.12Å; V286-A288 VanDerWaalsContact C-N 3.31Å; V286-A288 PolarHBondContact O-N 3.12Å; A288-T291 PolarHBondContact O-OG1 3.41Å; A288-T292 WeakPolarHBondContact O-CB 3.24Å; A288-T292 PolarHBondContact O-N 3.49Å; A288-T292 PolarHBondContact O-OG1 3.39Å; A288-F446 HydrophobicContact CB-CE1 4.3Å; A288-F446 HydrophobicContact CB-CZ 4.34Å
289	I	87	Confident	85.7	Confident	1 Å²	1	25.7 Å²	25.7	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-63.3	-49.5	172.3	-65.2	158.5	0	0	0	110.6	V247 L250 D285 V286 T291 T292 I293 L695 L712	V247-I289 HydrophobicContact CG2-CD1 3.91Å; V247-I289 HydrophobicContact CG2-CG1 4.16Å; V247-I289 HydrophobicContact CG2-CG2 4.39Å; L250-I289 HydrophobicContact CB-CD1 4.14Å; L250-I289 HydrophobicContact CD2-CD1 3.69Å; L250-I289 HydrophobicContact CG-CD1 4.43Å; D285-I289 WeakPolarHBondContact O-CG1 3.16Å; D285-I289 PolarHBondContact O-N 3.3Å; V286-I289 PolarHBondContact O-N 2.78Å; I289-T291 PolarHBondContact O-N 3.44Å; I289-T292 PolarHBondContact O-N 3.23Å; I289-I293 HydrophobicContact CG2-CD1 3.75Å; I289-I293 HydrophobicContact CG2-CG1 4.41Å; I289-I293 WeakPolarHBondContact O-CB 3.38Å; I289-I293 VanDerWaalsContact O-CG1 3.26Å; I289-I293 WeakPolarHBondContact O-CG1 3.39Å; I289-I293 PolarHBondContact O-N 2.74Å; I289-L695 HydrophobicContact CB-CD2 4.04Å; I289-L695 HydrophobicContact CD1-CD1 4.16Å; I289-L695 HydrophobicContact CG2-CD2 3.64Å; I289-L712 HydrophobicContact CG2-CD1 4.3Å
290	I	87	Confident	85.6	Confident	61 Å²	61	27.2 Å²	27.2	31%	0.313	15%	0.151	S	C	.	.	H	α-helix	trans	-60.2	-44.7	179.8	-68.1	167.3	0	0	0	111.3	V286 A287 I293 A294 L695 M698	V286-I290 HydrophobicContact CG1-CD1 3.89Å; V286-I290 VanDerWaalsContact O-CG1 3.31Å; V286-I290 WeakPolarHBondContact O-CG1 3.41Å; V286-I290 PolarHBondContact O-N 3.45Å; A287-I290 PolarHBondContact O-N 2.87Å; I290-I293 PolarHBondContact O-N 3.48Å; I290-A294 PolarHBondContact O-N 3.15Å; I290-L695 HydrophobicContact CD1-CD2 4.3Å; I290-L695 HydrophobicContact CG1-CD2 3.75Å; I290-M698 HydrophobicContact CG1-CG 4.39Å
291	T	85.9	Confident	85.2	Confident	37 Å²	37	28 Å²	28	23%	0.227	15%	0.149	C	C	.	.	H	α-helix	trans	-71.3	-34.4	178.3	53.1	0	0	0	0	112.3	F233 A287 A288 I289 A294 V295 L442	F233-T291 WeakPolarHBondContact CZ-OG1 3.4Å; A287-T291 WeakPolarHBondContact O-CB 3.42Å; A287-T291 WeakPolarHBondContact O-CG2 3.43Å; A287-T291 PolarHBondContact O-N 3.12Å; A287-T291 PolarHBondContact O-OG1 3.37Å; A288-T291 PolarHBondContact O-OG1 3.41Å; I289-T291 PolarHBondContact O-N 3.44Å; T291-A294 WeakPolarHBondContact O-CB 3.34Å; T291-A294 PolarHBondContact O-N 3.05Å; T291-V295 WeakPolarHBondContact O-CG2 3.23Å; T291-V295 PolarHBondContact O-N 2.76Å; T291-L442 HydrophobicContact CG2-CD2 4.09Å
292	T	86.7	Confident	84.3	Confident	1 Å²	1	30 Å²	30	1%	0.006	16%	0.162	C	C	.	.	H	α-helix	trans	-63.8	-43.1	171.6	-64.5	0	0	0	0	111.8	K242 I243 A288 I289 A294 V295 L296	K242-T292 HydrophobicContact CB-CG2 3.98Å; K242-T292 HydrophobicContact CD-CG2 4.27Å; I243-T292 HydrophobicContact CG1-CG2 4.14Å; A288-T292 WeakPolarHBondContact O-CB 3.24Å; A288-T292 PolarHBondContact O-N 3.49Å; A288-T292 PolarHBondContact O-OG1 3.39Å; I289-T292 PolarHBondContact O-N 3.23Å; T292-A294 VanDerWaalsContact C-N 3.28Å; T292-A294 PolarHBondContact O-N 2.96Å; T292-V295 PolarHBondContact O-N 3.3Å; T292-L296 HydrophobicContact CG2-CD1 3.91Å; T292-L296 WeakPolarHBondContact O-CB 3.42Å; T292-L296 WeakPolarHBondContact O-CG 3.3Å; T292-L296 PolarHBondContact O-N 3.17Å
293	I	84.9	Confident	83.2	Confident	2 Å²	2	30.7 Å²	30.7	1%	0.01	17%	0.166	C	C	.	.	H	α-helix	trans	-59.3	-40.3	172.6	-69.8	165.9	0	0	0	110.7	I243 I289 I290 N297 M698 Y701 L702 L712	I243-I293 HydrophobicContact CD1-CG1 4.18Å; I289-I293 HydrophobicContact CG2-CD1 3.75Å; I289-I293 HydrophobicContact CG2-CG1 4.41Å; I289-I293 WeakPolarHBondContact O-CB 3.38Å; I289-I293 VanDerWaalsContact O-CG1 3.26Å; I289-I293 WeakPolarHBondContact O-CG1 3.39Å; I289-I293 PolarHBondContact O-N 2.74Å; I290-I293 PolarHBondContact O-N 3.48Å; I293-N297 PolarHBondContact O-N 3.12Å; I293-M698 HydrophobicContact CD1-CB 3.93Å; I293-Y701 HydrophobicContact CG2-CD1 3.91Å; I293-L702 HydrophobicContact CB-CD1 4.46Å; I293-L702 HydrophobicContact CG1-CD1 4.25Å; I293-L702 HydrophobicContact CG2-CB 4.22Å; I293-L702 HydrophobicContact CG2-CD1 4.2Å; I293-L712 HydrophobicContact CD1-CD2 3.74Å; I293-L712 HydrophobicContact CG1-CD2 4.45Å
294	A	85.7	Confident	81.8	Confident	40 Å²	40	28.8 Å²	28.8	33%	0.331	16%	0.156	S	C	.	.	H	α-helix	trans	-66	-43.9	174.9	0	0	0	0	0	112.6	I290 T291 T292 L296 N297 V298	I290-A294 PolarHBondContact O-N 3.15Å; T291-A294 WeakPolarHBondContact O-CB 3.34Å; T291-A294 PolarHBondContact O-N 3.05Å; T292-A294 VanDerWaalsContact C-N 3.28Å; T292-A294 PolarHBondContact O-N 2.96Å; A294-L296 PolarHBondContact O-N 2.9Å; A294-N297 PolarHBondContact O-N 3.03Å; A294-V298 WeakPolarHBondContact O-CG2 3.38Å; A294-V298 PolarHBondContact O-N 2.88Å
295	V	85.8	Confident	80.5	Confident	4 Å²	4	28.8 Å²	28.8	2%	0.024	16%	0.16	C	C	.	.	H	α-helix	trans	-61	-42.6	175.2	171.6	0	0	0	0	111.2	A237 T291 T292 V298 Y299 L438 L442	A237-V295 HydrophobicContact CB-CG1 4.27Å; T291-V295 WeakPolarHBondContact O-CG2 3.23Å; T291-V295 PolarHBondContact O-N 2.76Å; T292-V295 PolarHBondContact O-N 3.3Å; V295-V298 CarbonylContact O-C 3.53Å; V295-V298 WeakPolarHBondContact O-CA 3.22Å; V295-V298 WeakPolarHBondContact O-CB 3.45Å; V295-V298 PolarHBondContact O-N 3.5Å; V295-V298 VanDerWaalsContact O-N 3.09Å; V295-Y299 PolarHBondContact O-N 3.07Å; V295-L438 HydrophobicContact CG2-CB 3.88Å; V295-L442 HydrophobicContact CG2-CD1 3.8Å
296	L	84.5	Confident	79.4	Confident	4 Å²	4	32.6 Å²	32.6	2%	0.021	19%	0.186	C	C	.	.	H	α-helix	trans	-65.9	-37	177.3	-75.3	162	0	0	0	112.5	A237 I243 T292 A294 V298 Y299 F300 L702	A237-L296 VanDerWaalsContact O-CD2 3.25Å; A237-L296 WeakPolarHBondContact O-CD2 3.46Å; I243-L296 HydrophobicContact CD1-CD1 3.46Å; I243-L296 VanDerWaalsContact CD1-CD1 3.46Å; I243-L296 HydrophobicContact CG1-CD1 3.76Å; T292-L296 HydrophobicContact CG2-CD1 3.91Å; T292-L296 WeakPolarHBondContact O-CB 3.42Å; T292-L296 WeakPolarHBondContact O-CG 3.3Å; T292-L296 PolarHBondContact O-N 3.17Å; A294-L296 PolarHBondContact O-N 2.9Å; L296-V298 VanDerWaalsContact C-N 3.27Å; L296-V298 PolarHBondContact O-N 3.03Å; L296-Y299 PolarHBondContact O-N 2.76Å; L296-F300 HydrophobicContact CD2-CD2 4.29Å; L296-F300 HydrophobicContact CD2-CE2 3.89Å; L296-F300 WeakPolarHBondContact O-CD2 3.48Å; L296-F300 PolarHBondContact O-N 3.18Å; L296-L702 HydrophobicContact CB-CD1 4.07Å; L296-L702 HydrophobicContact CD1-CD1 4.09Å
297	N	82.4	Confident	78.3	Confident	37 Å²	37	42.4 Å²	42.4	20%	0.198	22%	0.223	C	C	.	.	H	α-helix	trans	-69.1	-23.4	172	-168.9	43.9	0	0	0	113	I293 A294 Y701	I293-N297 PolarHBondContact O-N 3.12Å; A294-N297 PolarHBondContact O-N 3.03Å; N297-Y701 HydrophobicContact CB-CD1 4.08Å; N297-Y701 HydrophobicContact CB-CE1 3.6Å; N297-Y701 WeakPolarHBondContact ND2-CE1 3.22Å; N297-Y701 PolarHBondContact ND2-OH 3.22Å
298	V	83.1	Confident	77.4	Confident	28 Å²	28	41.4 Å²	41.4	17%	0.17	21%	0.213	C	C	.	.	H	α-helix	trans	-78.2	-42	170	173.6	0	0	0	0	111.2	A294 V295 L296 R301 W431 V434 L438	A294-V298 WeakPolarHBondContact O-CG2 3.38Å; A294-V298 PolarHBondContact O-N 2.88Å; V295-V298 CarbonylContact O-C 3.53Å; V295-V298 WeakPolarHBondContact O-CA 3.22Å; V295-V298 WeakPolarHBondContact O-CB 3.45Å; V295-V298 PolarHBondContact O-N 3.5Å; V295-V298 VanDerWaalsContact O-N 3.09Å; L296-V298 VanDerWaalsContact C-N 3.27Å; L296-V298 PolarHBondContact O-N 3.03Å; V298-R301 WeakPolarHBondContact O-CB 3.31Å; V298-R301 PolarHBondContact O-N 3.01Å; V298-W431 HydrophobicContact CG1-CE3 3.84Å; V298-W431 HydrophobicContact CG1-CZ3 4.24Å; V298-V434 HydrophobicContact CG1-CG1 4.06Å; V298-L438 HydrophobicContact CB-CD1 4.4Å; V298-L438 HydrophobicContact CG1-CD1 4.13Å; V298-L438 HydrophobicContact CG2-CD1 4.15Å
299	Y	82.9	Confident	76.7	Confident	74 Å²	74	44 Å²	44	29%	0.29	23%	0.23	S	C	.	.	H	α-helix	trans	-64.6	-50.1	179.1	-178.8	-89.6	0	0	0	112.4	A237 G238 V295 L296 R301 T432 S435	A237-Y299 HydrophobicContact CB-CD2 3.71Å; A237-Y299 HydrophobicContact CB-CE2 4.25Å; A237-Y299 HydrophobicContact CB-CG 4.43Å; G238-Y299 VanDerWaalsContact CA-CZ 3.48Å; V295-Y299 PolarHBondContact O-N 3.07Å; L296-Y299 PolarHBondContact O-N 2.76Å; Y299-R301 PolarHBondContact O-N 3.29Å; Y299-T432 HydrophobicContact CD2-CG2 3.72Å; Y299-T432 HydrophobicContact CE2-CG2 3.56Å; Y299-T432 HydrophobicContact CG-CG2 4.36Å; Y299-S435 WeakPolarHBondContact CD2-OG 3.47Å
300	F	79.7	Confident	76	Confident	63 Å²	63	49 Å²	49	28%	0.276	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	15.4	-179.7	-71	-68.4	0	0	0	113.9	L296 P703 C705 A706	L296-F300 HydrophobicContact CD2-CD2 4.29Å; L296-F300 HydrophobicContact CD2-CE2 3.89Å; L296-F300 WeakPolarHBondContact O-CD2 3.48Å; L296-F300 PolarHBondContact O-N 3.18Å; F300-P703 HydrophobicContact CB-CB 4.33Å; F300-P703 HydrophobicContact CB-CG 3.77Å; F300-P703 HydrophobicContact CD2-CG 4.13Å; F300-P703 HydrophobicContact CG-CG 4.32Å; F300-C705 HydrophobicContact CB-CB 4.38Å; F300-C705 HydrophobicContact CD1-CB 3.95Å; F300-C705 HydrophobicContact CE1-CB 4.43Å; F300-C705 HydrophobicContact CG-CB 4.16Å; F300-A706 HydrophobicContact CD2-CB 4Å; F300-A706 HydrophobicContact CE2-CB 3.69Å; F300-A706 HydrophobicContact CZ-CB 4.46Å
301	R	76.6	Confident	75.6	Confident	99 Å²	99	54.1 Å²	54.1	37%	0.374	28%	0.28	S	S	.	.			trans	-62.8	126.6	-178.9	-165.5	174.3	-169.7	154.7	8.7	110.3	V298 Y299 A305	V298-R301 WeakPolarHBondContact O-CB 3.31Å; V298-R301 PolarHBondContact O-N 3.01Å; Y299-R301 PolarHBondContact O-N 3.29Å; R301-A305 HydrophobicContact CG-CB 4.26Å
302	P	67.5	Low	75	Confident	46 Å²	46	52.6 Å²	52.6	30%	0.299	27%	0.272	S	S	.	.			trans	-62.8	140.3	-174.3	24.2	-34.3	0	0	0	111.4	S304 A305 M897	P302-S304 PolarHBondContact O-N 3.3Å; P302-A305 WeakPolarHBondContact O-CB 3.41Å; P302-A305 PolarHBondContact O-N 3.33Å; P302-M897 HydrophobicContact CG-CE 4.36Å
303	P	63	Low	74.4	Confident	16 Å²	16	57.4 Å²	57.4	10%	0.104	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-26.9	-173.7	27.6	-35.3	0	0	0	112.2	A305 E424 R427	P303-A305 PolarHBondContact O-N 2.77Å; P303-A305 VanDerWaalsContact O-N 3.13Å; P303-E424 HydrophobicContact CB-CB 3.89Å; P303-E424 HydrophobicContact CB-CG 4.06Å; P303-E424 HydrophobicContact CG-CB 4.28Å; P303-E424 HydrophobicContact CG-CG 4.47Å; P303-R427 HydrophobicContact CB-CB 4.43Å; P303-R427 WeakPolarHBondContact O-CD 3.36Å; P303-R427 PolarHBondContact O-NH1 3.33Å
304	S	57.6	Low	74	Confident	28 Å²	28	60.4 Å²	60.4	20%	0.196	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-7.2	173.2	52.6	0	0	0	0	114.6	P302	P302-S304 PolarHBondContact O-N 3.3Å
305	A	60.7	Low	73.6	Confident	23 Å²	23	60.8 Å²	60.8	19%	0.19	30%	0.302	C	S	.	.	S	Bend	trans	-65.3	162.2	169.8	0	0	0	0	0	113.1	R301 P302 P303	R301-A305 HydrophobicContact CG-CB 4.26Å; P302-A305 WeakPolarHBondContact O-CB 3.41Å; P302-A305 PolarHBondContact O-N 3.33Å; P303-A305 PolarHBondContact O-N 2.77Å; P303-A305 VanDerWaalsContact O-N 3.13Å
306	S	63.3	Low	73.1	Confident	83 Å²	83	62 Å²	62	58%	0.58	31%	0.307	S	S	*	.	P	Polyproline II helix	trans	-54.9	140.5	176.1	58.3	0	0	0	0	112.8
307	R	64.6	Low	72.4	Confident	209 Å²	209	64 Å²	64	79%	0.789	32%	0.318	S	S	*	.	P	Polyproline II helix	trans	-47.9	143.3	168.2	-63.7	178.7	179.7	169.6	0.3	110.8
308	L	69.3	Low	71.8	Confident	13 Å²	13	67.9 Å²	67.9	7%	0.068	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-47.3	127.6	174.6	-89.5	158.1	0	0	0	111.1	A312 R313 E430 W431 V434	L308-A312 HydrophobicContact CD2-CB 4.31Å; L308-R313 HydrophobicContact CB-CB 4.32Å; L308-E430 HydrophobicContact CD1-CB 3.91Å; L308-W431 HydrophobicContact CD2-CD2 4.49Å; L308-W431 HydrophobicContact CD2-CE3 4.09Å; L308-W431 HydrophobicContact CD2-CH2 3.42Å; L308-W431 VanDerWaalsContact CD2-CH2 3.42Å; L308-W431 HydrophobicContact CD2-CZ2 3.87Å; L308-W431 HydrophobicContact CD2-CZ3 3.56Å; L308-W431 HydrophobicContact CG-CD2 4.4Å; L308-W431 HydrophobicContact CG-CE3 4.48Å; L308-W431 HydrophobicContact CG-CH2 3.96Å; L308-W431 HydrophobicContact CG-CZ2 3.86Å; L308-W431 HydrophobicContact CG-CZ3 4.29Å; L308-V434 HydrophobicContact CD1-CG2 3.95Å; L308-V434 HydrophobicContact CD2-CG2 4.19Å
309	P	72.1	Confident	71.3	Confident	54 Å²	54	71.8 Å²	71.8	35%	0.351	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-52.6	146.3	176.3	-28	34.8	0	0	0	111.9	W311 A312 R313	P309-W311 VanDerWaalsContact C-N 3.27Å; P309-W311 HydrophobicContact CB-CG 4.37Å; P309-W311 PolarHBondContact O-N 3.25Å; P309-A312 HydrophobicContact CB-CB 4.12Å; P309-A312 HydrophobicContact CG-CB 4.37Å; P309-A312 PolarHBondContact O-N 3.02Å; P309-R313 WeakPolarHBondContact O-CB 3.27Å; P309-R313 PolarHBondContact O-N 2.85Å
310	S	72.7	Confident	71	Confident	106 Å²	106	69.7 Å²	69.7	74%	0.741	34%	0.341	S	S	*	.	H	α-helix	trans	-55.6	-41.1	-177.1	50.4	0	0	0	0	112.9	N314	S310-N314 WeakPolarHBondContact O-CB 3.35Å; S310-N314 PolarHBondContact O-N 3.18Å
311	W	79.1	Confident	70.6	Confident	169 Å²	169	67 Å²	67	64%	0.64	33%	0.33	S	S	*	.	H	α-helix	trans	-63.2	-49.1	174.5	70.3	-97.8	0	0	0	111.8	P309 R313 N314 L315	P309-W311 VanDerWaalsContact C-N 3.27Å; P309-W311 HydrophobicContact CB-CG 4.37Å; P309-W311 PolarHBondContact O-N 3.25Å; W311-R313 PolarHBondContact O-N 2.77Å; W311-N314 WeakPolarHBondContact O-CB 3.42Å; W311-N314 PolarHBondContact O-N 3.33Å; W311-N314 VanDerWaalsContact O-N 3.1Å; W311-L315 HydrophobicContact CE3-CD2 4.36Å; W311-L315 HydrophobicContact CZ3-CD2 4.04Å; W311-L315 WeakPolarHBondContact O-CB 3.36Å; W311-L315 PolarHBondContact O-N 2.93Å
312	A	72.6	Confident	70.3	Confident	6 Å²	6	71.8 Å²	71.8	5%	0.05	35%	0.349	C	S	.	.	H	α-helix	trans	-64.3	-40.8	-179.3	0	0	0	0	0	111.2	L308 P309 N314 L315 F316	L308-A312 HydrophobicContact CD2-CB 4.31Å; P309-A312 HydrophobicContact CB-CB 4.12Å; P309-A312 HydrophobicContact CG-CB 4.37Å; P309-A312 PolarHBondContact O-N 3.02Å; A312-N314 VanDerWaalsContact C-N 3.3Å; A312-N314 PolarHBondContact O-N 3.28Å; A312-L315 PolarHBondContact O-N 3.44Å; A312-F316 HydrophobicContact CB-CD2 4.26Å; A312-F316 WeakPolarHBondContact O-CB 3.38Å; A312-F316 VanDerWaalsContact O-CD2 3.3Å; A312-F316 WeakPolarHBondContact O-CD2 3.48Å; A312-F316 PolarHBondContact O-N 3.29Å
313	R	74.5	Confident	70.5	Confident	102 Å²	102	75.6 Å²	75.6	39%	0.385	37%	0.365	S	S	.	.	H	α-helix	trans	-63.3	-35.7	174.2	-169	-178.8	-99.2	-151.1	-1	111.7	L308 P309 W311 L317 E430	L308-R313 HydrophobicContact CB-CB 4.32Å; P309-R313 WeakPolarHBondContact O-CB 3.27Å; P309-R313 PolarHBondContact O-N 2.85Å; W311-R313 PolarHBondContact O-N 2.77Å; R313-L317 HydrophobicContact CG-CD1 3.62Å; R313-L317 HydrophobicContact CG-CG 4.05Å; R313-L317 WeakPolarHBondContact O-CA 3.5Å; R313-L317 WeakPolarHBondContact O-CB 3.45Å; R313-L317 PolarHBondContact O-N 3.44Å; R313-E430 IonicContact CZ-OE1 2.76Å; R313-E430 IonicContact CZ-OE2 3.72Å; R313-E430 IonicContact NE-OE2 3.08Å; R313-E430 PolarHBondContact NE-OE2 3.28Å; R313-E430 IonicContact NH1-OE1 2.76Å; R313-E430 IonicContact NH2-OE1 3.8Å; R313-E430 PolarHBondContact NH2-OE1 2.92Å; R313-E430 IonicContact NH2-OE2 2.66Å; R313-E430 PolarHBondContact NH2-OE2 2.98Å
314	N	75.7	Confident	70.9	Confident	65 Å²	65	76 Å²	76	35%	0.348	37%	0.366	S	S	.	.	H	α-helix	trans	-71.1	-42.9	175.8	-161	65.1	0	0	0	111.9	S310 W311 A312 K318 Q319	S310-N314 WeakPolarHBondContact O-CB 3.35Å; S310-N314 PolarHBondContact O-N 3.18Å; W311-N314 WeakPolarHBondContact O-CB 3.42Å; W311-N314 PolarHBondContact O-N 3.33Å; W311-N314 VanDerWaalsContact O-N 3.1Å; A312-N314 VanDerWaalsContact C-N 3.3Å; A312-N314 PolarHBondContact O-N 3.28Å; N314-K318 VanDerWaalsContact O-CB 3.3Å; N314-K318 WeakPolarHBondContact O-CB 3.26Å; N314-K318 PolarHBondContact O-N 2.85Å; N314-K318 WeakPolarHBondContact OD1-CD 3.38Å; N314-K318 VanDerWaalsContact OD1-CE 3.26Å; N314-K318 WeakPolarHBondContact OD1-CE 3.43Å; N314-K318 PolarHBondContact OD1-NZ 2.99Å; N314-Q319 PolarHBondContact O-N 2.89Å
315	L	77.7	Confident	71.4	Confident	48 Å²	48	82.3 Å²	82.3	25%	0.251	40%	0.398	S	S	.	.	I	π-helix	trans	-64	-60.7	177.5	-179	64.3	0	0	0	111.5	W311 A312 Q319 F320	W311-L315 HydrophobicContact CE3-CD2 4.36Å; W311-L315 HydrophobicContact CZ3-CD2 4.04Å; W311-L315 WeakPolarHBondContact O-CB 3.36Å; W311-L315 PolarHBondContact O-N 2.93Å; A312-L315 PolarHBondContact O-N 3.44Å; L315-Q319 WeakPolarHBondContact O-CB 3.45Å; L315-Q319 PolarHBondContact O-N 3.23Å; L315-Q319 VanDerWaalsContact O-N 3.07Å; L315-F320 HydrophobicContact CD1-CD2 4.06Å; L315-F320 HydrophobicContact CD1-CE2 3.69Å; L315-F320 HydrophobicContact CD1-CZ 4.17Å; L315-F320 HydrophobicContact CD2-CE2 3.88Å; L315-F320 HydrophobicContact CG-CD2 3.82Å; L315-F320 HydrophobicContact CG-CE2 3.52Å; L315-F320 HydrophobicContact CG-CZ 4.43Å; L315-F320 PolarHBondContact O-N 3.45Å
316	F	75.1	Confident	71.8	Confident	28 Å²	28	83.4 Å²	83.4	12%	0.123	40%	0.399	C	S	.	.	I	π-helix	trans	-76.3	-31.4	-175.3	-68.1	-75.4	0	0	0	114.4	A312 F320 P321 V434 I437 L438	A312-F316 HydrophobicContact CB-CD2 4.26Å; A312-F316 WeakPolarHBondContact O-CB 3.38Å; A312-F316 VanDerWaalsContact O-CD2 3.3Å; A312-F316 WeakPolarHBondContact O-CD2 3.48Å; A312-F316 PolarHBondContact O-N 3.29Å; F316-F320 AromaticContact CD1-CD2 3.62Å; F316-F320 HydrophobicContact CD1-CD2 3.62Å; F316-F320 HydrophobicContact CD1-CE2 4.05Å; F316-F320 AromaticContact CE1-CD2 3.79Å; F316-F320 HydrophobicContact CE1-CD2 3.79Å; F316-F320 AromaticContact CE1-CE2 3.74Å; F316-F320 HydrophobicContact CE1-CE2 3.74Å; F316-F320 HydrophobicContact CG-CD2 4.28Å; F316-F320 HydrophobicContact CZ-CE2 4.21Å; F316-P321 WeakPolarHBondContact O-CD 3.28Å; F316-P321 WeakPolarHBondContact O-CG 3.31Å; F316-V434 HydrophobicContact CB-CG2 3.91Å; F316-V434 HydrophobicContact CD1-CG1 4.11Å; F316-V434 HydrophobicContact CD2-CG1 4.23Å; F316-V434 HydrophobicContact CE1-CG1 4.37Å; F316-V434 HydrophobicContact CE2-CG1 4.48Å; F316-V434 HydrophobicContact CG-CG1 4.06Å; F316-V434 HydrophobicContact CG-CG2 4.25Å; F316-I437 HydrophobicContact CD1-CB 4.36Å; F316-I437 HydrophobicContact CD1-CG2 3.77Å; F316-I437 HydrophobicContact CE1-CG2 4.29Å; F316-I437 WeakPolarHBondContact O-CD1 3.15Å; F316-L438 HydrophobicContact CE1-CD2 3.69Å; F316-L438 HydrophobicContact CE1-CG 3.99Å; F316-L438 HydrophobicContact CZ-CD2 3.88Å; F316-L438 HydrophobicContact CZ-CG 4.41Å
317	L	70.4	Confident	71.7	Confident	47 Å²	47	90.8 Å²	90.8	25%	0.246	41%	0.414	C	S	.	.	I	π-helix	trans	-96.7	-8.4	-179.9	-50.5	-170.6	0	0	0	114.7	R313 F433	R313-L317 HydrophobicContact CG-CD1 3.62Å; R313-L317 HydrophobicContact CG-CG 4.05Å; R313-L317 WeakPolarHBondContact O-CA 3.5Å; R313-L317 WeakPolarHBondContact O-CB 3.45Å; R313-L317 PolarHBondContact O-N 3.44Å; L317-F433 HydrophobicContact CD2-CD1 3.64Å; L317-F433 HydrophobicContact CD2-CE1 3.97Å
318	K	69.9	Low	71.6	Confident	119 Å²	119	84.2 Å²	84.2	52%	0.517	40%	0.397	S	S	.	.	I	π-helix	trans	-127.3	-38.7	177.3	-50.3	-174.3	-164.6	158	0	115.7	N314 R322	N314-K318 VanDerWaalsContact O-CB 3.3Å; N314-K318 WeakPolarHBondContact O-CB 3.26Å; N314-K318 PolarHBondContact O-N 2.85Å; N314-K318 WeakPolarHBondContact OD1-CD 3.38Å; N314-K318 VanDerWaalsContact OD1-CE 3.26Å; N314-K318 WeakPolarHBondContact OD1-CE 3.43Å; N314-K318 PolarHBondContact OD1-NZ 2.99Å; K318-R322 VanDerWaalsContact O-CD 3.26Å; K318-R322 WeakPolarHBondContact O-CD 3.48Å; K318-R322 WeakPolarHBondContact O-CG 3.47Å; K318-R322 PolarHBondContact O-NE 3.45Å
319	Q	71.9	Confident	71.2	Confident	110 Å²	110	86.3 Å²	86.3	51%	0.514	41%	0.412	S	S	.	.	I	π-helix	trans	-87.3	-61.6	-175	-69.9	175.7	-40.6	0	0	111.4	N314 L315 R322 L323	N314-Q319 PolarHBondContact O-N 2.89Å; L315-Q319 WeakPolarHBondContact O-CB 3.45Å; L315-Q319 PolarHBondContact O-N 3.23Å; L315-Q319 VanDerWaalsContact O-N 3.07Å; Q319-R322 WeakPolarHBondContact O-CB 3.47Å; Q319-R322 PolarHBondContact O-N 2.94Å; Q319-L323 PolarHBondContact O-N 3.46Å
320	F	76.9	Confident	70.5	Confident	29 Å²	29	93.3 Å²	93.3	13%	0.127	43%	0.431	C	S	.	.	H	α-helix	trans	-57	-39.5	-177.8	-77.6	-54.8	0	0	0	115	L315 F316 R322 L323 L324 I437 F441	L315-F320 HydrophobicContact CD1-CD2 4.06Å; L315-F320 HydrophobicContact CD1-CE2 3.69Å; L315-F320 HydrophobicContact CD1-CZ 4.17Å; L315-F320 HydrophobicContact CD2-CE2 3.88Å; L315-F320 HydrophobicContact CG-CD2 3.82Å; L315-F320 HydrophobicContact CG-CE2 3.52Å; L315-F320 HydrophobicContact CG-CZ 4.43Å; L315-F320 PolarHBondContact O-N 3.45Å; F316-F320 AromaticContact CD1-CD2 3.62Å; F316-F320 HydrophobicContact CD1-CD2 3.62Å; F316-F320 HydrophobicContact CD1-CE2 4.05Å; F316-F320 AromaticContact CE1-CD2 3.79Å; F316-F320 HydrophobicContact CE1-CD2 3.79Å; F316-F320 AromaticContact CE1-CE2 3.74Å; F316-F320 HydrophobicContact CE1-CE2 3.74Å; F316-F320 HydrophobicContact CG-CD2 4.28Å; F316-F320 HydrophobicContact CZ-CE2 4.21Å; F320-R322 PolarHBondContact O-N 3.44Å; F320-L323 HydrophobicContact CD1-CD2 4.25Å; F320-L323 PolarHBondContact O-N 2.88Å; F320-L324 HydrophobicContact CB-CD1 4.24Å; F320-L324 WeakPolarHBondContact O-CB 3.45Å; F320-L324 VanDerWaalsContact O-CG 3.32Å; F320-L324 WeakPolarHBondContact O-CG 3.34Å; F320-L324 PolarHBondContact O-N 2.94Å; F320-I437 HydrophobicContact CB-CG2 3.55Å; F320-I437 HydrophobicContact CD2-CG2 4.13Å; F320-I437 HydrophobicContact CG-CG2 3.99Å; F320-F441 HydrophobicContact CD1-CD2 4.17Å; F320-F441 HydrophobicContact CD1-CE2 4.5Å; F320-F441 AromaticContact CE1-CD2 3.64Å; F320-F441 HydrophobicContact CE1-CD2 3.64Å; F320-F441 AromaticContact CE1-CE2 3.61Å; F320-F441 HydrophobicContact CE1-CE2 3.61Å; F320-F441 HydrophobicContact CE1-CG 4.16Å; F320-F441 HydrophobicContact CE1-CZ 4.1Å; F320-F441 HydrophobicContact CZ-CD2 4.36Å; F320-F441 HydrophobicContact CZ-CE1 4.46Å; F320-F441 HydrophobicContact CZ-CE2 4.24Å; F320-F441 HydrophobicContact CZ-CZ 4.28Å
321	P	71.2	Confident	69.7	Low	7 Å²	7	90.9 Å²	90.9	5%	0.045	42%	0.418	C	S	.	.	H	α-helix	trans	-63.4	-26.9	177.8	-24	34.8	0	0	0	113.7	F316 L325 M326 T328 F433 I437	F316-P321 WeakPolarHBondContact O-CD 3.28Å; F316-P321 WeakPolarHBondContact O-CG 3.31Å; P321-L325 CarbonylContact O-C 3.49Å; P321-L325 PolarHBondContact O-N 3.37Å; P321-M326 PolarHBondContact O-N 3.43Å; P321-T328 HydrophobicContact CB-CG2 4.12Å; P321-T328 HydrophobicContact CG-CG2 4.3Å; P321-F433 HydrophobicContact CG-CE1 4.32Å; P321-F433 HydrophobicContact CG-CZ 4.46Å; P321-I437 HydrophobicContact CG-CD1 3.85Å
322	R	69.9	Low	68.5	Low	200 Å²	200	84.7 Å²	84.7	76%	0.755	40%	0.397	S	S	*	.	H	α-helix	trans	-75.2	-44.8	174.3	-63.9	175.9	-175.3	-164.7	-1.3	111	K318 Q319 F320 L324 L325	K318-R322 VanDerWaalsContact O-CD 3.26Å; K318-R322 WeakPolarHBondContact O-CD 3.48Å; K318-R322 WeakPolarHBondContact O-CG 3.47Å; K318-R322 PolarHBondContact O-NE 3.45Å; Q319-R322 WeakPolarHBondContact O-CB 3.47Å; Q319-R322 PolarHBondContact O-N 2.94Å; F320-R322 PolarHBondContact O-N 3.44Å; R322-L324 VanDerWaalsContact C-N 3.33Å; R322-L324 PolarHBondContact O-N 3.41Å; R322-L325 PolarHBondContact O-N 2.95Å
323	L	72.6	Confident	67.7	Low	125 Å²	125	90.5 Å²	90.5	65%	0.654	43%	0.427	S	S	*	.	H	α-helix	trans	-62.4	-40.7	178	-173	68.8	0	0	0	111.8	Q319 F320 L325	Q319-L323 PolarHBondContact O-N 3.46Å; F320-L323 HydrophobicContact CD1-CD2 4.25Å; F320-L323 PolarHBondContact O-N 2.88Å; L323-L325 VanDerWaalsContact C-N 3.35Å
324	L	71.8	Confident	66.9	Low	24 Å²	24	94.9 Å²	94.9	13%	0.126	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	11.5	-177.7	-56.3	168.3	0	0	0	113.1	F320 R322 M326 I437 R440 F441 F444	F320-L324 HydrophobicContact CB-CD1 4.24Å; F320-L324 WeakPolarHBondContact O-CB 3.45Å; F320-L324 VanDerWaalsContact O-CG 3.32Å; F320-L324 WeakPolarHBondContact O-CG 3.34Å; F320-L324 PolarHBondContact O-N 2.94Å; R322-L324 VanDerWaalsContact C-N 3.33Å; R322-L324 PolarHBondContact O-N 3.41Å; L324-M326 HydrophobicContact CB-CE 3.65Å; L324-M326 HydrophobicContact CB-CG 4.46Å; L324-M326 HydrophobicContact CD1-CE 3.57Å; L324-M326 HydrophobicContact CG-CE 4.24Å; L324-M326 PolarHBondContact O-N 2.97Å; L324-I437 HydrophobicContact CD1-CG2 3.93Å; L324-R440 HydrophobicContact CD1-CB 4.33Å; L324-F441 HydrophobicContact CD1-CB 4.47Å; L324-F444 HydrophobicContact CD2-CD2 3.58Å; L324-F444 HydrophobicContact CD2-CE2 3.58Å
325	L	67.4	Low	66	Low	162 Å²	162	96.5 Å²	96.5	85%	0.848	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	21.3	179.7	-67.4	166.8	0	0	0	115.9	P321 R322 L323	P321-L325 CarbonylContact O-C 3.49Å; P321-L325 PolarHBondContact O-N 3.37Å; R322-L325 PolarHBondContact O-N 2.95Å; L323-L325 VanDerWaalsContact C-N 3.35Å
326	M	69.1	Low	65	Low	46 Å²	46	101.4 Å²	101.4	23%	0.227	46%	0.464	C	S	.	.	P	Polyproline II helix	trans	-83.8	128.4	-176.3	-75.2	-166.9	-99.4	0	0	112.8	P321 L324 T328 I437 R440	P321-M326 PolarHBondContact O-N 3.43Å; L324-M326 HydrophobicContact CB-CE 3.65Å; L324-M326 HydrophobicContact CB-CG 4.46Å; L324-M326 HydrophobicContact CD1-CE 3.57Å; L324-M326 HydrophobicContact CG-CE 4.24Å; L324-M326 PolarHBondContact O-N 2.97Å; M326-T328 PolarHBondContact O-N 2.89Å; M326-I437 HydrophobicContact CE-CG1 4.05Å; M326-R440 HydrophobicContact CE-CB 3.67Å; M326-R440 HydrophobicContact CE-CG 3.77Å; M326-R440 HydrophobicContact SD-CG 4.34Å
327	R	62.1	Low	64.2	Low	237 Å²	237	109.3 Å²	109.3	89%	0.894	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-71	118.6	170.3	-70.1	-179.5	175.6	175.9	0.2	110
328	T	61.5	Low	63.6	Low	71 Å²	71	116.5 Å²	116.5	44%	0.436	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-63.6	145.2	173.4	45.2	0	0	0	0	111.6	P321 M326 R330 F433	P321-T328 HydrophobicContact CB-CG2 4.12Å; P321-T328 HydrophobicContact CG-CG2 4.3Å; M326-T328 PolarHBondContact O-N 2.89Å; T328-R330 PolarHBondContact O-N 2.97Å; T328-F433 HydrophobicContact CG2-CE1 4.26Å; T328-F433 HydrophobicContact CG2-CZ 4.04Å
329	P	61.8	Low	62.9	Low	57 Å²	57	114.5 Å²	114.5	37%	0.37	51%	0.511	S	S	.	.			trans	-63.7	106.7	-175.5	-23.4	34.1	0	0	0	112.7	A331 L332 F433	P329-A331 PolarHBondContact O-N 2.68Å; P329-A331 VanDerWaalsContact O-N 3.14Å; P329-L332 HydrophobicContact CB-CD1 4.33Å; P329-F433 HydrophobicContact CG-CD2 4.13Å; P329-F433 HydrophobicContact CG-CE2 4.14Å
330	R	56.3	Low	62.3	Low	201 Å²	201	114 Å²	114	76%	0.758	51%	0.508	S	S	*	.	H	α-helix	trans	-66.3	-11.8	176.4	-68.7	-179	173.7	-179.8	-3.2	113.3	T328 R334	T328-R330 PolarHBondContact O-N 2.97Å; R330-R334 PolarHBondContact O-N 3.47Å
331	A	55.9	Low	61.4	Low	55 Å²	55	121.5 Å²	121.5	46%	0.455	54%	0.536	S	S	.	.	H	α-helix	trans	-63.4	-54.4	176.2	0	0	0	0	0	112.4	P329 L333 R334 Q335	P329-A331 PolarHBondContact O-N 2.68Å; P329-A331 VanDerWaalsContact O-N 3.14Å; A331-L333 PolarHBondContact O-N 2.92Å; A331-R334 PolarHBondContact O-N 2.86Å; A331-Q335 PolarHBondContact O-N 3.19Å
332	L	55.4	Low	60.7	Low	39 Å²	39	122.6 Å²	122.6	20%	0.204	55%	0.548	C	S	.	.	H	α-helix	trans	-44.2	-43.4	177.4	-87.9	162.4	0	0	0	113.1	P329 M426 E429	P329-L332 HydrophobicContact CB-CD1 4.33Å; L332-M426 HydrophobicContact CD2-CE 3.87Å; L332-M426 HydrophobicContact CD2-CG 4.01Å; L332-M426 HydrophobicContact CD2-SD 4.45Å; L332-E429 WeakPolarHBondContact CD2-OE2 3.41Å; L332-E429 WeakPolarHBondContact CG-OE2 3.4Å
333	L	55.5	Low	59.8	Low	129 Å²	129	119.1 Å²	119.1	68%	0.675	54%	0.535	S	S	*	.	H	α-helix	trans	-78	-30.3	-179.2	-67.6	174.2	0	0	0	114.1	A331	A331-L333 PolarHBondContact O-N 2.92Å
334	R	57.7	Low	58.9	Low	193 Å²	193	119.2 Å²	119.2	73%	0.728	53%	0.533	S	S	*	.	H	α-helix	trans	-77.3	-39.5	177.5	-78.6	-178.4	167.9	-175.2	-4.5	111.8	R330 A331 R337	R330-R334 PolarHBondContact O-N 3.47Å; A331-R334 PolarHBondContact O-N 2.86Å; R334-R337 PolarHBondContact O-N 3.01Å
335	Q	56.2	Low	57.9	Low	100 Å²	100	124.7 Å²	124.7	47%	0.467	56%	0.561	S	S	.	*	H	α-helix	trans	-78.3	-36.4	-170.2	-154.9	162.1	-12.5	0	0	112	A331 R337 R338 L339 Y422	A331-Q335 PolarHBondContact O-N 3.19Å; Q335-R337 PolarHBondContact O-N 2.75Å; Q335-R338 WeakPolarHBondContact O-CB 3.12Å; Q335-R338 PolarHBondContact O-N 2.94Å; Q335-L339 PolarHBondContact O-N 3.43Å; Q335-Y422 WeakPolarHBondContact CB-OH 3.48Å; Q335-Y422 WeakPolarHBondContact CG-OH 3.5Å
336	R	56.9	Low	57.1	Low	150 Å²	150	121 Å²	121	57%	0.566	55%	0.545	S	S	*	.	H	α-helix	trans	-55.9	-32.8	169.7	-164.7	171.4	174.2	178.5	-1.2	113.8	H340 M426	R336-H340 PolarHBondContact O-CD2 3.27Å; R336-H340 PolarHBondContact O-N 3.12Å; R336-M426 HydrophobicContact CB-CE 4.01Å; R336-M426 HydrophobicContact CG-CE 4.45Å
337	R	57.4	Low	56	Low	195 Å²	195	123.5 Å²	123.5	74%	0.736	57%	0.567	S	S	*	*	H	α-helix	trans	-70.6	-27.9	175.1	-66.7	-177.7	-178.7	-167	-0.8	113	R334 Q335 R341	R334-R337 PolarHBondContact O-N 3.01Å; Q335-R337 PolarHBondContact O-N 2.75Å; R337-R341 PolarHBondContact O-N 3.25Å
338	R	59.3	Low	55	Low	198 Å²	198	115.6 Å²	115.6	75%	0.747	55%	0.552	S	S	*	*	H	α-helix	trans	-70.7	-43.5	175.1	-67.9	-174.6	173.2	-174.5	-3.1	110.9	Q335 H340 R341 G342	Q335-R338 WeakPolarHBondContact O-CB 3.12Å; Q335-R338 PolarHBondContact O-N 2.94Å; R338-H340 PolarHBondContact O-N 3.31Å; R338-R341 PolarHBondContact O-N 3.36Å; R338-G342 PolarHBondContact O-N 2.97Å
339	L	55.1	Low	53.8	Low	76 Å²	76	116 Å²	116	40%	0.398	56%	0.563	S	S	.	*	H	α-helix	trans	-62.8	-43.7	179.7	-153.3	78.8	0	0	0	112.3	Q335 R341 G342 R343 Y422	Q335-L339 PolarHBondContact O-N 3.43Å; L339-R341 VanDerWaalsContact C-N 3.35Å; L339-R341 PolarHBondContact O-N 2.94Å; L339-G342 WeakPolarHBondContact O-CA 3.42Å; L339-G342 PolarHBondContact O-N 3.48Å; L339-G342 VanDerWaalsContact O-N 3.1Å; L339-R343 PolarHBondContact O-N 3.15Å; L339-Y422 HydrophobicContact CD2-CD1 3.77Å; L339-Y422 HydrophobicContact CD2-CE1 4.3Å; L339-Y422 HydrophobicContact CD2-CG 4.4Å
340	H	59.2	Low	52.7	Low	99 Å²	99	119 Å²	119	46%	0.458	58%	0.582	S	S	.	*	H	α-helix	trans	-62.9	-36.1	174.5	-79.6	-63.1	0	0	0	113.3	R336 R338 G342 R343 Q344	R336-H340 PolarHBondContact O-CD2 3.27Å; R336-H340 PolarHBondContact O-N 3.12Å; R338-H340 PolarHBondContact O-N 3.31Å; H340-G342 VanDerWaalsContact C-N 3.34Å; H340-R343 PolarHBondContact O-N 3.35Å; H340-Q344 WeakPolarHBondContact O-CG 3.45Å; H340-Q344 PolarHBondContact O-N 2.96Å; H340-Q344 VanDerWaalsContact O-N 3.09Å
341	R	57.3	Low	51.5	Low	187 Å²	187	118 Å²	118	71%	0.706	59%	0.589	S	S	*	*	H	α-helix	trans	-64.5	-37.2	171	-86.8	-172.6	170.8	-172.2	-3.6	112.4	R337 R338 L339 Q344 L345	R337-R341 PolarHBondContact O-N 3.25Å; R338-R341 PolarHBondContact O-N 3.36Å; L339-R341 VanDerWaalsContact C-N 3.35Å; L339-R341 PolarHBondContact O-N 2.94Å; R341-Q344 PolarHBondContact O-N 3.34Å; R341-L345 WeakPolarHBondContact O-CG 3.48Å; R341-L345 PolarHBondContact O-N 3.33Å
342	G	57	Low	50.4	Low	30 Å²	30	122.5 Å²	122.5	31%	0.309	61%	0.605	S	S	.	*	H	α-helix	trans	-59.1	-49.7	173.5	0	0	0	0	0	112.1	R338 L339 H340 Q344 L345 V346	R338-G342 PolarHBondContact O-N 2.97Å; L339-G342 WeakPolarHBondContact O-CA 3.42Å; L339-G342 PolarHBondContact O-N 3.48Å; L339-G342 VanDerWaalsContact O-N 3.1Å; H340-G342 VanDerWaalsContact C-N 3.34Å; G342-Q344 VanDerWaalsContact C-N 3.31Å; G342-Q344 PolarHBondContact O-N 2.69Å; G342-L345 PolarHBondContact O-N 2.66Å; G342-L345 VanDerWaalsContact O-N 3.11Å; G342-V346 PolarHBondContact O-N 2.97Å; G342-V346 VanDerWaalsContact O-N 3.17Å
343	R	50.5	Low	49.3	Very low	127 Å²	127	128.4 Å²	128.4	48%	0.479	64%	0.637	S	S	.	*	H	α-helix	trans	-59.8	-40.3	177.1	-159.2	176.8	-160.6	135.3	11.5	112.3	L339 H340 L345 V346 S347 E419	L339-R343 PolarHBondContact O-N 3.15Å; H340-R343 PolarHBondContact O-N 3.35Å; R343-L345 PolarHBondContact O-N 3.44Å; R343-V346 PolarHBondContact O-N 3.24Å; R343-S347 WeakPolarHBondContact O-CB 3.41Å; R343-S347 PolarHBondContact O-N 3.37Å; R343-S347 PolarHBondContact O-OG 3.45Å; R343-E419 IonicContact CZ-OE2 2.75Å; R343-E419 VanDerWaalsContact NH1-CD 3.26Å; R343-E419 IonicContact NH1-OE1 3.61Å; R343-E419 PolarHBondContact NH1-OE1 2.98Å; R343-E419 VanDerWaalsContact NH1-OE1 3.11Å; R343-E419 IonicContact NH1-OE2 3.62Å; R343-E419 PolarHBondContact NH1-OE2 3.04Å; R343-E419 IonicContact NH2-OE2 3.26Å
344	Q	53.9	Low	48.1	Very low	128 Å²	128	125.6 Å²	125.6	60%	0.598	64%	0.639	S	S	*	*	H	α-helix	trans	-64.3	-35	175	-74.6	-179.2	-45.2	0	0	113.4	H340 R341 G342 A348	H340-Q344 WeakPolarHBondContact O-CG 3.45Å; H340-Q344 PolarHBondContact O-N 2.96Å; H340-Q344 VanDerWaalsContact O-N 3.09Å; R341-Q344 PolarHBondContact O-N 3.34Å; G342-Q344 VanDerWaalsContact C-N 3.31Å; G342-Q344 PolarHBondContact O-N 2.69Å; Q344-A348 WeakPolarHBondContact O-CB 3.42Å; Q344-A348 PolarHBondContact O-N 3.08Å
345	L	50.8	Low	46.9	Very low	139 Å²	139	125.8 Å²	125.8	73%	0.728	65%	0.648	S	S	*	*	H	α-helix	trans	-69.7	-35.9	176.8	-76.1	163.1	0	0	0	112.3	R341 G342 R343	R341-L345 WeakPolarHBondContact O-CG 3.48Å; R341-L345 PolarHBondContact O-N 3.33Å; G342-L345 PolarHBondContact O-N 2.66Å; G342-L345 VanDerWaalsContact O-N 3.11Å; R343-L345 PolarHBondContact O-N 3.44Å
346	V	50.6	Low	45.6	Very low	85 Å²	85	129.6 Å²	129.6	52%	0.515	67%	0.667	S	S	.	*	H	α-helix	trans	-73.2	-40.3	175.4	179.7	0	0	0	0	111.1	G342 R343 A348 F415	G342-V346 PolarHBondContact O-N 2.97Å; G342-V346 VanDerWaalsContact O-N 3.17Å; R343-V346 PolarHBondContact O-N 3.24Å; V346-A348 VanDerWaalsContact C-N 3.32Å; V346-A348 PolarHBondContact O-N 2.92Å; V346-F415 HydrophobicContact CG1-CE2 4.43Å; V346-F415 HydrophobicContact CG2-CE1 4.39Å; V346-F415 HydrophobicContact CG2-CE2 3.92Å; V346-F415 HydrophobicContact CG2-CZ 3.67Å
347	S	46.2	Very low	44.4	Very low	98 Å²	98	131.8 Å²	131.8	69%	0.685	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	2.4	-177.8	78	0	0	0	0	115.2	R343	R343-S347 WeakPolarHBondContact O-CB 3.41Å; R343-S347 PolarHBondContact O-N 3.37Å; R343-S347 PolarHBondContact O-OG 3.45Å
348	A	41	Very low	43	Very low	70 Å²	70	133.1 Å²	133.1	58%	0.579	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.4	16	-176.1	0	0	0	0	0	113.9	Q344 V346 P350	Q344-A348 WeakPolarHBondContact O-CB 3.42Å; Q344-A348 PolarHBondContact O-N 3.08Å; V346-A348 VanDerWaalsContact C-N 3.32Å; V346-A348 PolarHBondContact O-N 2.92Å; A348-P350 WeakPolarHBondContact O-CD 2.79Å
349	A	36.4	Very low	41.7	Very low	81 Å²	81	132.9 Å²	132.9	67%	0.669	70%	0.696	S	S	*	*			trans	-67.6	111.6	167.2	0	0	0	0	0	109.3	M351	A349-M351 PolarHBondContact O-N 3.13Å
350	P	37.9	Very low	40.5	Very low	118 Å²	118	136.5 Å²	136.5	77%	0.766	72%	0.716	S	S	*	*			trans	-90.9	108.9	-169.2	32.8	-27.5	0	0	0	111.1	A348 N352	A348-P350 WeakPolarHBondContact O-CD 2.79Å; P350-N352 PolarHBondContact O-N 3.26Å; P350-N352 VanDerWaalsContact O-N 3.15Å
351	M	31.1	Very low	39.2	Very low	182 Å²	182	143.2 Å²	143.2	90%	0.897	74%	0.737	S	S	*	*			trans	-69.1	100.5	152.5	-82	-174.1	168.7	0	0	108.1	A349	A349-M351 PolarHBondContact O-N 3.13Å
352	N	33.5	Very low	38.1	Very low	149 Å²	149	137.9 Å²	137.9	80%	0.797	73%	0.733	S	S	*	*			trans	-148.1	135.9	165.5	-157.1	9.3	0	0	0	111.6	P350	P350-N352 PolarHBondContact O-N 3.26Å; P350-N352 VanDerWaalsContact O-N 3.15Å
353	N	31.1	Very low	36.8	Very low	163 Å²	163	144.5 Å²	144.5	87%	0.872	76%	0.757	S	S	*	*			trans	-97.4	133.8	-177.1	-77.5	-32	0	0	0	111
354	G	30.5	Very low	35.7	Very low	69 Å²	69	146.6 Å²	146.6	71%	0.711	77%	0.771	S	S	*	*			trans	104.8	148.5	158.1	0	0	0	0	0	117.3
355	H	33.8	Very low	34.8	Very low	198 Å²	198	145.6 Å²	145.6	92%	0.917	78%	0.779	S	S	*	*			trans	61.8	86.6	166.5	-70.8	-80.5	0	0	0	119.2
356	M	27.1	Very low	33.8	Very low	179 Å²	179	143.2 Å²	143.2	88%	0.882	78%	0.779	S	S	*	*			trans	-59.9	127.6	157.5	176.9	-161.5	-144	0	0	112.6
357	Q	32.5	Very low	32.7	Very low	196 Å²	196	143.6 Å²	143.6	92%	0.916	79%	0.785	S	S	*	*			trans	-146.4	151.1	153.8	-132.6	164.2	-8.7	0	0	111
358	R	28.7	Very low	31.8	Very low	223 Å²	223	147.1 Å²	147.1	84%	0.842	79%	0.791	S	S	*	*			trans	-91.3	145.7	-167.5	-67.9	169.4	166.6	161.8	-7.1	112.2
359	E	32.2	Very low	31.2	Very low	193 Å²	193	151.8 Å²	151.8	90%	0.902	80%	0.801	S	S	*	*			trans	-148.4	143.2	135.1	-137.7	167.7	-165.4	0	0	111.7
360	N	29.6	Very low	30.8	Very low	152 Å²	152	155.6 Å²	155.6	81%	0.813	81%	0.807	S	S	*	*			trans	-121.6	144.9	179.5	-71.9	-25.8	0	0	0	108.8
361	R	31.9	Very low	30.1	Very low	240 Å²	240	155.8 Å²	155.8	91%	0.906	81%	0.806	S	S	*	*			trans	169.1	150	138.3	170.3	166.6	-90.3	155.4	-9.3	112.9
362	A	32.8	Very low	30.1	Very low	75 Å²	75	153.7 Å²	153.7	62%	0.62	80%	0.804	S	S	*	*			trans	67.3	127.3	170.9	0	0	0	0	0	116.7
363	E	30.5	Very low	29.8	Very low	170 Å²	170	153.1 Å²	153.1	79%	0.794	81%	0.806	S	S	*	*			cis	75.7	137.3	37.8	-57.4	173.3	153	0	0	113.3
364	H	28.7	Very low	29.7	Very low	170 Å²	170	150.1 Å²	150.1	79%	0.787	80%	0.795	S	S	*	*			cis	-157.4	-166.1	-18.3	-129.5	-52.9	0	0	0	108.9
365	S	33.6	Very low	29.6	Very low	108 Å²	108	153.4 Å²	153.4	76%	0.755	80%	0.801	S	S	*	*			trans	68.5	114.6	178.7	-48.3	0	0	0	0	115
366	A	29.4	Very low	29.4	Very low	88 Å²	88	149.3 Å²	149.3	73%	0.727	79%	0.789	S	S	*	*			cis	68.7	134.7	30.9	0	0	0	0	0	113.1
367	S	28.9	Very low	29.5	Very low	94 Å²	94	148.1 Å²	148.1	66%	0.657	79%	0.785	S	S	*	*			cis	-150	161.3	12.5	-56.2	0	0	0	0	113.3
368	Q	26.4	Very low	29.3	Very low	171 Å²	171	149.1 Å²	149.1	80%	0.799	78%	0.781	S	S	*	*			trans	61	149.3	159.4	-73.6	140.3	-54.3	0	0	117.8
369	E	28.8	Very low	29.4	Very low	169 Å²	169	143.7 Å²	143.7	79%	0.79	78%	0.776	S	S	*	*			cis	-152	166.3	19.1	-149.2	161.9	-132.3	0	0	113.9
370	M	27.1	Very low	29.3	Very low	161 Å²	161	140.2 Å²	140.2	79%	0.793	77%	0.769	S	S	*	*			trans	60.8	77.3	159.7	-154.8	160.5	-92.2	0	0	121.4
371	T	24.9	Very low	29.3	Very low	121 Å²	121	140.2 Å²	140.2	74%	0.742	77%	0.769	S	S	*	*				36.5	101.9	129.8	57.3	0	0	0	0	121.2
372	T	30.8	Very low	29.3	Very low	139 Å²	139	135.9 Å²	135.9	85%	0.853	76%	0.763	S	S	*	*			trans	-155.5	111.6	130.9	13	0	0	0	0	107.5	P374	T372-P374 WeakPolarHBondContact O-CD 2.94Å
373	T	26.4	Very low	29.1	Very low	137 Å²	137	141.4 Å²	141.4	84%	0.84	78%	0.776	S	S	*	*			trans	-88.2	118.5	-169.8	45.3	0	0	0	0	112.4
374	P	29.6	Very low	29.3	Very low	100 Å²	100	140.1 Å²	140.1	65%	0.649	77%	0.772	S	S	*	*			trans	-69	148.2	157.8	31.8	-33.2	0	0	0	109.5	T372 V376	T372-P374 WeakPolarHBondContact O-CD 2.94Å; P374-V376 PolarHBondContact O-N 3.03Å
375	V	28.8	Very low	29.6	Very low	137 Å²	137	136.5 Å²	136.5	83%	0.83	77%	0.767	S	S	*	*			trans	-70.7	98.9	175.1	179.2	0	0	0	0	109.1	I377	V375-I377 HydrophobicContact CG1-CG1 4.32Å; V375-I377 PolarHBondContact O-N 3.47Å
376	V	28.4	Very low	29.6	Very low	112 Å²	112	140 Å²	140	68%	0.679	77%	0.768	S	S	*	*			trans	-86.6	101.7	171.6	179.7	0	0	0	0	108.2	P374 R378	P374-V376 PolarHBondContact O-N 3.03Å; V376-R378 PolarHBondContact O-N 3.29Å
377	I	30.3	Very low	30	Very low	155 Å²	155	139.7 Å²	139.7	80%	0.795	76%	0.76	S	S	*	*			trans	-67.3	96.9	169.5	-56.9	177	0	0	0	107.7	V375	V375-I377 HydrophobicContact CG1-CG1 4.32Å; V375-I377 PolarHBondContact O-N 3.47Å
378	R	26.9	Very low	30.5	Very low	217 Å²	217	141 Å²	141	82%	0.819	76%	0.76	S	S	*	*			trans	-72.8	125.6	166.6	-86.3	-178.1	165.3	171.2	-4.8	108.5	V376 T380	V376-R378 PolarHBondContact O-N 3.29Å; R378-T380 PolarHBondContact O-N 2.9Å
379	S	30.9	Very low	31	Very low	108 Å²	108	140 Å²	140	76%	0.755	76%	0.756	S	S	*	*			trans	-64.6	103.9	169.5	38.9	0	0	0	0	110.5	N381	S379-N381 PolarHBondContact O-N 3.41Å
380	T	31.3	Very low	31.3	Very low	121 Å²	121	143.8 Å²	143.8	74%	0.742	76%	0.763	S	S	*	*			trans	-73.5	111.1	166.8	44.4	0	0	0	0	109.1	R378 L382	R378-T380 PolarHBondContact O-N 2.9Å; T380-L382 PolarHBondContact O-N 3.37Å; T380-L382 VanDerWaalsContact O-N 3.08Å
381	N	28.6	Very low	31.6	Very low	152 Å²	152	147.5 Å²	147.5	81%	0.813	77%	0.768	S	S	*	*			trans	-60.8	109.5	177.6	-67.2	-33.4	0	0	0	110.9	S379	S379-N381 PolarHBondContact O-N 3.41Å
382	L	31.2	Very low	32.2	Very low	149 Å²	149	150 Å²	150	78%	0.78	77%	0.769	S	S	*	*			trans	-94.3	113.8	165.9	-125.3	79.2	0	0	0	109.1	T380	T380-L382 PolarHBondContact O-N 3.37Å; T380-L382 VanDerWaalsContact O-N 3.08Å
383	H	30.5	Very low	32.3	Very low	191 Å²	191	147.6 Å²	147.6	88%	0.884	76%	0.757	S	S	*	*			trans	-77.2	121.6	170.3	-113	-82.3	0	0	0	109.2
384	I	34.7	Very low	33	Very low	142 Å²	142	149.8 Å²	149.8	73%	0.728	76%	0.758	S	S	*	*			trans	-116.5	143.2	171.2	-61.5	-179.4	0	0	0	108.5
385	S	33.4	Very low	33.7	Very low	95 Å²	95	153.3 Å²	153.3	66%	0.664	77%	0.766	S	S	*	*			trans	-77.4	152.2	-172	-165.7	0	0	0	0	113.1	S387	S385-S387 PolarHBondContact O-N 2.89Å
386	K	35	Very low	34.4	Very low	180 Å²	180	149.9 Å²	149.9	78%	0.783	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	38.4	-179.5	-74.9	-166.2	161.2	-158.3	0	114.2
387	S	37.9	Very low	35	Very low	82 Å²	82	150.5 Å²	150.5	57%	0.573	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	-29.4	-174.7	43.6	0	0	0	0	115	S385	S385-S387 PolarHBondContact O-N 2.89Å
388	D	38.9	Very low	35.7	Very low	121 Å²	121	147 Å²	147	65%	0.647	73%	0.732	S	S	*	*			trans	-110.8	16.3	-163.3	-67	-82.9	0	0	0	114.7	R390	D388-R390 PolarHBondContact O-N 3.3Å
389	E	36.5	Very low	36.5	Very low	151 Å²	151	139.1 Å²	139.1	71%	0.706	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	19.3	-168.6	-145.8	167.6	-141	0	0	115.2
390	R	34.5	Very low	37.3	Very low	249 Å²	249	137.8 Å²	137.8	94%	0.94	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139	10.5	-175.1	-66.3	-166.5	-175.5	-174.2	3.4	116.8	D388	D388-R390 PolarHBondContact O-N 3.3Å
391	R	34.8	Very low	38.3	Very low	238 Å²	238	135.2 Å²	135.2	90%	0.898	68%	0.684	S	S	*	*	S	Bend	trans	-127.3	26.1	175.6	-153	-179.8	-70.3	-179.7	-0.4	113.4
392	F	36.7	Very low	39.8	Very low	174 Å²	174	132.9 Å²	132.9	76%	0.763	67%	0.669	S	S	*	*			trans	-116.8	34.1	-164.1	-130.1	-84.1	0	0	0	113.5
393	S	33	Very low	41.1	Very low	88 Å²	88	129.3 Å²	129.3	62%	0.615	65%	0.65	S	S	*	*			trans	-112.1	146.2	-173.5	-160.5	0	0	0	0	113.3	E395	S393-E395 PolarHBondContact O-N 3.39Å; S393-E395 VanDerWaalsContact O-N 3.07Å
394	E	40.8	Very low	42.6	Very low	183 Å²	183	124.1 Å²	124.1	86%	0.855	63%	0.628	S	S	*	*	S	Bend	trans	68	-30.4	160	-74.3	162.6	135.1	0	0	122
395	E	44.2	Very low	44.2	Very low	175 Å²	175	122 Å²	122	82%	0.818	62%	0.618	S	S	*	*	S	Bend	trans	-110.1	-19.2	-176.7	-70	-166.7	140.4	0	0	116.9	S393 P398	S393-E395 PolarHBondContact O-N 3.39Å; S393-E395 VanDerWaalsContact O-N 3.07Å; E395-P398 WeakPolarHBondContact O-CD 3.5Å
396	T	43.5	Very low	45.8	Very low	65 Å²	65	121.1 Å²	121.1	40%	0.399	60%	0.603	S	S	.	*	S	Bend	trans	-94.5	-11	-169.5	49.5	0	0	0	0	115.8
397	L	42.3	Very low	47.3	Very low	124 Å²	124	113.4 Å²	113.4	65%	0.649	57%	0.573	S	S	*	*	H	α-helix	trans	-70.5	-43	-179.5	-134.5	77.6	0	0	0	115.9	A399 N401	L397-A399 PolarHBondContact O-N 2.94Å; L397-N401 VanDerWaalsContact O-CG 3.27Å; L397-N401 PolarHBondContact O-N 3.19Å; L397-N401 PolarHBondContact O-ND2 3.46Å
398	P	43.5	Very low	48.9	Very low	82 Å²	82	114.1 Å²	114.1	53%	0.532	57%	0.57	S	S	.	*	H	α-helix	trans	-71.6	-35	-164	25.7	-33.4	0	0	0	114.3	E395 N401 H402	E395-P398 WeakPolarHBondContact O-CD 3.5Å; P398-N401 PolarHBondContact O-N 3.46Å; P398-H402 PolarHBondContact O-N 2.87Å
399	A	44.4	Very low	50.5	Low	52 Å²	52	112.1 Å²	112.1	43%	0.43	56%	0.562	S	S	.	*	H	α-helix	trans	-68.3	-41.3	-178.1	0	0	0	0	0	112.7	L397 N401 H402 L403	L397-A399 PolarHBondContact O-N 2.94Å; A399-N401 VanDerWaalsContact C-N 3.34Å; A399-H402 PolarHBondContact O-N 2.99Å; A399-L403 PolarHBondContact O-N 2.97Å
400	C	47.2	Very low	52.2	Low	80 Å²	80	105.8 Å²	105.8	54%	0.541	54%	0.535	S	S	.	.	H	α-helix	trans	-66.5	-38.5	174.8	-166.3	0	0	0	0	111.1	H402 L404	C400-H402 VanDerWaalsContact C-N 3.33Å; C400-H402 PolarHBondContact O-N 3.2Å; C400-L404 VanDerWaalsContact O-CB 3.3Å; C400-L404 WeakPolarHBondContact O-CB 3.5Å; C400-L404 PolarHBondContact O-N 3.01Å; C400-L404 VanDerWaalsContact O-N 3.08Å
401	N	52.4	Low	54	Low	66 Å²	66	95.3 Å²	95.3	35%	0.353	50%	0.501	S	S	.	.	H	α-helix	trans	-63.7	-33.7	174	-71.3	-16.6	0	0	0	112.8	L397 P398 A399 N405	L397-N401 VanDerWaalsContact O-CG 3.27Å; L397-N401 PolarHBondContact O-N 3.19Å; L397-N401 PolarHBondContact O-ND2 3.46Å; P398-N401 PolarHBondContact O-N 3.46Å; A399-N401 VanDerWaalsContact C-N 3.34Å; N401-N405 VanDerWaalsContact O-CB 3.26Å; N401-N405 WeakPolarHBondContact O-CB 3.47Å; N401-N405 PolarHBondContact O-N 2.9Å; N401-N405 PolarHBondContact O-ND2 2.98Å
402	H	60.4	Low	55.9	Low	104 Å²	104	88.1 Å²	88.1	48%	0.481	48%	0.481	S	S	.	.	H	α-helix	trans	-62.6	-57.9	176.6	-170.1	-70.6	0	0	0	111.8	P398 A399 C400 L404 N405 E406	P398-H402 PolarHBondContact O-N 2.87Å; A399-H402 PolarHBondContact O-N 2.99Å; C400-H402 VanDerWaalsContact C-N 3.33Å; C400-H402 PolarHBondContact O-N 3.2Å; H402-L404 VanDerWaalsContact C-N 3.25Å; H402-L404 PolarHBondContact O-N 3.13Å; H402-N405 PolarHBondContact O-N 3.16Å; H402-N405 VanDerWaalsContact O-N 3.11Å; H402-E406 IonicContact CE1-OE2 2.81Å; H402-E406 PolarHBondContact CE1-OE2 2.99Å; H402-E406 VanDerWaalsContact CE1-OE2 3.28Å; H402-E406 IonicContact ND1-OE2 3.9Å; H402-E406 PolarHBondContact ND1-OE2 3.41Å; H402-E406 WeakPolarHBondContact O-CB 3.42Å; H402-E406 PolarHBondContact O-N 2.89Å
403	L	58.7	Low	57.7	Low	74 Å²	74	84.9 Å²	84.9	39%	0.387	47%	0.468	S	S	.	.	H	α-helix	trans	-60.9	-35.4	-179.8	-73.9	168.1	0	0	0	112	A399 A407	A399-L403 PolarHBondContact O-N 2.97Å; L403-A407 WeakPolarHBondContact O-CB 3.5Å; L403-A407 PolarHBondContact O-N 3.22Å
404	L	61.5	Low	59.7	Low	82 Å²	82	81.9 Å²	81.9	43%	0.429	45%	0.445	S	S	.	.	H	α-helix	trans	-66.9	-43.6	174.4	-174.4	62.6	0	0	0	112	C400 H402 E406 L408	C400-L404 VanDerWaalsContact O-CB 3.3Å; C400-L404 WeakPolarHBondContact O-CB 3.5Å; C400-L404 PolarHBondContact O-N 3.01Å; C400-L404 VanDerWaalsContact O-N 3.08Å; H402-L404 VanDerWaalsContact C-N 3.25Å; H402-L404 PolarHBondContact O-N 3.13Å; L404-E406 VanDerWaalsContact C-N 3.35Å; L404-L408 HydrophobicContact CD1-CD1 4.44Å; L404-L408 HydrophobicContact CG-CD1 4.04Å; L404-L408 VanDerWaalsContact O-CB 3.31Å; L404-L408 WeakPolarHBondContact O-CB 3.41Å; L404-L408 WeakPolarHBondContact O-CD1 3.47Å; L404-L408 WeakPolarHBondContact O-CG 3.37Å; L404-L408 PolarHBondContact O-N 2.92Å
405	N	68.8	Low	61.4	Low	96 Å²	96	78.2 Å²	78.2	51%	0.513	43%	0.427	S	S	.	.	H	α-helix	trans	-64.6	-37.8	176	-74.2	-22	0	0	0	112.2	N401 H402 L408 T409	N401-N405 VanDerWaalsContact O-CB 3.26Å; N401-N405 WeakPolarHBondContact O-CB 3.47Å; N401-N405 PolarHBondContact O-N 2.9Å; N401-N405 PolarHBondContact O-ND2 2.98Å; H402-N405 PolarHBondContact O-N 3.16Å; H402-N405 VanDerWaalsContact O-N 3.11Å; N405-L408 PolarHBondContact O-N 3.34Å; N405-T409 WeakPolarHBondContact O-CG2 3.17Å; N405-T409 PolarHBondContact O-N 3.47Å; N405-T409 PolarHBondContact O-OG1 3.47Å; N405-T409 VanDerWaalsContact O-OG1 3.06Å
406	E	67	Low	62.9	Low	77 Å²	77	72.4 Å²	72.4	36%	0.36	40%	0.401	S	S	.	.	H	α-helix	trans	-68.7	-41.7	178.7	-169.8	156.6	-142.3	0	0	112.1	H402 L404 T409 S410	H402-E406 IonicContact CE1-OE2 2.81Å; H402-E406 PolarHBondContact CE1-OE2 2.99Å; H402-E406 VanDerWaalsContact CE1-OE2 3.28Å; H402-E406 IonicContact ND1-OE2 3.9Å; H402-E406 PolarHBondContact ND1-OE2 3.41Å; H402-E406 WeakPolarHBondContact O-CB 3.42Å; H402-E406 PolarHBondContact O-N 2.89Å; L404-E406 VanDerWaalsContact C-N 3.35Å; E406-T409 PolarHBondContact O-OG1 3.01Å; E406-T409 VanDerWaalsContact O-OG1 3.07Å; E406-S410 WeakPolarHBondContact O-CB 3.41Å; E406-S410 PolarHBondContact O-N 3.42Å; E406-S410 PolarHBondContact O-OG 3.47Å
407	A	66.1	Low	64.5	Low	18 Å²	18	70.2 Å²	70.2	15%	0.149	39%	0.386	C	S	.	.	H	α-helix	trans	-65.3	-39.1	170.2	0	0	0	0	0	112.1	L403 A411 I869	L403-A407 WeakPolarHBondContact O-CB 3.5Å; L403-A407 PolarHBondContact O-N 3.22Å; A407-A411 VanDerWaalsContact O-CB 3.31Å; A407-A411 WeakPolarHBondContact O-CB 3.42Å; A407-A411 PolarHBondContact O-N 3.1Å; A407-I869 HydrophobicContact CB-CG1 4.4Å
408	L	71.3	Confident	66	Low	98 Å²	98	71 Å²	71	51%	0.513	38%	0.381	S	S	.	.	H	α-helix	trans	-68.1	-40.6	177.1	-76.8	168.4	0	0	0	112.9	L404 N405 A411 D412	L404-L408 HydrophobicContact CD1-CD1 4.44Å; L404-L408 HydrophobicContact CG-CD1 4.04Å; L404-L408 VanDerWaalsContact O-CB 3.31Å; L404-L408 WeakPolarHBondContact O-CB 3.41Å; L404-L408 WeakPolarHBondContact O-CD1 3.47Å; L404-L408 WeakPolarHBondContact O-CG 3.37Å; L404-L408 PolarHBondContact O-N 2.92Å; N405-L408 PolarHBondContact O-N 3.34Å; L408-A411 PolarHBondContact O-N 2.92Å; L408-D412 PolarHBondContact O-N 3.44Å
409	T	73.8	Confident	67.6	Low	78 Å²	78	70.5 Å²	70.5	48%	0.479	37%	0.372	S	S	.	.	H	α-helix	trans	-69.9	-37	176.7	52.2	0	0	0	0	111.7	N405 E406 D412 Q413	N405-T409 WeakPolarHBondContact O-CG2 3.17Å; N405-T409 PolarHBondContact O-N 3.47Å; N405-T409 PolarHBondContact O-OG1 3.47Å; N405-T409 VanDerWaalsContact O-OG1 3.06Å; E406-T409 PolarHBondContact O-OG1 3.01Å; E406-T409 VanDerWaalsContact O-OG1 3.07Å; T409-D412 PolarHBondContact O-N 3.41Å; T409-Q413 WeakPolarHBondContact O-CG 3.24Å; T409-Q413 PolarHBondContact O-N 2.99Å
410	S	72.5	Confident	68.9	Low	18 Å²	18	73.2 Å²	73.2	13%	0.126	37%	0.371	C	S	.	.	H	α-helix	trans	-64	-42	171.3	-60.1	0	0	0	0	111.6	E406 Q413 I414	E406-S410 WeakPolarHBondContact O-CB 3.41Å; E406-S410 PolarHBondContact O-N 3.42Å; E406-S410 PolarHBondContact O-OG 3.47Å; S410-Q413 PolarHBondContact O-N 3.08Å; S410-I414 WeakPolarHBondContact O-CD1 3.34Å; S410-I414 VanDerWaalsContact O-CG1 3.29Å; S410-I414 WeakPolarHBondContact O-CG1 3.47Å; S410-I414 PolarHBondContact O-N 2.92Å
411	A	71.8	Confident	70	Confident	29 Å²	29	74.4 Å²	74.4	24%	0.24	37%	0.37	C	S	.	.	H	α-helix	trans	-63.7	-41.8	173.9	0	0	0	0	0	112.7	A407 L408 I414 F415	A407-A411 VanDerWaalsContact O-CB 3.31Å; A407-A411 WeakPolarHBondContact O-CB 3.42Å; A407-A411 PolarHBondContact O-N 3.1Å; L408-A411 PolarHBondContact O-N 2.92Å; A411-I414 WeakPolarHBondContact O-CB 3.39Å; A411-I414 PolarHBondContact O-N 3.2Å; A411-F415 VanDerWaalsContact O-CD2 3.24Å; A411-F415 WeakPolarHBondContact O-CD2 3.45Å; A411-F415 PolarHBondContact O-N 2.92Å
412	D	74.2	Confident	71	Confident	87 Å²	87	73.9 Å²	73.9	47%	0.465	36%	0.364	S	S	.	.	H	α-helix	trans	-67.3	-36.9	176.5	-168.5	65	0	0	0	111.9	L408 T409 I414 F415 N416	L408-D412 PolarHBondContact O-N 3.44Å; T409-D412 PolarHBondContact O-N 3.41Å; D412-I414 VanDerWaalsContact C-N 3.35Å; D412-I414 PolarHBondContact O-N 3.04Å; D412-F415 PolarHBondContact O-N 2.72Å; D412-N416 VanDerWaalsContact CG-ND2 3.33Å; D412-N416 WeakPolarHBondContact O-CB 3.24Å; D412-N416 PolarHBondContact O-N 3.3Å; D412-N416 PolarHBondContact O-ND2 2.94Å; D412-N416 PolarHBondContact OD2-ND2 3.42Å
413	Q	73.6	Confident	71.6	Confident	106 Å²	106	71 Å²	71	50%	0.495	36%	0.358	S	S	.	.	H	α-helix	trans	-58.2	-46	170.3	-75.2	176.2	61.8	0	0	111.6	T409 S410 N416 H417	T409-Q413 WeakPolarHBondContact O-CG 3.24Å; T409-Q413 PolarHBondContact O-N 2.99Å; S410-Q413 PolarHBondContact O-N 3.08Å; Q413-N416 PolarHBondContact O-N 2.82Å; Q413-H417 WeakPolarHBondContact O-CB 3.41Å; Q413-H417 PolarHBondContact O-N 3.08Å
414	I	76.3	Confident	72.3	Confident	26 Å²	26	70.5 Å²	70.5	13%	0.133	35%	0.354	C	S	.	.	H	α-helix	trans	-60.8	-46.5	175.5	-67.3	163.3	0	0	0	110.8	S410 A411 D412 H417 Y418 I872 I875 L879	S410-I414 WeakPolarHBondContact O-CD1 3.34Å; S410-I414 VanDerWaalsContact O-CG1 3.29Å; S410-I414 WeakPolarHBondContact O-CG1 3.47Å; S410-I414 PolarHBondContact O-N 2.92Å; A411-I414 WeakPolarHBondContact O-CB 3.39Å; A411-I414 PolarHBondContact O-N 3.2Å; D412-I414 VanDerWaalsContact C-N 3.35Å; D412-I414 PolarHBondContact O-N 3.04Å; I414-H417 PolarHBondContact O-N 3.45Å; I414-Y418 HydrophobicContact CG2-CD2 3.74Å; I414-Y418 HydrophobicContact CG2-CE2 3.7Å; I414-Y418 VanDerWaalsContact O-CD2 3.29Å; I414-Y418 WeakPolarHBondContact O-CD2 3.46Å; I414-Y418 PolarHBondContact O-N 2.86Å; I414-I872 HydrophobicContact CD1-CG2 4.19Å; I414-I875 HydrophobicContact CD1-CB 4.34Å; I414-I875 HydrophobicContact CD1-CG2 3.78Å; I414-I875 HydrophobicContact CG1-CG2 4.14Å; I414-L879 HydrophobicContact CG1-CD1 4.02Å; I414-L879 HydrophobicContact CG2-CD1 4.42Å
415	F	75.7	Confident	72.9	Confident	106 Å²	106	70.5 Å²	70.5	47%	0.465	35%	0.351	S	S	.	.	H	α-helix	trans	-63.2	-41.4	177.4	-85.9	-66.9	0	0	0	113.1	V346 A411 D412 Y418 E419	V346-F415 HydrophobicContact CG1-CE2 4.43Å; V346-F415 HydrophobicContact CG2-CE1 4.39Å; V346-F415 HydrophobicContact CG2-CE2 3.92Å; V346-F415 HydrophobicContact CG2-CZ 3.67Å; A411-F415 VanDerWaalsContact O-CD2 3.24Å; A411-F415 WeakPolarHBondContact O-CD2 3.45Å; A411-F415 PolarHBondContact O-N 2.92Å; D412-F415 PolarHBondContact O-N 2.72Å; F415-Y418 PolarHBondContact O-N 3.5Å; F415-E419 PolarHBondContact O-N 2.91Å
416	N	77.1	Confident	73	Confident	52 Å²	52	67.3 Å²	67.3	28%	0.278	33%	0.334	S	S	.	.	H	α-helix	trans	-65.1	-39.5	175.4	-76.5	-61.2	0	0	0	111.7	D412 Q413 E419 R420	D412-N416 VanDerWaalsContact CG-ND2 3.33Å; D412-N416 WeakPolarHBondContact O-CB 3.24Å; D412-N416 PolarHBondContact O-N 3.3Å; D412-N416 PolarHBondContact O-ND2 2.94Å; D412-N416 PolarHBondContact OD2-ND2 3.42Å; Q413-N416 PolarHBondContact O-N 2.82Å; N416-E419 PolarHBondContact O-N 3.16Å; N416-R420 VanDerWaalsContact O-CG 3.29Å; N416-R420 WeakPolarHBondContact O-CG 3.32Å; N416-R420 PolarHBondContact O-N 3.37Å
417	H	75.5	Confident	73.5	Confident	20 Å²	20	66.6 Å²	66.6	9%	0.093	33%	0.328	C	S	.	.	H	α-helix	trans	-61.6	-46.9	173.3	179.7	85.3	0	0	0	111.4	Q413 I414 E419 R420 M421 E883	Q413-H417 WeakPolarHBondContact O-CB 3.41Å; Q413-H417 PolarHBondContact O-N 3.08Å; I414-H417 PolarHBondContact O-N 3.45Å; H417-E419 VanDerWaalsContact C-N 3.35Å; H417-E419 PolarHBondContact O-N 3.4Å; H417-R420 WeakPolarHBondContact O-CB 3.48Å; H417-R420 PolarHBondContact O-N 2.91Å; H417-M421 WeakPolarHBondContact O-CB 3.46Å; H417-M421 WeakPolarHBondContact O-CG 3.19Å; H417-M421 PolarHBondContact O-N 3.24Å; H417-E883 IonicContact CE1-OE1 2.9Å; H417-E883 IonicContact CG-OE1 3.21Å; H417-E883 IonicContact ND1-OE1 2.7Å; H417-E883 PolarHBondContact ND1-OE1 3.04Å
418	Y	74.8	Confident	73.9	Confident	139 Å²	139	70.8 Å²	70.8	55%	0.545	34%	0.34	S	S	.	.	H	α-helix	trans	-61.6	-37.6	174.3	-85.4	-68.7	0	0	0	113.1	I414 F415 Y422	I414-Y418 HydrophobicContact CG2-CD2 3.74Å; I414-Y418 HydrophobicContact CG2-CE2 3.7Å; I414-Y418 VanDerWaalsContact O-CD2 3.29Å; I414-Y418 WeakPolarHBondContact O-CD2 3.46Å; I414-Y418 PolarHBondContact O-N 2.86Å; F415-Y418 PolarHBondContact O-N 3.5Å; Y418-Y422 VanDerWaalsContact O-CB 3.23Å; Y418-Y422 WeakPolarHBondContact O-CB 3.28Å; Y418-Y422 PolarHBondContact O-N 3.23Å
419	E	76	Confident	74.2	Confident	73 Å²	73	70 Å²	70	34%	0.341	33%	0.333	S	S	.	.	H	α-helix	trans	-68.1	-37	175.6	-171.6	164.8	-140.6	0	0	112.1	R343 F415 N416 H417 A423	R343-E419 IonicContact CZ-OE2 2.75Å; R343-E419 VanDerWaalsContact NH1-CD 3.26Å; R343-E419 IonicContact NH1-OE1 3.61Å; R343-E419 PolarHBondContact NH1-OE1 2.98Å; R343-E419 VanDerWaalsContact NH1-OE1 3.11Å; R343-E419 IonicContact NH1-OE2 3.62Å; R343-E419 PolarHBondContact NH1-OE2 3.04Å; R343-E419 IonicContact NH2-OE2 3.26Å; F415-E419 PolarHBondContact O-N 2.91Å; N416-E419 PolarHBondContact O-N 3.16Å; H417-E419 VanDerWaalsContact C-N 3.35Å; H417-E419 PolarHBondContact O-N 3.4Å; E419-A423 WeakPolarHBondContact O-CB 3.34Å; E419-A423 PolarHBondContact O-N 3.45Å
420	R	72.2	Confident	74.4	Confident	108 Å²	108	68 Å²	68	41%	0.408	32%	0.318	S	S	.	.	H	α-helix	trans	-62.6	-54.8	171.5	-69.1	168.6	-170.4	174.2	1.5	111.5	N416 H417 Y422 A423 E424 E883	N416-R420 VanDerWaalsContact O-CG 3.29Å; N416-R420 WeakPolarHBondContact O-CG 3.32Å; N416-R420 PolarHBondContact O-N 3.37Å; H417-R420 WeakPolarHBondContact O-CB 3.48Å; H417-R420 PolarHBondContact O-N 2.91Å; R420-Y422 VanDerWaalsContact C-N 3.32Å; R420-Y422 PolarHBondContact O-N 3.4Å; R420-A423 CarbonylContact O-C 3.59Å; R420-A423 PolarHBondContact O-N 3.09Å; R420-A423 VanDerWaalsContact O-N 3.11Å; R420-E424 PolarHBondContact O-N 2.85Å; R420-E883 IonicContact NH1-OE1 3.35Å; R420-E883 PolarHBondContact NH1-OE1 3.05Å; R420-E883 IonicContact NH1-OE2 2.68Å; R420-E883 PolarHBondContact NH1-OE2 3.23Å; R420-E883 VanDerWaalsContact NH1-OE2 3.16Å
421	M	71.2	Confident	74.8	Confident	106 Å²	106	67.9 Å²	67.9	52%	0.522	32%	0.316	S	S	.	.	H	α-helix	trans	-51.4	-50	177.1	-82.2	-88.6	-83	0	0	111.4	H417 A423 E424 E425	H417-M421 WeakPolarHBondContact O-CB 3.46Å; H417-M421 WeakPolarHBondContact O-CG 3.19Å; H417-M421 PolarHBondContact O-N 3.24Å; M421-A423 PolarHBondContact O-N 2.94Å; M421-E424 PolarHBondContact O-N 3.01Å; M421-E425 PolarHBondContact O-N 2.75Å
422	Y	71.6	Confident	75.2	Confident	54 Å²	54	68.4 Å²	68.4	21%	0.212	32%	0.316	C	S	.	.	H	α-helix	trans	-67.5	-34.7	-179.9	-166.6	-107.9	0	0	0	112.8	Q335 L339 Y418 R420 E424 M426	Q335-Y422 WeakPolarHBondContact CB-OH 3.48Å; Q335-Y422 WeakPolarHBondContact CG-OH 3.5Å; L339-Y422 HydrophobicContact CD2-CD1 3.77Å; L339-Y422 HydrophobicContact CD2-CE1 4.3Å; L339-Y422 HydrophobicContact CD2-CG 4.4Å; Y418-Y422 VanDerWaalsContact O-CB 3.23Å; Y418-Y422 WeakPolarHBondContact O-CB 3.28Å; Y418-Y422 PolarHBondContact O-N 3.23Å; R420-Y422 VanDerWaalsContact C-N 3.32Å; R420-Y422 PolarHBondContact O-N 3.4Å; Y422-E424 VanDerWaalsContact C-N 3.26Å; Y422-E424 PolarHBondContact O-N 3.27Å; Y422-M426 HydrophobicContact CD1-SD 4.4Å; Y422-M426 HydrophobicContact CE1-CE 3.5Å; Y422-M426 HydrophobicContact CE1-CG 4.28Å; Y422-M426 HydrophobicContact CE1-SD 3.91Å; Y422-M426 WeakPolarHBondContact O-CB 3.33Å; Y422-M426 PolarHBondContact O-N 2.83Å; Y422-M426 WeakPolarHBondContact OH-CE 3.06Å
423	A	74.2	Confident	75.5	Confident	44 Å²	44	65.4 Å²	65.4	36%	0.364	30%	0.299	S	S	.	.	H	α-helix	trans	-72.3	-15.1	172.3	0	0	0	0	0	113.6	E419 R420 M421 R427	E419-A423 WeakPolarHBondContact O-CB 3.34Å; E419-A423 PolarHBondContact O-N 3.45Å; R420-A423 CarbonylContact O-C 3.59Å; R420-A423 PolarHBondContact O-N 3.09Å; R420-A423 VanDerWaalsContact O-N 3.11Å; M421-A423 PolarHBondContact O-N 2.94Å; A423-R427 VanDerWaalsContact O-CG 3.31Å; A423-R427 WeakPolarHBondContact O-CG 3.02Å; A423-R427 PolarHBondContact O-N 2.85Å; A423-R427 PolarHBondContact O-NE 3.35Å
424	E	72.9	Confident	75.9	Confident	64 Å²	64	60.6 Å²	60.6	30%	0.299	28%	0.276	S	S	.	.	H	α-helix	trans	-88.2	-41.1	171.6	-74.4	-168.3	175.7	0	0	112.3	P303 R420 M421 Y422 R427 R428	P303-E424 HydrophobicContact CB-CB 3.89Å; P303-E424 HydrophobicContact CB-CG 4.06Å; P303-E424 HydrophobicContact CG-CB 4.28Å; P303-E424 HydrophobicContact CG-CG 4.47Å; R420-E424 PolarHBondContact O-N 2.85Å; M421-E424 PolarHBondContact O-N 3.01Å; Y422-E424 VanDerWaalsContact C-N 3.26Å; Y422-E424 PolarHBondContact O-N 3.27Å; E424-R427 WeakPolarHBondContact O-CB 3.31Å; E424-R427 PolarHBondContact O-N 3.18Å; E424-R427 VanDerWaalsContact O-N 3.11Å; E424-R427 IonicContact OE1-CZ 2.83Å; E424-R427 IonicContact OE1-NH1 2.66Å; E424-R427 IonicContact OE1-NH2 3.82Å; E424-R427 PolarHBondContact OE1-NH2 2.93Å; E424-R428 PolarHBondContact O-N 3.05Å
425	E	74.6	Confident	76.2	Confident	81 Å²	81	59.3 Å²	59.3	38%	0.379	27%	0.27	S	S	.	.	H	α-helix	trans	-63.7	-42.4	172.7	-151.2	59.6	-125.9	0	0	111	M421 R427 R428 E429	M421-E425 PolarHBondContact O-N 2.75Å; E425-R427 VanDerWaalsContact C-N 3.28Å; E425-R427 PolarHBondContact O-N 3.45Å; E425-R428 CarbonylContact O-C 3.58Å; E425-R428 WeakPolarHBondContact O-CA 3.27Å; E425-R428 WeakPolarHBondContact O-CB 3.12Å; E425-R428 PolarHBondContact O-N 3.22Å; E425-R428 WeakPolarHBondContact OE1-CD 3.38Å; E425-R428 IonicContact OE1-CZ 3.73Å; E425-R428 IonicContact OE1-NE 3.91Å; E425-R428 IonicContact OE1-NH1 3.39Å; E425-R428 PolarHBondContact OE1-NH1 3.22Å; E425-R428 IonicContact OE2-CZ 3.41Å; E425-R428 IonicContact OE2-NH1 3.27Å; E425-R428 PolarHBondContact OE2-NH1 3.49Å; E425-R428 IonicContact OE2-NH2 2.73Å; E425-E429 PolarHBondContact O-N 3.36Å
426	M	71.7	Confident	76.6	Confident	30 Å²	30	57 Å²	57	15%	0.148	26%	0.262	C	S	.	.	H	α-helix	trans	-60.4	-34.1	171.3	-83.1	-167	162.3	0	0	113.6	L332 R336 Y422 E430	L332-M426 HydrophobicContact CD2-CE 3.87Å; L332-M426 HydrophobicContact CD2-CG 4.01Å; L332-M426 HydrophobicContact CD2-SD 4.45Å; R336-M426 HydrophobicContact CB-CE 4.01Å; R336-M426 HydrophobicContact CG-CE 4.45Å; Y422-M426 HydrophobicContact CD1-SD 4.4Å; Y422-M426 HydrophobicContact CE1-CE 3.5Å; Y422-M426 HydrophobicContact CE1-CG 4.28Å; Y422-M426 HydrophobicContact CE1-SD 3.91Å; Y422-M426 WeakPolarHBondContact O-CB 3.33Å; Y422-M426 PolarHBondContact O-N 2.83Å; Y422-M426 WeakPolarHBondContact OH-CE 3.06Å; M426-E430 WeakPolarHBondContact O-CG 3.45Å; M426-E430 PolarHBondContact O-N 3.24Å
427	R	76	Confident	76.8	Confident	62 Å²	62	54.6 Å²	54.6	23%	0.234	25%	0.249	C	C	.	.	H	α-helix	trans	-68.9	-37.6	174.1	-83.1	179.2	-79.6	166.8	-8.5	110.9	P303 A423 E424 E425 W431	P303-R427 HydrophobicContact CB-CB 4.43Å; P303-R427 WeakPolarHBondContact O-CD 3.36Å; P303-R427 PolarHBondContact O-NH1 3.33Å; A423-R427 VanDerWaalsContact O-CG 3.31Å; A423-R427 WeakPolarHBondContact O-CG 3.02Å; A423-R427 PolarHBondContact O-N 2.85Å; A423-R427 PolarHBondContact O-NE 3.35Å; E424-R427 WeakPolarHBondContact O-CB 3.31Å; E424-R427 PolarHBondContact O-N 3.18Å; E424-R427 VanDerWaalsContact O-N 3.11Å; E424-R427 IonicContact OE1-CZ 2.83Å; E424-R427 IonicContact OE1-NH1 2.66Å; E424-R427 IonicContact OE1-NH2 3.82Å; E424-R427 PolarHBondContact OE1-NH2 2.93Å; E425-R427 VanDerWaalsContact C-N 3.28Å; E425-R427 PolarHBondContact O-N 3.45Å; R427-W431 PolarHBondContact O-N 3.4Å; R427-W431 VanDerWaalsContact O-N 3.14Å
428	R	74.3	Confident	77.3	Confident	106 Å²	106	55.6 Å²	55.6	40%	0.4	26%	0.255	S	S	.	.	H	α-helix	trans	-66.1	-48.7	174.5	-163.8	-177.9	-62.4	139.5	4.3	111.2	E424 E425 E430 W431 T432	E424-R428 PolarHBondContact O-N 3.05Å; E425-R428 CarbonylContact O-C 3.58Å; E425-R428 WeakPolarHBondContact O-CA 3.27Å; E425-R428 WeakPolarHBondContact O-CB 3.12Å; E425-R428 PolarHBondContact O-N 3.22Å; E425-R428 WeakPolarHBondContact OE1-CD 3.38Å; E425-R428 IonicContact OE1-CZ 3.73Å; E425-R428 IonicContact OE1-NE 3.91Å; E425-R428 IonicContact OE1-NH1 3.39Å; E425-R428 PolarHBondContact OE1-NH1 3.22Å; E425-R428 IonicContact OE2-CZ 3.41Å; E425-R428 IonicContact OE2-NH1 3.27Å; E425-R428 PolarHBondContact OE2-NH1 3.49Å; E425-R428 IonicContact OE2-NH2 2.73Å; R428-E430 VanDerWaalsContact C-N 3.31Å; R428-E430 PolarHBondContact O-N 3.48Å; R428-W431 PolarHBondContact O-N 3.15Å; R428-W431 VanDerWaalsContact O-N 3.14Å; R428-T432 HydrophobicContact CG-CG2 4.33Å; R428-T432 WeakPolarHBondContact O-CG2 2.89Å; R428-T432 PolarHBondContact O-N 2.99Å; R428-T432 PolarHBondContact O-OG1 3.21Å
429	E	77.5	Confident	77.7	Confident	80 Å²	80	49 Å²	49	37%	0.374	23%	0.229	S	C	.	.	H	α-helix	trans	-57.8	-39	175.4	-72.6	-170.7	160.7	0	0	112.8	L332 E425 T432 F433	L332-E429 WeakPolarHBondContact CD2-OE2 3.41Å; L332-E429 WeakPolarHBondContact CG-OE2 3.4Å; E425-E429 PolarHBondContact O-N 3.36Å; E429-T432 PolarHBondContact O-OG1 2.66Å; E429-F433 VanDerWaalsContact O-CB 3.27Å; E429-F433 WeakPolarHBondContact O-CB 3.26Å; E429-F433 PolarHBondContact O-N 2.65Å; E429-F433 VanDerWaalsContact O-N 3.12Å
430	E	79.3	Confident	78.1	Confident	36 Å²	36	48.2 Å²	48.2	17%	0.168	22%	0.223	C	C	.	.	H	α-helix	trans	-66	-42.4	174.2	-79.3	-172.4	-164.3	0	0	112.5	L308 R313 M426 R428 V434	L308-E430 HydrophobicContact CD1-CB 3.91Å; R313-E430 IonicContact CZ-OE1 2.76Å; R313-E430 IonicContact CZ-OE2 3.72Å; R313-E430 IonicContact NE-OE2 3.08Å; R313-E430 PolarHBondContact NE-OE2 3.28Å; R313-E430 IonicContact NH1-OE1 2.76Å; R313-E430 IonicContact NH2-OE1 3.8Å; R313-E430 PolarHBondContact NH2-OE1 2.92Å; R313-E430 IonicContact NH2-OE2 2.66Å; R313-E430 PolarHBondContact NH2-OE2 2.98Å; M426-E430 WeakPolarHBondContact O-CG 3.45Å; M426-E430 PolarHBondContact O-N 3.24Å; R428-E430 VanDerWaalsContact C-N 3.31Å; R428-E430 PolarHBondContact O-N 3.48Å; E430-V434 VanDerWaalsContact O-CG2 3.3Å; E430-V434 WeakPolarHBondContact O-CG2 3.41Å; E430-V434 PolarHBondContact O-N 2.92Å; E430-V434 VanDerWaalsContact O-N 3.11Å
431	W	80.1	Confident	78.7	Confident	17 Å²	17	46.4 Å²	46.4	6%	0.064	22%	0.218	C	C	.	.	H	α-helix	trans	-71.8	-39.8	178.8	-79	117.1	0	0	0	113.2	V298 L308 R427 R428 F433 V434 S435	V298-W431 HydrophobicContact CG1-CE3 3.84Å; V298-W431 HydrophobicContact CG1-CZ3 4.24Å; L308-W431 HydrophobicContact CD2-CD2 4.49Å; L308-W431 HydrophobicContact CD2-CE3 4.09Å; L308-W431 HydrophobicContact CD2-CH2 3.42Å; L308-W431 VanDerWaalsContact CD2-CH2 3.42Å; L308-W431 HydrophobicContact CD2-CZ2 3.87Å; L308-W431 HydrophobicContact CD2-CZ3 3.56Å; L308-W431 HydrophobicContact CG-CD2 4.4Å; L308-W431 HydrophobicContact CG-CE3 4.48Å; L308-W431 HydrophobicContact CG-CH2 3.96Å; L308-W431 HydrophobicContact CG-CZ2 3.86Å; L308-W431 HydrophobicContact CG-CZ3 4.29Å; R427-W431 PolarHBondContact O-N 3.4Å; R427-W431 VanDerWaalsContact O-N 3.14Å; R428-W431 PolarHBondContact O-N 3.15Å; R428-W431 VanDerWaalsContact O-N 3.14Å; W431-F433 VanDerWaalsContact C-N 3.34Å; W431-F433 PolarHBondContact O-N 2.87Å; W431-V434 HydrophobicContact CE3-CB 4.49Å; W431-V434 HydrophobicContact CE3-CG1 4.48Å; W431-V434 PolarHBondContact O-N 3.43Å; W431-S435 PolarHBondContact O-N 3.43Å; W431-S435 PolarHBondContact O-OG 3.33Å
432	T	79.6	Confident	79.4	Confident	39 Å²	39	42.5 Å²	42.5	24%	0.239	20%	0.199	C	C	.	.	H	α-helix	trans	-65.7	-37.3	176.6	57.8	0	0	0	0	111.6	Y299 R428 E429 S435 L436	Y299-T432 HydrophobicContact CD2-CG2 3.72Å; Y299-T432 HydrophobicContact CE2-CG2 3.56Å; Y299-T432 HydrophobicContact CG-CG2 4.36Å; R428-T432 HydrophobicContact CG-CG2 4.33Å; R428-T432 WeakPolarHBondContact O-CG2 2.89Å; R428-T432 PolarHBondContact O-N 2.99Å; R428-T432 PolarHBondContact O-OG1 3.21Å; E429-T432 PolarHBondContact O-OG1 2.66Å; T432-S435 VanDerWaalsContact CA-OG 3.28Å; T432-S435 WeakPolarHBondContact CA-OG 3.23Å; T432-S435 PolarHBondContact O-N 3.42Å; T432-S435 PolarHBondContact O-OG 3.11Å; T432-L436 PolarHBondContact O-N 3.48Å
433	F	80.8	Confident	80.1	Confident	25 Å²	25	41.2 Å²	41.2	11%	0.11	20%	0.196	C	C	.	.	H	α-helix	trans	-65.6	-36.6	172.3	-171.4	-109.2	0	0	0	112.5	L317 P321 T328 P329 E429 W431 L436 I437	L317-F433 HydrophobicContact CD2-CD1 3.64Å; L317-F433 HydrophobicContact CD2-CE1 3.97Å; P321-F433 HydrophobicContact CG-CE1 4.32Å; P321-F433 HydrophobicContact CG-CZ 4.46Å; T328-F433 HydrophobicContact CG2-CE1 4.26Å; T328-F433 HydrophobicContact CG2-CZ 4.04Å; P329-F433 HydrophobicContact CG-CD2 4.13Å; P329-F433 HydrophobicContact CG-CE2 4.14Å; E429-F433 VanDerWaalsContact O-CB 3.27Å; E429-F433 WeakPolarHBondContact O-CB 3.26Å; E429-F433 PolarHBondContact O-N 2.65Å; E429-F433 VanDerWaalsContact O-N 3.12Å; W431-F433 VanDerWaalsContact C-N 3.34Å; W431-F433 PolarHBondContact O-N 2.87Å; F433-L436 PolarHBondContact O-N 3.33Å; F433-I437 HydrophobicContact CD1-CD1 3.9Å; F433-I437 HydrophobicContact CE1-CD1 3.54Å; F433-I437 HydrophobicContact CZ-CD1 3.98Å; F433-I437 WeakPolarHBondContact O-CG1 3.49Å; F433-I437 PolarHBondContact O-N 3.37Å; F433-I437 VanDerWaalsContact O-N 3.14Å
434	V	82.9	Confident	80.6	Confident	4 Å²	4	45 Å²	45	2%	0.024	20%	0.204	C	C	.	.	H	α-helix	trans	-64.4	-43.7	172.2	170.4	0	0	0	0	111.6	V298 L308 F316 E430 W431 L436 I437 L438	V298-V434 HydrophobicContact CG1-CG1 4.06Å; L308-V434 HydrophobicContact CD1-CG2 3.95Å; L308-V434 HydrophobicContact CD2-CG2 4.19Å; F316-V434 HydrophobicContact CB-CG2 3.91Å; F316-V434 HydrophobicContact CD1-CG1 4.11Å; F316-V434 HydrophobicContact CD2-CG1 4.23Å; F316-V434 HydrophobicContact CE1-CG1 4.37Å; F316-V434 HydrophobicContact CE2-CG1 4.48Å; F316-V434 HydrophobicContact CG-CG1 4.06Å; F316-V434 HydrophobicContact CG-CG2 4.25Å; E430-V434 VanDerWaalsContact O-CG2 3.3Å; E430-V434 WeakPolarHBondContact O-CG2 3.41Å; E430-V434 PolarHBondContact O-N 2.92Å; E430-V434 VanDerWaalsContact O-N 3.11Å; W431-V434 HydrophobicContact CE3-CB 4.49Å; W431-V434 HydrophobicContact CE3-CG1 4.48Å; W431-V434 PolarHBondContact O-N 3.43Å; V434-L436 PolarHBondContact O-N 3.31Å; V434-I437 PolarHBondContact O-N 3.49Å; V434-L438 HydrophobicContact CG1-CD1 4.24Å; V434-L438 WeakPolarHBondContact O-CG 3.16Å; V434-L438 PolarHBondContact O-N 2.96Å
435	S	82.5	Confident	81.2	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-63.2	-37.8	175.6	46.1	0	0	0	0	113.2	Y299 W431 T432 I437 L438 D439	Y299-S435 WeakPolarHBondContact CD2-OG 3.47Å; W431-S435 PolarHBondContact O-N 3.43Å; W431-S435 PolarHBondContact O-OG 3.33Å; T432-S435 VanDerWaalsContact CA-OG 3.28Å; T432-S435 WeakPolarHBondContact CA-OG 3.23Å; T432-S435 PolarHBondContact O-N 3.42Å; T432-S435 PolarHBondContact O-OG 3.11Å; S435-I437 VanDerWaalsContact C-N 3.28Å; S435-I437 PolarHBondContact O-N 2.95Å; S435-L438 PolarHBondContact O-N 3.48Å; S435-D439 PolarHBondContact O-N 3.26Å
436	L	83	Confident	81.8	Confident	58 Å²	58	42.3 Å²	42.3	30%	0.304	19%	0.193	S	C	.	.	H	α-helix	trans	-64	-34	175	-179.6	64.5	0	0	0	112.2	T432 F433 V434 R440	T432-L436 PolarHBondContact O-N 3.48Å; F433-L436 PolarHBondContact O-N 3.33Å; V434-L436 PolarHBondContact O-N 3.31Å; L436-R440 VanDerWaalsContact O-CG 3.26Å; L436-R440 WeakPolarHBondContact O-CG 3.38Å; L436-R440 PolarHBondContact O-N 3.21Å
437	I	82.9	Confident	82.6	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-71.4	-40.3	174.3	-70.9	170.9	0	0	0	111.3	F316 F320 P321 L324 M326 F433 V434 S435 R440 F441	F316-I437 HydrophobicContact CD1-CB 4.36Å; F316-I437 HydrophobicContact CD1-CG2 3.77Å; F316-I437 HydrophobicContact CE1-CG2 4.29Å; F316-I437 WeakPolarHBondContact O-CD1 3.15Å; F320-I437 HydrophobicContact CB-CG2 3.55Å; F320-I437 HydrophobicContact CD2-CG2 4.13Å; F320-I437 HydrophobicContact CG-CG2 3.99Å; P321-I437 HydrophobicContact CG-CD1 3.85Å; L324-I437 HydrophobicContact CD1-CG2 3.93Å; M326-I437 HydrophobicContact CE-CG1 4.05Å; F433-I437 HydrophobicContact CD1-CD1 3.9Å; F433-I437 HydrophobicContact CE1-CD1 3.54Å; F433-I437 HydrophobicContact CZ-CD1 3.98Å; F433-I437 WeakPolarHBondContact O-CG1 3.49Å; F433-I437 PolarHBondContact O-N 3.37Å; F433-I437 VanDerWaalsContact O-N 3.14Å; V434-I437 PolarHBondContact O-N 3.49Å; S435-I437 VanDerWaalsContact C-N 3.28Å; S435-I437 PolarHBondContact O-N 2.95Å; I437-R440 PolarHBondContact O-N 3.02Å; I437-F441 VanDerWaalsContact O-CB 3.28Å; I437-F441 WeakPolarHBondContact O-CB 3.4Å; I437-F441 PolarHBondContact O-N 3.06Å
438	L	84.2	Confident	83	Confident	41 Å²	41	44.1 Å²	44.1	22%	0.215	21%	0.213	C	C	.	.	H	α-helix	trans	-61	-48.9	175	-72.3	167.7	0	0	0	111.1	V295 V298 F316 V434 S435 R440 F441 L442	V295-L438 HydrophobicContact CG2-CB 3.88Å; V298-L438 HydrophobicContact CB-CD1 4.4Å; V298-L438 HydrophobicContact CG1-CD1 4.13Å; V298-L438 HydrophobicContact CG2-CD1 4.15Å; F316-L438 HydrophobicContact CE1-CD2 3.69Å; F316-L438 HydrophobicContact CE1-CG 3.99Å; F316-L438 HydrophobicContact CZ-CD2 3.88Å; F316-L438 HydrophobicContact CZ-CG 4.41Å; V434-L438 HydrophobicContact CG1-CD1 4.24Å; V434-L438 WeakPolarHBondContact O-CG 3.16Å; V434-L438 PolarHBondContact O-N 2.96Å; S435-L438 PolarHBondContact O-N 3.48Å; L438-R440 PolarHBondContact O-N 3.11Å; L438-F441 PolarHBondContact O-N 2.96Å; L438-L442 WeakPolarHBondContact O-CB 3.39Å; L438-L442 WeakPolarHBondContact O-CD1 3.26Å; L438-L442 WeakPolarHBondContact O-CG 3.49Å; L438-L442 PolarHBondContact O-N 3.45Å
439	D	83.8	Confident	83.5	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-49.4	-53.9	172.6	-93.4	-30.2	0	0	0	111.8	A237 K242 S435 F441 L442 L443	A237-D439 WeakPolarHBondContact CA-OD2 3.26Å; A237-D439 VanDerWaalsContact CB-OD2 3.23Å; A237-D439 WeakPolarHBondContact CB-OD2 3.5Å; A237-D439 PolarHBondContact N-OD2 3.08Å; K242-D439 IonicContact NZ-OD1 3.28Å; K242-D439 PolarHBondContact NZ-OD1 3.49Å; K242-D439 IonicContact NZ-OD2 3.21Å; K242-D439 PolarHBondContact NZ-OD2 3.09Å; S435-D439 PolarHBondContact O-N 3.26Å; D439-F441 VanDerWaalsContact C-N 3.35Å; D439-F441 PolarHBondContact O-N 3.18Å; D439-L442 PolarHBondContact O-N 3.3Å; D439-L443 WeakPolarHBondContact O-CB 3.48Å; D439-L443 PolarHBondContact O-N 2.81Å
440	R	84.2	Confident	83.9	Confident	58 Å²	58	39.3 Å²	39.3	22%	0.219	20%	0.197	C	C	.	.	H	α-helix	trans	-69.3	-31.3	-176.3	-64.8	-68.9	168.9	-163.8	-11.5	113	Y234 L324 M326 L436 I437 L438 F444	Y234-R440 PolarHBondContact O-NH2 3.22Å; L324-R440 HydrophobicContact CD1-CB 4.33Å; M326-R440 HydrophobicContact CE-CB 3.67Å; M326-R440 HydrophobicContact CE-CG 3.77Å; M326-R440 HydrophobicContact SD-CG 4.34Å; L436-R440 VanDerWaalsContact O-CG 3.26Å; L436-R440 WeakPolarHBondContact O-CG 3.38Å; L436-R440 PolarHBondContact O-N 3.21Å; I437-R440 PolarHBondContact O-N 3.02Å; L438-R440 PolarHBondContact O-N 3.11Å; R440-F444 WeakPolarHBondContact O-CD2 3.47Å
441	F	85.3	Confident	84.1	Confident	69 Å²	69	41.8 Å²	41.8	30%	0.303	21%	0.212	S	C	.	.	H	α-helix	trans	-71.4	-43.4	174.6	179.8	-111.8	0	0	0	111.7	F320 L324 I437 L438 D439 F444 I445	F320-F441 HydrophobicContact CD1-CD2 4.17Å; F320-F441 HydrophobicContact CD1-CE2 4.5Å; F320-F441 AromaticContact CE1-CD2 3.64Å; F320-F441 HydrophobicContact CE1-CD2 3.64Å; F320-F441 AromaticContact CE1-CE2 3.61Å; F320-F441 HydrophobicContact CE1-CE2 3.61Å; F320-F441 HydrophobicContact CE1-CG 4.16Å; F320-F441 HydrophobicContact CE1-CZ 4.1Å; F320-F441 HydrophobicContact CZ-CD2 4.36Å; F320-F441 HydrophobicContact CZ-CE1 4.46Å; F320-F441 HydrophobicContact CZ-CE2 4.24Å; F320-F441 HydrophobicContact CZ-CZ 4.28Å; L324-F441 HydrophobicContact CD1-CB 4.47Å; I437-F441 VanDerWaalsContact O-CB 3.28Å; I437-F441 WeakPolarHBondContact O-CB 3.4Å; I437-F441 PolarHBondContact O-N 3.06Å; L438-F441 PolarHBondContact O-N 2.96Å; D439-F441 VanDerWaalsContact C-N 3.35Å; D439-F441 PolarHBondContact O-N 3.18Å; F441-F444 PolarHBondContact O-N 3.29Å; F441-I445 HydrophobicContact CD1-CD1 4Å; F441-I445 HydrophobicContact CE1-CD1 3.53Å; F441-I445 HydrophobicContact CE2-CD1 4.39Å; F441-I445 HydrophobicContact CZ-CD1 3.76Å; F441-I445 PolarHBondContact O-N 3.03Å
442	L	86	Confident	84	Confident	24 Å²	24	42.8 Å²	42.8	13%	0.126	23%	0.227	C	C	.	.	H	α-helix	trans	-62.5	-42.2	175.5	-68.9	165.4	0	0	0	111.3	F233 T291 V295 L438 D439 F444 I445 F446	F233-L442 HydrophobicContact CD1-CB 3.81Å; F233-L442 HydrophobicContact CD1-CD1 4.27Å; F233-L442 HydrophobicContact CE1-CB 3.74Å; F233-L442 HydrophobicContact CE1-CD1 3.8Å; F233-L442 HydrophobicContact CE1-CG 4.37Å; F233-L442 HydrophobicContact CG-CB 4.26Å; F233-L442 HydrophobicContact CZ-CB 4.13Å; T291-L442 HydrophobicContact CG2-CD2 4.09Å; V295-L442 HydrophobicContact CG2-CD1 3.8Å; L438-L442 WeakPolarHBondContact O-CB 3.39Å; L438-L442 WeakPolarHBondContact O-CD1 3.26Å; L438-L442 WeakPolarHBondContact O-CG 3.49Å; L438-L442 PolarHBondContact O-N 3.45Å; D439-L442 PolarHBondContact O-N 3.3Å; L442-F444 VanDerWaalsContact C-N 3.31Å; L442-F444 PolarHBondContact O-N 2.94Å; L442-I445 PolarHBondContact O-N 3.36Å; L442-F446 HydrophobicContact CB-CD2 4.29Å; L442-F446 HydrophobicContact CB-CE2 4.49Å; L442-F446 HydrophobicContact CD2-CE2 4.21Å; L442-F446 WeakPolarHBondContact O-CD2 3.4Å; L442-F446 PolarHBondContact O-N 2.81Å
443	L	86	Confident	83.9	Confident	27 Å²	27	41.9 Å²	41.9	14%	0.141	23%	0.225	C	C	.	.	H	α-helix	trans	-49.3	-49.8	174.8	-170.6	161.3	0	0	0	111.9	V230 F233 Y234 D439 I445 F447	V230-L443 HydrophobicContact CG1-CG 4.47Å; F233-L443 HydrophobicContact CB-CB 3.74Å; F233-L443 HydrophobicContact CB-CD1 4.38Å; F233-L443 HydrophobicContact CB-CG 4.24Å; Y234-L443 HydrophobicContact CD2-CD1 4.19Å; D439-L443 WeakPolarHBondContact O-CB 3.48Å; D439-L443 PolarHBondContact O-N 2.81Å; L443-I445 PolarHBondContact O-N 3.29Å; L443-F447 WeakPolarHBondContact O-CB 3.46Å; L443-F447 PolarHBondContact O-N 2.85Å
444	F	85.4	Confident	83.6	Confident	124 Å²	124	41.7 Å²	41.7	54%	0.544	23%	0.226	S	C	.	.	H	α-helix	trans	-66.5	-35.2	180	-73.4	-65.3	0	0	0	113.3	L324 R440 F441 L442 G448	L324-F444 HydrophobicContact CD2-CD2 3.58Å; L324-F444 HydrophobicContact CD2-CE2 3.58Å; R440-F444 WeakPolarHBondContact O-CD2 3.47Å; F441-F444 PolarHBondContact O-N 3.29Å; L442-F444 VanDerWaalsContact C-N 3.31Å; L442-F444 PolarHBondContact O-N 2.94Å; F444-G448 PolarHBondContact O-N 3.44Å; F444-G448 VanDerWaalsContact O-N 3.16Å
445	I	86.4	Confident	83.1	Confident	74 Å²	74	49.4 Å²	49.4	38%	0.379	26%	0.26	S	S	.	.	H	α-helix	trans	-66.5	-55.2	175.8	-67.4	171.6	0	0	0	110.2	F441 L442 L443 F447 G448 I449	F441-I445 HydrophobicContact CD1-CD1 4Å; F441-I445 HydrophobicContact CE1-CD1 3.53Å; F441-I445 HydrophobicContact CE2-CD1 4.39Å; F441-I445 HydrophobicContact CZ-CD1 3.76Å; F441-I445 PolarHBondContact O-N 3.03Å; L442-I445 PolarHBondContact O-N 3.36Å; L443-I445 PolarHBondContact O-N 3.29Å; I445-F447 PolarHBondContact O-N 2.93Å; I445-G448 PolarHBondContact O-N 3.5Å; I445-I449 HydrophobicContact CG2-CD1 3.91Å; I445-I449 WeakPolarHBondContact O-CG1 3.24Å; I445-I449 PolarHBondContact O-N 2.97Å; I445-I449 VanDerWaalsContact O-N 3.13Å
446	F	87	Confident	82.4	Confident	14 Å²	14	54.1 Å²	54.1	6%	0.061	29%	0.285	C	S	.	.	H	α-helix	trans	-63.1	-40.3	-178	-80.6	-81.5	0	0	0	111.8	V230 F233 L284 A287 A288 L442 G448 I449 T450	V230-F446 HydrophobicContact CG2-CB 4.16Å; F233-F446 HydrophobicContact CD2-CB 4.45Å; F233-F446 HydrophobicContact CD2-CD2 4.12Å; F233-F446 HydrophobicContact CD2-CG 4.46Å; F233-F446 HydrophobicContact CE2-CB 4.13Å; F233-F446 HydrophobicContact CE2-CD1 4.41Å; F233-F446 AromaticContact CE2-CD2 3.26Å; F233-F446 HydrophobicContact CE2-CD2 3.26Å; F233-F446 AromaticContact CE2-CE2 3.68Å; F233-F446 HydrophobicContact CE2-CE2 3.68Å; F233-F446 AromaticContact CE2-CG 3.69Å; F233-F446 HydrophobicContact CE2-CG 3.69Å; F233-F446 HydrophobicContact CE2-CZ 4.42Å; F233-F446 AromaticContact CZ-CD2 3.56Å; F233-F446 HydrophobicContact CZ-CD2 3.56Å; F233-F446 AromaticContact CZ-CE2 3.49Å; F233-F446 HydrophobicContact CZ-CE2 3.49Å; F233-F446 VanDerWaalsContact CZ-CE2 3.49Å; F233-F446 HydrophobicContact CZ-CG 4.37Å; F233-F446 HydrophobicContact CZ-CZ 4.25Å; L284-F446 HydrophobicContact CB-CD1 4.38Å; L284-F446 HydrophobicContact CB-CE1 4.29Å; L284-F446 HydrophobicContact CD2-CD1 3.78Å; L284-F446 HydrophobicContact CD2-CE1 3.78Å; L284-F446 VanDerWaalsContact O-CE1 3.28Å; L284-F446 WeakPolarHBondContact O-CE1 3.33Å; A287-F446 HydrophobicContact CB-CE1 4.11Å; A287-F446 HydrophobicContact CB-CZ 3.93Å; A288-F446 HydrophobicContact CB-CE1 4.3Å; A288-F446 HydrophobicContact CB-CZ 4.34Å; L442-F446 HydrophobicContact CB-CD2 4.29Å; L442-F446 HydrophobicContact CB-CE2 4.49Å; L442-F446 HydrophobicContact CD2-CE2 4.21Å; L442-F446 WeakPolarHBondContact O-CD2 3.4Å; L442-F446 PolarHBondContact O-N 2.81Å; F446-G448 PolarHBondContact O-N 3.3Å; F446-I449 PolarHBondContact O-N 3.15Å; F446-T450 PolarHBondContact O-N 3.19Å; F446-T450 PolarHBondContact O-OG1 2.87Å
447	F	87.7	Confident	81.5	Confident	90 Å²	90	52.5 Å²	52.5	40%	0.395	28%	0.277	S	S	.	.	H	α-helix	trans	-58.4	-45	173.9	-173.8	-98.6	0	0	0	112.5	Y227 V230 L443 I445 I449 T450 L451	Y227-F447 HydrophobicContact CD1-CD2 4.38Å; Y227-F447 HydrophobicContact CD1-CE2 4.19Å; Y227-F447 HydrophobicContact CE1-CD2 4.16Å; Y227-F447 AromaticContact CE1-CE2 3.79Å; Y227-F447 HydrophobicContact CE1-CE2 3.79Å; V230-F447 HydrophobicContact CG1-CB 3.8Å; V230-F447 HydrophobicContact CG1-CD2 4.2Å; L443-F447 WeakPolarHBondContact O-CB 3.46Å; L443-F447 PolarHBondContact O-N 2.85Å; I445-F447 PolarHBondContact O-N 2.93Å; F447-I449 PolarHBondContact O-N 3.42Å; F447-T450 PolarHBondContact O-N 3.34Å; F447-L451 HydrophobicContact CE1-CD2 4.49Å; F447-L451 WeakPolarHBondContact O-CB 3.46Å; F447-L451 PolarHBondContact O-N 3.18Å
448	G	84.4	Confident	80.4	Confident	40 Å²	40	58.4 Å²	58.4	41%	0.412	30%	0.303	S	S	.	.	H	α-helix	trans	-62.9	-40.1	178.9	0	0	0	0	0	113.2	F444 I445 F446 G452	F444-G448 PolarHBondContact O-N 3.44Å; F444-G448 VanDerWaalsContact O-N 3.16Å; I445-G448 PolarHBondContact O-N 3.5Å; F446-G448 PolarHBondContact O-N 3.3Å; G448-G452 PolarHBondContact O-N 3.19Å
449	I	85.6	Confident	79.2	Confident	79 Å²	79	59.7 Å²	59.7	41%	0.405	32%	0.32	S	S	.	.	H	α-helix	trans	-70.7	-45.7	178.2	-54.9	163.1	0	0	0	110.8	L284 I445 F446 F447 L451 G452 G453	L284-I449 HydrophobicContact CD1-CB 4.48Å; L284-I449 HydrophobicContact CD1-CG2 3.88Å; L284-I449 HydrophobicContact CD2-CB 4.27Å; L284-I449 HydrophobicContact CD2-CD1 3.99Å; L284-I449 HydrophobicContact CD2-CG2 3.96Å; L284-I449 HydrophobicContact CG-CG2 4.49Å; I445-I449 HydrophobicContact CG2-CD1 3.91Å; I445-I449 WeakPolarHBondContact O-CG1 3.24Å; I445-I449 PolarHBondContact O-N 2.97Å; I445-I449 VanDerWaalsContact O-N 3.13Å; F446-I449 PolarHBondContact O-N 3.15Å; F447-I449 PolarHBondContact O-N 3.42Å; I449-L451 VanDerWaalsContact C-N 3.32Å; I449-L451 PolarHBondContact O-N 3.03Å; I449-G452 PolarHBondContact O-N 3.05Å; I449-G453 PolarHBondContact O-N 2.73Å
450	T	84	Confident	77.7	Confident	6 Å²	6	65.8 Å²	65.8	4%	0.037	34%	0.344	C	S	.	.	H	α-helix	trans	-57.1	-45.2	176.1	-64.7	0	0	0	0	111.3	A226 Y227 V230 F446 F447 G453 T454	A226-T450 HydrophobicContact CB-CG2 3.99Å; A226-T450 WeakPolarHBondContact O-CG2 3.19Å; A226-T450 PolarHBondContact O-OG1 2.89Å; Y227-T450 HydrophobicContact CD1-CG2 3.98Å; Y227-T450 HydrophobicContact CD2-CG2 4.3Å; Y227-T450 HydrophobicContact CE1-CG2 3.8Å; Y227-T450 HydrophobicContact CE2-CG2 4.13Å; Y227-T450 HydrophobicContact CG-CG2 4.22Å; V230-T450 WeakPolarHBondContact CG2-OG1 3.04Å; F446-T450 PolarHBondContact O-N 3.19Å; F446-T450 PolarHBondContact O-OG1 2.87Å; F447-T450 PolarHBondContact O-N 3.34Å; T450-G453 PolarHBondContact O-N 3Å; T450-T454 WeakPolarHBondContact O-CG2 3.43Å; T450-T454 PolarHBondContact O-N 3.43Å
451	L	83.8	Confident	75.8	Confident	89 Å²	89	68.4 Å²	68.4	47%	0.466	37%	0.366	S	S	.	.	H	α-helix	trans	-59.3	-49.6	178.3	-176	65.4	0	0	0	111.8	F447 I449 G453 T454 F455	F447-L451 HydrophobicContact CE1-CD2 4.49Å; F447-L451 WeakPolarHBondContact O-CB 3.46Å; F447-L451 PolarHBondContact O-N 3.18Å; I449-L451 VanDerWaalsContact C-N 3.32Å; I449-L451 PolarHBondContact O-N 3.03Å; L451-G453 VanDerWaalsContact C-N 3.29Å; L451-G453 PolarHBondContact O-N 3.22Å; L451-T454 PolarHBondContact O-N 3.28Å; L451-T454 VanDerWaalsContact O-N 3.15Å; L451-T454 PolarHBondContact O-OG1 3.04Å; L451-F455 PolarHBondContact O-N 3.11Å
452	G	79.1	Confident	73.6	Confident	38 Å²	38	69.6 Å²	69.6	39%	0.392	38%	0.381	S	S	.	.	H	α-helix	trans	-61	-35.9	176.7	0	0	0	0	0	113.4	G448 I449 N456	G448-G452 PolarHBondContact O-N 3.19Å; I449-G452 PolarHBondContact O-N 3.05Å; G452-N456 PolarHBondContact O-ND2 3.42Å
453	G	76.2	Confident	71.3	Confident	19 Å²	19	72.2 Å²	72.2	20%	0.196	40%	0.395	C	S	.	.	H	α-helix	trans	-61.8	-44.2	172.7	0	0	0	0	0	112.8	I449 T450 L451 F455	I449-G453 PolarHBondContact O-N 2.73Å; T450-G453 PolarHBondContact O-N 3Å; L451-G453 VanDerWaalsContact C-N 3.29Å; L451-G453 PolarHBondContact O-N 3.22Å; G453-F455 PolarHBondContact O-N 3.29Å
454	T	75.6	Confident	68.9	Low	21 Å²	21	75.7 Å²	75.7	13%	0.129	41%	0.413	C	S	.	.	H	α-helix	trans	-67.8	-34.3	-177.5	56.6	0	0	0	0	114.4	V223 Y227 Y277 T450 L451 N456 V457	V223-T454 HydrophobicContact CG1-CG2 3.92Å; V223-T454 HydrophobicContact CG2-CG2 4.15Å; Y227-T454 HydrophobicContact CE2-CG2 4.18Å; Y277-T454 HydrophobicContact CE2-CG2 4.15Å; T450-T454 WeakPolarHBondContact O-CG2 3.43Å; T450-T454 PolarHBondContact O-N 3.43Å; L451-T454 PolarHBondContact O-N 3.28Å; L451-T454 VanDerWaalsContact O-N 3.15Å; L451-T454 PolarHBondContact O-OG1 3.04Å; T454-N456 PolarHBondContact O-N 2.92Å; T454-V457 PolarHBondContact O-N 3.03Å
455	F	72.5	Confident	66.6	Low	167 Å²	167	75.6 Å²	75.6	73%	0.732	41%	0.413	S	S	*	.	H	α-helix	trans	-64.3	-37.7	-176.9	-176.9	-99.8	0	0	0	113.2	L451 G453 V457	L451-F455 PolarHBondContact O-N 3.11Å; G453-F455 PolarHBondContact O-N 3.29Å; F455-V457 PolarHBondContact O-N 3.26Å; F455-V457 VanDerWaalsContact O-N 3.12Å
456	N	67	Low	64.2	Low	99 Å²	99	76.7 Å²	76.7	53%	0.529	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-13.8	-175.7	-77.8	-87.1	0	0	0	114.4	G452 T454	G452-N456 PolarHBondContact O-ND2 3.42Å; T454-N456 PolarHBondContact O-N 2.92Å
457	V	63.7	Low	62.1	Low	23 Å²	23	82.3 Å²	82.3	14%	0.139	44%	0.44	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-20.8	-172.7	177.5	0	0	0	0	113.2	F144 I219 Y277 T454 F455	F144-V457 HydrophobicContact CE2-CG1 4.14Å; F144-V457 VanDerWaalsContact CE2-O 3.27Å; F144-V457 WeakPolarHBondContact CE2-O 3.32Å; I219-V457 HydrophobicContact CD1-CG1 4.1Å; I219-V457 HydrophobicContact CG2-CG1 4.43Å; Y277-V457 HydrophobicContact CD2-CG2 4.38Å; Y277-V457 HydrophobicContact CG-CG2 4.5Å; T454-V457 PolarHBondContact O-N 3.03Å; F455-V457 PolarHBondContact O-N 3.26Å; F455-V457 VanDerWaalsContact O-N 3.12Å
458	F	60.3	Low	59.9	Low	124 Å²	124	83.6 Å²	83.6	54%	0.544	46%	0.455	S	S	.	.	S	Bend	trans	-111.2	16.3	-161.8	-77.7	-81	0	0	0	116.4	F144 T215 I219	F144-F458 HydrophobicContact CZ-CD1 4.09Å; F144-F458 HydrophobicContact CZ-CE1 4.09Å; T215-F458 HydrophobicContact CG2-CE1 4.21Å; T215-F458 HydrophobicContact CG2-CZ 4.41Å; I219-F458 HydrophobicContact CG2-CZ 4.24Å
459	A	58.3	Low	57.7	Low	68 Å²	68	84.1 Å²	84.1	56%	0.562	45%	0.448	S	S	*	.			trans	-104.9	5.3	-159.6	0	0	0	0	0	119
460	Y	53.4	Low	55.7	Low	128 Å²	128	83.1 Å²	83.1	50%	0.502	44%	0.442	S	S	.	.			trans	-134.2	110.9	-160.6	-63.4	-80.2	0	0	0	116.7
461	V	44.9	Very low	53.4	Low	113 Å²	113	86.3 Å²	86.3	69%	0.685	46%	0.458	S	S	*	.			trans	-168.3	158.9	-175.2	159.1	0	0	0	0	108.7
462	P	39.2	Very low	51.2	Low	95 Å²	95	83.8 Å²	83.8	62%	0.617	45%	0.445	S	S	*	.			cis	-130.2	-126.7	8.4	37.6	-13.3	0	0	0	117.9
463	N	36.7	Very low	48.9	Very low	79 Å²	79	84.2 Å²	84.2	42%	0.422	44%	0.442	S	S	.	.			trans	-116	-174.5	-151.1	-89.7	4.1	0	0	0	118.2	E146 V188 R208	E146-N463 PolarHBondContact OE1-OD1 3.38Å; V188-N463 HydrophobicContact CG1-CB 3.98Å; V188-N463 WeakPolarHBondContact CG1-OD1 3.26Å; V188-N463 VanDerWaalsContact CG2-OD1 3.28Å; V188-N463 WeakPolarHBondContact CG2-OD1 3.33Å; R208-N463 VanDerWaalsContact CZ-OD1 3.25Å; R208-N463 PolarHBondContact NH2-OD1 3.01Å
464	L	36.5	Very low	47.2	Very low	100 Å²	100	84.9 Å²	84.9	52%	0.524	44%	0.444	S	S	.	.			trans	-148.3	169.9	-153.2	-169.9	69.4	0	0	0	115.1	D189 K206	D189-L464 HydrophobicContact CB-CB 4.42Å; D189-L464 WeakPolarHBondContact OD2-CB 3.31Å; D189-L464 WeakPolarHBondContact OD2-CD2 3.16Å; D189-L464 VanDerWaalsContact OD2-CG 3.28Å; D189-L464 WeakPolarHBondContact OD2-CG 3.36Å; K206-L464 HydrophobicContact CD-CB 4.45Å; K206-L464 HydrophobicContact CD-CD2 3.76Å
465	F	36.1	Very low	45.9	Very low	122 Å²	122	86.1 Å²	86.1	54%	0.535	45%	0.448	S	S	.	.			trans	-176.7	173.9	162.5	-109.3	-71.9	0	0	0	109.6	D189	D189-F465 VanDerWaalsContact OD1-CD1 3.24Å; D189-F465 WeakPolarHBondContact OD1-CD1 3.35Å; D189-F465 WeakPolarHBondContact OD1-CE1 3.24Å; D189-F465 WeakPolarHBondContact OD2-CA 3.4Å; D189-F465 PolarHBondContact OD2-N 3.17Å
466	D	36	Very low	45.1	Very low	96 Å²	96	80.7 Å²	80.7	51%	0.513	43%	0.426	S	S	.	.			cis	-163.2	-176	-1.9	-156.4	-10.2	0	0	0	112.1
467	R	42.3	Very low	45	Very low	132 Å²	132	76.9 Å²	76.9	50%	0.498	41%	0.405	S	S	.	.			trans	-156.2	-156.3	174.2	-137.4	-171	-72.4	-174.4	5.6	122	N172 S193	N172-R467 PolarHBondContact ND2-O 3.08Å; S193-R467 PolarHBondContact OG-NH1 2.89Å
468	V	42.6	Very low	45	Very low	117 Å²	117	78.5 Å²	78.5	71%	0.709	41%	0.413	S	S	*	.			trans	-155.6	168.3	-164.5	-170.1	0	0	0	0	115.1	N172	N172-V468 WeakPolarHBondContact ND2-CA 3.16Å; N172-V468 PolarHBondContact ND2-N 2.82Å; N172-V468 VanDerWaalsContact ND2-N 3.15Å
469	D	38.7	Very low	45.5	Very low	51 Å²	51	78.5 Å²	78.5	27%	0.273	41%	0.41	S	S	.	.			trans	-132.1	175.9	-149	-58.7	1.6	0	0	0	120.3	W167 N172	W167-D469 VanDerWaalsContact CB-OD2 3.25Å; W167-D469 WeakPolarHBondContact CB-OD2 3.21Å; W167-D469 VanDerWaalsContact CD1-CB 3.44Å; W167-D469 HydrophobicContact CG-CB 4.24Å; W167-D469 VanDerWaalsContact CG-CG 3.48Å; W167-D469 PolarHBondContact NE1-OD1 2.86Å; N172-D469 WeakPolarHBondContact CB-OD1 3.17Å; N172-D469 PolarHBondContact ND2-OD1 3.07Å
470	Q	42.8	Very low	46.7	Very low	59 Å²	59	75.3 Å²	75.3	28%	0.276	38%	0.383	S	S	.	.			trans	-153.1	180	-161.9	-57.5	155.9	10.5	0	0	120.7	L194 E196	L194-Q470 HydrophobicContact CD2-CB 3.98Å; L194-Q470 HydrophobicContact CD2-CG 4.27Å; L194-Q470 PolarHBondContact O-NE2 2.75Å; E196-Q470 HydrophobicContact CG-CG 4.06Å; E196-Q470 WeakPolarHBondContact OE1-CG 3.25Å; E196-Q470 PolarHBondContact OE1-NE2 3.26Å
471	L	36	Very low	47.9	Very low	72 Å²	72	70.3 Å²	70.3	38%	0.377	37%	0.365	S	S	.	.			trans	172	175.7	147.7	-115	65.6	0	0	0	117	V51 Q164 F165 A166	V51-L471 HydrophobicContact CB-CD2 3.99Å; V51-L471 HydrophobicContact CG1-CD2 3.59Å; V51-L471 HydrophobicContact CG2-CD2 3.67Å; Q164-L471 HydrophobicContact CB-CD1 4.05Å; Q164-L471 HydrophobicContact CB-CG 4.2Å; Q164-L471 HydrophobicContact CG-CD1 3.72Å; Q164-L471 HydrophobicContact CG-CG 4.26Å; F165-L471 WeakPolarHBondContact O-CD1 3.18Å; A166-L471 HydrophobicContact CB-CD1 3.64Å; A166-L471 HydrophobicContact CB-CD2 3.97Å; A166-L471 HydrophobicContact CB-CG 4.49Å
472	N	36.9	Very low	49.6	Very low	36 Å²	36	68.8 Å²	68.8	19%	0.193	36%	0.355	C	S	.	.			cis	-150.4	0	-14.8	-121.7	-12	0	0	0	113.5	R49 V50 V51 Q164	R49-N472 HydrophobicContact CB-CB 3.85Å; R49-N472 VanDerWaalsContact CB-ND2 3.29Å; R49-N472 WeakPolarHBondContact CB-ND2 3.36Å; R49-N472 WeakPolarHBondContact CB-OD1 3.38Å; R49-N472 WeakPolarHBondContact CD-OD1 3.28Å; R49-N472 PolarHBondContact NH1-O 3.29Å; R49-N472 VanDerWaalsContact NH1-O 3.17Å; R49-N472 PolarHBondContact NH2-O 2.68Å; R49-N472 PolarHBondContact O-ND2 3.01Å; V50-N472 PolarHBondContact O-ND2 2.99Å; V51-N472 WeakPolarHBondContact CG2-ND2 3.44Å; Q164-N472 WeakPolarHBondContact CB-OD1 3.48Å; Q164-N472 PolarHBondContact OE1-OD1 3.11Å
473	C	30.3	Very low	51.7	Low	48 Å²	48	68 Å²	68	32%	0.324	35%	0.346	S	S	.	.				0	0	0	-57.8	0	0	0	0	121.5	S47 S48 R49	S47-C473 VanDerWaalsContact C-SG 3.53Å; S47-C473 WeakPolarHBondContact O-CB 3.22Å; S47-C473 PolarHBondContact O-SG 3.46Å; S48-C473 WeakPolarHBondContact CA-SG 3.47Å; S48-C473 VanDerWaalsContact N-CB 3.31Å; R49-C473 VanDerWaalsContact CB-CA 3.4Å; R49-C473 HydrophobicContact CB-CB 4.49Å; R49-C473 VanDerWaalsContact CZ-O 3.31Å; R49-C473 VanDerWaalsContact N-CA 3.28Å; R49-C473 PolarHBondContact NE-O 2.92Å; R49-C473 PolarHBondContact NH2-O 3.29Å
474	S	41.7	Very low	54	Low	33 Å²	33	65.3 Å²	65.3	23%	0.231	33%	0.332	C	S	.	.				0	-174.5	0	88.5	0	0	0	0	126.2	K46 S47 S48 R49	K46-S474 VanDerWaalsContact C-OG 3.29Å; S47-S474 VanDerWaalsContact C-OG 3.31Å; S47-S474 WeakPolarHBondContact CA-OG 3.38Å; S47-S474 PolarHBondContact N-OG 2.68Å; S48-S474 VanDerWaalsContact CA-CB 3.48Å; S48-S474 PolarHBondContact N-OG 2.98Å; S48-S474 WeakPolarHBondContact O-CB 3.32Å; R49-S474 VanDerWaalsContact N-CB 3.28Å
475	E	48.3	Very low	56.3	Low	46 Å²	46	63 Å²	63	22%	0.215	32%	0.318	C	S	.	.			trans	53.8	66.8	141.2	-149.1	-157.4	-143	0	0	125.9	D41 K46	D41-E475 HydrophobicContact CB-CG 3.63Å; D41-E475 VanDerWaalsContact CG-CG 3.46Å; D41-E475 WeakPolarHBondContact OD1-CA 3.41Å; D41-E475 WeakPolarHBondContact OD1-CG 3.46Å; K46-E475 PolarHBondContact NZ-O 3.06Å
476	D	56.1	Low	58.6	Low	53 Å²	53	67.3 Å²	67.3	28%	0.283	33%	0.33	S	S	.	.			trans	-150.8	-3	162.1	-106	-52.7	0	0	0	116.1	K46 I549	K46-D476 IonicContact NZ-OD1 2.8Å; K46-D476 PolarHBondContact NZ-OD1 2.96Å; K46-D476 IonicContact NZ-OD2 2.67Å; K46-D476 PolarHBondContact NZ-OD2 3.04Å; D476-I549 HydrophobicContact CB-CD1 4.06Å; D476-I549 VanDerWaalsContact O-CD1 3.28Å; D476-I549 WeakPolarHBondContact O-CD1 3.19Å
477	E	64	Low	60.6	Low	19 Å²	19	66.4 Å²	66.4	9%	0.089	34%	0.343	C	S	.	.			trans	-78.3	-34.4	-160.6	-163	177.5	-173.7	0	0	115.4	R479 L480 I549 I552 R553	E477-R479 PolarHBondContact O-N 2.95Å; E477-L480 PolarHBondContact O-N 2.89Å; E477-I549 HydrophobicContact CB-CD1 4.41Å; E477-I552 HydrophobicContact CG-CG2 4.25Å; E477-I552 WeakPolarHBondContact OE1-CA 3.39Å; E477-R553 PolarHBondContact OE1-N 3.31Å
478	D	62.9	Low	62.8	Low	57 Å²	57	61.8 Å²	61.8	31%	0.305	33%	0.326	S	S	.	.	H	α-helix	trans	-45.3	-56.2	-176.8	172.4	23.8	0	0	0	112.8	V38 L480 M481 V482	V38-D478 HydrophobicContact CG1-CB 3.55Å; V38-D478 VanDerWaalsContact CG1-CG 3.42Å; V38-D478 WeakPolarHBondContact CG1-OD1 3.41Å; V38-D478 WeakPolarHBondContact CG2-OD1 3.49Å; D478-L480 PolarHBondContact O-N 3.3Å; D478-M481 WeakPolarHBondContact O-CB 3.2Å; D478-M481 PolarHBondContact O-N 3.05Å; D478-V482 PolarHBondContact O-N 3.27Å
479	R	72.7	Confident	64.8	Low	124 Å²	124	60.1 Å²	60.1	47%	0.468	31%	0.313	S	S	.	.	H	α-helix	trans	-60.1	-24	-170.2	-173.5	167.7	59	93.6	1.7	113.9	E477 N545 Y546	E477-R479 PolarHBondContact O-N 2.95Å; R479-N545 PolarHBondContact NH1-O 3.02Å; R479-N545 PolarHBondContact NH2-O 3.45Å; R479-Y546 HydrophobicContact CG-CD1 4.46Å
480	L	82.1	Confident	67.1	Low	1 Å²	1	59.6 Å²	59.6	1%	0.005	31%	0.313	C	S	.	.	H	α-helix	trans	-81.2	-38.1	175.6	175	52.7	0	0	0	112.1	E477 D478 V482 D483 L484 W541 Y546 I549 I552	E477-L480 PolarHBondContact O-N 2.89Å; D478-L480 PolarHBondContact O-N 3.3Å; L480-V482 VanDerWaalsContact C-N 3.31Å; L480-V482 PolarHBondContact O-N 3.43Å; L480-D483 PolarHBondContact O-N 3.05Å; L480-L484 PolarHBondContact O-N 3.2Å; L480-W541 HydrophobicContact CD1-CB 4.03Å; L480-W541 HydrophobicContact CD1-CD2 3.85Å; L480-W541 HydrophobicContact CD1-CE3 4.49Å; L480-W541 HydrophobicContact CD1-CG 3.6Å; L480-W541 HydrophobicContact CD2-CD2 4.17Å; L480-W541 HydrophobicContact CD2-CG 4.39Å; L480-W541 HydrophobicContact CD2-CZ2 3.92Å; L480-Y546 HydrophobicContact CB-CD1 3.9Å; L480-Y546 HydrophobicContact CB-CG 4.03Å; L480-Y546 HydrophobicContact CD1-CD1 4.08Å; L480-Y546 HydrophobicContact CD1-CD2 3.72Å; L480-Y546 HydrophobicContact CD1-CE1 4.24Å; L480-Y546 HydrophobicContact CD1-CE2 3.87Å; L480-Y546 HydrophobicContact CD1-CG 3.81Å; L480-Y546 HydrophobicContact CG-CG 4.35Å; L480-I549 HydrophobicContact CD2-CB 3.87Å; L480-I549 HydrophobicContact CD2-CD1 4.35Å; L480-I549 HydrophobicContact CD2-CG2 3.57Å; L480-I552 HydrophobicContact CD2-CG2 3.35Å; L480-I552 HydrophobicContact CG-CG2 3.94Å
481	M	78.6	Confident	69	Low	24 Å²	24	63.9 Å²	63.9	12%	0.118	34%	0.337	C	S	.	.	H	α-helix	trans	-63.1	-37	-179.1	-67.9	-73.3	-82.4	0	0	112	D478 F485 I552 V554	D478-M481 WeakPolarHBondContact O-CB 3.2Å; D478-M481 PolarHBondContact O-N 3.05Å; M481-F485 WeakPolarHBondContact O-CD2 3.3Å; M481-I552 HydrophobicContact SD-CB 4.24Å; M481-I552 HydrophobicContact SD-CD1 3.96Å; M481-V554 HydrophobicContact CE-CG2 4.12Å; M481-V554 HydrophobicContact SD-CG2 4.04Å
482	V	80.4	Confident	71.3	Confident	80 Å²	80	64.2 Å²	64.2	49%	0.485	34%	0.342	S	S	.	.	H	α-helix	trans	-66.6	-43.2	-179.6	178.4	0	0	0	0	112.8	D478 L480	D478-V482 PolarHBondContact O-N 3.27Å; L480-V482 VanDerWaalsContact C-N 3.31Å; L480-V482 PolarHBondContact O-N 3.43Å
483	D	83.4	Confident	73.5	Confident	78 Å²	78	63.8 Å²	63.8	42%	0.417	34%	0.34	S	S	.	.	H	α-helix	trans	-77.4	-32.5	-175.7	-88.7	-35.1	0	0	0	112.9	L480 R486 Y546	L480-D483 PolarHBondContact O-N 3.05Å; D483-R486 WeakPolarHBondContact O-CB 3.43Å; D483-Y546 HydrophobicContact CB-CE1 4.35Å; D483-Y546 WeakPolarHBondContact CB-OH 3.46Å; D483-Y546 PolarHBondContact OD2-OH 2.94Å
484	L	85.1	Confident	76.1	Confident	24 Å²	24	61.9 Å²	61.9	13%	0.126	33%	0.327	C	S	.	.	H	α-helix	trans	-71	-37.8	-174.7	-165.6	67.7	0	0	0	113.5	L480 R486 M539 W541 I552	L480-L484 PolarHBondContact O-N 3.2Å; L484-R486 VanDerWaalsContact C-N 3.25Å; L484-R486 PolarHBondContact O-N 2.96Å; L484-M539 HydrophobicContact CD2-SD 3.64Å; L484-M539 HydrophobicContact CG-SD 3.93Å; L484-W541 HydrophobicContact CD1-CE3 4.11Å; L484-W541 HydrophobicContact CD2-CE3 4.02Å; L484-W541 HydrophobicContact CD2-CZ3 3.97Å; L484-I552 HydrophobicContact CD2-CD1 3.47Å; L484-I552 VanDerWaalsContact CD2-CD1 3.47Å
485	F	86.1	Confident	78	Confident	52 Å²	52	62.9 Å²	62.9	23%	0.228	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	5.5	-176.4	-74.7	-80	0	0	0	114.4	M481 G487 M539 V554 K558 V559 I584	M481-F485 WeakPolarHBondContact O-CD2 3.3Å; F485-G487 PolarHBondContact O-N 2.97Å; F485-M539 HydrophobicContact CD1-CE 4.24Å; F485-M539 HydrophobicContact CE1-CE 3.52Å; F485-M539 HydrophobicContact CE1-SD 4.32Å; F485-M539 HydrophobicContact CZ-CE 3.83Å; F485-M539 HydrophobicContact CZ-SD 4Å; F485-V554 HydrophobicContact CE1-CG1 4.09Å; F485-V554 HydrophobicContact CE2-CG1 3.86Å; F485-V554 HydrophobicContact CE2-CG2 3.91Å; F485-V554 HydrophobicContact CZ-CB 4.21Å; F485-V554 HydrophobicContact CZ-CG1 3.43Å; F485-V554 VanDerWaalsContact CZ-CG1 3.43Å; F485-V554 HydrophobicContact CZ-CG2 3.87Å; F485-K558 HydrophobicContact CD1-CB 4.08Å; F485-K558 HydrophobicContact CE1-CB 3.78Å; F485-K558 HydrophobicContact CZ-CB 4.47Å; F485-V559 HydrophobicContact CE1-CG1 3.94Å; F485-V559 HydrophobicContact CZ-CG1 4Å; F485-I584 HydrophobicContact CZ-CD1 4.42Å
486	R	82.5	Confident	79.3	Confident	211 Å²	211	64.7 Å²	64.7	80%	0.796	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	80.1	-173.3	-167.8	178.3	-179	159.7	3.3	113.3	D483 L484	D483-R486 WeakPolarHBondContact O-CB 3.43Å; L484-R486 VanDerWaalsContact C-N 3.25Å; L484-R486 PolarHBondContact O-N 2.96Å
487	G	79.8	Confident	80.1	Confident	77 Å²	77	67.7 Å²	67.7	79%	0.794	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	102.5	9.8	177	0	0	0	0	0	114.8	F485	F485-G487 PolarHBondContact O-N 2.97Å
488	Y	88	Confident	80.1	Confident	36 Å²	36	71.7 Å²	71.7	14%	0.141	40%	0.4	C	S	.	.			trans	-66.1	153.7	171	-174.9	-98.5	0	0	0	111.7	D536 Q538 M539 K558 W560	Y488-D536 VanDerWaalsContact CE2-OD2 3.29Å; Y488-D536 WeakPolarHBondContact CE2-OD2 3.32Å; Y488-D536 PolarHBondContact OH-OD2 3.46Å; Y488-Q538 HydrophobicContact CD2-CB 3.96Å; Y488-Q538 HydrophobicContact CE2-CB 4.02Å; Y488-M539 HydrophobicContact CD1-CE 3.74Å; Y488-M539 HydrophobicContact CD2-CE 3.36Å; Y488-M539 HydrophobicContact CE1-CE 3.79Å; Y488-M539 HydrophobicContact CE2-CE 3.38Å; Y488-M539 HydrophobicContact CE2-CG 4.45Å; Y488-M539 HydrophobicContact CG-CE 3.51Å; Y488-K558 WeakPolarHBondContact CD1-O 3.41Å; Y488-K558 WeakPolarHBondContact CE1-O 3.38Å; Y488-W560 WeakPolarHBondContact OH-CB 3.45Å; Y488-W560 PolarHBondContact OH-N 3.15Å
489	N	85	Confident	80.3	Confident	82 Å²	82	76.8 Å²	76.8	44%	0.439	43%	0.427	S	S	.	.			trans	-135.5	102.5	178.7	-177.6	-4.3	0	0	0	111.2	L491 V492	N489-L491 PolarHBondContact O-N 2.89Å; N489-L491 PolarHBondContact OD1-N 3.06Å; N489-L491 VanDerWaalsContact OD1-N 3.15Å; N489-V492 HydrophobicContact CB-CG2 4.35Å; N489-V492 PolarHBondContact O-N 2.76Å
490	S	85.4	Confident	79.9	Confident	39 Å²	39	72.8 Å²	72.8	27%	0.273	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-7	-177.4	50.5	0	0	0	0	115.5	D557 V559 W560	S490-D557 PolarHBondContact OG-O 3.05Å; S490-V559 VanDerWaalsContact CB-C 3.42Å; S490-V559 WeakPolarHBondContact CB-O 3.22Å; S490-W560 WeakPolarHBondContact O-CA 3.47Å; S490-W560 WeakPolarHBondContact O-CB 3.32Å
491	L	84.1	Confident	79.5	Confident	149 Å²	149	78.1 Å²	78.1	78%	0.78	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-3.8	176.5	-57.8	179.8	0	0	0	113.7	N489	N489-L491 PolarHBondContact O-N 2.89Å; N489-L491 PolarHBondContact OD1-N 3.06Å; N489-L491 VanDerWaalsContact OD1-N 3.15Å
492	V	83.8	Confident	79.7	Confident	79 Å²	79	78.9 Å²	78.9	48%	0.479	46%	0.458	S	S	.	.	S	Bend	trans	-109.6	124.5	-175.2	-178.1	0	0	0	0	110.7	N489	N489-V492 HydrophobicContact CB-CG2 4.35Å; N489-V492 PolarHBondContact O-N 2.76Å
493	L	83.5	Confident	80.1	Confident	27 Å²	27	75.7 Å²	75.7	14%	0.141	44%	0.438	C	S	.	.			trans	-58.3	125.2	172.6	-178.5	73.4	0	0	0	109.8	L495 L503 W560 Y625 I630	L493-L495 HydrophobicContact CD2-CD1 3.73Å; L493-L495 HydrophobicContact CD2-CD2 4.29Å; L493-L495 HydrophobicContact CD2-CG 3.78Å; L493-L495 HydrophobicContact CG-CD1 4.47Å; L493-L495 HydrophobicContact CG-CD2 4.46Å; L493-L495 HydrophobicContact CG-CG 3.99Å; L493-L495 PolarHBondContact O-N 2.78Å; L493-L503 HydrophobicContact CD1-CB 4.45Å; L493-L503 HydrophobicContact CD1-CD2 3.94Å; L493-W560 HydrophobicContact CD1-CH2 3.59Å; L493-W560 HydrophobicContact CD1-CZ2 3.24Å; L493-W560 HydrophobicContact CD1-CZ3 4.37Å; L493-Y625 HydrophobicContact CB-CE1 4.5Å; L493-Y625 HydrophobicContact CD1-CE1 4.41Å; L493-Y625 HydrophobicContact CD2-CE1 4.23Å; L493-I630 HydrophobicContact CD1-CD1 4.43Å; L493-I630 HydrophobicContact CD1-CG1 4.46Å
494	P	84.5	Confident	80.4	Confident	9 Å²	9	76.2 Å²	76.2	6%	0.058	44%	0.44	C	S	.	.			trans	-78.2	58.9	-170.9	31	-36.6	0	0	0	114	D536 F537 W560	P494-D536 HydrophobicContact CB-CB 4.12Å; P494-D536 VanDerWaalsContact CB-CG 3.49Å; P494-D536 WeakPolarHBondContact CB-OD1 3.04Å; P494-D536 HydrophobicContact CG-CB 4.21Å; P494-F537 HydrophobicContact CB-CD1 4.36Å; P494-F537 HydrophobicContact CB-CE1 4.38Å; P494-F537 WeakPolarHBondContact O-CD1 3.18Å; P494-W560 HydrophobicContact CG-CD2 4.47Å; P494-W560 HydrophobicContact CG-CE3 4.04Å
495	L	81	Confident	80.7	Confident	53 Å²	53	75.1 Å²	75.1	28%	0.277	43%	0.434	S	S	.	.			trans	-85	136.1	170.4	-60.6	-176.5	0	0	0	111.2	L493 N497 L503 F537	L493-L495 HydrophobicContact CD2-CD1 3.73Å; L493-L495 HydrophobicContact CD2-CD2 4.29Å; L493-L495 HydrophobicContact CD2-CG 3.78Å; L493-L495 HydrophobicContact CG-CD1 4.47Å; L493-L495 HydrophobicContact CG-CD2 4.46Å; L493-L495 HydrophobicContact CG-CG 3.99Å; L493-L495 PolarHBondContact O-N 2.78Å; L495-N497 VanDerWaalsContact C-N 3.34Å; L495-N497 PolarHBondContact O-N 2.83Å; L495-L503 HydrophobicContact CD2-CB 4.28Å; L495-F537 WeakPolarHBondContact O-CE1 3.23Å
496	S	75.5	Confident	81.1	Confident	85 Å²	85	75.7 Å²	75.7	59%	0.594	44%	0.438	S	S	*	.	S	Bend	trans	-77.4	-17	-179.1	60.7	0	0	0	0	114.3
497	N	73.4	Confident	81.6	Confident	115 Å²	115	65.7 Å²	65.7	62%	0.615	40%	0.4	S	S	*	.	S	Bend	trans	-154.7	146.2	174.1	-89.9	-69.9	0	0	0	109.9	L495 N499 S500	L495-N497 VanDerWaalsContact C-N 3.34Å; L495-N497 PolarHBondContact O-N 2.83Å; N497-N499 PolarHBondContact O-N 3.11Å; N497-N499 VanDerWaalsContact O-N 3.09Å; N497-S500 VanDerWaalsContact O-CB 3.25Å; N497-S500 WeakPolarHBondContact O-CB 3.3Å; N497-S500 PolarHBondContact O-N 3Å; N497-S500 PolarHBondContact O-OG 2.91Å; N497-S500 VanDerWaalsContact O-OG 3.06Å
498	A	63.9	Low	82.2	Confident	104 Å²	104	62.7 Å²	62.7	86%	0.86	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-15.3	178.2	0	0	0	0	0	114.6
499	N	66.6	Low	82.4	Confident	163 Å²	163	61.1 Å²	61.1	87%	0.872	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.7	20.6	175.3	-62.3	-4.5	0	0	0	112.2	N497	N497-N499 PolarHBondContact O-N 3.11Å; N497-N499 VanDerWaalsContact O-N 3.09Å
500	S	64.7	Low	82.7	Confident	40 Å²	40	58.3 Å²	58.3	28%	0.28	35%	0.347	S	S	.	.	S	Bend	trans	-76.5	176.8	-177.1	71.8	0	0	0	0	113.1	N497	N497-S500 VanDerWaalsContact O-CB 3.25Å; N497-S500 WeakPolarHBondContact O-CB 3.3Å; N497-S500 PolarHBondContact O-N 3Å; N497-S500 PolarHBondContact O-OG 2.91Å; N497-S500 VanDerWaalsContact O-OG 3.06Å
501	T	75.2	Confident	83	Confident	114 Å²	114	56.4 Å²	56.4	70%	0.699	33%	0.334	S	S	*	.	P	Polyproline II helix	trans	-56.4	151.2	158.9	48	0	0	0	0	111.1
502	P	82.6	Confident	83.3	Confident	40 Å²	40	50.5 Å²	50.5	26%	0.26	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-58.1	159.8	169	23.4	-33.2	0	0	0	111.9	L504 E629 I631	P502-L504 PolarHBondContact O-N 3.28Å; P502-E629 WeakPolarHBondContact CB-O 3.07Å; P502-I631 HydrophobicContact CB-CD1 4.41Å; P502-I631 HydrophobicContact CB-CG1 4.16Å; P502-I631 HydrophobicContact CG-CD1 3.5Å; P502-I631 VanDerWaalsContact CG-CD1 3.5Å; P502-I631 HydrophobicContact CG-CG1 3.78Å
503	L	87.5	Confident	83.6	Confident	12 Å²	12	48.6 Å²	48.6	6%	0.063	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	124.7	170.6	-174.5	74.2	0	0	0	109.3	L493 L495 W534 W560 E629 I630 I631	L493-L503 HydrophobicContact CD1-CB 4.45Å; L493-L503 HydrophobicContact CD1-CD2 3.94Å; L495-L503 HydrophobicContact CD2-CB 4.28Å; L503-W534 HydrophobicContact CD2-CB 4.35Å; L503-W560 HydrophobicContact CD2-CH2 3.41Å; L503-W560 VanDerWaalsContact CD2-CH2 3.41Å; L503-W560 HydrophobicContact CD2-CZ2 4.49Å; L503-W560 HydrophobicContact CD2-CZ3 3.49Å; L503-W560 VanDerWaalsContact CD2-CZ3 3.49Å; L503-E629 PolarHBondContact N-O 3.21Å; L503-I630 HydrophobicContact CB-CG1 4.39Å; L503-I630 WeakPolarHBondContact O-CA 3.34Å; L503-I631 PolarHBondContact O-N 3.09Å
504	L	89.8	Confident	83.9	Confident	90 Å²	90	47.3 Å²	47.3	47%	0.471	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	114.1	171.3	-173.1	65.1	0	0	0	108.9	P502 I631 S633	P502-L504 PolarHBondContact O-N 3.28Å; L504-I631 HydrophobicContact CD1-CG2 4.08Å; L504-S633 WeakPolarHBondContact CD1-OG 3.44Å
505	L	92.4	Very high	84	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	108.2	178	178.6	65	0	0	0	109.4	F507 L532 W534 P562 I564 I630 I631 L632 S633	L505-F507 PolarHBondContact O-N 3.33Å; L505-L532 HydrophobicContact CD1-CB 4.31Å; L505-W534 HydrophobicContact CD1-CB 3.93Å; L505-W534 HydrophobicContact CD1-CE3 4.18Å; L505-P562 HydrophobicContact CD1-CG 3.98Å; L505-P562 HydrophobicContact CD2-CB 3.75Å; L505-P562 HydrophobicContact CD2-CG 3.89Å; L505-I564 HydrophobicContact CD2-CD1 3.63Å; L505-I564 HydrophobicContact CD2-CG1 3.61Å; L505-I630 HydrophobicContact CB-CG2 3.96Å; L505-I630 HydrophobicContact CD2-CG2 4.25Å; L505-I631 PolarHBondContact N-O 3.29Å; L505-L632 HydrophobicContact CB-CD2 4.26Å; L505-L632 HydrophobicContact CD2-CD2 3.87Å; L505-L632 HydrophobicContact CG-CD2 4.27Å; L505-L632 WeakPolarHBondContact O-CA 3.25Å; L505-S633 PolarHBondContact O-N 2.77Å; L505-S633 PolarHBondContact O-OG 3.48Å
506	H	93.5	Very high	84.3	Confident	65 Å²	65	49.5 Å²	49.5	30%	0.301	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	122.9	171.5	-69.2	-96.5	0	0	0	109	K533 S633 F634	H506-K533 HydrophobicContact CB-CB 4.14Å; H506-K533 PolarHBondContact N-O 3.41Å; H506-K533 PolarHBondContact O-N 2.98Å; H506-S633 WeakPolarHBondContact CA-O 3.41Å; H506-S633 WeakPolarHBondContact CA-OG 3.48Å; H506-S633 PolarHBondContact CD2-OG 3.44Å; H506-S633 PolarHBondContact CE1-OG 3.09Å; H506-S633 PolarHBondContact N-OG 3.25Å; H506-S633 PolarHBondContact ND1-OG 3.04Å; H506-S633 VanDerWaalsContact ND1-OG 3.12Å; H506-F634 PolarHBondContact ND1-O 2.94Å
507	F	93.2	Very high	84.9	Confident	1 Å²	1	45.5 Å²	45.5	0%	0.004	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	134	-178.5	-169.8	-87.5	0	0	0	110.2	L505 L530 T531 L532 I564 F620 S633 N635 M668 F670	L505-F507 PolarHBondContact O-N 3.33Å; F507-L530 HydrophobicContact CE2-CB 4.46Å; F507-L530 HydrophobicContact CE2-CD1 4.34Å; F507-L530 HydrophobicContact CZ-CD1 4.37Å; F507-L530 HydrophobicContact CZ-CD2 3.95Å; F507-T531 CarbonylContact C-O 3.55Å; F507-T531 WeakPolarHBondContact CA-O 3.45Å; F507-L532 HydrophobicContact CD2-CD2 4.31Å; F507-L532 HydrophobicContact CD2-CG 4.11Å; F507-L532 HydrophobicContact CE2-CD2 4.38Å; F507-L532 HydrophobicContact CE2-CG 4.25Å; F507-I564 HydrophobicContact CD2-CG2 4.13Å; F507-I564 HydrophobicContact CE2-CB 4.35Å; F507-I564 HydrophobicContact CE2-CG2 3.6Å; F507-I564 HydrophobicContact CZ-CG2 4.26Å; F507-F620 HydrophobicContact CE1-CB 4.29Å; F507-F620 HydrophobicContact CE1-CD2 4.04Å; F507-F620 HydrophobicContact CE1-CG 4.14Å; F507-F620 HydrophobicContact CZ-CB 4.1Å; F507-F620 HydrophobicContact CZ-CD1 4Å; F507-F620 HydrophobicContact CZ-CD2 4.04Å; F507-F620 HydrophobicContact CZ-CE1 4.43Å; F507-F620 HydrophobicContact CZ-CE2 4.45Å; F507-F620 AromaticContact CZ-CG 3.79Å; F507-F620 HydrophobicContact CZ-CG 3.79Å; F507-S633 PolarHBondContact N-O 3.38Å; F507-N635 PolarHBondContact O-N 3.5Å; F507-M668 HydrophobicContact CB-CE 4.03Å; F507-M668 HydrophobicContact CD1-CE 4.45Å; F507-M668 HydrophobicContact CD1-SD 3.86Å; F507-F670 AromaticContact CD1-CE2 3.98Å; F507-F670 HydrophobicContact CD1-CE2 3.98Å; F507-F670 AromaticContact CD1-CZ 3.9Å; F507-F670 HydrophobicContact CD1-CZ 3.9Å; F507-F670 AromaticContact CE1-CE2 3.61Å; F507-F670 HydrophobicContact CE1-CE2 3.61Å; F507-F670 AromaticContact CE1-CZ 3.82Å; F507-F670 HydrophobicContact CE1-CZ 3.82Å
508	G	91.9	Very high	85.6	Confident	13 Å²	13	41.8 Å²	41.8	13%	0.134	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	155.2	170.7	0	0	0	0	0	110.8	T531	G508-T531 PolarHBondContact N-O 3.47Å; G508-T531 PolarHBondContact O-N 2.95Å
509	L	92.7	Very high	86.7	Confident	4 Å²	4	37.9 Å²	37.9	2%	0.021	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	119.7	175.4	-173.2	75.5	0	0	0	108.5	V528 L530 L618 F620 V641 D642 F670	L509-V528 HydrophobicContact CD1-CB 3.75Å; L509-V528 HydrophobicContact CD1-CG1 3.97Å; L509-V528 HydrophobicContact CD1-CG2 3.85Å; L509-V528 HydrophobicContact CD2-CG1 4.45Å; L509-V528 HydrophobicContact CG-CB 4.41Å; L509-V528 HydrophobicContact CG-CG1 4.27Å; L509-L530 HydrophobicContact CD1-CD2 3.43Å; L509-L530 VanDerWaalsContact CD1-CD2 3.43Å; L509-L618 HydrophobicContact CD2-CD1 3.69Å; L509-F620 HydrophobicContact CD1-CE2 3.92Å; L509-F620 HydrophobicContact CD1-CZ 4.15Å; L509-F620 HydrophobicContact CD2-CE2 4.41Å; L509-V641 HydrophobicContact CD2-CG1 4.46Å; L509-V641 HydrophobicContact CD2-CG2 3.97Å; L509-V641 CarbonylContact O-C 3.57Å; L509-V641 WeakPolarHBondContact O-CA 3.44Å; L509-D642 PolarHBondContact O-N 3.4Å; L509-F670 HydrophobicContact CB-CD1 3.97Å; L509-F670 HydrophobicContact CB-CD2 4.44Å; L509-F670 HydrophobicContact CB-CE1 3.49Å; L509-F670 VanDerWaalsContact CB-CE1 3.49Å; L509-F670 HydrophobicContact CB-CE2 4.05Å; L509-F670 HydrophobicContact CB-CG 4.41Å; L509-F670 HydrophobicContact CB-CZ 3.52Å; L509-F670 HydrophobicContact CD2-CB 4.18Å; L509-F670 HydrophobicContact CD2-CD1 3.97Å; L509-F670 HydrophobicContact CD2-CD2 4.06Å; L509-F670 HydrophobicContact CD2-CE1 4.36Å; L509-F670 HydrophobicContact CD2-CE2 4.47Å; L509-F670 HydrophobicContact CD2-CG 3.79Å
510	Q	91.9	Very high	87.5	Confident	22 Å²	22	35.5 Å²	35.5	10%	0.103	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	128	170.9	-170.5	-176.1	14.4	0	0	108.9	V528 W529 D642 D645	Q510-V528 CarbonylContact O-C 3.59Å; Q510-V528 WeakPolarHBondContact O-CA 3.25Å; Q510-V528 WeakPolarHBondContact O-CB 3.29Å; Q510-W529 HydrophobicContact CB-CB 4.36Å; Q510-W529 PolarHBondContact N-O 3.05Å; Q510-W529 PolarHBondContact O-N 2.73Å; Q510-D642 WeakPolarHBondContact CA-O 3.29Å; Q510-D642 HydrophobicContact CB-CB 4.22Å; Q510-D642 HydrophobicContact CG-CB 4.07Å; Q510-D645 PolarHBondContact NE2-OD2 2.83Å
511	L	92.3	Very high	88.5	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	108.1	-179.1	176.8	68	0	0	0	110.5	T526 V528 V641 D642 L643 Y646 I654 I672	L511-T526 HydrophobicContact CD1-CG2 3.79Å; L511-V528 HydrophobicContact CB-CG1 4.48Å; L511-V528 HydrophobicContact CD1-CG1 3.7Å; L511-V641 HydrophobicContact CB-CG1 3.54Å; L511-D642 PolarHBondContact N-O 3.08Å; L511-L643 HydrophobicContact CB-CD2 4.11Å; L511-L643 HydrophobicContact CD2-CD2 4.19Å; L511-Y646 HydrophobicContact CD2-CD2 4.15Å; L511-Y646 HydrophobicContact CD2-CE2 4.05Å; L511-Y646 HydrophobicContact CG-CD2 4.01Å; L511-Y646 HydrophobicContact CG-CE2 4.21Å; L511-Y646 WeakPolarHBondContact O-CA 3.36Å; L511-Y646 WeakPolarHBondContact O-CB 3.33Å; L511-Y646 WeakPolarHBondContact O-CD2 3.36Å; L511-I654 HydrophobicContact CD2-CD1 3.49Å; L511-I654 VanDerWaalsContact CD2-CD1 3.49Å; L511-I672 HydrophobicContact CD2-CD1 4.33Å
512	V	90	Very high	89.2	Confident	25 Å²	25	35.1 Å²	35.1	15%	0.152	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	-40.1	-179.9	-178.1	0	0	0	0	111.1	N527 W529 S647	V512-N527 PolarHBondContact N-O 3.39Å; V512-W529 HydrophobicContact CG2-CD2 4.09Å; V512-W529 HydrophobicContact CG2-CG 4.08Å; V512-S647 WeakPolarHBondContact O-CB 3.5Å; V512-S647 PolarHBondContact O-N 2.98Å
513	L	89.1	Confident	89.6	Confident	39 Å²	39	34.8 Å²	34.8	20%	0.204	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	130.4	178.3	178.8	60.9	0	0	0	112.4	I515 N527 S647	L513-I515 HydrophobicContact CD2-CG1 4.27Å; L513-I515 HydrophobicContact CG-CG1 4.17Å; L513-I515 PolarHBondContact O-N 3.22Å; L513-N527 HydrophobicContact CB-CB 4.28Å; L513-N527 PolarHBondContact N-O 2.82Å; L513-N527 PolarHBondContact O-N 3.44Å; L513-S647 VanDerWaalsContact CD1-O 3.25Å; L513-S647 WeakPolarHBondContact CD1-O 3.39Å
514	L	90	Very high	89.9	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	99.3	161.2	176.9	63.4	0	0	0	108.4	M524 T526 Y646 S649 W652 V674	L514-M524 HydrophobicContact CD1-CG 3.82Å; L514-M524 HydrophobicContact CD1-SD 3.99Å; L514-T526 HydrophobicContact CD1-CG2 3.85Å; L514-Y646 HydrophobicContact CB-CE2 4.29Å; L514-S649 WeakPolarHBondContact O-CB 3.44Å; L514-S649 PolarHBondContact O-OG 2.76Å; L514-W652 HydrophobicContact CD2-CB 3.76Å; L514-W652 HydrophobicContact CD2-CG 4.24Å; L514-V674 HydrophobicContact CD2-CG1 3.61Å
515	I	86.3	Confident	90	Very high	51 Å²	51	31.7 Å²	31.7	26%	0.262	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	-55	-168.1	-49.7	179.6	0	0	0	110.3	A103 L513 H525 N527 I597	A103-I515 HydrophobicContact CB-CD1 3.67Å; A103-I515 HydrophobicContact CB-CG2 4.03Å; L513-I515 HydrophobicContact CD2-CG1 4.27Å; L513-I515 HydrophobicContact CG-CG1 4.17Å; L513-I515 PolarHBondContact O-N 3.22Å; I515-H525 HydrophobicContact CB-CB 4.09Å; I515-H525 WeakPolarHBondContact CB-O 3.46Å; I515-H525 PolarHBondContact N-O 3.34Å; I515-N527 HydrophobicContact CD1-CB 4.13Å; I515-N527 HydrophobicContact CG1-CB 4.35Å; I515-I597 HydrophobicContact CD1-CG2 4.07Å
516	N	87	Confident	89.9	Confident	57 Å²	57	31.7 Å²	31.7	31%	0.305	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	161.4	178.3	-167.3	32.1	0	0	0	110.6	H525	N516-H525 PolarHBondContact N-O 3.05Å; N516-H525 PolarHBondContact O-N 3.05Å
517	L	89.4	Confident	89.8	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	108.6	165.4	-179.6	168.1	0	0	0	105.4	E519 I604 Q614 W652 V674	L517-E519 HydrophobicContact CD2-CG 3.85Å; L517-E519 PolarHBondContact O-N 3.46Å; L517-I604 HydrophobicContact CD1-CD1 4.1Å; L517-I604 HydrophobicContact CD2-CD1 3.58Å; L517-I604 HydrophobicContact CD2-CG1 3.95Å; L517-I604 HydrophobicContact CG-CD1 4.1Å; L517-Q614 HydrophobicContact CD1-CB 4.09Å; L517-Q614 HydrophobicContact CD1-CG 4.18Å; L517-W652 HydrophobicContact CB-CZ2 4.09Å; L517-W652 HydrophobicContact CD1-CH2 4.2Å; L517-W652 HydrophobicContact CD1-CZ2 3.95Å; L517-W652 HydrophobicContact CD2-CH2 4.49Å; L517-W652 HydrophobicContact CD2-CZ2 3.92Å; L517-W652 HydrophobicContact CG-CZ2 4.22Å; L517-V674 HydrophobicContact CD1-CG2 4.08Å
518	D	88.2	Confident	89.8	Confident	37 Å²	37	29.4 Å²	29.4	20%	0.198	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	99.2	-179.6	-176.4	-30.1	0	0	0	108.6	K520 N521 Q522 I523	D518-K520 VanDerWaalsContact C-N 3.25Å; D518-K520 PolarHBondContact O-N 3.5Å; D518-K520 WeakPolarHBondContact OD1-CB 3.23Å; D518-K520 PolarHBondContact OD1-N 3.38Å; D518-K520 VanDerWaalsContact OD1-N 3.1Å; D518-N521 PolarHBondContact OD1-N 3.34Å; D518-N521 PolarHBondContact OD2-ND2 3.34Å; D518-Q522 WeakPolarHBondContact O-CA 3.36Å; D518-Q522 PolarHBondContact O-N 3.02Å; D518-I523 PolarHBondContact N-O 3.39Å; D518-I523 PolarHBondContact O-N 2.95Å
519	E	86.7	Confident	89.8	Confident	23 Å²	23	32.4 Å²	32.4	11%	0.107	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-34.1	-177.6	-56.5	87.4	166.4	0	0	111.9	L517 I604 R676 P732	L517-E519 HydrophobicContact CD2-CG 3.85Å; L517-E519 PolarHBondContact O-N 3.46Å; E519-I604 HydrophobicContact CB-CG2 4.28Å; E519-I604 HydrophobicContact CG-CG2 4.17Å; E519-R676 IonicContact OE1-CZ 2.83Å; E519-R676 IonicContact OE1-NH1 3.39Å; E519-R676 PolarHBondContact OE1-NH1 3.1Å; E519-R676 IonicContact OE1-NH2 2.7Å; E519-R676 PolarHBondContact OE1-NH2 3.38Å; E519-P732 VanDerWaalsContact O-CB 3.27Å; E519-P732 WeakPolarHBondContact O-CB 3.26Å; E519-P732 WeakPolarHBondContact O-CD 3.33Å; E519-P732 VanDerWaalsContact O-CG 3.23Å; E519-P732 WeakPolarHBondContact O-CG 3.31Å
520	K	83.2	Confident	89.7	Confident	113 Å²	113	32.3 Å²	32.3	49%	0.491	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-43.2	-175.3	176.8	-173.9	158.8	-82.1	0	111.5	D518	D518-K520 VanDerWaalsContact C-N 3.25Å; D518-K520 PolarHBondContact O-N 3.5Å; D518-K520 WeakPolarHBondContact OD1-CB 3.23Å; D518-K520 PolarHBondContact OD1-N 3.38Å; D518-K520 VanDerWaalsContact OD1-N 3.1Å
521	N	86.1	Confident	89.8	Confident	82 Å²	82	32.4 Å²	32.4	44%	0.439	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-5.1	-177.8	-58.1	-37.6	0	0	0	112.9	D518 I523	D518-N521 PolarHBondContact OD1-N 3.34Å; D518-N521 PolarHBondContact OD2-ND2 3.34Å; N521-I523 HydrophobicContact CB-CD1 4.18Å
522	Q	89	Confident	89.8	Confident	63 Å²	63	32.5 Å²	32.5	29%	0.294	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	64	43	178.1	-62.6	-172.2	-26.7	0	0	114.1	D518 C602	D518-Q522 WeakPolarHBondContact O-CA 3.36Å; D518-Q522 PolarHBondContact O-N 3.02Å; Q522-C602 WeakPolarHBondContact CB-O 3.38Å; Q522-C602 PolarHBondContact O-N 3.26Å
523	I	91.5	Very high	90	Very high	34 Å²	34	34.2 Å²	34.2	17%	0.174	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	129	-176.6	-61.3	165.1	0	0	0	111.1	D518 N521 A570 K599 S600	D518-I523 PolarHBondContact N-O 3.39Å; D518-I523 PolarHBondContact O-N 2.95Å; N521-I523 HydrophobicContact CB-CD1 4.18Å; I523-A570 HydrophobicContact CD1-CB 3.97Å; I523-A570 HydrophobicContact CG1-CB 3.81Å; I523-A570 HydrophobicContact CG2-CB 4.44Å; I523-K599 HydrophobicContact CG2-CB 3.78Å; I523-K599 HydrophobicContact CG2-CG 4.48Å; I523-S600 CarbonylContact C-O 3.57Å; I523-S600 WeakPolarHBondContact CA-O 3.39Å
524	M	93.2	Very high	90.2	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.005	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	129.6	168.1	-176	-178.2	63.8	0	0	110.4	L514 T526 K599 S600 C602 C616 L618 I672	L514-M524 HydrophobicContact CD1-CG 3.82Å; L514-M524 HydrophobicContact CD1-SD 3.99Å; M524-T526 HydrophobicContact CE-CG2 3.89Å; M524-T526 HydrophobicContact CG-CG2 4.12Å; M524-T526 HydrophobicContact SD-CG2 4.03Å; M524-K599 CarbonylContact O-C 3.58Å; M524-K599 WeakPolarHBondContact O-CA 3.19Å; M524-S600 PolarHBondContact N-O 3.26Å; M524-S600 PolarHBondContact O-N 3.02Å; M524-C602 HydrophobicContact CB-CB 4.45Å; M524-C616 HydrophobicContact CB-CB 4.38Å; M524-C616 HydrophobicContact CE-CB 3.83Å; M524-C616 HydrophobicContact SD-CB 3.46Å; M524-C616 WeakPolarHBondContact SD-CB 3.44Å; M524-L618 HydrophobicContact CE-CD1 4.33Å; M524-L618 HydrophobicContact CE-CD2 3.88Å; M524-L618 HydrophobicContact CE-CG 3.97Å; M524-I672 HydrophobicContact CE-CD1 4.2Å
525	H	91.6	Very high	90.3	Very high	36 Å²	36	36.7 Å²	36.7	17%	0.167	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	116	176.1	-69.8	-120.8	0	0	0	110.5	I515 N516 Y598	I515-H525 HydrophobicContact CB-CB 4.09Å; I515-H525 WeakPolarHBondContact CB-O 3.46Å; I515-H525 PolarHBondContact N-O 3.34Å; N516-H525 PolarHBondContact N-O 3.05Å; N516-H525 PolarHBondContact O-N 3.05Å; H525-Y598 WeakPolarHBondContact CA-O 3.46Å
526	T	91.9	Very high	90.5	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	140	177.9	51	0	0	0	0	111.7	L511 L514 M524 I597 Y598	L511-T526 HydrophobicContact CD1-CG2 3.79Å; L514-T526 HydrophobicContact CD1-CG2 3.85Å; M524-T526 HydrophobicContact CE-CG2 3.89Å; M524-T526 HydrophobicContact CG-CG2 4.12Å; M524-T526 HydrophobicContact SD-CG2 4.03Å; T526-I597 CarbonylContact O-C 3.54Å; T526-I597 VanDerWaalsContact O-CA 3.3Å; T526-I597 WeakPolarHBondContact O-CA 3.41Å; T526-Y598 PolarHBondContact N-O 3.28Å; T526-Y598 PolarHBondContact O-N 2.83Å
527	N	91	Very high	90.5	Very high	18 Å²	18	35.1 Å²	35.1	10%	0.096	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	113.9	162	-177	2.9	0	0	0	107.6	V512 L513 I515 I597	V512-N527 PolarHBondContact N-O 3.39Å; L513-N527 HydrophobicContact CB-CB 4.28Å; L513-N527 PolarHBondContact N-O 2.82Å; L513-N527 PolarHBondContact O-N 3.44Å; I515-N527 HydrophobicContact CD1-CB 4.13Å; I515-N527 HydrophobicContact CG1-CB 4.35Å; N527-I597 HydrophobicContact CB-CG1 4.45Å
528	V	92	Very high	90.3	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	149.6	-178.2	-62.1	0	0	0	0	110.6	L509 Q510 L511 L530 A596 Y598	L509-V528 HydrophobicContact CD1-CB 3.75Å; L509-V528 HydrophobicContact CD1-CG1 3.97Å; L509-V528 HydrophobicContact CD1-CG2 3.85Å; L509-V528 HydrophobicContact CD2-CG1 4.45Å; L509-V528 HydrophobicContact CG-CB 4.41Å; L509-V528 HydrophobicContact CG-CG1 4.27Å; Q510-V528 CarbonylContact O-C 3.59Å; Q510-V528 WeakPolarHBondContact O-CA 3.25Å; Q510-V528 WeakPolarHBondContact O-CB 3.29Å; L511-V528 HydrophobicContact CB-CG1 4.48Å; L511-V528 HydrophobicContact CD1-CG1 3.7Å; V528-L530 HydrophobicContact CG2-CD2 4Å; V528-A596 WeakPolarHBondContact CG2-O 3.46Å; V528-A596 PolarHBondContact N-O 2.04Å; V528-A596 PolarHBondContact O-N 2.92Å; V528-A596 VanDerWaalsContact O-O 3.07Å; V528-Y598 HydrophobicContact CG2-CD2 3.59Å; V528-Y598 HydrophobicContact CG2-CE2 3.95Å
529	W	91.9	Very high	90.3	Very high	75 Å²	75	37.6 Å²	37.6	28%	0.284	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	126.8	162.5	-61.7	-2.2	0	0	0	107	Q510 V512 V593 P595	Q510-W529 HydrophobicContact CB-CB 4.36Å; Q510-W529 PolarHBondContact N-O 3.05Å; Q510-W529 PolarHBondContact O-N 2.73Å; V512-W529 HydrophobicContact CG2-CD2 4.09Å; V512-W529 HydrophobicContact CG2-CG 4.08Å; W529-V593 HydrophobicContact CB-CG1 4.05Å; W529-V593 HydrophobicContact CE3-CG1 4.42Å; W529-P595 HydrophobicContact CG-CB 4.45Å
530	L	92.1	Very high	90.5	Very high	2 Å²	2	43 Å²	43	1%	0.01	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	136.1	171.8	-52.6	-171.3	0	0	0	108	F507 L509 V528 L532 V576 V593 P594 Y598 F620	F507-L530 HydrophobicContact CE2-CB 4.46Å; F507-L530 HydrophobicContact CE2-CD1 4.34Å; F507-L530 HydrophobicContact CZ-CD1 4.37Å; F507-L530 HydrophobicContact CZ-CD2 3.95Å; L509-L530 HydrophobicContact CD1-CD2 3.43Å; L509-L530 VanDerWaalsContact CD1-CD2 3.43Å; V528-L530 HydrophobicContact CG2-CD2 4Å; L530-L532 HydrophobicContact CB-CD1 3.55Å; L530-L532 HydrophobicContact CD1-CD1 4.4Å; L530-V576 HydrophobicContact CD1-CG1 4.06Å; L530-V593 VanDerWaalsContact O-CA 3.27Å; L530-V593 WeakPolarHBondContact O-CA 3.45Å; L530-P594 HydrophobicContact CB-CG 4.12Å; L530-P594 PolarHBondContact N-O 2.79Å; L530-P594 WeakPolarHBondContact O-CD 3.39Å; L530-Y598 HydrophobicContact CD1-CE2 4.31Å; L530-Y598 HydrophobicContact CD2-CE2 4.11Å; L530-Y598 HydrophobicContact CG-CE2 4.47Å; L530-F620 HydrophobicContact CD1-CE1 4.38Å; L530-F620 HydrophobicContact CD2-CE1 4.14Å; L530-F620 HydrophobicContact CD2-CZ 3.94Å
531	T	92.6	Very high	90.8	Very high	25 Å²	25	38.8 Å²	38.8	15%	0.153	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	109.5	171	-63	0	0	0	0	108.1	F507 G508 K533 L591	F507-T531 CarbonylContact C-O 3.55Å; F507-T531 WeakPolarHBondContact CA-O 3.45Å; G508-T531 PolarHBondContact N-O 3.47Å; G508-T531 PolarHBondContact O-N 2.95Å; T531-K533 HydrophobicContact CG2-CG 4.46Å; T531-L591 HydrophobicContact CG2-CD1 4.02Å
532	L	93.1	Very high	91	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.005	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	115.1	177.2	-60.1	95.5	0	0	0	108.8	L505 F507 L530 W534 P562 I564 W592 P594	L505-L532 HydrophobicContact CD1-CB 4.31Å; F507-L532 HydrophobicContact CD2-CD2 4.31Å; F507-L532 HydrophobicContact CD2-CG 4.11Å; F507-L532 HydrophobicContact CE2-CD2 4.38Å; F507-L532 HydrophobicContact CE2-CG 4.25Å; L530-L532 HydrophobicContact CB-CD1 3.55Å; L530-L532 HydrophobicContact CD1-CD1 4.4Å; L532-W534 HydrophobicContact CB-CE3 4.39Å; L532-W534 HydrophobicContact CB-CZ3 4.19Å; L532-P562 HydrophobicContact CD2-CG 3.74Å; L532-I564 HydrophobicContact CD2-CB 4.23Å; L532-I564 HydrophobicContact CD2-CG1 3.89Å; L532-W592 HydrophobicContact CB-CB 4.47Å; L532-W592 HydrophobicContact CD1-CE3 3.99Å; L532-W592 HydrophobicContact CD2-CE3 4.3Å; L532-W592 PolarHBondContact N-O 3.25Å; L532-W592 PolarHBondContact O-N 2.72Å; L532-P594 HydrophobicContact CD1-CG 4.06Å
533	K	93.7	Very high	90.9	Very high	61 Å²	61	36.7 Å²	36.7	27%	0.265	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	124.7	169.3	-52.6	174.8	-171.5	165.4	0	110.6	H506 T531 M590 L591 N635 D636	H506-K533 HydrophobicContact CB-CB 4.14Å; H506-K533 PolarHBondContact N-O 3.41Å; H506-K533 PolarHBondContact O-N 2.98Å; T531-K533 HydrophobicContact CG2-CG 4.46Å; K533-M590 VanDerWaalsContact CA-O 3.23Å; K533-M590 WeakPolarHBondContact CA-O 3.35Å; K533-L591 HydrophobicContact CG-CD1 3.78Å; K533-N635 VanDerWaalsContact CD-OD1 3.28Å; K533-N635 WeakPolarHBondContact CD-OD1 3.22Å; K533-N635 WeakPolarHBondContact CE-OD1 3.24Å; K533-N635 PolarHBondContact NZ-OD1 2.95Å; K533-D636 IonicContact NZ-OD1 2.77Å; K533-D636 PolarHBondContact NZ-OD1 3.32Å; K533-D636 IonicContact NZ-OD2 2.75Å; K533-D636 PolarHBondContact NZ-OD2 2.79Å
534	W	93.2	Very high	90.6	Very high	8 Å²	8	40.5 Å²	40.5	3%	0.03	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	178.8	169.2	70	100.7	0	0	0	110	L503 L505 L532 W560 P562 V582 M590 W592	L503-W534 HydrophobicContact CD2-CB 4.35Å; L505-W534 HydrophobicContact CD1-CB 3.93Å; L505-W534 HydrophobicContact CD1-CE3 4.18Å; L532-W534 HydrophobicContact CB-CE3 4.39Å; L532-W534 HydrophobicContact CB-CZ3 4.19Å; W534-W560 AromaticContact CD1-CZ3 3.85Å; W534-W560 HydrophobicContact CD2-CZ3 4.44Å; W534-W560 HydrophobicContact CG-CZ3 4.24Å; W534-W560 WeakPolarHBondContact CZ2-O 3.44Å; W534-W560 AromaticContact NE1-CE3 3.64Å; W534-W560 AromaticContact NE1-CZ3 3.81Å; W534-P562 HydrophobicContact CE3-CG 4.39Å; W534-V582 HydrophobicContact CH2-CG1 3.99Å; W534-V582 HydrophobicContact CH2-CG2 4.33Å; W534-V582 HydrophobicContact CZ2-CG1 4.42Å; W534-M590 HydrophobicContact CD2-CB 3.65Å; W534-M590 HydrophobicContact CD2-CG 4.33Å; W534-M590 VanDerWaalsContact CE2-CB 3.43Å; W534-M590 HydrophobicContact CE3-CB 4.09Å; W534-M590 HydrophobicContact CG-CB 4.08Å; W534-M590 HydrophobicContact CG-CG 4.45Å; W534-M590 HydrophobicContact CH2-CB 4.14Å; W534-M590 HydrophobicContact CZ2-CB 3.7Å; W534-M590 HydrophobicContact CZ2-CE 3.92Å; W534-M590 HydrophobicContact CZ2-CG 4.18Å; W534-M590 HydrophobicContact CZ3-CB 4.31Å; W534-M590 PolarHBondContact N-O 3.49Å; W534-M590 VanDerWaalsContact N-O 3.08Å; W534-M590 PolarHBondContact O-N 3.24Å; W534-W592 HydrophobicContact CH2-CB 3.91Å; W534-W592 HydrophobicContact CZ3-CB 3.71Å
535	Y	91.8	Very high	90	Very high	84 Å²	84	45 Å²	45	33%	0.329	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	131.3	178.9	164.1	-96	0	0	0	109.4	F537 R540 E587 G588	Y535-F537 HydrophobicContact CE1-CB 3.86Å; Y535-F537 WeakPolarHBondContact OH-CA 3.31Å; Y535-F537 WeakPolarHBondContact OH-CB 3.43Å; Y535-R540 PolarHBondContact OH-NE 2.93Å; Y535-R540 PolarHBondContact OH-NH1 3.41Å; Y535-R540 PolarHBondContact OH-NH2 2.93Å; Y535-E587 WeakPolarHBondContact CE2-O 3.45Å; Y535-G588 WeakPolarHBondContact CA-O 3.37Å; Y535-G588 WeakPolarHBondContact CD2-O 3.24Å
536	D	90.9	Very high	89.4	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	118	173.8	-171.4	-28.4	0	0	0	109.3	Y488 P494 Q538 M539 G588 M590	Y488-D536 VanDerWaalsContact CE2-OD2 3.29Å; Y488-D536 WeakPolarHBondContact CE2-OD2 3.32Å; Y488-D536 PolarHBondContact OH-OD2 3.46Å; P494-D536 HydrophobicContact CB-CB 4.12Å; P494-D536 VanDerWaalsContact CB-CG 3.49Å; P494-D536 WeakPolarHBondContact CB-OD1 3.04Å; P494-D536 HydrophobicContact CG-CB 4.21Å; D536-Q538 PolarHBondContact O-N 3.36Å; D536-Q538 WeakPolarHBondContact OD1-CB 3.04Å; D536-Q538 PolarHBondContact OD1-N 2.85Å; D536-M539 HydrophobicContact CB-CB 4.18Å; D536-M539 HydrophobicContact CB-CG 4.06Å; D536-M539 PolarHBondContact O-N 3.35Å; D536-G588 PolarHBondContact N-O 3.49Å; D536-G588 WeakPolarHBondContact O-CA 3.44Å; D536-M590 HydrophobicContact CB-CG 3.91Å; D536-M590 HydrophobicContact CB-SD 4.21Å
537	F	86.9	Confident	88.5	Confident	74 Å²	74	46.9 Å²	46.9	33%	0.325	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	-14.6	-176.8	72.6	-89.7	0	0	0	114	P494 L495 Y535	P494-F537 HydrophobicContact CB-CD1 4.36Å; P494-F537 HydrophobicContact CB-CE1 4.38Å; P494-F537 WeakPolarHBondContact O-CD1 3.18Å; L495-F537 WeakPolarHBondContact O-CE1 3.23Å; Y535-F537 HydrophobicContact CE1-CB 3.86Å; Y535-F537 WeakPolarHBondContact OH-CA 3.31Å; Y535-F537 WeakPolarHBondContact OH-CB 3.43Å
538	Q	85.6	Confident	88	Confident	88 Å²	88	52.1 Å²	52.1	41%	0.411	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	-26	178.6	-54.1	-172.1	7.3	0	0	111.6	Y488 D536 R540	Y488-Q538 HydrophobicContact CD2-CB 3.96Å; Y488-Q538 HydrophobicContact CE2-CB 4.02Å; D536-Q538 PolarHBondContact O-N 3.36Å; D536-Q538 WeakPolarHBondContact OD1-CB 3.04Å; D536-Q538 PolarHBondContact OD1-N 2.85Å; Q538-R540 PolarHBondContact O-N 2.95Å
539	M	87.9	Confident	87.4	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.005	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	43.6	-174.7	-71.6	-70.6	154.8	0	0	113.3	L484 F485 Y488 D536 V559 I584 G588 M590	L484-M539 HydrophobicContact CD2-SD 3.64Å; L484-M539 HydrophobicContact CG-SD 3.93Å; F485-M539 HydrophobicContact CD1-CE 4.24Å; F485-M539 HydrophobicContact CE1-CE 3.52Å; F485-M539 HydrophobicContact CE1-SD 4.32Å; F485-M539 HydrophobicContact CZ-CE 3.83Å; F485-M539 HydrophobicContact CZ-SD 4Å; Y488-M539 HydrophobicContact CD1-CE 3.74Å; Y488-M539 HydrophobicContact CD2-CE 3.36Å; Y488-M539 HydrophobicContact CE1-CE 3.79Å; Y488-M539 HydrophobicContact CE2-CE 3.38Å; Y488-M539 HydrophobicContact CE2-CG 4.45Å; Y488-M539 HydrophobicContact CG-CE 3.51Å; D536-M539 HydrophobicContact CB-CB 4.18Å; D536-M539 HydrophobicContact CB-CG 4.06Å; D536-M539 PolarHBondContact O-N 3.35Å; M539-V559 HydrophobicContact CE-CG1 4.3Å; M539-I584 HydrophobicContact CB-CG2 3.95Å; M539-I584 HydrophobicContact CG-CD1 4.33Å; M539-I584 HydrophobicContact SD-CD1 3.68Å; M539-G588 WeakPolarHBondContact O-CA 3.5Å; M539-M590 HydrophobicContact CB-SD 3.88Å; M539-M590 HydrophobicContact CG-CE 4.08Å; M539-M590 HydrophobicContact CG-SD 3.81Å
540	R	90.5	Very high	87.2	Confident	137 Å²	137	56.9 Å²	56.9	52%	0.517	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	133.2	-171.8	-74.9	-176.4	152.7	-165.1	-12.6	113.2	Y535 Q538 E587	Y535-R540 PolarHBondContact OH-NE 2.93Å; Y535-R540 PolarHBondContact OH-NH1 3.41Å; Y535-R540 PolarHBondContact OH-NH2 2.93Å; Q538-R540 PolarHBondContact O-N 2.95Å; R540-E587 VanDerWaalsContact CZ-O 3.28Å; R540-E587 PolarHBondContact NE-O 3.37Å; R540-E587 PolarHBondContact NH2-O 3.42Å
541	W	91.2	Very high	87.1	Confident	25 Å²	25	61.7 Å²	61.7	10%	0.095	30%	0.297	C	S	.	.			trans	-142.3	171.9	171.9	70.4	96.8	0	0	0	112.5	L480 L484 Y546 I549 R550 I552 I584 N586	L480-W541 HydrophobicContact CD1-CB 4.03Å; L480-W541 HydrophobicContact CD1-CD2 3.85Å; L480-W541 HydrophobicContact CD1-CE3 4.49Å; L480-W541 HydrophobicContact CD1-CG 3.6Å; L480-W541 HydrophobicContact CD2-CD2 4.17Å; L480-W541 HydrophobicContact CD2-CG 4.39Å; L480-W541 HydrophobicContact CD2-CZ2 3.92Å; L484-W541 HydrophobicContact CD1-CE3 4.11Å; L484-W541 HydrophobicContact CD2-CE3 4.02Å; L484-W541 HydrophobicContact CD2-CZ3 3.97Å; W541-Y546 HydrophobicContact CB-CD2 4.42Å; W541-Y546 HydrophobicContact CB-CE2 4.07Å; W541-Y546 AromaticContact CD1-CD2 3.92Å; W541-Y546 HydrophobicContact CG-CD2 4.46Å; W541-I549 PolarHBondContact NE1-O 2.86Å; W541-R550 WeakPolarHBondContact CZ2-O 3.43Å; W541-I552 HydrophobicContact CH2-CD1 4Å; W541-I552 HydrophobicContact CH2-CG1 3.78Å; W541-I552 HydrophobicContact CZ2-CG1 4.4Å; W541-I552 HydrophobicContact CZ2-CG2 4.31Å; W541-I552 HydrophobicContact CZ3-CD1 4.07Å; W541-I552 HydrophobicContact CZ3-CG1 4.31Å; W541-I584 HydrophobicContact CH2-CB 4.31Å; W541-I584 HydrophobicContact CH2-CG2 4.01Å; W541-I584 HydrophobicContact CZ3-CB 4.39Å; W541-I584 HydrophobicContact CZ3-CG2 3.68Å; W541-N586 HydrophobicContact CD2-CB 3.77Å; W541-N586 HydrophobicContact CE3-CB 4.36Å; W541-N586 HydrophobicContact CG-CB 4.2Å; W541-N586 HydrophobicContact CH2-CB 4.21Å; W541-N586 HydrophobicContact CZ2-CB 3.62Å; W541-N586 PolarHBondContact N-O 2.88Å
542	N	89.1	Confident	86.9	Confident	84 Å²	84	60.5 Å²	60.5	45%	0.449	29%	0.29	S	S	.	.			trans	-105.7	114.3	172.3	-178.1	-4.8	0	0	0	109.1	V544 N545	N542-V544 PolarHBondContact O-N 3.33Å; N542-V544 VanDerWaalsContact O-N 3.07Å; N542-V544 WeakPolarHBondContact OD1-CB 3.24Å; N542-V544 WeakPolarHBondContact OD1-CG2 3.49Å; N542-V544 PolarHBondContact OD1-N 2.83Å; N542-N545 PolarHBondContact O-N 2.96Å; N542-N545 VanDerWaalsContact O-N 3.08Å
543	P	87.1	Confident	86.6	Confident	16 Å²	16	62.4 Å²	62.4	10%	0.104	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-52.3	-31	-179.5	-30.4	36.8	0	0	0	114.5	N545 Y546 E548 I549 R550 N586	P543-N545 PolarHBondContact O-N 2.93Å; P543-N545 VanDerWaalsContact O-N 3.13Å; P543-Y546 CarbonylContact O-C 3.4Å; P543-Y546 PolarHBondContact O-N 2.87Å; P543-E548 VanDerWaalsContact O-CA 3.28Å; P543-E548 WeakPolarHBondContact O-CA 3.47Å; P543-E548 PolarHBondContact O-N 3.38Å; P543-I549 WeakPolarHBondContact CB-O 3.47Å; P543-I549 WeakPolarHBondContact CG-O 3.32Å; P543-R550 HydrophobicContact CB-CG 4.3Å; P543-R550 HydrophobicContact CG-CG 4.13Å; P543-N586 HydrophobicContact CG-CB 3.81Å; P543-N586 VanDerWaalsContact CG-CG 3.42Å; P543-N586 VanDerWaalsContact CG-OD1 3.27Å; P543-N586 WeakPolarHBondContact CG-OD1 2.99Å
544	V	85.1	Confident	86.3	Confident	114 Å²	114	59.6 Å²	59.6	69%	0.691	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-57.9	-28.5	180	179.8	0	0	0	0	112.5	N542	N542-V544 PolarHBondContact O-N 3.33Å; N542-V544 VanDerWaalsContact O-N 3.07Å; N542-V544 WeakPolarHBondContact OD1-CB 3.24Å; N542-V544 WeakPolarHBondContact OD1-CG2 3.49Å; N542-V544 PolarHBondContact OD1-N 2.83Å
545	N	80.3	Confident	85.9	Confident	95 Å²	95	60.7 Å²	60.7	51%	0.508	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-79.7	-23.1	179	-66.3	0.2	0	0	0	112.6	R479 N542 P543	R479-N545 PolarHBondContact NH1-O 3.02Å; R479-N545 PolarHBondContact NH2-O 3.45Å; N542-N545 PolarHBondContact O-N 2.96Å; N542-N545 VanDerWaalsContact O-N 3.08Å; P543-N545 PolarHBondContact O-N 2.93Å; P543-N545 VanDerWaalsContact O-N 3.13Å
546	Y	80.2	Confident	85.7	Confident	33 Å²	33	57.1 Å²	57.1	13%	0.129	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-131.5	62.6	-165.6	-52.6	-84.6	0	0	0	111.3	R479 L480 D483 W541 P543 E548 I549	R479-Y546 HydrophobicContact CG-CD1 4.46Å; L480-Y546 HydrophobicContact CB-CD1 3.9Å; L480-Y546 HydrophobicContact CB-CG 4.03Å; L480-Y546 HydrophobicContact CD1-CD1 4.08Å; L480-Y546 HydrophobicContact CD1-CD2 3.72Å; L480-Y546 HydrophobicContact CD1-CE1 4.24Å; L480-Y546 HydrophobicContact CD1-CE2 3.87Å; L480-Y546 HydrophobicContact CD1-CG 3.81Å; L480-Y546 HydrophobicContact CG-CG 4.35Å; D483-Y546 HydrophobicContact CB-CE1 4.35Å; D483-Y546 WeakPolarHBondContact CB-OH 3.46Å; D483-Y546 PolarHBondContact OD2-OH 2.94Å; W541-Y546 HydrophobicContact CB-CD2 4.42Å; W541-Y546 HydrophobicContact CB-CE2 4.07Å; W541-Y546 AromaticContact CD1-CD2 3.92Å; W541-Y546 HydrophobicContact CG-CD2 4.46Å; P543-Y546 CarbonylContact O-C 3.4Å; P543-Y546 PolarHBondContact O-N 2.87Å; Y546-E548 PolarHBondContact O-N 2.8Å; Y546-E548 VanDerWaalsContact O-N 3.11Å; Y546-I549 VanDerWaalsContact O-CB 3.29Å; Y546-I549 WeakPolarHBondContact O-CB 3.43Å; Y546-I549 WeakPolarHBondContact O-CD1 3.39Å; Y546-I549 WeakPolarHBondContact O-CG1 3.39Å; Y546-I549 PolarHBondContact O-N 3.31Å
547	G	71.6	Confident	85.4	Confident	43 Å²	43	61.5 Å²	61.5	44%	0.443	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.5	20.8	170.1	0	0	0	0	0	115.8	I549	G547-I549 PolarHBondContact O-N 2.76Å
548	E	82.2	Confident	85.4	Confident	129 Å²	129	61.9 Å²	61.9	60%	0.603	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.3	18.1	-166.5	-68	-158.8	-153.6	0	0	115.3	P543 Y546 R550	P543-E548 VanDerWaalsContact O-CA 3.28Å; P543-E548 WeakPolarHBondContact O-CA 3.47Å; P543-E548 PolarHBondContact O-N 3.38Å; Y546-E548 PolarHBondContact O-N 2.8Å; Y546-E548 VanDerWaalsContact O-N 3.11Å; E548-R550 VanDerWaalsContact O-CG 3.31Å; E548-R550 WeakPolarHBondContact O-CG 3.41Å; E548-R550 PolarHBondContact O-N 3.35Å; E548-R550 VanDerWaalsContact O-N 3.12Å; E548-R550 IonicContact OE2-NH2 3.49Å; E548-R550 PolarHBondContact OE2-NH2 3.19Å
549	I	79	Confident	85.6	Confident	26 Å²	26	57.9 Å²	57.9	13%	0.133	29%	0.289	C	S	.	.			trans	-61.9	117.5	174.6	-61.8	162.3	0	0	0	109.9	D476 E477 L480 W541 P543 Y546 G547 Q551 I552	D476-I549 HydrophobicContact CB-CD1 4.06Å; D476-I549 VanDerWaalsContact O-CD1 3.28Å; D476-I549 WeakPolarHBondContact O-CD1 3.19Å; E477-I549 HydrophobicContact CB-CD1 4.41Å; L480-I549 HydrophobicContact CD2-CB 3.87Å; L480-I549 HydrophobicContact CD2-CD1 4.35Å; L480-I549 HydrophobicContact CD2-CG2 3.57Å; W541-I549 PolarHBondContact NE1-O 2.86Å; P543-I549 WeakPolarHBondContact CB-O 3.47Å; P543-I549 WeakPolarHBondContact CG-O 3.32Å; Y546-I549 VanDerWaalsContact O-CB 3.29Å; Y546-I549 WeakPolarHBondContact O-CB 3.43Å; Y546-I549 WeakPolarHBondContact O-CD1 3.39Å; Y546-I549 WeakPolarHBondContact O-CG1 3.39Å; Y546-I549 PolarHBondContact O-N 3.31Å; G547-I549 PolarHBondContact O-N 2.76Å; I549-Q551 WeakPolarHBondContact CG2-O 3.39Å; I549-I552 HydrophobicContact CG2-CG2 3.76Å
550	R	87.5	Confident	85.8	Confident	149 Å²	149	58.1 Å²	58.1	56%	0.562	29%	0.29	S	S	*	.			trans	-99.5	-22.6	177.5	-50.6	-172.3	-171.2	-174.8	0	112.7	W541 P543 E548 D585 N586	W541-R550 WeakPolarHBondContact CZ2-O 3.43Å; P543-R550 HydrophobicContact CB-CG 4.3Å; P543-R550 HydrophobicContact CG-CG 4.13Å; E548-R550 VanDerWaalsContact O-CG 3.31Å; E548-R550 WeakPolarHBondContact O-CG 3.41Å; E548-R550 PolarHBondContact O-N 3.35Å; E548-R550 VanDerWaalsContact O-N 3.12Å; E548-R550 IonicContact OE2-NH2 3.49Å; E548-R550 PolarHBondContact OE2-NH2 3.19Å; R550-D585 CarbonylContact O-C 3.56Å; R550-D585 WeakPolarHBondContact O-CA 3.16Å; R550-N586 PolarHBondContact O-N 3.36Å
551	Q	88.5	Confident	85.7	Confident	103 Å²	103	55.3 Å²	55.3	48%	0.481	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	142.9	-178.1	-65.4	-179.9	-5.5	0	0	110.8	I549 V583 I584 D585	I549-Q551 WeakPolarHBondContact CG2-O 3.39Å; Q551-V583 HydrophobicContact CB-CG1 4.32Å; Q551-I584 CarbonylContact C-O 3.55Å; Q551-I584 WeakPolarHBondContact CA-O 3.33Å; Q551-D585 HydrophobicContact CG-CB 4.26Å
552	I	88.9	Confident	85.6	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	162.1	175.9	58.8	178.9	0	0	0	110.2	E477 L480 M481 L484 W541 I549 V554 V583 I584	E477-I552 HydrophobicContact CG-CG2 4.25Å; E477-I552 WeakPolarHBondContact OE1-CA 3.39Å; L480-I552 HydrophobicContact CD2-CG2 3.35Å; L480-I552 HydrophobicContact CG-CG2 3.94Å; M481-I552 HydrophobicContact SD-CB 4.24Å; M481-I552 HydrophobicContact SD-CD1 3.96Å; L484-I552 HydrophobicContact CD2-CD1 3.47Å; L484-I552 VanDerWaalsContact CD2-CD1 3.47Å; W541-I552 HydrophobicContact CH2-CD1 4Å; W541-I552 HydrophobicContact CH2-CG1 3.78Å; W541-I552 HydrophobicContact CZ2-CG1 4.4Å; W541-I552 HydrophobicContact CZ2-CG2 4.31Å; W541-I552 HydrophobicContact CZ3-CD1 4.07Å; W541-I552 HydrophobicContact CZ3-CG1 4.31Å; I549-I552 HydrophobicContact CG2-CG2 3.76Å; I552-V554 HydrophobicContact CD1-CG2 4.02Å; I552-V554 HydrophobicContact CG1-CG2 4.13Å; I552-V583 WeakPolarHBondContact O-CA 3.44Å; I552-I584 HydrophobicContact CD1-CB 4.42Å; I552-I584 HydrophobicContact CD1-CD1 4.45Å; I552-I584 HydrophobicContact CG1-CB 3.88Å; I552-I584 HydrophobicContact CG1-CG1 4.43Å; I552-I584 PolarHBondContact N-O 3.02Å; I552-I584 PolarHBondContact O-N 2.85Å
553	R	87.2	Confident	85.6	Confident	41 Å²	41	52.3 Å²	52.3	16%	0.155	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	113.7	-178.8	-67.4	116.5	171.6	-70.6	-8.6	113.1	A157 Y158 E162 E477 N581 V583	A157-R553 WeakPolarHBondContact O-CB 3.19Å; A157-R553 WeakPolarHBondContact O-CD 3.43Å; A157-R553 WeakPolarHBondContact O-CG 3.3Å; A157-R553 PolarHBondContact O-NH1 2.89Å; Y158-R553 VanDerWaalsContact C-NH1 3.35Å; Y158-R553 VanDerWaalsContact CA-NH1 3.33Å; E162-R553 WeakPolarHBondContact OE2-CD 3.47Å; E162-R553 IonicContact OE2-CZ 2.73Å; E162-R553 IonicContact OE2-NE 3.69Å; E477-R553 PolarHBondContact OE1-N 3.31Å; R553-N581 HydrophobicContact CB-CB 4.42Å; R553-V583 HydrophobicContact CG-CG2 4.06Å
554	V	87	Confident	85.8	Confident	2 Å²	2	52.1 Å²	52.1	1%	0.012	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	137.6	-169.1	-169.5	0	0	0	0	112.3	M481 F485 I552 K558 V559 N581 V582 I584	M481-V554 HydrophobicContact CE-CG2 4.12Å; M481-V554 HydrophobicContact SD-CG2 4.04Å; F485-V554 HydrophobicContact CE1-CG1 4.09Å; F485-V554 HydrophobicContact CE2-CG1 3.86Å; F485-V554 HydrophobicContact CE2-CG2 3.91Å; F485-V554 HydrophobicContact CZ-CB 4.21Å; F485-V554 HydrophobicContact CZ-CG1 3.43Å; F485-V554 VanDerWaalsContact CZ-CG1 3.43Å; F485-V554 HydrophobicContact CZ-CG2 3.87Å; I552-V554 HydrophobicContact CD1-CG2 4.02Å; I552-V554 HydrophobicContact CG1-CG2 4.13Å; V554-K558 HydrophobicContact CG1-CB 3.86Å; V554-K558 HydrophobicContact CG1-CG 4.23Å; V554-V559 HydrophobicContact CB-CG1 4.39Å; V554-V559 HydrophobicContact CG1-CG1 4.07Å; V554-N581 CarbonylContact O-C 3.56Å; V554-N581 VanDerWaalsContact O-CA 3.26Å; V554-N581 WeakPolarHBondContact O-CA 3.33Å; V554-N581 VanDerWaalsContact O-CB 3.25Å; V554-N581 WeakPolarHBondContact O-CB 3.49Å; V554-V582 PolarHBondContact N-O 2.99Å; V554-V582 PolarHBondContact O-N 3.06Å; V554-I584 HydrophobicContact CB-CD1 4.21Å; V554-I584 HydrophobicContact CG2-CD1 3.56Å; V554-I584 HydrophobicContact CG2-CG1 4.11Å
555	A	86.2	Confident	86.1	Confident	31 Å²	31	47.6 Å²	47.6	26%	0.256	24%	0.236	S	C	.	.			trans	-60.1	140.7	173.6	0	0	0	0	0	113	D557 K558 N581	A555-D557 WeakPolarHBondContact CB-OD1 3.46Å; A555-D557 PolarHBondContact O-N 2.92Å; A555-K558 PolarHBondContact O-N 3.11Å; A555-K558 VanDerWaalsContact O-N 3.14Å; A555-N581 WeakPolarHBondContact CA-OD1 3.47Å
556	T	86.6	Confident	86.6	Confident	9 Å²	9	43.1 Å²	43.1	6%	0.055	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-9.6	-170	71.7	0	0	0	0	115.7	R561 H579 S580 V582 W592	T556-R561 PolarHBondContact OG1-NH1 3.36Å; T556-H579 HydrophobicContact CG2-CB 4.29Å; T556-S580 WeakPolarHBondContact CG2-O 3.37Å; T556-V582 HydrophobicContact CG2-CG2 4.15Å; T556-W592 HydrophobicContact CG2-CZ2 4.05Å
557	D	85.7	Confident	87.1	Confident	92 Å²	92	43.6 Å²	43.6	49%	0.492	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-20.5	177.3	70.8	-53.2	0	0	0	112.9	S490 A555	S490-D557 PolarHBondContact OG-O 3.05Å; A555-D557 WeakPolarHBondContact CB-OD1 3.46Å; A555-D557 PolarHBondContact O-N 2.92Å
558	K	85.3	Confident	88.1	Confident	82 Å²	82	42.7 Å²	42.7	36%	0.357	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-20.8	-178.8	-50.7	-50.9	-179.2	-154	0	113.8	F485 Y488 V554 A555	F485-K558 HydrophobicContact CD1-CB 4.08Å; F485-K558 HydrophobicContact CE1-CB 3.78Å; F485-K558 HydrophobicContact CZ-CB 4.47Å; Y488-K558 WeakPolarHBondContact CD1-O 3.41Å; Y488-K558 WeakPolarHBondContact CE1-O 3.38Å; V554-K558 HydrophobicContact CG1-CB 3.86Å; V554-K558 HydrophobicContact CG1-CG 4.23Å; A555-K558 PolarHBondContact O-N 3.11Å; A555-K558 VanDerWaalsContact O-N 3.14Å
559	V	90.4	Very high	88.5	Confident	3 Å²	3	37.4 Å²	37.4	2%	0.018	18%	0.176	C	C	.	.	S	Bend	trans	-111.7	150.8	-174.7	-64.8	0	0	0	0	110.9	F485 S490 M539 V554 V582 I584 M590	F485-V559 HydrophobicContact CE1-CG1 3.94Å; F485-V559 HydrophobicContact CZ-CG1 4Å; S490-V559 VanDerWaalsContact CB-C 3.42Å; S490-V559 WeakPolarHBondContact CB-O 3.22Å; M539-V559 HydrophobicContact CE-CG1 4.3Å; V554-V559 HydrophobicContact CB-CG1 4.39Å; V554-V559 HydrophobicContact CG1-CG1 4.07Å; V559-V582 HydrophobicContact CG2-CB 4.28Å; V559-V582 HydrophobicContact CG2-CG2 3.71Å; V559-I584 HydrophobicContact CG1-CD1 4.04Å; V559-M590 HydrophobicContact CB-CE 3.88Å; V559-M590 HydrophobicContact CG1-CE 3.85Å; V559-M590 HydrophobicContact CG2-CE 4.43Å
560	W	91.9	Very high	88.9	Confident	6 Å²	6	38.5 Å²	38.5	2%	0.023	19%	0.189	C	C	.	.			trans	-65	137.6	166.8	176.7	88.4	0	0	0	109.3	Y488 S490 L493 P494 L503 W534 P562 Y625 I630	Y488-W560 WeakPolarHBondContact OH-CB 3.45Å; Y488-W560 PolarHBondContact OH-N 3.15Å; S490-W560 WeakPolarHBondContact O-CA 3.47Å; S490-W560 WeakPolarHBondContact O-CB 3.32Å; L493-W560 HydrophobicContact CD1-CH2 3.59Å; L493-W560 HydrophobicContact CD1-CZ2 3.24Å; L493-W560 HydrophobicContact CD1-CZ3 4.37Å; P494-W560 HydrophobicContact CG-CD2 4.47Å; P494-W560 HydrophobicContact CG-CE3 4.04Å; L503-W560 HydrophobicContact CD2-CH2 3.41Å; L503-W560 VanDerWaalsContact CD2-CH2 3.41Å; L503-W560 HydrophobicContact CD2-CZ2 4.49Å; L503-W560 HydrophobicContact CD2-CZ3 3.49Å; L503-W560 VanDerWaalsContact CD2-CZ3 3.49Å; W534-W560 AromaticContact CD1-CZ3 3.85Å; W534-W560 HydrophobicContact CD2-CZ3 4.44Å; W534-W560 HydrophobicContact CG-CZ3 4.24Å; W534-W560 WeakPolarHBondContact CZ2-O 3.44Å; W534-W560 AromaticContact NE1-CE3 3.64Å; W534-W560 AromaticContact NE1-CZ3 3.81Å; W560-P562 HydrophobicContact CH2-CB 3.68Å; W560-P562 HydrophobicContact CH2-CG 4.39Å; W560-P562 HydrophobicContact CZ2-CB 4.35Å; W560-P562 HydrophobicContact CZ3-CB 4.22Å; W560-P562 HydrophobicContact CZ3-CG 4.45Å; W560-Y625 AromaticContact CZ2-CE2 3.93Å; W560-Y625 HydrophobicContact CZ2-CE2 3.93Å; W560-Y625 PolarHBondContact NE1-OH 3.44Å; W560-I630 HydrophobicContact CH2-CD1 4.12Å; W560-I630 HydrophobicContact CZ2-CD1 4.31Å
561	R	88.5	Confident	88.6	Confident	79 Å²	79	35.8 Å²	35.8	30%	0.298	19%	0.185	S	C	.	.			trans	-133.3	139.7	-179.5	70.1	-173.3	-168.2	172.2	8.1	111.4	T556 H579	T556-R561 PolarHBondContact OG1-NH1 3.36Å; R561-H579 PolarHBondContact NH1-CD2 3.33Å; R561-H579 PolarHBondContact NH1-NE2 3.36Å; R561-H579 PolarHBondContact NH2-NE2 3.05Å
562	P	90.4	Very high	88	Confident	5 Å²	5	33.2 Å²	33.2	3%	0.032	19%	0.187	C	C	.	.			trans	-72.5	143.5	177.1	30.6	-35.7	0	0	0	111.9	L505 L532 W534 W560 I564	L505-P562 HydrophobicContact CD1-CG 3.98Å; L505-P562 HydrophobicContact CD2-CB 3.75Å; L505-P562 HydrophobicContact CD2-CG 3.89Å; L532-P562 HydrophobicContact CD2-CG 3.74Å; W534-P562 HydrophobicContact CE3-CG 4.39Å; W560-P562 HydrophobicContact CH2-CB 3.68Å; W560-P562 HydrophobicContact CH2-CG 4.39Å; W560-P562 HydrophobicContact CZ2-CB 4.35Å; W560-P562 HydrophobicContact CZ3-CB 4.22Å; W560-P562 HydrophobicContact CZ3-CG 4.45Å; P562-I564 VanDerWaalsContact C-N 3.28Å; P562-I564 HydrophobicContact CB-CD1 4.46Å; P562-I564 HydrophobicContact CB-CG1 4.15Å; P562-I564 HydrophobicContact CG-CG1 4.47Å; P562-I564 PolarHBondContact O-N 3.26Å; P562-I564 VanDerWaalsContact O-N 3.12Å
563	D	89	Confident	87.7	Confident	40 Å²	40	37.7 Å²	37.7	21%	0.214	21%	0.211	C	C	.	.			trans	-87.2	48.2	-176.5	69.3	-29.8	0	0	0	113	V565 S622 W623 T624 Y625	D563-V565 PolarHBondContact O-N 3.46Å; D563-S622 VanDerWaalsContact CG-OG 3.27Å; D563-S622 VanDerWaalsContact OD1-CB 3.29Å; D563-S622 WeakPolarHBondContact OD1-CB 3.42Å; D563-S622 PolarHBondContact OD1-OG 2.72Å; D563-S622 PolarHBondContact OD2-OG 3.03Å; D563-W623 PolarHBondContact O-N 2.91Å; D563-W623 WeakPolarHBondContact OD2-CB 3.39Å; D563-W623 PolarHBondContact OD2-N 2.94Å; D563-W623 VanDerWaalsContact OD2-N 3.08Å; D563-T624 WeakPolarHBondContact OD2-CB 3.4Å; D563-T624 PolarHBondContact OD2-N 3.34Å; D563-T624 PolarHBondContact OD2-OG1 3Å; D563-Y625 WeakPolarHBondContact OD1-CD2 3.25Å
564	I	90.6	Very high	87.4	Confident	13 Å²	13	40 Å²	40	7%	0.067	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	114.3	-177.6	-53.7	-53	0	0	0	110.7	L505 F507 L532 P562 F620 G621 L632	L505-I564 HydrophobicContact CD2-CD1 3.63Å; L505-I564 HydrophobicContact CD2-CG1 3.61Å; F507-I564 HydrophobicContact CD2-CG2 4.13Å; F507-I564 HydrophobicContact CE2-CB 4.35Å; F507-I564 HydrophobicContact CE2-CG2 3.6Å; F507-I564 HydrophobicContact CZ-CG2 4.26Å; L532-I564 HydrophobicContact CD2-CB 4.23Å; L532-I564 HydrophobicContact CD2-CG1 3.89Å; P562-I564 VanDerWaalsContact C-N 3.28Å; P562-I564 HydrophobicContact CB-CD1 4.46Å; P562-I564 HydrophobicContact CB-CG1 4.15Å; P562-I564 HydrophobicContact CG-CG1 4.47Å; P562-I564 PolarHBondContact O-N 3.26Å; P562-I564 VanDerWaalsContact O-N 3.12Å; I564-F620 HydrophobicContact CG2-CB 4.02Å; I564-F620 HydrophobicContact CG2-CD1 4.15Å; I564-G621 WeakPolarHBondContact CA-O 3.5Å; I564-L632 HydrophobicContact CD1-CD2 4.13Å
565	V	91.5	Very high	87.1	Confident	19 Å²	19	45.9 Å²	45.9	12%	0.115	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	158.4	-177.3	-62.2	0	0	0	0	112.2	D563 Y574 F620 G621 W623	D563-V565 PolarHBondContact O-N 3.46Å; V565-Y574 HydrophobicContact CB-CD1 4.45Å; V565-F620 WeakPolarHBondContact O-CA 3.39Å; V565-G621 PolarHBondContact N-O 2.83Å; V565-G621 PolarHBondContact O-N 2.89Å; V565-W623 HydrophobicContact CG2-CB 3.86Å; V565-W623 HydrophobicContact CG2-CD2 4.28Å; V565-W623 HydrophobicContact CG2-CE3 3.7Å; V565-W623 HydrophobicContact CG2-CG 4.39Å
566	L	91.6	Very high	86.7	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	108.1	172.6	-177.8	69.7	0	0	0	110.5	N568 N569 Y598 L618 F620	L566-N568 VanDerWaalsContact CD1-OD1 3.31Å; L566-N568 WeakPolarHBondContact CD1-OD1 3.46Å; L566-N568 PolarHBondContact O-N 3.43Å; L566-N569 HydrophobicContact CB-CB 4.35Å; L566-N569 HydrophobicContact CD2-CB 4.14Å; L566-N569 HydrophobicContact CG-CB 4.27Å; L566-N569 VanDerWaalsContact O-CB 3.29Å; L566-N569 WeakPolarHBondContact O-CB 3.11Å; L566-N569 PolarHBondContact O-N 3.12Å; L566-Y598 HydrophobicContact CB-CD1 3.97Å; L566-Y598 HydrophobicContact CB-CE1 3.95Å; L566-Y598 HydrophobicContact CD2-CD1 3.63Å; L566-Y598 HydrophobicContact CD2-CE1 4.45Å; L566-Y598 HydrophobicContact CD2-CG 3.84Å; L566-Y598 HydrophobicContact CG-CD1 4.44Å; L566-L618 HydrophobicContact CD1-CB 3.99Å; L566-L618 HydrophobicContact CD1-CD2 3.9Å; L566-L618 HydrophobicContact CD2-CD2 4.22Å; L566-F620 HydrophobicContact CB-CD1 4.44Å; L566-F620 HydrophobicContact CB-CE1 4.1Å; L566-F620 HydrophobicContact CD1-CE1 4.23Å; L566-F620 HydrophobicContact CD1-CE2 4.27Å; L566-F620 HydrophobicContact CD1-CZ 4.11Å
567	F	90	Very high	86.2	Confident	44 Å²	44	46.4 Å²	46.4	19%	0.193	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-32.9	-178.1	-82.3	-77.3	0	0	0	114.2	L619 S622 W623 R667	F567-L619 HydrophobicContact CB-CB 4.33Å; F567-L619 HydrophobicContact CB-CD2 3.94Å; F567-L619 HydrophobicContact CB-CG 4.06Å; F567-L619 HydrophobicContact CD2-CG 4.33Å; F567-L619 PolarHBondContact N-O 2.82Å; F567-S622 WeakPolarHBondContact CZ-O 3.03Å; F567-W623 HydrophobicContact CD1-CE3 4.09Å; F567-W623 AromaticContact CD1-CZ3 3.79Å; F567-W623 HydrophobicContact CD1-CZ3 3.79Å; F567-W623 AromaticContact CE1-CE3 3.54Å; F567-W623 HydrophobicContact CE1-CE3 3.54Å; F567-W623 AromaticContact CE1-CZ3 3.62Å; F567-W623 HydrophobicContact CE1-CZ3 3.62Å; F567-W623 HydrophobicContact CZ-CE3 4.16Å; F567-R667 VanDerWaalsContact CE1-NH2 3.35Å; F567-R667 HydrophobicContact CE2-CG 4.41Å
568	N	92.5	Very high	85.9	Confident	24 Å²	24	44 Å²	44	13%	0.128	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	24.5	-179.3	70.5	-54.4	0	0	0	113.4	L566 S601 T617 L619	L566-N568 VanDerWaalsContact CD1-OD1 3.31Å; L566-N568 WeakPolarHBondContact CD1-OD1 3.46Å; L566-N568 PolarHBondContact O-N 3.43Å; N568-S601 PolarHBondContact ND2-O 2.95Å; N568-S601 VanDerWaalsContact ND2-O 3.14Å; N568-S601 PolarHBondContact O-N 3.45Å; N568-S601 PolarHBondContact O-OG 2.78Å; N568-T617 PolarHBondContact ND2-O 3.32Å; N568-L619 PolarHBondContact OD1-N 3.22Å
569	N	90.2	Very high	85.7	Confident	18 Å²	18	43.6 Å²	43.6	10%	0.096	23%	0.233	C	C	.	.	B	Isolated β-bridge	trans	-59	139.6	173.8	-178.8	21.4	0	0	0	112.7	L566 D571 N573 Y574 K599	L566-N569 HydrophobicContact CB-CB 4.35Å; L566-N569 HydrophobicContact CD2-CB 4.14Å; L566-N569 HydrophobicContact CG-CB 4.27Å; L566-N569 VanDerWaalsContact O-CB 3.29Å; L566-N569 WeakPolarHBondContact O-CB 3.11Å; L566-N569 PolarHBondContact O-N 3.12Å; N569-D571 PolarHBondContact OD1-N 2.9Å; N569-N573 VanDerWaalsContact ND2-C 3.34Å; N569-N573 PolarHBondContact ND2-O 3.27Å; N569-Y574 HydrophobicContact CB-CD1 4.1Å; N569-Y574 HydrophobicContact CB-CE1 3.8Å; N569-K599 PolarHBondContact OD1-O 3.31Å
570	A	87.7	Confident	85.4	Confident	49 Å²	49	43.6 Å²	43.6	41%	0.405	23%	0.233	S	C	.	.	S	Bend	trans	-103.7	-14.1	178.4	0	0	0	0	0	114.2	I523 K599	I523-A570 HydrophobicContact CD1-CB 3.97Å; I523-A570 HydrophobicContact CG1-CB 3.81Å; I523-A570 HydrophobicContact CG2-CB 4.44Å; A570-K599 PolarHBondContact N-O 2.97Å
571	D	80.1	Confident	85.3	Confident	91 Å²	91	45 Å²	45	49%	0.487	24%	0.241	S	C	.	.	S	Bend	trans	-90.5	-15.5	-172	-146.3	43	0	0	0	114.2	N569 N573 K599	N569-D571 PolarHBondContact OD1-N 2.9Å; D571-N573 PolarHBondContact O-N 2.7Å; D571-K599 HydrophobicContact CB-CB 4.3Å; D571-K599 HydrophobicContact CB-CD 3.98Å; D571-K599 WeakPolarHBondContact OD1-CD 3.44Å; D571-K599 IonicContact OD1-NZ 2.8Å; D571-K599 PolarHBondContact OD1-NZ 3.02Å; D571-K599 IonicContact OD2-NZ 3.92Å; D571-K599 PolarHBondContact OD2-NZ 3.48Å
572	G	77.4	Confident	85.4	Confident	50 Å²	50	41.2 Å²	41.2	52%	0.515	23%	0.227	S	C	.	.	S	Bend	trans	78.2	-18.7	-176	0	0	0	0	0	115.4	Y574	G572-Y574 WeakPolarHBondContact O-CD2 3.46Å; G572-Y574 WeakPolarHBondContact O-CE2 2.86Å
573	N	81.4	Confident	85.5	Confident	94 Å²	94	42.2 Å²	42.2	50%	0.503	23%	0.233	S	C	.	.			trans	-83.8	115.6	166.7	-176.2	9	0	0	0	110.3	N569 D571 E575	N569-N573 VanDerWaalsContact ND2-C 3.34Å; N569-N573 PolarHBondContact ND2-O 3.27Å; D571-N573 PolarHBondContact O-N 2.7Å; N573-E575 PolarHBondContact OD1-N 3.12Å; N573-E575 VanDerWaalsContact OD1-N 3.11Å
574	Y	81.2	Confident	85.7	Confident	90 Å²	90	40.3 Å²	40.3	35%	0.353	22%	0.223	S	C	.	.			trans	-96.7	-8.6	-177.6	-66.6	-88.5	0	0	0	114	V565 N569 G572	V565-Y574 HydrophobicContact CB-CD1 4.45Å; N569-Y574 HydrophobicContact CB-CD1 4.1Å; N569-Y574 HydrophobicContact CB-CE1 3.8Å; G572-Y574 WeakPolarHBondContact O-CD2 3.46Å; G572-Y574 WeakPolarHBondContact O-CE2 2.86Å
575	E	80.5	Confident	85.7	Confident	124 Å²	124	41.4 Å²	41.4	58%	0.579	23%	0.228	S	C	*	.	S	Bend	trans	-78.7	156	179.4	-58.8	-168	142.7	0	0	112	N573	N573-E575 PolarHBondContact OD1-N 3.12Å; N573-E575 VanDerWaalsContact OD1-N 3.11Å
576	V	78.7	Confident	85.7	Confident	18 Å²	18	42.1 Å²	42.1	11%	0.109	23%	0.232	C	C	.	.			trans	-69.5	141.2	174.7	-67.2	0	0	0	0	110.8	L530 F578 H579 W592 P594 A596	L530-V576 HydrophobicContact CD1-CG1 4.06Å; V576-F578 WeakPolarHBondContact CG2-O 3.37Å; V576-F578 PolarHBondContact O-N 3.46Å; V576-H579 WeakPolarHBondContact CG2-ND1 3.38Å; V576-W592 HydrophobicContact CG2-CH2 3.93Å; V576-W592 HydrophobicContact CG2-CZ2 3.95Å; V576-P594 HydrophobicContact CB-CB 4.08Å; V576-P594 HydrophobicContact CG1-CB 4.18Å; V576-P594 HydrophobicContact CG1-CG 4.09Å; V576-P594 HydrophobicContact CG2-CB 3.93Å; V576-P594 HydrophobicContact CG2-CG 4.49Å; V576-A596 HydrophobicContact CB-CB 4.2Å; V576-A596 HydrophobicContact CG1-CB 4.19Å
577	S	75.6	Confident	85.7	Confident	33 Å²	33	47.6 Å²	47.6	23%	0.231	26%	0.257	C	S	.	.	S	Bend	trans	-63.3	-27	-173.2	-44.9	0	0	0	0	114.2	Y107 I597	Y107-S577 WeakPolarHBondContact CD2-O 2.76Å; Y107-S577 VanDerWaalsContact CE2-O 3.28Å; Y107-S577 WeakPolarHBondContact CE2-O 3.39Å; S577-I597 PolarHBondContact OG-N 3.28Å
578	F	79.4	Confident	85.7	Confident	43 Å²	43	45.5 Å²	45.5	19%	0.189	25%	0.248	C	C	.	.			trans	-135.2	147.1	175.5	-169.9	-110.9	0	0	0	111	V97 Y107 V576 S580 P595	V97-F578 HydrophobicContact CB-CZ 4.48Å; V97-F578 HydrophobicContact CG1-CD1 4.4Å; V97-F578 HydrophobicContact CG1-CE1 4.13Å; V97-F578 HydrophobicContact CG1-CZ 4.24Å; V97-F578 HydrophobicContact CG2-CE1 3.63Å; V97-F578 HydrophobicContact CG2-CE2 4.32Å; V97-F578 HydrophobicContact CG2-CZ 3.45Å; V97-F578 VanDerWaalsContact CG2-CZ 3.45Å; Y107-F578 AromaticContact CD1-CD2 3.92Å; Y107-F578 HydrophobicContact CD1-CD2 3.92Å; Y107-F578 HydrophobicContact CD1-CE2 4.37Å; Y107-F578 HydrophobicContact CD2-CB 4.25Å; Y107-F578 AromaticContact CD2-CD2 3.98Å; Y107-F578 HydrophobicContact CD2-CD2 3.98Å; Y107-F578 HydrophobicContact CE1-CD2 4Å; Y107-F578 HydrophobicContact CE1-CG 4.41Å; Y107-F578 HydrophobicContact CE2-CB 3.66Å; Y107-F578 HydrophobicContact CE2-CD2 4.08Å; Y107-F578 HydrophobicContact CE2-CG 4.25Å; Y107-F578 AromaticContact CG-CD2 3.91Å; Y107-F578 HydrophobicContact CG-CD2 3.91Å; V576-F578 WeakPolarHBondContact CG2-O 3.37Å; V576-F578 PolarHBondContact O-N 3.46Å; F578-S580 VanDerWaalsContact CD1-N 3.35Å; F578-P595 HydrophobicContact CB-CG 3.87Å; F578-P595 HydrophobicContact CD1-CG 4Å; F578-P595 HydrophobicContact CG-CG 4.33Å; F578-P595 PolarHBondContact N-O 2.99Å
579	H	81.7	Confident	85.7	Confident	73 Å²	73	47.4 Å²	47.4	34%	0.338	26%	0.258	S	S	.	.			trans	-106.8	76.6	174.6	-71	3.5	0	0	0	109.7	T556 R561 V576	T556-H579 HydrophobicContact CG2-CB 4.29Å; R561-H579 PolarHBondContact NH1-CD2 3.33Å; R561-H579 PolarHBondContact NH1-NE2 3.36Å; R561-H579 PolarHBondContact NH2-NE2 3.05Å; V576-H579 WeakPolarHBondContact CG2-ND1 3.38Å
580	S	84.4	Confident	85.8	Confident	3 Å²	3	46.7 Å²	46.7	2%	0.021	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-64.9	150.5	169.9	50.6	0	0	0	0	110.9	S156 T556 F578 W592 V593 P594	S156-S580 VanDerWaalsContact OG-CB 3.28Å; S156-S580 WeakPolarHBondContact OG-CB 3.25Å; T556-S580 WeakPolarHBondContact CG2-O 3.37Å; F578-S580 VanDerWaalsContact CD1-N 3.35Å; S580-W592 VanDerWaalsContact O-CD1 3.32Å; S580-W592 PolarHBondContact O-NE1 3.38Å; S580-V593 VanDerWaalsContact OG-C 3.26Å; S580-V593 PolarHBondContact OG-O 2.77Å; S580-P594 WeakPolarHBondContact OG-CA 3.5Å
581	N	89.1	Confident	86.1	Confident	34 Å²	34	47.1 Å²	47.1	18%	0.182	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-61.7	151.7	179.4	-73.3	14.4	0	0	0	112.1	A157 R553 V554 A555	A157-N581 HydrophobicContact CB-CB 3.63Å; A157-N581 VanDerWaalsContact CB-CG 3.5Å; A157-N581 WeakPolarHBondContact CB-ND2 3.37Å; R553-N581 HydrophobicContact CB-CB 4.42Å; V554-N581 CarbonylContact O-C 3.56Å; V554-N581 VanDerWaalsContact O-CA 3.26Å; V554-N581 WeakPolarHBondContact O-CA 3.33Å; V554-N581 VanDerWaalsContact O-CB 3.25Å; V554-N581 WeakPolarHBondContact O-CB 3.49Å; A555-N581 WeakPolarHBondContact CA-OD1 3.47Å
582	V	91.2	Very high	86.7	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	127.7	170.6	-173.2	0	0	0	0	108.2	W534 V554 T556 V559 I584 M590 L591 W592	W534-V582 HydrophobicContact CH2-CG1 3.99Å; W534-V582 HydrophobicContact CH2-CG2 4.33Å; W534-V582 HydrophobicContact CZ2-CG1 4.42Å; V554-V582 PolarHBondContact N-O 2.99Å; V554-V582 PolarHBondContact O-N 3.06Å; T556-V582 HydrophobicContact CG2-CG2 4.15Å; V559-V582 HydrophobicContact CG2-CB 4.28Å; V559-V582 HydrophobicContact CG2-CG2 3.71Å; V582-I584 HydrophobicContact CG1-CG1 4.4Å; V582-M590 HydrophobicContact CG1-CB 4.37Å; V582-M590 HydrophobicContact CG1-CE 4.19Å; V582-L591 WeakPolarHBondContact CG1-O 3.47Å; V582-W592 HydrophobicContact CG1-CB 4.32Å; V582-W592 HydrophobicContact CG2-CB 4.02Å; V582-W592 HydrophobicContact CG2-CG 3.91Å
583	V	91.6	Very high	87.3	Confident	27 Å²	27	43 Å²	43	16%	0.164	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	122.7	168	-177.5	0	0	0	0	107.3	Q551 I552 R553 L591	Q551-V583 HydrophobicContact CB-CG1 4.32Å; I552-V583 WeakPolarHBondContact O-CA 3.44Å; R553-V583 HydrophobicContact CG-CG2 4.06Å; V583-L591 HydrophobicContact CB-CB 4.36Å; V583-L591 PolarHBondContact N-O 3.28Å; V583-L591 PolarHBondContact O-N 3.19Å
584	I	92.8	Very high	87.8	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	135.5	176	-48.9	-175	0	0	0	107.8	F485 M539 W541 Q551 I552 V554 V559 V582 M590	F485-I584 HydrophobicContact CZ-CD1 4.42Å; M539-I584 HydrophobicContact CB-CG2 3.95Å; M539-I584 HydrophobicContact CG-CD1 4.33Å; M539-I584 HydrophobicContact SD-CD1 3.68Å; W541-I584 HydrophobicContact CH2-CB 4.31Å; W541-I584 HydrophobicContact CH2-CG2 4.01Å; W541-I584 HydrophobicContact CZ3-CB 4.39Å; W541-I584 HydrophobicContact CZ3-CG2 3.68Å; Q551-I584 CarbonylContact C-O 3.55Å; Q551-I584 WeakPolarHBondContact CA-O 3.33Å; I552-I584 HydrophobicContact CD1-CB 4.42Å; I552-I584 HydrophobicContact CD1-CD1 4.45Å; I552-I584 HydrophobicContact CG1-CB 3.88Å; I552-I584 HydrophobicContact CG1-CG1 4.43Å; I552-I584 PolarHBondContact N-O 3.02Å; I552-I584 PolarHBondContact O-N 2.85Å; V554-I584 HydrophobicContact CB-CD1 4.21Å; V554-I584 HydrophobicContact CG2-CD1 3.56Å; V554-I584 HydrophobicContact CG2-CG1 4.11Å; V559-I584 HydrophobicContact CG1-CD1 4.04Å; V582-I584 HydrophobicContact CG1-CG1 4.4Å; I584-M590 HydrophobicContact CB-SD 4.2Å; I584-M590 HydrophobicContact CD1-CE 3.89Å; I584-M590 HydrophobicContact CD1-SD 3.88Å; I584-M590 HydrophobicContact CG1-CE 4.08Å; I584-M590 HydrophobicContact CG1-SD 3.74Å; I584-M590 HydrophobicContact CG2-SD 3.69Å
585	D	91.8	Very high	88.2	Confident	35 Å²	35	35 Å²	35	19%	0.187	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	146.8	175.5	173.1	72.7	0	0	0	110.6	R550 Q551 E587 G588 N589	R550-D585 CarbonylContact O-C 3.56Å; R550-D585 WeakPolarHBondContact O-CA 3.16Å; Q551-D585 HydrophobicContact CG-CB 4.26Å; D585-E587 PolarHBondContact O-N 3.5Å; D585-G588 PolarHBondContact O-N 2.84Å; D585-N589 HydrophobicContact CB-CB 4.11Å; D585-N589 PolarHBondContact N-O 3.37Å; D585-N589 PolarHBondContact OD2-ND2 3.06Å
586	N	91.3	Very high	88.6	Confident	35 Å²	35	29.1 Å²	29.1	19%	0.187	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-17.6	-165.5	76.1	-110.5	0	0	0	114.8	W541 P543 R550 G588	W541-N586 HydrophobicContact CD2-CB 3.77Å; W541-N586 HydrophobicContact CE3-CB 4.36Å; W541-N586 HydrophobicContact CG-CB 4.2Å; W541-N586 HydrophobicContact CH2-CB 4.21Å; W541-N586 HydrophobicContact CZ2-CB 3.62Å; W541-N586 PolarHBondContact N-O 2.88Å; P543-N586 HydrophobicContact CG-CB 3.81Å; P543-N586 VanDerWaalsContact CG-CG 3.42Å; P543-N586 VanDerWaalsContact CG-OD1 3.27Å; P543-N586 WeakPolarHBondContact CG-OD1 2.99Å; R550-N586 PolarHBondContact O-N 3.36Å; N586-G588 VanDerWaalsContact C-N 3.26Å
587	E	91.4	Very high	89	Confident	114 Å²	114	29.2 Å²	29.2	53%	0.533	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	-1.5	173.9	-59.8	-167	156.7	0	0	113.9	Y535 R540 D585 N589	Y535-E587 WeakPolarHBondContact CE2-O 3.45Å; R540-E587 VanDerWaalsContact CZ-O 3.28Å; R540-E587 PolarHBondContact NE-O 3.37Å; R540-E587 PolarHBondContact NH2-O 3.42Å; D585-E587 PolarHBondContact O-N 3.5Å; E587-N589 PolarHBondContact OE2-ND2 3.41Å
588	G	89.2	Confident	89.8	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	87.7	15.3	-173.6	0	0	0	0	0	114	Y535 D536 M539 D585 N586	Y535-G588 WeakPolarHBondContact CA-O 3.37Å; Y535-G588 WeakPolarHBondContact CD2-O 3.24Å; D536-G588 PolarHBondContact N-O 3.49Å; D536-G588 WeakPolarHBondContact O-CA 3.44Å; M539-G588 WeakPolarHBondContact O-CA 3.5Å; D585-G588 PolarHBondContact O-N 2.84Å; N586-G588 VanDerWaalsContact C-N 3.26Å
589	N	92.8	Very high	90.4	Very high	65 Å²	65	28 Å²	28	35%	0.348	14%	0.143	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	126.6	174.4	-52.7	-55.9	0	0	0	109.1	D585 E587	D585-N589 HydrophobicContact CB-CB 4.11Å; D585-N589 PolarHBondContact N-O 3.37Å; D585-N589 PolarHBondContact OD2-ND2 3.06Å; E587-N589 PolarHBondContact OE2-ND2 3.41Å
590	M	92.5	Very high	90.9	Very high	2 Å²	2	24.5 Å²	24.5	1%	0.01	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	125.9	-176.2	-54.7	-72.2	-80.2	0	0	108.8	K533 W534 D536 M539 V559 V582 I584	K533-M590 VanDerWaalsContact CA-O 3.23Å; K533-M590 WeakPolarHBondContact CA-O 3.35Å; W534-M590 HydrophobicContact CD2-CB 3.65Å; W534-M590 HydrophobicContact CD2-CG 4.33Å; W534-M590 VanDerWaalsContact CE2-CB 3.43Å; W534-M590 HydrophobicContact CE3-CB 4.09Å; W534-M590 HydrophobicContact CG-CB 4.08Å; W534-M590 HydrophobicContact CG-CG 4.45Å; W534-M590 HydrophobicContact CH2-CB 4.14Å; W534-M590 HydrophobicContact CZ2-CB 3.7Å; W534-M590 HydrophobicContact CZ2-CE 3.92Å; W534-M590 HydrophobicContact CZ2-CG 4.18Å; W534-M590 HydrophobicContact CZ3-CB 4.31Å; W534-M590 PolarHBondContact N-O 3.49Å; W534-M590 VanDerWaalsContact N-O 3.08Å; W534-M590 PolarHBondContact O-N 3.24Å; D536-M590 HydrophobicContact CB-CG 3.91Å; D536-M590 HydrophobicContact CB-SD 4.21Å; M539-M590 HydrophobicContact CB-SD 3.88Å; M539-M590 HydrophobicContact CG-CE 4.08Å; M539-M590 HydrophobicContact CG-SD 3.81Å; V559-M590 HydrophobicContact CB-CE 3.88Å; V559-M590 HydrophobicContact CG1-CE 3.85Å; V559-M590 HydrophobicContact CG2-CE 4.43Å; V582-M590 HydrophobicContact CG1-CB 4.37Å; V582-M590 HydrophobicContact CG1-CE 4.19Å; I584-M590 HydrophobicContact CB-SD 4.2Å; I584-M590 HydrophobicContact CD1-CE 3.89Å; I584-M590 HydrophobicContact CD1-SD 3.88Å; I584-M590 HydrophobicContact CG1-CE 4.08Å; I584-M590 HydrophobicContact CG1-SD 3.74Å; I584-M590 HydrophobicContact CG2-SD 3.69Å
591	L	93.1	Very high	91.3	Very high	58 Å²	58	27 Å²	27	30%	0.304	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	116.7	176.6	168.5	64.7	0	0	0	109.9	T531 K533 V582 V583 V593	T531-L591 HydrophobicContact CG2-CD1 4.02Å; K533-L591 HydrophobicContact CG-CD1 3.78Å; V582-L591 WeakPolarHBondContact CG1-O 3.47Å; V583-L591 HydrophobicContact CB-CB 4.36Å; V583-L591 PolarHBondContact N-O 3.28Å; V583-L591 PolarHBondContact O-N 3.19Å; L591-V593 HydrophobicContact CD1-CG2 3.76Å; L591-V593 HydrophobicContact CG-CG2 4.12Å
592	W	93.5	Very high	91.5	Very high	11 Å²	11	25.7 Å²	25.7	4%	0.042	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	129.7	174.3	-173.5	36.9	0	0	0	110.7	L532 W534 T556 V576 S580 V582 P594	L532-W592 HydrophobicContact CB-CB 4.47Å; L532-W592 HydrophobicContact CD1-CE3 3.99Å; L532-W592 HydrophobicContact CD2-CE3 4.3Å; L532-W592 PolarHBondContact N-O 3.25Å; L532-W592 PolarHBondContact O-N 2.72Å; W534-W592 HydrophobicContact CH2-CB 3.91Å; W534-W592 HydrophobicContact CZ3-CB 3.71Å; T556-W592 HydrophobicContact CG2-CZ2 4.05Å; V576-W592 HydrophobicContact CG2-CH2 3.93Å; V576-W592 HydrophobicContact CG2-CZ2 3.95Å; S580-W592 VanDerWaalsContact O-CD1 3.32Å; S580-W592 PolarHBondContact O-NE1 3.38Å; V582-W592 HydrophobicContact CG1-CB 4.32Å; V582-W592 HydrophobicContact CG2-CB 4.02Å; V582-W592 HydrophobicContact CG2-CG 3.91Å; W592-P594 HydrophobicContact CD2-CG 3.93Å; W592-P594 HydrophobicContact CE3-CG 4.21Å; W592-P594 HydrophobicContact CH2-CB 4.47Å; W592-P594 HydrophobicContact CH2-CG 4.13Å; W592-P594 HydrophobicContact CZ2-CB 3.81Å; W592-P594 HydrophobicContact CZ2-CG 3.84Å; W592-P594 HydrophobicContact CZ3-CG 4.31Å
593	V	91	Very high	91.4	Very high	45 Å²	45	32.6 Å²	32.6	27%	0.273	17%	0.174	S	C	.	.			trans	-127.7	75.8	-179.5	-170.4	0	0	0	0	111.3	W529 L530 S580 L591	W529-V593 HydrophobicContact CB-CG1 4.05Å; W529-V593 HydrophobicContact CE3-CG1 4.42Å; L530-V593 VanDerWaalsContact O-CA 3.27Å; L530-V593 WeakPolarHBondContact O-CA 3.45Å; S580-V593 VanDerWaalsContact OG-C 3.26Å; S580-V593 PolarHBondContact OG-O 2.77Å; L591-V593 HydrophobicContact CD1-CG2 3.76Å; L591-V593 HydrophobicContact CG-CG2 4.12Å
594	P	91.2	Very high	91.3	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.166	C	C	.	.			trans	-78	127.1	176.4	29.8	-33.1	0	0	0	112	L530 L532 V576 S580 W592	L530-P594 HydrophobicContact CB-CG 4.12Å; L530-P594 PolarHBondContact N-O 2.79Å; L530-P594 WeakPolarHBondContact O-CD 3.39Å; L532-P594 HydrophobicContact CD1-CG 4.06Å; V576-P594 HydrophobicContact CB-CB 4.08Å; V576-P594 HydrophobicContact CG1-CB 4.18Å; V576-P594 HydrophobicContact CG1-CG 4.09Å; V576-P594 HydrophobicContact CG2-CB 3.93Å; V576-P594 HydrophobicContact CG2-CG 4.49Å; S580-P594 WeakPolarHBondContact OG-CA 3.5Å; W592-P594 HydrophobicContact CD2-CG 3.93Å; W592-P594 HydrophobicContact CE3-CG 4.21Å; W592-P594 HydrophobicContact CH2-CB 4.47Å; W592-P594 HydrophobicContact CH2-CG 4.13Å; W592-P594 HydrophobicContact CZ2-CB 3.81Å; W592-P594 HydrophobicContact CZ2-CG 3.84Å; W592-P594 HydrophobicContact CZ3-CG 4.31Å
595	P	88.7	Confident	91.1	Very high	16 Å²	16	34.7 Å²	34.7	10%	0.104	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	125.9	167.4	30.3	-30.1	0	0	0	109.9	W529 F578	W529-P595 HydrophobicContact CG-CB 4.45Å; F578-P595 HydrophobicContact CB-CG 3.87Å; F578-P595 HydrophobicContact CD1-CG 4Å; F578-P595 HydrophobicContact CG-CG 4.33Å; F578-P595 PolarHBondContact N-O 2.99Å
596	A	88.4	Confident	90.9	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	-134	138.6	-175.4	0	0	0	0	0	111.5	V528 V576 Y598	V528-A596 WeakPolarHBondContact CG2-O 3.46Å; V528-A596 PolarHBondContact N-O 2.04Å; V528-A596 PolarHBondContact O-N 2.92Å; V528-A596 VanDerWaalsContact O-O 3.07Å; V576-A596 HydrophobicContact CB-CB 4.2Å; V576-A596 HydrophobicContact CG1-CB 4.19Å; A596-Y598 HydrophobicContact CB-CD2 4.11Å; A596-Y598 HydrophobicContact CB-CE2 3.54Å
597	I	89.1	Confident	90.8	Very high	19 Å²	19	34 Å²	34	10%	0.097	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	110.6	171.7	-64.1	147.1	0	0	0	108	S102 A103 I515 T526 N527 S577	S102-I597 WeakPolarHBondContact O-CD1 3.48Å; A103-I597 HydrophobicContact CB-CG2 4.46Å; I515-I597 HydrophobicContact CD1-CG2 4.07Å; T526-I597 CarbonylContact O-C 3.54Å; T526-I597 VanDerWaalsContact O-CA 3.3Å; T526-I597 WeakPolarHBondContact O-CA 3.41Å; N527-I597 HydrophobicContact CB-CG1 4.45Å; S577-I597 PolarHBondContact OG-N 3.28Å
598	Y	90.9	Very high	90.7	Very high	4 Å²	4	32.7 Å²	32.7	2%	0.016	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	142.2	-179.8	-75.8	-62.9	0	0	0	112.3	H525 T526 V528 L530 L566 A596 F620	H525-Y598 WeakPolarHBondContact CA-O 3.46Å; T526-Y598 PolarHBondContact N-O 3.28Å; T526-Y598 PolarHBondContact O-N 2.83Å; V528-Y598 HydrophobicContact CG2-CD2 3.59Å; V528-Y598 HydrophobicContact CG2-CE2 3.95Å; L530-Y598 HydrophobicContact CD1-CE2 4.31Å; L530-Y598 HydrophobicContact CD2-CE2 4.11Å; L530-Y598 HydrophobicContact CG-CE2 4.47Å; L566-Y598 HydrophobicContact CB-CD1 3.97Å; L566-Y598 HydrophobicContact CB-CE1 3.95Å; L566-Y598 HydrophobicContact CD2-CD1 3.63Å; L566-Y598 HydrophobicContact CD2-CE1 4.45Å; L566-Y598 HydrophobicContact CD2-CG 3.84Å; L566-Y598 HydrophobicContact CG-CD1 4.44Å; A596-Y598 HydrophobicContact CB-CD2 4.11Å; A596-Y598 HydrophobicContact CB-CE2 3.54Å; Y598-F620 HydrophobicContact CD2-CE1 4.29Å; Y598-F620 AromaticContact CD2-CZ 3.95Å; Y598-F620 HydrophobicContact CD2-CZ 3.95Å; Y598-F620 AromaticContact CE2-CE1 3.7Å; Y598-F620 HydrophobicContact CE2-CE1 3.7Å; Y598-F620 AromaticContact CE2-CZ 3.75Å; Y598-F620 HydrophobicContact CE2-CZ 3.75Å; Y598-F620 AromaticContact CZ-CE1 3.88Å
599	K	91.8	Very high	90.6	Very high	46 Å²	46	32.9 Å²	32.9	20%	0.2	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	90.3	172.3	-62.4	-178.2	-164	145	0	107.9	I523 M524 N569 A570 D571	I523-K599 HydrophobicContact CG2-CB 3.78Å; I523-K599 HydrophobicContact CG2-CG 4.48Å; M524-K599 CarbonylContact O-C 3.58Å; M524-K599 WeakPolarHBondContact O-CA 3.19Å; N569-K599 PolarHBondContact OD1-O 3.31Å; A570-K599 PolarHBondContact N-O 2.97Å; D571-K599 HydrophobicContact CB-CB 4.3Å; D571-K599 HydrophobicContact CB-CD 3.98Å; D571-K599 WeakPolarHBondContact OD1-CD 3.44Å; D571-K599 IonicContact OD1-NZ 2.8Å; D571-K599 PolarHBondContact OD1-NZ 3.02Å; D571-K599 IonicContact OD2-NZ 3.92Å; D571-K599 PolarHBondContact OD2-NZ 3.48Å
600	S	93.3	Very high	90.3	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	142.9	-178.1	87.9	0	0	0	0	111.8	I523 M524 T617 L618	I523-S600 CarbonylContact C-O 3.57Å; I523-S600 WeakPolarHBondContact CA-O 3.39Å; M524-S600 PolarHBondContact N-O 3.26Å; M524-S600 PolarHBondContact O-N 3.02Å; S600-T617 PolarHBondContact OG-O 2.99Å; S600-L618 VanDerWaalsContact CB-CD2 3.47Å
601	S	92.3	Very high	90.1	Very high	56 Å²	56	30.8 Å²	30.8	39%	0.392	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	127.4	171.2	52.3	0	0	0	0	109.9	N568	N568-S601 PolarHBondContact ND2-O 2.95Å; N568-S601 VanDerWaalsContact ND2-O 3.14Å; N568-S601 PolarHBondContact O-N 3.45Å; N568-S601 PolarHBondContact O-OG 2.78Å
602	C	92.9	Very high	89.9	Confident	6 Å²	6	28.2 Å²	28.2	4%	0.041	14%	0.144	C	C	.	.			trans	-139.3	122.8	-177.6	179.2	0	0	0	0	110.5	Q522 M524 I604 C616	Q522-C602 WeakPolarHBondContact CB-O 3.38Å; Q522-C602 PolarHBondContact O-N 3.26Å; M524-C602 HydrophobicContact CB-CB 4.45Å; C602-I604 HydrophobicContact CB-CD1 4.14Å; C602-I604 WeakPolarHBondContact O-CD1 3.27Å; C602-I604 PolarHBondContact O-N 3.15Å; C602-I604 VanDerWaalsContact SG-CD1 3.54Å; C602-C616 HydrophobicContact CB-CB 3.74Å; C602-C616 WeakPolarHBondContact CB-SG 3.08Å; C602-C616 WeakPolarHBondContact SG-CA 3.45Å; C602-C616 WeakPolarHBondContact SG-CB 3.23Å; C602-C616 CovalentContact SG-SG 2.03Å; C602-C616 PolarHBondContact SG-SG 3.43Å
603	I	89.9	Confident	89.8	Confident	146 Å²	146	29.9 Å²	29.9	75%	0.749	15%	0.153	S	C	*	.			trans	-78.3	115	178.7	-57.4	174.9	0	0	0	108.7
604	I	89.5	Confident	89.9	Confident	3 Å²	3	27.9 Å²	27.9	2%	0.015	14%	0.141	C	C	.	.			trans	-92.1	123.9	-175.9	-54.4	-45.7	0	0	0	109.9	L517 E519 C602 V606 Q614	L517-I604 HydrophobicContact CD1-CD1 4.1Å; L517-I604 HydrophobicContact CD2-CD1 3.58Å; L517-I604 HydrophobicContact CD2-CG1 3.95Å; L517-I604 HydrophobicContact CG-CD1 4.1Å; E519-I604 HydrophobicContact CB-CG2 4.28Å; E519-I604 HydrophobicContact CG-CG2 4.17Å; C602-I604 HydrophobicContact CB-CD1 4.14Å; C602-I604 WeakPolarHBondContact O-CD1 3.27Å; C602-I604 PolarHBondContact O-N 3.15Å; C602-I604 VanDerWaalsContact SG-CD1 3.54Å; I604-V606 HydrophobicContact CG2-CG1 4.33Å; I604-Q614 HydrophobicContact CD1-CG 4.44Å; I604-Q614 HydrophobicContact CG2-CG 4.39Å
605	D	88.6	Confident	90	Very high	68 Å²	68	31.6 Å²	31.6	36%	0.364	16%	0.163	S	C	.	.			trans	-89.3	122.9	169.3	-175.2	15.6	0	0	0	110.2	E607 Q614 T737	D605-E607 PolarHBondContact OD1-N 2.92Å; D605-Q614 PolarHBondContact O-NE2 3.45Å; D605-T737 PolarHBondContact OD1-OG1 3.42Å
606	V	88.1	Confident	90.4	Very high	3 Å²	3	30.9 Å²	30.9	2%	0.018	16%	0.158	C	C	.	.			trans	-97.9	-0.9	-177.5	-62.3	0	0	0	0	112.9	I604 Y608 F609 L731 P732 P739	I604-V606 HydrophobicContact CG2-CG1 4.33Å; V606-Y608 VanDerWaalsContact C-N 3.32Å; V606-Y608 PolarHBondContact O-N 3.12Å; V606-F609 WeakPolarHBondContact O-CB 3.48Å; V606-F609 PolarHBondContact O-N 3.08Å; V606-F609 VanDerWaalsContact O-N 3.14Å; V606-L731 HydrophobicContact CG1-CD2 4.37Å; V606-P732 HydrophobicContact CG1-CG 3.98Å; V606-P739 HydrophobicContact CB-CB 4.18Å; V606-P739 HydrophobicContact CG2-CB 4.1Å; V606-P739 HydrophobicContact CG2-CG 4.23Å; V606-P739 WeakPolarHBondContact O-CA 3.48Å; V606-P739 VanDerWaalsContact O-CB 3.22Å; V606-P739 WeakPolarHBondContact O-CB 2.99Å
607	E	88.4	Confident	90.6	Very high	53 Å²	53	32.9 Å²	32.9	25%	0.248	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-46.5	-170.9	178.2	151.7	-114.4	0	0	112.9	D605 T737 L740 K743	D605-E607 PolarHBondContact OD1-N 2.92Å; E607-T737 HydrophobicContact CB-CG2 4.41Å; E607-L740 WeakPolarHBondContact O-CB 2.9Å; E607-L740 PolarHBondContact O-N 3.33Å; E607-K743 IonicContact OE1-NZ 2.64Å; E607-K743 PolarHBondContact OE1-NZ 3.1Å
608	Y	88.9	Confident	90.9	Very high	86 Å²	86	32 Å²	32	34%	0.337	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	8.8	-175.7	-62.7	-77.6	0	0	0	115	V606 F611 L740 S921 A922	V606-Y608 VanDerWaalsContact C-N 3.32Å; V606-Y608 PolarHBondContact O-N 3.12Å; Y608-F611 CarbonylContact O-C 3.54Å; Y608-F611 WeakPolarHBondContact O-CA 3.44Å; Y608-F611 PolarHBondContact O-N 2.96Å; Y608-L740 HydrophobicContact CD1-CD2 4.45Å; Y608-S921 WeakPolarHBondContact CE1-O 3.37Å; Y608-A922 HydrophobicContact CD1-CB 4.26Å
609	F	87.2	Confident	90.9	Very high	4 Å²	4	33.8 Å²	33.8	2%	0.018	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	131.4	-177.4	176.6	-87.9	0	0	0	112.7	V606 D612 Y681 L685 I730 L731	V606-F609 WeakPolarHBondContact O-CB 3.48Å; V606-F609 PolarHBondContact O-N 3.08Å; V606-F609 VanDerWaalsContact O-N 3.14Å; F609-D612 WeakPolarHBondContact CA-OD1 3.43Å; F609-Y681 HydrophobicContact CE1-CD1 4.44Å; F609-Y681 HydrophobicContact CE2-CE1 4.37Å; F609-Y681 AromaticContact CZ-CD1 3.72Å; F609-Y681 HydrophobicContact CZ-CD1 3.72Å; F609-Y681 AromaticContact CZ-CE1 3.79Å; F609-Y681 HydrophobicContact CZ-CE1 3.79Å; F609-Y681 HydrophobicContact CZ-CG 4.19Å; F609-L685 HydrophobicContact CE1-CD2 4.44Å; F609-I730 HydrophobicContact CZ-CG2 4.14Å; F609-L731 HydrophobicContact CB-CD2 4.49Å; F609-L731 HydrophobicContact CD1-CD1 4.11Å; F609-L731 HydrophobicContact CD1-CD2 3.86Å; F609-L731 HydrophobicContact CD1-CG 4.46Å; F609-L731 HydrophobicContact CD2-CD2 3.7Å; F609-L731 HydrophobicContact CE1-CD1 4.47Å; F609-L731 HydrophobicContact CE1-CD2 3.93Å; F609-L731 HydrophobicContact CE1-CG 4.46Å; F609-L731 HydrophobicContact CE2-CD2 3.76Å; F609-L731 HydrophobicContact CG-CD1 4.49Å; F609-L731 HydrophobicContact CG-CD2 3.74Å; F609-L731 HydrophobicContact CZ-CD2 3.87Å
610	P	87.5	Confident	91	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.006	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	cis	-99.2	25.9	9.3	40.9	-38.3	0	0	0	114.6	D612 R676 S678 Y681 I686	P610-D612 VanDerWaalsContact C-OD1 3.29Å; P610-D612 WeakPolarHBondContact CA-OD1 3.39Å; P610-R676 WeakPolarHBondContact O-CD 3.47Å; P610-S678 VanDerWaalsContact O-CB 3.24Å; P610-S678 WeakPolarHBondContact O-CB 3.48Å; P610-Y681 HydrophobicContact CB-CD2 4.04Å; P610-Y681 HydrophobicContact CB-CG 3.9Å; P610-I686 HydrophobicContact CG-CD1 4.01Å
611	F	88.1	Confident	90.9	Very high	21 Å²	21	31.6 Å²	31.6	9%	0.092	17%	0.166	C	C	.	.	S	Bend	trans	-104.9	27.8	176.8	-53.9	-79.6	0	0	0	111.5	Y608 I686 A922 V925	Y608-F611 CarbonylContact O-C 3.54Å; Y608-F611 WeakPolarHBondContact O-CA 3.44Å; Y608-F611 PolarHBondContact O-N 2.96Å; F611-I686 HydrophobicContact CE2-CD1 3.75Å; F611-I686 HydrophobicContact CZ-CD1 3.83Å; F611-A922 HydrophobicContact CB-CB 4.18Å; F611-A922 HydrophobicContact CD2-CB 4Å; F611-A922 HydrophobicContact CG-CB 4.32Å; F611-V925 HydrophobicContact CD1-CB 4.44Å; F611-V925 HydrophobicContact CD1-CG2 3.83Å; F611-V925 HydrophobicContact CD2-CG2 3.83Å; F611-V925 HydrophobicContact CE1-CB 4.38Å; F611-V925 HydrophobicContact CE1-CG1 4.43Å; F611-V925 HydrophobicContact CE1-CG2 3.93Å; F611-V925 HydrophobicContact CE2-CG2 3.93Å; F611-V925 HydrophobicContact CG-CG2 3.79Å; F611-V925 HydrophobicContact CZ-CG2 3.98Å
612	D	89.4	Confident	90.8	Very high	4 Å²	4	29.6 Å²	29.6	2%	0.021	15%	0.152	C	C	.	.			trans	-80.2	150.4	-172.7	51.4	-61.8	0	0	0	114.1	F609 P610 Q614 R676	F609-D612 WeakPolarHBondContact CA-OD1 3.43Å; P610-D612 VanDerWaalsContact C-OD1 3.29Å; P610-D612 WeakPolarHBondContact CA-OD1 3.39Å; D612-Q614 PolarHBondContact OD2-NE2 3.09Å; D612-R676 VanDerWaalsContact CG-NE 3.3Å; D612-R676 PolarHBondContact O-N 2.82Å; D612-R676 VanDerWaalsContact O-N 3.09Å; D612-R676 WeakPolarHBondContact OD1-CD 3.2Å; D612-R676 IonicContact OD1-CZ 2.85Å; D612-R676 IonicContact OD1-NE 3.5Å; D612-R676 PolarHBondContact OD1-NE 2.9Å; D612-R676 IonicContact OD1-NH2 3.16Å; D612-R676 IonicContact OD2-CZ 3.87Å; D612-R676 IonicContact OD2-NE 2.64Å; D612-R676 PolarHBondContact OD2-NE 2.85Å; D612-R676 VanDerWaalsContact OD2-NE 3.08Å; D612-R676 IonicContact OD2-NH2 3.82Å; D612-R676 PolarHBondContact OD2-NH2 3.33Å
613	E	91.1	Very high	90.6	Very high	46 Å²	46	36.5 Å²	36.5	22%	0.215	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	141.3	164.2	-73.9	176.8	-156.5	0	0	108.7	R673 V674 R675 N924	E613-R673 IonicContact OE2-CZ 2.68Å; E613-R673 IonicContact OE2-NE 3.97Å; E613-R673 PolarHBondContact OE2-NE 3.16Å; E613-R673 IonicContact OE2-NH2 2.72Å; E613-R673 PolarHBondContact OE2-NH2 3.04Å; E613-V674 CarbonylContact C-O 3.6Å; E613-V674 WeakPolarHBondContact CA-O 3.5Å; E613-R675 HydrophobicContact CG-CB 3.92Å; E613-R675 HydrophobicContact CG-CG 3.85Å; E613-R675 IonicContact OE1-CZ 3.02Å; E613-R675 IonicContact OE1-NE 3.84Å; E613-R675 PolarHBondContact OE1-NE 2.68Å; E613-R675 IonicContact OE1-NH2 2.74Å; E613-R675 PolarHBondContact OE1-NH2 2.81Å; E613-N924 PolarHBondContact OE1-ND2 2.99Å
614	Q	93.2	Very high	90.3	Very high	4 Å²	4	33.9 Å²	33.9	2%	0.019	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	142.5	178.7	-51.2	-59.5	-25.1	0	0	109.4	L517 I604 D605 D612 W652 R673 V674	L517-Q614 HydrophobicContact CD1-CB 4.09Å; L517-Q614 HydrophobicContact CD1-CG 4.18Å; I604-Q614 HydrophobicContact CD1-CG 4.44Å; I604-Q614 HydrophobicContact CG2-CG 4.39Å; D605-Q614 PolarHBondContact O-NE2 3.45Å; D612-Q614 PolarHBondContact OD2-NE2 3.09Å; Q614-W652 HydrophobicContact CG-CH2 3.7Å; Q614-W652 HydrophobicContact CG-CZ3 3.88Å; Q614-R673 WeakPolarHBondContact O-CA 3.31Å; Q614-V674 HydrophobicContact CB-CG2 3.93Å; Q614-V674 PolarHBondContact N-O 2.81Å; Q614-V674 PolarHBondContact O-N 3.15Å
615	V	93.7	Very high	90.2	Very high	78 Å²	78	36.5 Å²	36.5	47%	0.473	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	99.8	174.4	-179.9	0	0	0	0	107.8	R671 R673	V615-R671 HydrophobicContact CG1-CB 4.44Å; V615-R673 HydrophobicContact CG2-CB 4.28Å; V615-R673 HydrophobicContact CG2-CG 3.99Å
616	C	95.4	Very high	89.9	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	141.7	179.9	-66.5	0	0	0	0	111	M524 C602 I672	M524-C616 HydrophobicContact CB-CB 4.38Å; M524-C616 HydrophobicContact CE-CB 3.83Å; M524-C616 HydrophobicContact SD-CB 3.46Å; M524-C616 WeakPolarHBondContact SD-CB 3.44Å; C602-C616 HydrophobicContact CB-CB 3.74Å; C602-C616 WeakPolarHBondContact CB-SG 3.08Å; C602-C616 WeakPolarHBondContact SG-CA 3.45Å; C602-C616 WeakPolarHBondContact SG-CB 3.23Å; C602-C616 CovalentContact SG-SG 2.03Å; C602-C616 PolarHBondContact SG-SG 3.43Å; C616-I672 PolarHBondContact N-O 3.07Å; C616-I672 PolarHBondContact O-N 3.42Å
617	T	94.3	Very high	89.6	Confident	42 Å²	42	41.6 Å²	41.6	26%	0.258	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	149.4	-177.2	65.2	0	0	0	0	112.5	N568 S600 F670 R671	N568-T617 PolarHBondContact ND2-O 3.32Å; S600-T617 PolarHBondContact OG-O 2.99Å; T617-F670 CarbonylContact C-O 3.55Å; T617-F670 VanDerWaalsContact CA-O 3.25Å; T617-F670 WeakPolarHBondContact CA-O 3.45Å; T617-R671 HydrophobicContact CG2-CG 4.13Å
618	L	93.8	Very high	89.2	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	110.7	167.2	-62.4	171.3	0	0	0	107.6	L509 M524 L566 S600 F620 E669 F670 I672	L509-L618 HydrophobicContact CD2-CD1 3.69Å; M524-L618 HydrophobicContact CE-CD1 4.33Å; M524-L618 HydrophobicContact CE-CD2 3.88Å; M524-L618 HydrophobicContact CE-CG 3.97Å; L566-L618 HydrophobicContact CD1-CB 3.99Å; L566-L618 HydrophobicContact CD1-CD2 3.9Å; L566-L618 HydrophobicContact CD2-CD2 4.22Å; S600-L618 VanDerWaalsContact CB-CD2 3.47Å; L618-F620 HydrophobicContact CB-CD2 4.26Å; L618-F620 HydrophobicContact CB-CE2 3.76Å; L618-F620 HydrophobicContact CD1-CE2 4.42Å; L618-E669 WeakPolarHBondContact O-CA 3.26Å; L618-F670 HydrophobicContact CB-CB 4.33Å; L618-F670 PolarHBondContact N-O 2.88Å; L618-F670 PolarHBondContact O-N 3.33Å; L618-I672 HydrophobicContact CD1-CD1 3.83Å
619	L	92.9	Very high	89.1	Confident	42 Å²	42	45.9 Å²	45.9	22%	0.22	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	101.2	-177.4	-178.7	62.9	0	0	0	110.6	F567 N568 R667 E669	F567-L619 HydrophobicContact CB-CB 4.33Å; F567-L619 HydrophobicContact CB-CD2 3.94Å; F567-L619 HydrophobicContact CB-CG 4.06Å; F567-L619 HydrophobicContact CD2-CG 4.33Å; F567-L619 PolarHBondContact N-O 2.82Å; N568-L619 PolarHBondContact OD1-N 3.22Å; L619-R667 HydrophobicContact CD1-CB 4.13Å; L619-E669 HydrophobicContact CD1-CB 4.1Å; L619-E669 HydrophobicContact CD1-CG 4.46Å
620	F	93.6	Very high	89.1	Confident	0 Å²	0	46 Å²	46	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	152.1	178.3	-69.9	-80.1	0	0	0	112.6	F507 L509 L530 I564 V565 L566 Y598 L618 R667 M668 F670	F507-F620 HydrophobicContact CE1-CB 4.29Å; F507-F620 HydrophobicContact CE1-CD2 4.04Å; F507-F620 HydrophobicContact CE1-CG 4.14Å; F507-F620 HydrophobicContact CZ-CB 4.1Å; F507-F620 HydrophobicContact CZ-CD1 4Å; F507-F620 HydrophobicContact CZ-CD2 4.04Å; F507-F620 HydrophobicContact CZ-CE1 4.43Å; F507-F620 HydrophobicContact CZ-CE2 4.45Å; F507-F620 AromaticContact CZ-CG 3.79Å; F507-F620 HydrophobicContact CZ-CG 3.79Å; L509-F620 HydrophobicContact CD1-CE2 3.92Å; L509-F620 HydrophobicContact CD1-CZ 4.15Å; L509-F620 HydrophobicContact CD2-CE2 4.41Å; L530-F620 HydrophobicContact CD1-CE1 4.38Å; L530-F620 HydrophobicContact CD2-CE1 4.14Å; L530-F620 HydrophobicContact CD2-CZ 3.94Å; I564-F620 HydrophobicContact CG2-CB 4.02Å; I564-F620 HydrophobicContact CG2-CD1 4.15Å; V565-F620 WeakPolarHBondContact O-CA 3.39Å; L566-F620 HydrophobicContact CB-CD1 4.44Å; L566-F620 HydrophobicContact CB-CE1 4.1Å; L566-F620 HydrophobicContact CD1-CE1 4.23Å; L566-F620 HydrophobicContact CD1-CE2 4.27Å; L566-F620 HydrophobicContact CD1-CZ 4.11Å; Y598-F620 HydrophobicContact CD2-CE1 4.29Å; Y598-F620 AromaticContact CD2-CZ 3.95Å; Y598-F620 HydrophobicContact CD2-CZ 3.95Å; Y598-F620 AromaticContact CE2-CE1 3.7Å; Y598-F620 HydrophobicContact CE2-CE1 3.7Å; Y598-F620 AromaticContact CE2-CZ 3.75Å; Y598-F620 HydrophobicContact CE2-CZ 3.75Å; Y598-F620 AromaticContact CZ-CE1 3.88Å; L618-F620 HydrophobicContact CB-CD2 4.26Å; L618-F620 HydrophobicContact CB-CE2 3.76Å; L618-F620 HydrophobicContact CD1-CE2 4.42Å; F620-R667 CarbonylContact O-C 3.6Å; F620-R667 VanDerWaalsContact O-CA 3.3Å; F620-R667 WeakPolarHBondContact O-CA 3.46Å; F620-M668 PolarHBondContact N-O 3.41Å; F620-M668 PolarHBondContact O-N 2.66Å; F620-F670 AromaticContact CD2-CD2 3.9Å; F620-F670 HydrophobicContact CD2-CD2 3.9Å; F620-F670 AromaticContact CD2-CE2 3.93Å; F620-F670 HydrophobicContact CD2-CE2 3.93Å; F620-F670 HydrophobicContact CE2-CD2 4.3Å; F620-F670 HydrophobicContact CE2-CE2 4.49Å
621	G	91.1	Very high	89.2	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	173.6	174.9	166.7	0	0	0	0	0	111.4	I564 V565	I564-G621 WeakPolarHBondContact CA-O 3.5Å; V565-G621 PolarHBondContact N-O 2.83Å; V565-G621 PolarHBondContact O-N 2.89Å
622	S	90.1	Very high	89.4	Confident	15 Å²	15	47.2 Å²	47.2	11%	0.105	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	145.1	172.8	175.2	0	0	0	0	110.9	D563 F567 T624 Y625	D563-S622 VanDerWaalsContact CG-OG 3.27Å; D563-S622 VanDerWaalsContact OD1-CB 3.29Å; D563-S622 WeakPolarHBondContact OD1-CB 3.42Å; D563-S622 PolarHBondContact OD1-OG 2.72Å; D563-S622 PolarHBondContact OD2-OG 3.03Å; F567-S622 WeakPolarHBondContact CZ-O 3.03Å; S622-T624 PolarHBondContact OG-N 3.26Å; S622-Y625 WeakPolarHBondContact OG-CB 3.28Å; S622-Y625 PolarHBondContact OG-N 3.21Å
623	W	87.1	Confident	89.5	Confident	150 Å²	150	47.9 Å²	47.9	57%	0.568	24%	0.239	S	C	*	.	S	Bend	trans	-85.8	-35.7	174.4	-170.3	-107.4	0	0	0	112.5	D563 V565 F567	D563-W623 PolarHBondContact O-N 2.91Å; D563-W623 WeakPolarHBondContact OD2-CB 3.39Å; D563-W623 PolarHBondContact OD2-N 2.94Å; D563-W623 VanDerWaalsContact OD2-N 3.08Å; V565-W623 HydrophobicContact CG2-CB 3.86Å; V565-W623 HydrophobicContact CG2-CD2 4.28Å; V565-W623 HydrophobicContact CG2-CE3 3.7Å; V565-W623 HydrophobicContact CG2-CG 4.39Å; F567-W623 HydrophobicContact CD1-CE3 4.09Å; F567-W623 AromaticContact CD1-CZ3 3.79Å; F567-W623 HydrophobicContact CD1-CZ3 3.79Å; F567-W623 AromaticContact CE1-CE3 3.54Å; F567-W623 HydrophobicContact CE1-CE3 3.54Å; F567-W623 AromaticContact CE1-CZ3 3.62Å; F567-W623 HydrophobicContact CE1-CZ3 3.62Å; F567-W623 HydrophobicContact CZ-CE3 4.16Å
624	T	85.3	Confident	89.4	Confident	91 Å²	91	47.2 Å²	47.2	56%	0.558	24%	0.235	S	C	*	.	S	Bend	trans	-112.6	-31	-170.1	60	0	0	0	0	114.9	D563 S622	D563-T624 WeakPolarHBondContact OD2-CB 3.4Å; D563-T624 PolarHBondContact OD2-N 3.34Å; D563-T624 PolarHBondContact OD2-OG1 3Å; S622-T624 PolarHBondContact OG-N 3.26Å
625	Y	86.4	Confident	89.1	Confident	59 Å²	59	48 Å²	48	23%	0.231	24%	0.24	C	C	.	.			trans	-90.1	145.4	-179.4	-59.1	-73.9	0	0	0	112.3	L493 W560 D563 S622 E629 I630	L493-Y625 HydrophobicContact CB-CE1 4.5Å; L493-Y625 HydrophobicContact CD1-CE1 4.41Å; L493-Y625 HydrophobicContact CD2-CE1 4.23Å; W560-Y625 AromaticContact CZ2-CE2 3.93Å; W560-Y625 HydrophobicContact CZ2-CE2 3.93Å; W560-Y625 PolarHBondContact NE1-OH 3.44Å; D563-Y625 WeakPolarHBondContact OD1-CD2 3.25Å; S622-Y625 WeakPolarHBondContact OG-CB 3.28Å; S622-Y625 PolarHBondContact OG-N 3.21Å; Y625-E629 HydrophobicContact CD1-CB 4.17Å; Y625-I630 HydrophobicContact CD2-CD1 3.39Å; Y625-I630 HydrophobicContact CD2-CG1 4.23Å; Y625-I630 HydrophobicContact CE2-CD1 4.05Å; Y625-I630 HydrophobicContact CG-CD1 3.76Å; Y625-I630 HydrophobicContact CG-CG1 4.08Å
626	N	82.7	Confident	88.4	Confident	103 Å²	103	49.8 Å²	49.8	55%	0.551	25%	0.247	S	C	*	.			trans	-95.2	172.1	-177.1	-60.2	-86.2	0	0	0	112.5	Q628 E629 I630	N626-Q628 PolarHBondContact O-N 2.99Å; N626-E629 WeakPolarHBondContact CB-OE2 3.49Å; N626-E629 PolarHBondContact N-OE2 3.01Å; N626-E629 PolarHBondContact ND2-OE2 3.42Å; N626-E629 PolarHBondContact O-N 3.15Å; N626-I630 PolarHBondContact O-N 3.29Å
627	E	81.7	Confident	87.6	Confident	74 Å²	74	52.6 Å²	52.6	35%	0.346	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-9.6	174.2	60.8	-173.2	-161	0	0	115	Q664	E627-Q664 PolarHBondContact OE1-NE2 3.34Å; E627-Q664 PolarHBondContact OE2-NE2 3.21Å
628	Q	80.8	Confident	86.9	Confident	162 Å²	162	52.5 Å²	52.5	76%	0.757	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	-7.1	174.1	-61.8	-176.7	5	0	0	113.5	N626	N626-Q628 PolarHBondContact O-N 2.99Å
629	E	85.3	Confident	86.5	Confident	68 Å²	68	58.4 Å²	58.4	32%	0.318	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.7	-45.2	-173.5	-65.4	167.2	104.6	0	0	111.2	P502 L503 Y625 N626	P502-E629 WeakPolarHBondContact CB-O 3.07Å; L503-E629 PolarHBondContact N-O 3.21Å; Y625-E629 HydrophobicContact CD1-CB 4.17Å; N626-E629 WeakPolarHBondContact CB-OE2 3.49Å; N626-E629 PolarHBondContact N-OE2 3.01Å; N626-E629 PolarHBondContact ND2-OE2 3.42Å; N626-E629 PolarHBondContact O-N 3.15Å
630	I	87.9	Confident	86.2	Confident	6 Å²	6	56.6 Å²	56.6	3%	0.031	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	129.4	173.6	-59.4	-174.8	0	0	0	109.7	L493 L503 L505 W560 Y625 N626 L632	L493-I630 HydrophobicContact CD1-CD1 4.43Å; L493-I630 HydrophobicContact CD1-CG1 4.46Å; L503-I630 HydrophobicContact CB-CG1 4.39Å; L503-I630 WeakPolarHBondContact O-CA 3.34Å; L505-I630 HydrophobicContact CB-CG2 3.96Å; L505-I630 HydrophobicContact CD2-CG2 4.25Å; W560-I630 HydrophobicContact CH2-CD1 4.12Å; W560-I630 HydrophobicContact CZ2-CD1 4.31Å; Y625-I630 HydrophobicContact CD2-CD1 3.39Å; Y625-I630 HydrophobicContact CD2-CG1 4.23Å; Y625-I630 HydrophobicContact CE2-CD1 4.05Å; Y625-I630 HydrophobicContact CG-CD1 3.76Å; Y625-I630 HydrophobicContact CG-CG1 4.08Å; N626-I630 PolarHBondContact O-N 3.29Å; I630-L632 HydrophobicContact CG2-CD2 4.42Å
631	I	90.3	Very high	86.1	Confident	46 Å²	46	56.7 Å²	56.7	24%	0.236	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	128.5	169.7	-73	-175.9	0	0	0	108.8	P502 L503 L504 L505 K665	P502-I631 HydrophobicContact CB-CD1 4.41Å; P502-I631 HydrophobicContact CB-CG1 4.16Å; P502-I631 HydrophobicContact CG-CD1 3.5Å; P502-I631 VanDerWaalsContact CG-CD1 3.5Å; P502-I631 HydrophobicContact CG-CG1 3.78Å; L503-I631 PolarHBondContact O-N 3.09Å; L504-I631 HydrophobicContact CD1-CG2 4.08Å; L505-I631 PolarHBondContact N-O 3.29Å; I631-K665 HydrophobicContact CG2-CB 3.91Å; I631-K665 HydrophobicContact CG2-CD 4.12Å
632	L	91.1	Very high	86	Confident	2 Å²	2	59.2 Å²	59.2	1%	0.01	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	140.2	172.9	-54.8	-180	0	0	0	111	L505 I564 I630 L661 K665 M668	L505-L632 HydrophobicContact CB-CD2 4.26Å; L505-L632 HydrophobicContact CD2-CD2 3.87Å; L505-L632 HydrophobicContact CG-CD2 4.27Å; L505-L632 WeakPolarHBondContact O-CA 3.25Å; I564-L632 HydrophobicContact CD1-CD2 4.13Å; I630-L632 HydrophobicContact CG2-CD2 4.42Å; L632-L661 VanDerWaalsContact O-CD2 3.25Å; L632-L661 WeakPolarHBondContact O-CD2 3.15Å; L632-K665 WeakPolarHBondContact CB-O 3.49Å; L632-K665 PolarHBondContact N-O 3.24Å; L632-M668 HydrophobicContact CB-CE 4.4Å; L632-M668 HydrophobicContact CD1-CB 4.09Å
633	S	91.5	Very high	85.9	Confident	18 Å²	18	58.6 Å²	58.6	13%	0.126	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	157	167.1	41.1	0	0	0	0	109.8	L504 L505 H506 F507 M668	L504-S633 WeakPolarHBondContact CD1-OG 3.44Å; L505-S633 PolarHBondContact O-N 2.77Å; L505-S633 PolarHBondContact O-OG 3.48Å; H506-S633 WeakPolarHBondContact CA-O 3.41Å; H506-S633 WeakPolarHBondContact CA-OG 3.48Å; H506-S633 PolarHBondContact CD2-OG 3.44Å; H506-S633 PolarHBondContact CE1-OG 3.09Å; H506-S633 PolarHBondContact N-OG 3.25Å; H506-S633 PolarHBondContact ND1-OG 3.04Å; H506-S633 VanDerWaalsContact ND1-OG 3.12Å; F507-S633 PolarHBondContact N-O 3.38Å; S633-M668 WeakPolarHBondContact O-CE 3.47Å
634	F	89.9	Confident	85.7	Confident	31 Å²	31	56.8 Å²	56.8	14%	0.136	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	140.8	166.3	-66.9	-55.7	0	0	0	110.2	H506 D636 V638 E639 A659 L661 M668	H506-F634 PolarHBondContact ND1-O 2.94Å; F634-D636 PolarHBondContact O-N 2.84Å; F634-V638 WeakPolarHBondContact CD1-O 3.19Å; F634-E639 HydrophobicContact CD2-CB 4.29Å; F634-E639 HydrophobicContact CD2-CG 3.73Å; F634-E639 HydrophobicContact CE2-CB 3.79Å; F634-E639 HydrophobicContact CE2-CG 3.47Å; F634-E639 VanDerWaalsContact CE2-CG 3.47Å; F634-E639 WeakPolarHBondContact CE2-OE1 3.16Å; F634-E639 HydrophobicContact CZ-CB 3.93Å; F634-E639 HydrophobicContact CZ-CG 4.15Å; F634-A659 HydrophobicContact CD1-CB 4.49Å; F634-A659 HydrophobicContact CE1-CB 3.57Å; F634-A659 HydrophobicContact CZ-CB 4.22Å; F634-A659 WeakPolarHBondContact CZ-O 3.3Å; F634-L661 HydrophobicContact CD1-CD1 3.84Å; F634-L661 HydrophobicContact CD2-CD1 3.9Å; F634-L661 HydrophobicContact CE1-CD1 3.31Å; F634-L661 HydrophobicContact CE2-CD1 3.4Å; F634-L661 VanDerWaalsContact CE2-CD1 3.4Å; F634-L661 HydrophobicContact CG-CD1 4.11Å; F634-L661 HydrophobicContact CZ-CD1 3.1Å; F634-M668 HydrophobicContact CD1-CE 3.7Å; F634-M668 HydrophobicContact CD1-SD 3.84Å; F634-M668 HydrophobicContact CE1-CE 4.04Å; F634-M668 HydrophobicContact CE1-CG 4.35Å; F634-M668 HydrophobicContact CE1-SD 3.85Å
635	N	85.3	Confident	85.6	Confident	21 Å²	21	56.3 Å²	56.3	11%	0.112	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-66.6	129	165.5	-179.1	62.4	0	0	0	110.2	F507 K533 G637 V638	F507-N635 PolarHBondContact O-N 3.5Å; K533-N635 VanDerWaalsContact CD-OD1 3.28Å; K533-N635 WeakPolarHBondContact CD-OD1 3.22Å; K533-N635 WeakPolarHBondContact CE-OD1 3.24Å; K533-N635 PolarHBondContact NZ-OD1 2.95Å; N635-G637 PolarHBondContact O-N 3.16Å; N635-V638 PolarHBondContact O-N 3.47Å
636	D	79.6	Confident	85.6	Confident	116 Å²	116	54.2 Å²	54.2	62%	0.62	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	51	21.2	173.5	-51	-31.5	0	0	0	115.7	K533 F634	K533-D636 IonicContact NZ-OD1 2.77Å; K533-D636 PolarHBondContact NZ-OD1 3.32Å; K533-D636 IonicContact NZ-OD2 2.75Å; K533-D636 PolarHBondContact NZ-OD2 2.79Å; F634-D636 PolarHBondContact O-N 2.84Å
637	G	78.1	Confident	85.6	Confident	59 Å²	59	52.5 Å²	52.5	61%	0.608	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	83.3	2.5	-178.9	0	0	0	0	0	115.7	N635 E639	N635-G637 PolarHBondContact O-N 3.16Å; G637-E639 PolarHBondContact O-N 2.66Å
638	V	81.4	Confident	85.8	Confident	39 Å²	39	53.5 Å²	53.5	24%	0.236	29%	0.285	C	S	.	.			trans	-78.3	105.3	-172.9	-176.7	0	0	0	0	111.2	F634 N635 G640	F634-V638 WeakPolarHBondContact CD1-O 3.19Å; N635-V638 PolarHBondContact O-N 3.47Å; V638-G640 PolarHBondContact O-N 3.17Å
639	E	84.3	Confident	85.9	Confident	125 Å²	125	46.1 Å²	46.1	58%	0.584	25%	0.251	S	S	*	.			trans	-81.2	37.5	-178.8	-48.7	-153.4	136.2	0	0	113.7	F634 G637 A659	F634-E639 HydrophobicContact CD2-CB 4.29Å; F634-E639 HydrophobicContact CD2-CG 3.73Å; F634-E639 HydrophobicContact CE2-CB 3.79Å; F634-E639 HydrophobicContact CE2-CG 3.47Å; F634-E639 VanDerWaalsContact CE2-CG 3.47Å; F634-E639 WeakPolarHBondContact CE2-OE1 3.16Å; F634-E639 HydrophobicContact CZ-CB 3.93Å; F634-E639 HydrophobicContact CZ-CG 4.15Å; G637-E639 PolarHBondContact O-N 2.66Å; E639-A659 PolarHBondContact O-N 2.85Å
640	G	87.7	Confident	85.5	Confident	4 Å²	4	45.1 Å²	45.1	4%	0.041	25%	0.251	C	S	.	.	B	Isolated β-bridge	trans	-160.9	-179.6	-172.9	0	0	0	0	0	114.6	V638 A657	V638-G640 PolarHBondContact O-N 3.17Å; G640-A657 WeakPolarHBondContact CA-O 3.19Å
641	V	90.1	Very high	85.3	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.006	26%	0.257	C	S	.	.			trans	-79.9	131.4	168.8	-179.2	0	0	0	0	109.5	L509 L511 L643 A657 F670 I672	L509-V641 HydrophobicContact CD2-CG1 4.46Å; L509-V641 HydrophobicContact CD2-CG2 3.97Å; L509-V641 CarbonylContact O-C 3.57Å; L509-V641 WeakPolarHBondContact O-CA 3.44Å; L511-V641 HydrophobicContact CB-CG1 3.54Å; V641-L643 HydrophobicContact CG1-CD2 4.07Å; V641-A657 HydrophobicContact CB-CB 3.78Å; V641-A657 HydrophobicContact CG2-CB 3.82Å; V641-A657 WeakPolarHBondContact CG2-O 3.28Å; V641-A657 PolarHBondContact N-O 3.4Å; V641-F670 HydrophobicContact CG2-CB 4.2Å; V641-F670 HydrophobicContact CG2-CD1 3.55Å; V641-F670 HydrophobicContact CG2-CE1 4.36Å; V641-F670 HydrophobicContact CG2-CG 4.25Å; V641-I672 HydrophobicContact CG2-CG1 4.43Å
642	D	88.6	Confident	85.2	Confident	54 Å²	54	44 Å²	44	29%	0.289	25%	0.245	S	C	.	.	B	Isolated β-bridge	trans	-75.3	132.6	170	-166	-18.5	0	0	0	110.1	L509 Q510 L511 Q644	L509-D642 PolarHBondContact O-N 3.4Å; Q510-D642 WeakPolarHBondContact CA-O 3.29Å; Q510-D642 HydrophobicContact CB-CB 4.22Å; Q510-D642 HydrophobicContact CG-CB 4.07Å; L511-D642 PolarHBondContact N-O 3.08Å; D642-Q644 WeakPolarHBondContact OD1-CB 3.36Å; D642-Q644 PolarHBondContact OD1-N 2.78Å
643	L	88	Confident	85.2	Confident	2 Å²	2	44.6 Å²	44.6	1%	0.01	25%	0.249	C	C	.	.			trans	-119.7	11.6	-175.2	-61.2	175.8	0	0	0	112.6	L511 V641 D645 Y646 I654 V935 L938 L939	L511-L643 HydrophobicContact CB-CD2 4.11Å; L511-L643 HydrophobicContact CD2-CD2 4.19Å; V641-L643 HydrophobicContact CG1-CD2 4.07Å; L643-D645 VanDerWaalsContact C-N 3.31Å; L643-D645 PolarHBondContact O-N 3.27Å; L643-Y646 HydrophobicContact CD2-CD2 4.39Å; L643-Y646 HydrophobicContact CD2-CG 4.22Å; L643-Y646 WeakPolarHBondContact O-CB 3.07Å; L643-Y646 PolarHBondContact O-N 2.81Å; L643-I654 HydrophobicContact CD2-CD1 4.28Å; L643-V935 HydrophobicContact CB-CG1 4.09Å; L643-L938 HydrophobicContact CD1-CB 4.2Å; L643-L938 HydrophobicContact CD1-CD1 3.8Å; L643-L939 HydrophobicContact CB-CD2 4.21Å
644	Q	84.5	Confident	85.2	Confident	112 Å²	112	43.7 Å²	43.7	52%	0.523	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-43.4	-173.9	-177.5	177.6	-65.9	0	0	112.8	D642 L939	D642-Q644 WeakPolarHBondContact OD1-CB 3.36Å; D642-Q644 PolarHBondContact OD1-N 2.78Å; Q644-L939 HydrophobicContact CB-CD2 4.49Å
645	D	82.6	Confident	85.2	Confident	80 Å²	80	44.1 Å²	44.1	43%	0.428	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	20	179.7	-61.6	-56.8	0	0	0	112.3	Q510 L643 S647	Q510-D645 PolarHBondContact NE2-OD2 2.83Å; L643-D645 VanDerWaalsContact C-N 3.31Å; L643-D645 PolarHBondContact O-N 3.27Å; D645-S647 PolarHBondContact O-N 2.95Å
646	Y	86	Confident	85.4	Confident	15 Å²	15	46.6 Å²	46.6	6%	0.059	26%	0.257	C	S	.	.			trans	-69.3	113.5	-176	176.8	-109	0	0	0	112.6	L511 L514 L643 Y648 S649 I654 V935	L511-Y646 HydrophobicContact CD2-CD2 4.15Å; L511-Y646 HydrophobicContact CD2-CE2 4.05Å; L511-Y646 HydrophobicContact CG-CD2 4.01Å; L511-Y646 HydrophobicContact CG-CE2 4.21Å; L511-Y646 WeakPolarHBondContact O-CA 3.36Å; L511-Y646 WeakPolarHBondContact O-CB 3.33Å; L511-Y646 WeakPolarHBondContact O-CD2 3.36Å; L514-Y646 HydrophobicContact CB-CE2 4.29Å; L643-Y646 HydrophobicContact CD2-CD2 4.39Å; L643-Y646 HydrophobicContact CD2-CG 4.22Å; L643-Y646 WeakPolarHBondContact O-CB 3.07Å; L643-Y646 PolarHBondContact O-N 2.81Å; Y646-Y648 HydrophobicContact CD1-CD1 4.07Å; Y646-Y648 HydrophobicContact CD1-CE1 4.46Å; Y646-Y648 AromaticContact CE1-CD1 3.91Å; Y646-Y648 HydrophobicContact CE1-CD1 3.91Å; Y646-S649 PolarHBondContact OH-N 2.92Å; Y646-I654 HydrophobicContact CD1-CD1 4.47Å; Y646-I654 HydrophobicContact CD2-CD1 4.11Å; Y646-I654 HydrophobicContact CE1-CD1 3.9Å; Y646-I654 HydrophobicContact CE1-CG1 4.41Å; Y646-I654 HydrophobicContact CE2-CD1 3.48Å; Y646-I654 VanDerWaalsContact CE2-CD1 3.48Å; Y646-V935 HydrophobicContact CD1-CG2 4.14Å
647	S	84	Confident	86	Confident	67 Å²	67	41.1 Å²	41.1	47%	0.469	23%	0.227	S	C	.	.	B	Isolated β-bridge	trans	-80.7	116.9	170.4	-69.8	0	0	0	0	111.3	V512 L513 D645 S649	V512-S647 WeakPolarHBondContact O-CB 3.5Å; V512-S647 PolarHBondContact O-N 2.98Å; L513-S647 VanDerWaalsContact CD1-O 3.25Å; L513-S647 WeakPolarHBondContact CD1-O 3.39Å; D645-S647 PolarHBondContact O-N 2.95Å; S647-S649 PolarHBondContact O-N 3.08Å
648	Y	84.1	Confident	86.8	Confident	96 Å²	96	40.1 Å²	40.1	38%	0.376	21%	0.21	S	C	.	.	P	Polyproline II helix	trans	-54.9	126	-178.9	-53.2	-62.4	0	0	0	113.7	Y646 Q931 V935	Y646-Y648 HydrophobicContact CD1-CD1 4.07Å; Y646-Y648 HydrophobicContact CD1-CE1 4.46Å; Y646-Y648 AromaticContact CE1-CD1 3.91Å; Y646-Y648 HydrophobicContact CE1-CD1 3.91Å; Y648-Q931 HydrophobicContact CD1-CB 4.22Å; Y648-Q931 HydrophobicContact CD1-CG 3.51Å; Y648-Q931 HydrophobicContact CE1-CB 4.36Å; Y648-Q931 HydrophobicContact CE1-CG 3.83Å; Y648-Q931 HydrophobicContact CG-CG 4.49Å; Y648-V935 HydrophobicContact CE1-CB 4.4Å; Y648-V935 HydrophobicContact CE1-CG2 4Å
649	S	83.4	Confident	87.3	Confident	6 Å²	6	38.7 Å²	38.7	4%	0.042	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-70.9	149.6	175.8	-166.5	0	0	0	0	112.7	L514 Y646 S647 K677	L514-S649 WeakPolarHBondContact O-CB 3.44Å; L514-S649 PolarHBondContact O-OG 2.76Å; Y646-S649 PolarHBondContact OH-N 2.92Å; S647-S649 PolarHBondContact O-N 3.08Å; S649-K677 PolarHBondContact O-NZ 2.93Å
650	S	76.6	Confident	87.6	Confident	47 Å²	47	35.3 Å²	35.3	33%	0.329	19%	0.19	S	C	.	.	S	Bend	trans	-90.3	5.3	-177	64.3	0	0	0	0	114.7	S268	S268-S650 PolarHBondContact N-O 2.84Å; S268-S650 VanDerWaalsContact N-O 3.08Å; S268-S650 PolarHBondContact OG-O 2.96Å
651	I	83.8	Confident	87.6	Confident	29 Å²	29	37.2 Å²	37.2	15%	0.149	20%	0.199	C	C	.	.	S	Bend	trans	-131.8	-32.9	-178.6	-55.2	174.4	0	0	0	111.3	C266 K677	C266-I651 HydrophobicContact CB-CD1 3.89Å; C266-I651 HydrophobicContact CB-CG1 4.05Å; C266-I651 VanDerWaalsContact O-CG1 3.31Å; C266-I651 WeakPolarHBondContact O-CG1 3.21Å; I651-K677 WeakPolarHBondContact O-CB 3.24Å; I651-K677 PolarHBondContact O-N 3.36Å
652	W	89.4	Confident	87.3	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	147.3	-170	-64.4	101.9	0	0	0	112	L514 L517 Q614 V674 R676 K677	L514-W652 HydrophobicContact CD2-CB 3.76Å; L514-W652 HydrophobicContact CD2-CG 4.24Å; L517-W652 HydrophobicContact CB-CZ2 4.09Å; L517-W652 HydrophobicContact CD1-CH2 4.2Å; L517-W652 HydrophobicContact CD1-CZ2 3.95Å; L517-W652 HydrophobicContact CD2-CH2 4.49Å; L517-W652 HydrophobicContact CD2-CZ2 3.92Å; L517-W652 HydrophobicContact CG-CZ2 4.22Å; Q614-W652 HydrophobicContact CG-CH2 3.7Å; Q614-W652 HydrophobicContact CG-CZ3 3.88Å; W652-V674 HydrophobicContact CB-CB 4.37Å; W652-V674 HydrophobicContact CD2-CB 4.43Å; W652-V674 HydrophobicContact CD2-CG2 4.15Å; W652-V674 HydrophobicContact CE3-CB 3.85Å; W652-V674 HydrophobicContact CE3-CG2 3.58Å; W652-V674 HydrophobicContact CZ3-CG2 3.92Å; W652-R676 HydrophobicContact CE3-CB 4.18Å; W652-R676 HydrophobicContact CH2-CB 4.21Å; W652-R676 VanDerWaalsContact CH2-CZ 3.49Å; W652-R676 VanDerWaalsContact CH2-NH2 3.28Å; W652-R676 HydrophobicContact CZ3-CB 3.77Å; W652-K677 PolarHBondContact O-NZ 2.82Å
653	D	89.6	Confident	86.7	Confident	14 Å²	14	44.8 Å²	44.8	8%	0.075	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	133.2	170.4	-80.7	-35.8	0	0	0	109.3	V674 R675 K677 V929 Q931	D653-V674 CarbonylContact O-C 3.59Å; D653-V674 WeakPolarHBondContact O-CA 3.38Å; D653-R675 PolarHBondContact N-O 2.9Å; D653-R675 PolarHBondContact O-N 2.88Å; D653-K677 WeakPolarHBondContact OD1-CE 3.25Å; D653-K677 IonicContact OD1-NZ 2.66Å; D653-K677 PolarHBondContact OD1-NZ 3.11Å; D653-K677 WeakPolarHBondContact OD2-CE 3.46Å; D653-K677 IonicContact OD2-NZ 3.38Å; D653-V929 HydrophobicContact CB-CB 4.49Å; D653-V929 HydrophobicContact CB-CG1 4.28Å; D653-Q931 WeakPolarHBondContact OD1-CB 3.5Å; D653-Q931 WeakPolarHBondContact OD1-CG 3.42Å; D653-Q931 PolarHBondContact OD1-OE1 2.76Å
654	I	91.5	Very high	86.2	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	125.9	175.9	-62.2	178.3	0	0	0	108.7	L511 L643 Y646 A657 V674 Q931 V934 L938	L511-I654 HydrophobicContact CD2-CD1 3.49Å; L511-I654 VanDerWaalsContact CD2-CD1 3.49Å; L643-I654 HydrophobicContact CD2-CD1 4.28Å; Y646-I654 HydrophobicContact CD1-CD1 4.47Å; Y646-I654 HydrophobicContact CD2-CD1 4.11Å; Y646-I654 HydrophobicContact CE1-CD1 3.9Å; Y646-I654 HydrophobicContact CE1-CG1 4.41Å; Y646-I654 HydrophobicContact CE2-CD1 3.48Å; Y646-I654 VanDerWaalsContact CE2-CD1 3.48Å; I654-A657 HydrophobicContact CG2-CB 4.46Å; I654-V674 HydrophobicContact CG1-CG1 4.08Å; I654-Q931 PolarHBondContact O-NE2 2.9Å; I654-Q931 PolarHBondContact O-OE1 2.92Å; I654-V934 VanDerWaalsContact O-CG1 3.28Å; I654-V934 WeakPolarHBondContact O-CG1 3.45Å; I654-L938 HydrophobicContact CG2-CD1 4.4Å
655	I	89.7	Confident	85.9	Confident	40 Å²	40	51.8 Å²	51.8	21%	0.205	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	-44.9	-179.2	-56.8	-58.4	0	0	0	111.4	R673 R675 V929	I655-R673 HydrophobicContact CB-CB 4.48Å; I655-R673 HydrophobicContact CB-CG 4.15Å; I655-R673 PolarHBondContact N-O 2.85Å; I655-R675 HydrophobicContact CD1-CB 3.86Å; I655-R675 HydrophobicContact CG1-CB 3.9Å; I655-V929 HydrophobicContact CD1-CG1 4.42Å; I655-V929 HydrophobicContact CD1-CG2 4.06Å
656	E	91	Very high	86	Confident	73 Å²	73	49.1 Å²	49.1	34%	0.341	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	153.1	178.7	56.7	-176.5	158.8	0	0	109.5	R673	E656-R673 HydrophobicContact CG-CB 3.56Å; E656-R673 HydrophobicContact CG-CG 4.26Å; E656-R673 PolarHBondContact O-N 3.09Å; E656-R673 WeakPolarHBondContact OE1-CD 3.3Å; E656-R673 IonicContact OE1-CZ 3.09Å; E656-R673 IonicContact OE1-NE 3.75Å; E656-R673 IonicContact OE1-NH1 2.77Å; E656-R673 PolarHBondContact OE1-NH1 3.43Å
657	A	92.7	Very high	86.2	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.255	C	S	.	.			trans	-144.6	53.1	-180	0	0	0	0	0	113.6	G640 V641 I654 R671 Y942	G640-A657 WeakPolarHBondContact CA-O 3.19Å; V641-A657 HydrophobicContact CB-CB 3.78Å; V641-A657 HydrophobicContact CG2-CB 3.82Å; V641-A657 WeakPolarHBondContact CG2-O 3.28Å; V641-A657 PolarHBondContact N-O 3.4Å; I654-A657 HydrophobicContact CG2-CB 4.46Å; A657-R671 WeakPolarHBondContact CA-O 3.29Å; A657-Y942 PolarHBondContact N-OH 3.32Å; A657-Y942 VanDerWaalsContact N-OH 3.15Å
658	P	93.5	Very high	86.5	Confident	39 Å²	39	48 Å²	48	25%	0.253	23%	0.233	S	C	.	.	B	Isolated β-bridge	trans	-69	156.5	-179.1	29.6	-37.3	0	0	0	113.1	R671 Y942	P658-R671 WeakPolarHBondContact CD-O 3.38Å; P658-R671 HydrophobicContact CG-CB 4.48Å; P658-R671 PolarHBondContact O-N 3.07Å; P658-Y942 WeakPolarHBondContact CD-OH 3.45Å; P658-Y942 VanDerWaalsContact N-OH 3.09Å
659	A	92.1	Very high	87	Confident	8 Å²	8	44.9 Å²	44.9	7%	0.066	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	143.8	176.6	0	0	0	0	0	111.2	F634 E639 E669 F670	F634-A659 HydrophobicContact CD1-CB 4.49Å; F634-A659 HydrophobicContact CE1-CB 3.57Å; F634-A659 HydrophobicContact CZ-CB 4.22Å; F634-A659 WeakPolarHBondContact CZ-O 3.3Å; E639-A659 PolarHBondContact O-N 2.85Å; A659-E669 CarbonylContact C-O 3.55Å; A659-E669 WeakPolarHBondContact CA-O 3.39Å; A659-F670 HydrophobicContact CB-CD1 3.45Å; A659-F670 VanDerWaalsContact CB-CD1 3.45Å; A659-F670 HydrophobicContact CB-CE1 3.48Å; A659-F670 VanDerWaalsContact CB-CE1 3.48Å; A659-F670 HydrophobicContact CB-CG 4.22Å; A659-F670 HydrophobicContact CB-CZ 4.25Å
660	V	90.2	Very high	87.5	Confident	54 Å²	54	44.6 Å²	44.6	33%	0.327	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	125.3	-174.6	-175.9	0	0	0	0	110.8	E669	V660-E669 PolarHBondContact N-O 3.38Å; V660-E669 PolarHBondContact O-N 3.32Å
661	L	88.5	Confident	88.3	Confident	45 Å²	45	47.2 Å²	47.2	24%	0.236	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	127.4	171.6	-77.4	73.4	0	0	0	110.4	L632 F634 K665 R667 M668	L632-L661 VanDerWaalsContact O-CD2 3.25Å; L632-L661 WeakPolarHBondContact O-CD2 3.15Å; F634-L661 HydrophobicContact CD1-CD1 3.84Å; F634-L661 HydrophobicContact CD2-CD1 3.9Å; F634-L661 HydrophobicContact CE1-CD1 3.31Å; F634-L661 HydrophobicContact CE2-CD1 3.4Å; F634-L661 VanDerWaalsContact CE2-CD1 3.4Å; F634-L661 HydrophobicContact CG-CD1 4.11Å; F634-L661 HydrophobicContact CZ-CD1 3.1Å; L661-K665 HydrophobicContact CB-CG 4.45Å; L661-K665 HydrophobicContact CD2-CB 3.85Å; L661-K665 HydrophobicContact CD2-CD 3.87Å; L661-K665 HydrophobicContact CD2-CG 3.66Å; L661-R667 WeakPolarHBondContact CA-O 3.32Å; L661-M668 HydrophobicContact CD1-CE 3.95Å; L661-M668 HydrophobicContact CD1-CG 4.42Å; L661-M668 HydrophobicContact CG-CE 4.3Å
662	T	83.7	Confident	88.8	Confident	51 Å²	51	45.9 Å²	45.9	31%	0.313	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	155.3	-174.9	-67	0	0	0	0	110.1	R667	T662-R667 PolarHBondContact N-O 3.39Å; T662-R667 PolarHBondContact O-N 2.68Å
663	R	75.5	Confident	89	Confident	163 Å²	163	49.9 Å²	49.9	62%	0.615	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.3	72.4	-175.6	-69.6	-173.6	179.5	-155.8	-0.9	113.3	K665 S666	R663-K665 PolarHBondContact O-N 2.93Å; R663-S666 WeakPolarHBondContact CB-OG 3.12Å; R663-S666 WeakPolarHBondContact O-CB 3.35Å; R663-S666 PolarHBondContact O-N 3.09Å; R663-S666 PolarHBondContact O-OG 3.09Å
664	Q	77.4	Confident	89.1	Confident	145 Å²	145	49.2 Å²	49.2	68%	0.678	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.9	34.5	174.2	-54.2	-169	93.9	0	0	114.7	E627 S666	E627-Q664 PolarHBondContact OE1-NE2 3.34Å; E627-Q664 PolarHBondContact OE2-NE2 3.21Å; Q664-S666 VanDerWaalsContact C-N 3.34Å; Q664-S666 PolarHBondContact O-N 3.42Å
665	K	78.9	Confident	89.1	Confident	116 Å²	116	50.4 Å²	50.4	50%	0.504	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.2	16.2	-176.1	-50.7	-170	177.3	-173.6	0	116.2	I631 L632 L661 R663	I631-K665 HydrophobicContact CG2-CB 3.91Å; I631-K665 HydrophobicContact CG2-CD 4.12Å; L632-K665 WeakPolarHBondContact CB-O 3.49Å; L632-K665 PolarHBondContact N-O 3.24Å; L661-K665 HydrophobicContact CB-CG 4.45Å; L661-K665 HydrophobicContact CD2-CB 3.85Å; L661-K665 HydrophobicContact CD2-CD 3.87Å; L661-K665 HydrophobicContact CD2-CG 3.66Å; R663-K665 PolarHBondContact O-N 2.93Å
666	S	84.2	Confident	89.1	Confident	23 Å²	23	49.1 Å²	49.1	16%	0.161	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-16.3	171.2	61.9	0	0	0	0	114.4	R663 Q664	R663-S666 WeakPolarHBondContact CB-OG 3.12Å; R663-S666 WeakPolarHBondContact O-CB 3.35Å; R663-S666 PolarHBondContact O-N 3.09Å; R663-S666 PolarHBondContact O-OG 3.09Å; Q664-S666 VanDerWaalsContact C-N 3.34Å; Q664-S666 PolarHBondContact O-N 3.42Å
667	R	89.7	Confident	88.9	Confident	58 Å²	58	47.2 Å²	47.2	22%	0.219	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	147.9	-178.6	-60.8	-173.6	-177.3	-159.7	-7.8	111.8	F567 L619 F620 L661 T662	F567-R667 VanDerWaalsContact CE1-NH2 3.35Å; F567-R667 HydrophobicContact CE2-CG 4.41Å; L619-R667 HydrophobicContact CD1-CB 4.13Å; F620-R667 CarbonylContact O-C 3.6Å; F620-R667 VanDerWaalsContact O-CA 3.3Å; F620-R667 WeakPolarHBondContact O-CA 3.46Å; L661-R667 WeakPolarHBondContact CA-O 3.32Å; T662-R667 PolarHBondContact N-O 3.39Å; T662-R667 PolarHBondContact O-N 2.68Å
668	M	91.6	Very high	88.6	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	127.1	175.2	-163.2	177.1	-67.1	0	0	109.6	F507 F620 L632 S633 F634 L661 F670	F507-M668 HydrophobicContact CB-CE 4.03Å; F507-M668 HydrophobicContact CD1-CE 4.45Å; F507-M668 HydrophobicContact CD1-SD 3.86Å; F620-M668 PolarHBondContact N-O 3.41Å; F620-M668 PolarHBondContact O-N 2.66Å; L632-M668 HydrophobicContact CB-CE 4.4Å; L632-M668 HydrophobicContact CD1-CB 4.09Å; S633-M668 WeakPolarHBondContact O-CE 3.47Å; F634-M668 HydrophobicContact CD1-CE 3.7Å; F634-M668 HydrophobicContact CD1-SD 3.84Å; F634-M668 HydrophobicContact CE1-CE 4.04Å; F634-M668 HydrophobicContact CE1-CG 4.35Å; F634-M668 HydrophobicContact CE1-SD 3.85Å; L661-M668 HydrophobicContact CD1-CE 3.95Å; L661-M668 HydrophobicContact CD1-CG 4.42Å; L661-M668 HydrophobicContact CG-CE 4.3Å; M668-F670 HydrophobicContact CB-CE2 4.24Å; M668-F670 HydrophobicContact CG-CD2 4.44Å; M668-F670 HydrophobicContact CG-CE2 3.76Å; M668-F670 HydrophobicContact CG-CZ 3.98Å; M668-F670 HydrophobicContact SD-CE1 4.19Å; M668-F670 HydrophobicContact SD-CE2 3.66Å; M668-F670 HydrophobicContact SD-CZ 3.32Å; M668-F670 WeakPolarHBondContact SD-CZ 3.4Å
669	E	93.2	Very high	88	Confident	31 Å²	31	51 Å²	51	15%	0.145	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	111.5	-178.1	-172	-164.3	161.2	0	0	109.3	L618 L619 A659 V660 R671	L618-E669 WeakPolarHBondContact O-CA 3.26Å; L619-E669 HydrophobicContact CD1-CB 4.1Å; L619-E669 HydrophobicContact CD1-CG 4.46Å; A659-E669 CarbonylContact C-O 3.55Å; A659-E669 WeakPolarHBondContact CA-O 3.39Å; V660-E669 PolarHBondContact N-O 3.38Å; V660-E669 PolarHBondContact O-N 3.32Å; E669-R671 VanDerWaalsContact CD-NH2 3.25Å; E669-R671 HydrophobicContact CG-CG 4.41Å; E669-R671 IonicContact OE1-CZ 3.09Å; E669-R671 IonicContact OE1-NE 2.83Å; E669-R671 PolarHBondContact OE1-NE 3.27Å; E669-R671 IonicContact OE1-NH2 2.66Å; E669-R671 PolarHBondContact OE1-NH2 2.98Å; E669-R671 VanDerWaalsContact OE1-NH2 3.09Å; E669-R671 IonicContact OE2-CZ 2.69Å; E669-R671 IonicContact OE2-NE 2.66Å; E669-R671 IonicContact OE2-NH2 3.15Å; E669-R671 PolarHBondContact OE2-NH2 3.33Å
670	F	93.8	Very high	87.4	Confident	1 Å²	1	52.4 Å²	52.4	0%	0.004	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	131.5	171.7	-60.4	-96.8	0	0	0	109	F507 L509 T617 L618 F620 V641 A659 M668	F507-F670 AromaticContact CD1-CE2 3.98Å; F507-F670 HydrophobicContact CD1-CE2 3.98Å; F507-F670 AromaticContact CD1-CZ 3.9Å; F507-F670 HydrophobicContact CD1-CZ 3.9Å; F507-F670 AromaticContact CE1-CE2 3.61Å; F507-F670 HydrophobicContact CE1-CE2 3.61Å; F507-F670 AromaticContact CE1-CZ 3.82Å; F507-F670 HydrophobicContact CE1-CZ 3.82Å; L509-F670 HydrophobicContact CB-CD1 3.97Å; L509-F670 HydrophobicContact CB-CD2 4.44Å; L509-F670 HydrophobicContact CB-CE1 3.49Å; L509-F670 VanDerWaalsContact CB-CE1 3.49Å; L509-F670 HydrophobicContact CB-CE2 4.05Å; L509-F670 HydrophobicContact CB-CG 4.41Å; L509-F670 HydrophobicContact CB-CZ 3.52Å; L509-F670 HydrophobicContact CD2-CB 4.18Å; L509-F670 HydrophobicContact CD2-CD1 3.97Å; L509-F670 HydrophobicContact CD2-CD2 4.06Å; L509-F670 HydrophobicContact CD2-CE1 4.36Å; L509-F670 HydrophobicContact CD2-CE2 4.47Å; L509-F670 HydrophobicContact CD2-CG 3.79Å; T617-F670 CarbonylContact C-O 3.55Å; T617-F670 VanDerWaalsContact CA-O 3.25Å; T617-F670 WeakPolarHBondContact CA-O 3.45Å; L618-F670 HydrophobicContact CB-CB 4.33Å; L618-F670 PolarHBondContact N-O 2.88Å; L618-F670 PolarHBondContact O-N 3.33Å; F620-F670 AromaticContact CD2-CD2 3.9Å; F620-F670 HydrophobicContact CD2-CD2 3.9Å; F620-F670 AromaticContact CD2-CE2 3.93Å; F620-F670 HydrophobicContact CD2-CE2 3.93Å; F620-F670 HydrophobicContact CE2-CD2 4.3Å; F620-F670 HydrophobicContact CE2-CE2 4.49Å; V641-F670 HydrophobicContact CG2-CB 4.2Å; V641-F670 HydrophobicContact CG2-CD1 3.55Å; V641-F670 HydrophobicContact CG2-CE1 4.36Å; V641-F670 HydrophobicContact CG2-CG 4.25Å; A659-F670 HydrophobicContact CB-CD1 3.45Å; A659-F670 VanDerWaalsContact CB-CD1 3.45Å; A659-F670 HydrophobicContact CB-CE1 3.48Å; A659-F670 VanDerWaalsContact CB-CE1 3.48Å; A659-F670 HydrophobicContact CB-CG 4.22Å; A659-F670 HydrophobicContact CB-CZ 4.25Å; M668-F670 HydrophobicContact CB-CE2 4.24Å; M668-F670 HydrophobicContact CG-CD2 4.44Å; M668-F670 HydrophobicContact CG-CE2 3.76Å; M668-F670 HydrophobicContact CG-CZ 3.98Å; M668-F670 HydrophobicContact SD-CE1 4.19Å; M668-F670 HydrophobicContact SD-CE2 3.66Å; M668-F670 HydrophobicContact SD-CZ 3.32Å; M668-F670 WeakPolarHBondContact SD-CZ 3.4Å
671	R	94.2	Very high	87.1	Confident	101 Å²	101	50.8 Å²	50.8	38%	0.381	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	97.3	-179.6	-61	-170	174.6	145.9	10.8	109.6	V615 T617 A657 P658 E669	V615-R671 HydrophobicContact CG1-CB 4.44Å; T617-R671 HydrophobicContact CG2-CG 4.13Å; A657-R671 WeakPolarHBondContact CA-O 3.29Å; P658-R671 WeakPolarHBondContact CD-O 3.38Å; P658-R671 HydrophobicContact CG-CB 4.48Å; P658-R671 PolarHBondContact O-N 3.07Å; E669-R671 VanDerWaalsContact CD-NH2 3.25Å; E669-R671 HydrophobicContact CG-CG 4.41Å; E669-R671 IonicContact OE1-CZ 3.09Å; E669-R671 IonicContact OE1-NE 2.83Å; E669-R671 PolarHBondContact OE1-NE 3.27Å; E669-R671 IonicContact OE1-NH2 2.66Å; E669-R671 PolarHBondContact OE1-NH2 2.98Å; E669-R671 VanDerWaalsContact OE1-NH2 3.09Å; E669-R671 IonicContact OE2-CZ 2.69Å; E669-R671 IonicContact OE2-NE 2.66Å; E669-R671 IonicContact OE2-NH2 3.15Å; E669-R671 PolarHBondContact OE2-NH2 3.33Å
672	I	93.8	Very high	86.8	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	113	-179.7	-59.4	175	0	0	0	108.2	L511 M524 C616 L618 V641 V674	L511-I672 HydrophobicContact CD2-CD1 4.33Å; M524-I672 HydrophobicContact CE-CD1 4.2Å; C616-I672 PolarHBondContact N-O 3.07Å; C616-I672 PolarHBondContact O-N 3.42Å; L618-I672 HydrophobicContact CD1-CD1 3.83Å; V641-I672 HydrophobicContact CG2-CG1 4.43Å; I672-V674 HydrophobicContact CG2-CG1 4.04Å
673	R	93.8	Very high	86.6	Confident	85 Å²	85	48.9 Å²	48.9	32%	0.321	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	127.3	175.1	-175.7	176.5	-169.9	155.7	0.4	110.7	E613 Q614 V615 I655 E656	E613-R673 IonicContact OE2-CZ 2.68Å; E613-R673 IonicContact OE2-NE 3.97Å; E613-R673 PolarHBondContact OE2-NE 3.16Å; E613-R673 IonicContact OE2-NH2 2.72Å; E613-R673 PolarHBondContact OE2-NH2 3.04Å; Q614-R673 WeakPolarHBondContact O-CA 3.31Å; V615-R673 HydrophobicContact CG2-CB 4.28Å; V615-R673 HydrophobicContact CG2-CG 3.99Å; I655-R673 HydrophobicContact CB-CB 4.48Å; I655-R673 HydrophobicContact CB-CG 4.15Å; I655-R673 PolarHBondContact N-O 2.85Å; E656-R673 HydrophobicContact CG-CB 3.56Å; E656-R673 HydrophobicContact CG-CG 4.26Å; E656-R673 PolarHBondContact O-N 3.09Å; E656-R673 WeakPolarHBondContact OE1-CD 3.3Å; E656-R673 IonicContact OE1-CZ 3.09Å; E656-R673 IonicContact OE1-NE 3.75Å; E656-R673 IonicContact OE1-NH1 2.77Å; E656-R673 PolarHBondContact OE1-NH1 3.43Å
674	V	92.5	Very high	86.8	Confident	0 Å²	0	42 Å²	42	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	145.3	-178.3	-66	0	0	0	0	112.3	L514 L517 E613 Q614 W652 D653 I654 I672	L514-V674 HydrophobicContact CD2-CG1 3.61Å; L517-V674 HydrophobicContact CD1-CG2 4.08Å; E613-V674 CarbonylContact C-O 3.6Å; E613-V674 WeakPolarHBondContact CA-O 3.5Å; Q614-V674 HydrophobicContact CB-CG2 3.93Å; Q614-V674 PolarHBondContact N-O 2.81Å; Q614-V674 PolarHBondContact O-N 3.15Å; W652-V674 HydrophobicContact CB-CB 4.37Å; W652-V674 HydrophobicContact CD2-CB 4.43Å; W652-V674 HydrophobicContact CD2-CG2 4.15Å; W652-V674 HydrophobicContact CE3-CB 3.85Å; W652-V674 HydrophobicContact CE3-CG2 3.58Å; W652-V674 HydrophobicContact CZ3-CG2 3.92Å; D653-V674 CarbonylContact O-C 3.59Å; D653-V674 WeakPolarHBondContact O-CA 3.38Å; I654-V674 HydrophobicContact CG1-CG1 4.08Å; I672-V674 HydrophobicContact CG2-CG1 4.04Å
675	R	90.7	Very high	87	Confident	25 Å²	25	35.3 Å²	35.3	9%	0.094	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	141.2	174.5	-171.3	-178.9	-75.9	173.9	-15.1	110.1	E613 D653 I655 N924 E927	E613-R675 HydrophobicContact CG-CB 3.92Å; E613-R675 HydrophobicContact CG-CG 3.85Å; E613-R675 IonicContact OE1-CZ 3.02Å; E613-R675 IonicContact OE1-NE 3.84Å; E613-R675 PolarHBondContact OE1-NE 2.68Å; E613-R675 IonicContact OE1-NH2 2.74Å; E613-R675 PolarHBondContact OE1-NH2 2.81Å; D653-R675 PolarHBondContact N-O 2.9Å; D653-R675 PolarHBondContact O-N 2.88Å; I655-R675 HydrophobicContact CD1-CB 3.86Å; I655-R675 HydrophobicContact CG1-CB 3.9Å; R675-N924 PolarHBondContact NE-ND2 2.65Å; R675-E927 IonicContact CZ-OE1 3.74Å; R675-E927 IonicContact CZ-OE2 2.76Å; R675-E927 IonicContact NH1-OE1 3.98Å; R675-E927 PolarHBondContact NH1-OE1 2.91Å; R675-E927 IonicContact NH1-OE2 3.97Å; R675-E927 IonicContact NH2-OE1 2.74Å; R675-E927 PolarHBondContact NH2-OE1 2.93Å; R675-E927 VanDerWaalsContact NH2-OE1 3.14Å; R675-E927 IonicContact NH2-OE2 3.62Å; R675-E927 PolarHBondContact NH2-OE2 3.35Å
676	R	90.3	Very high	87.3	Confident	12 Å²	12	30.5 Å²	30.5	5%	0.045	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	136.7	-178.1	-172.8	-176.5	-59.7	-82.7	2.2	112.9	E519 P610 D612 W652 S678 Y681	E519-R676 IonicContact OE1-CZ 2.83Å; E519-R676 IonicContact OE1-NH1 3.39Å; E519-R676 PolarHBondContact OE1-NH1 3.1Å; E519-R676 IonicContact OE1-NH2 2.7Å; E519-R676 PolarHBondContact OE1-NH2 3.38Å; P610-R676 WeakPolarHBondContact O-CD 3.47Å; D612-R676 VanDerWaalsContact CG-NE 3.3Å; D612-R676 PolarHBondContact O-N 2.82Å; D612-R676 VanDerWaalsContact O-N 3.09Å; D612-R676 WeakPolarHBondContact OD1-CD 3.2Å; D612-R676 IonicContact OD1-CZ 2.85Å; D612-R676 IonicContact OD1-NE 3.5Å; D612-R676 PolarHBondContact OD1-NE 2.9Å; D612-R676 IonicContact OD1-NH2 3.16Å; D612-R676 IonicContact OD2-CZ 3.87Å; D612-R676 IonicContact OD2-NE 2.64Å; D612-R676 PolarHBondContact OD2-NE 2.85Å; D612-R676 VanDerWaalsContact OD2-NE 3.08Å; D612-R676 IonicContact OD2-NH2 3.82Å; D612-R676 PolarHBondContact OD2-NH2 3.33Å; W652-R676 HydrophobicContact CE3-CB 4.18Å; W652-R676 HydrophobicContact CH2-CB 4.21Å; W652-R676 VanDerWaalsContact CH2-CZ 3.49Å; W652-R676 VanDerWaalsContact CH2-NH2 3.28Å; W652-R676 HydrophobicContact CZ3-CB 3.77Å; R676-S678 PolarHBondContact O-N 3.11Å; R676-Y681 HydrophobicContact CG-CE2 4.48Å
677	K	87.3	Confident	87.4	Confident	34 Å²	34	32.3 Å²	32.3	15%	0.148	15%	0.15	C	C	.	.			trans	-76.6	87.6	168.6	-63.7	178.6	-178.4	170.2	0	110.7	S268 S649 I651 W652 D653 L679	S268-K677 WeakPolarHBondContact OG-CD 3.48Å; S649-K677 PolarHBondContact O-NZ 2.93Å; I651-K677 WeakPolarHBondContact O-CB 3.24Å; I651-K677 PolarHBondContact O-N 3.36Å; W652-K677 PolarHBondContact O-NZ 2.82Å; D653-K677 WeakPolarHBondContact OD1-CE 3.25Å; D653-K677 IonicContact OD1-NZ 2.66Å; D653-K677 PolarHBondContact OD1-NZ 3.11Å; D653-K677 WeakPolarHBondContact OD2-CE 3.46Å; D653-K677 IonicContact OD2-NZ 3.38Å; K677-L679 VanDerWaalsContact C-N 3.27Å; K677-L679 PolarHBondContact O-N 2.95Å; K677-L679 VanDerWaalsContact O-N 3.16Å
678	S	85.8	Confident	87.1	Confident	32 Å²	32	29.6 Å²	29.6	22%	0.224	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-21.1	-169.1	67.7	0	0	0	0	116.1	P610 R676 F680 Y681 T682	P610-S678 VanDerWaalsContact O-CB 3.24Å; P610-S678 WeakPolarHBondContact O-CB 3.48Å; R676-S678 PolarHBondContact O-N 3.11Å; S678-F680 VanDerWaalsContact C-N 3.34Å; S678-F680 PolarHBondContact O-N 3.42Å; S678-F680 VanDerWaalsContact O-N 3.15Å; S678-Y681 PolarHBondContact O-N 2.88Å; S678-T682 PolarHBondContact O-N 3.18Å; S678-T682 PolarHBondContact O-OG1 3.14Å
679	L	80.5	Confident	86.9	Confident	85 Å²	85	29.6 Å²	29.6	45%	0.445	14%	0.14	S	C	.	.	H	α-helix	trans	-48.8	-47	-168.6	-173.9	154.8	0	0	0	114.1	K677 Y681 T682 V683	K677-L679 VanDerWaalsContact C-N 3.27Å; K677-L679 PolarHBondContact O-N 2.95Å; K677-L679 VanDerWaalsContact O-N 3.16Å; L679-Y681 PolarHBondContact O-N 2.83Å; L679-T682 PolarHBondContact O-N 2.78Å; L679-V683 HydrophobicContact CD2-CG2 4.45Å; L679-V683 WeakPolarHBondContact O-CG2 3.41Å; L679-V683 PolarHBondContact O-N 2.92Å
680	F	80.6	Confident	86.6	Confident	39 Å²	39	29.4 Å²	29.4	17%	0.171	14%	0.141	C	C	.	.	H	α-helix	trans	-59.2	-48	179.9	175.7	-99.6	0	0	0	111.8	S678 V683 V684	S678-F680 VanDerWaalsContact C-N 3.34Å; S678-F680 PolarHBondContact O-N 3.42Å; S678-F680 VanDerWaalsContact O-N 3.15Å; F680-V683 PolarHBondContact O-N 2.82Å; F680-V684 HydrophobicContact CD2-CG2 4.32Å; F680-V684 HydrophobicContact CE2-CG2 4.12Å; F680-V684 HydrophobicContact CZ-CG2 4.35Å; F680-V684 WeakPolarHBondContact O-CB 3.12Å; F680-V684 WeakPolarHBondContact O-CG2 2.94Å; F680-V684 PolarHBondContact O-N 3.49Å
681	Y	83.4	Confident	86.3	Confident	19 Å²	19	31.2 Å²	31.2	8%	0.075	15%	0.15	C	C	.	.	H	α-helix	trans	-69.9	-38	179	-59.8	-78.4	0	0	0	112	F609 P610 R676 S678 L679 V683 L685 I686 I730	F609-Y681 HydrophobicContact CE1-CD1 4.44Å; F609-Y681 HydrophobicContact CE2-CE1 4.37Å; F609-Y681 AromaticContact CZ-CD1 3.72Å; F609-Y681 HydrophobicContact CZ-CD1 3.72Å; F609-Y681 AromaticContact CZ-CE1 3.79Å; F609-Y681 HydrophobicContact CZ-CE1 3.79Å; F609-Y681 HydrophobicContact CZ-CG 4.19Å; P610-Y681 HydrophobicContact CB-CD2 4.04Å; P610-Y681 HydrophobicContact CB-CG 3.9Å; R676-Y681 HydrophobicContact CG-CE2 4.48Å; S678-Y681 PolarHBondContact O-N 2.88Å; L679-Y681 PolarHBondContact O-N 2.83Å; Y681-V683 VanDerWaalsContact C-N 3.28Å; Y681-V683 PolarHBondContact O-N 3Å; Y681-L685 WeakPolarHBondContact O-CA 3.29Å; Y681-L685 WeakPolarHBondContact O-CB 3.42Å; Y681-L685 PolarHBondContact O-N 2.96Å; Y681-I686 PolarHBondContact O-N 2.85Å; Y681-I730 HydrophobicContact CE1-CD1 4.5Å; Y681-I730 HydrophobicContact CE1-CG2 4.25Å
682	T	82.8	Confident	86	Confident	38 Å²	38	26.5 Å²	26.5	23%	0.233	13%	0.132	C	C	.	.	I	π-helix	trans	-57.5	-42.9	174.2	-62.6	0	0	0	0	111.4	S678 L679 I686 I687	S678-T682 PolarHBondContact O-N 3.18Å; S678-T682 PolarHBondContact O-OG1 3.14Å; L679-T682 PolarHBondContact O-N 2.78Å; T682-I686 WeakPolarHBondContact O-CB 3.36Å; T682-I686 PolarHBondContact O-N 3.35Å; T682-I687 WeakPolarHBondContact O-CG1 3.36Å; T682-I687 PolarHBondContact O-N 2.88Å
683	V	78.9	Confident	85.7	Confident	19 Å²	19	26.6 Å²	26.6	12%	0.115	13%	0.133	C	C	.	.	I	π-helix	trans	-79.1	-41.6	-178.4	175.6	0	0	0	0	113.4	M271 L279 L679 F680 Y681 I687 P688	M271-V683 HydrophobicContact CE-CG1 3.53Å; M271-V683 HydrophobicContact SD-CG1 4.35Å; L279-V683 HydrophobicContact CB-CG1 4.44Å; L279-V683 HydrophobicContact CD1-CG1 3.93Å; L279-V683 HydrophobicContact CD2-CG1 3.67Å; L279-V683 HydrophobicContact CG-CG1 4.21Å; L679-V683 HydrophobicContact CD2-CG2 4.45Å; L679-V683 WeakPolarHBondContact O-CG2 3.41Å; L679-V683 PolarHBondContact O-N 2.92Å; F680-V683 PolarHBondContact O-N 2.82Å; Y681-V683 VanDerWaalsContact C-N 3.28Å; Y681-V683 PolarHBondContact O-N 3Å; V683-I687 HydrophobicContact CG2-CD1 4.44Å; V683-P688 WeakPolarHBondContact O-CD 3.43Å
684	V	78.7	Confident	85.4	Confident	18 Å²	18	25.2 Å²	25.2	11%	0.109	13%	0.13	C	C	.	.	I	π-helix	trans	-84.9	-26.1	-175.2	177.9	0	0	0	0	112.8	F680	F680-V684 HydrophobicContact CD2-CG2 4.32Å; F680-V684 HydrophobicContact CE2-CG2 4.12Å; F680-V684 HydrophobicContact CZ-CG2 4.35Å; F680-V684 WeakPolarHBondContact O-CB 3.12Å; F680-V684 WeakPolarHBondContact O-CG2 2.94Å; F680-V684 PolarHBondContact O-N 3.49Å
685	L	82.6	Confident	85.2	Confident	4 Å²	4	25.2 Å²	25.2	2%	0.021	13%	0.13	C	C	.	.	I	π-helix	trans	-119.8	-48.5	-172	-166.1	73.7	0	0	0	113.6	F609 Y681 T689 F723 L726 V727 M741	F609-L685 HydrophobicContact CE1-CD2 4.44Å; Y681-L685 WeakPolarHBondContact O-CA 3.29Å; Y681-L685 WeakPolarHBondContact O-CB 3.42Å; Y681-L685 PolarHBondContact O-N 2.96Å; L685-T689 WeakPolarHBondContact O-CB 3.4Å; L685-T689 WeakPolarHBondContact O-CG2 2.98Å; L685-T689 PolarHBondContact O-N 2.81Å; L685-T689 PolarHBondContact O-OG1 2.84Å; L685-F723 HydrophobicContact CD1-CD1 4.43Å; L685-L726 HydrophobicContact CD1-CD2 3.84Å; L685-V727 HydrophobicContact CD1-CG2 3.73Å; L685-V727 HydrophobicContact CD2-CG2 3.85Å; L685-V727 HydrophobicContact CG-CG2 4.32Å; L685-M741 HydrophobicContact CD2-CE 4.34Å; L685-M741 HydrophobicContact CD2-CG 3.85Å; L685-M741 HydrophobicContact CG-CE 4.07Å
686	I	85.1	Confident	85.1	Confident	16 Å²	16	24.1 Å²	24.1	8%	0.082	13%	0.126	C	C	.	.	I	π-helix	trans	-74.6	-53.5	-174.8	-57.6	-179.8	0	0	0	111.1	P610 F611 Y681 T682 T689 V690 M741	P610-I686 HydrophobicContact CG-CD1 4.01Å; F611-I686 HydrophobicContact CE2-CD1 3.75Å; F611-I686 HydrophobicContact CZ-CD1 3.83Å; Y681-I686 PolarHBondContact O-N 2.85Å; T682-I686 WeakPolarHBondContact O-CB 3.36Å; T682-I686 PolarHBondContact O-N 3.35Å; I686-T689 PolarHBondContact O-N 2.66Å; I686-T689 PolarHBondContact O-OG1 3.35Å; I686-V690 HydrophobicContact CG2-CG2 4.07Å; I686-V690 VanDerWaalsContact O-CG2 3.3Å; I686-V690 WeakPolarHBondContact O-CG2 3.49Å; I686-V690 PolarHBondContact O-N 3.23Å; I686-M741 HydrophobicContact CG1-CE 4.32Å; I686-M741 HydrophobicContact CG1-SD 4.16Å
687	I	85.2	Confident	84.9	Confident	60 Å²	60	23.8 Å²	23.8	31%	0.308	13%	0.125	S	C	.	.	H	α-helix	trans	-57.1	-47.6	-178	-68.6	173.9	0	0	0	112.2	L279 T682 V683 T689 L691	L279-I687 HydrophobicContact CD1-CG2 4.05Å; T682-I687 WeakPolarHBondContact O-CG1 3.36Å; T682-I687 PolarHBondContact O-N 2.88Å; V683-I687 HydrophobicContact CG2-CD1 4.44Å; I687-T689 PolarHBondContact O-N 2.95Å; I687-L691 HydrophobicContact CG2-CD1 3.76Å; I687-L691 HydrophobicContact CG2-CG 4.43Å; I687-L691 WeakPolarHBondContact O-CB 3.49Å; I687-L691 VanDerWaalsContact O-CG 3.28Å; I687-L691 WeakPolarHBondContact O-CG 3.36Å; I687-L691 PolarHBondContact O-N 3.24Å
688	P	85.3	Confident	84.9	Confident	1 Å²	1	24.6 Å²	24.6	1%	0.006	13%	0.13	C	C	.	.	H	α-helix	trans	-62.9	-41	179.2	-27.6	38.6	0	0	0	113.7	F282 V683 L691 M692 F723	F282-P688 HydrophobicContact CD1-CB 4.46Å; F282-P688 HydrophobicContact CE1-CB 3.82Å; F282-P688 HydrophobicContact CE1-CG 4.43Å; F282-P688 HydrophobicContact CE2-CB 4.29Å; F282-P688 HydrophobicContact CZ-CB 3.72Å; V683-P688 WeakPolarHBondContact O-CD 3.43Å; P688-L691 PolarHBondContact O-N 3.32Å; P688-M692 WeakPolarHBondContact O-CG 3.28Å; P688-M692 PolarHBondContact O-N 2.83Å; P688-F723 HydrophobicContact CB-CE1 3.95Å; P688-F723 HydrophobicContact CB-CE2 4.23Å; P688-F723 HydrophobicContact CB-CZ 3.47Å; P688-F723 VanDerWaalsContact CB-CZ 3.47Å; P688-F723 HydrophobicContact CG-CZ 4.45Å
689	T	85.9	Confident	85.1	Confident	1 Å²	1	23 Å²	23	1%	0.006	12%	0.119	C	C	.	.	H	α-helix	trans	-71.9	-37.4	-177.3	54.8	0	0	0	0	112.4	L685 I686 I687 M692 A693 F723 M741 L745	L685-T689 WeakPolarHBondContact O-CB 3.4Å; L685-T689 WeakPolarHBondContact O-CG2 2.98Å; L685-T689 PolarHBondContact O-N 2.81Å; L685-T689 PolarHBondContact O-OG1 2.84Å; I686-T689 PolarHBondContact O-N 2.66Å; I686-T689 PolarHBondContact O-OG1 3.35Å; I687-T689 PolarHBondContact O-N 2.95Å; T689-M692 PolarHBondContact O-N 2.8Å; T689-A693 PolarHBondContact O-N 3.49Å; T689-F723 HydrophobicContact CG2-CB 4.05Å; T689-F723 HydrophobicContact CG2-CD1 4.14Å; T689-F723 HydrophobicContact CG2-CD2 4.11Å; T689-F723 HydrophobicContact CG2-CG 3.85Å; T689-M741 HydrophobicContact CG2-CE 4.2Å; T689-M741 WeakPolarHBondContact OG1-CE 3.37Å; T689-L745 HydrophobicContact CG2-CD2 3.74Å
690	V	88.3	Confident	85.6	Confident	27 Å²	27	19 Å²	19	16%	0.164	10%	0.098	C	C	.	.	H	α-helix	trans	-60.3	-44.4	169.7	172.4	0	0	0	0	110.9	I686 A693 F694 Y744 T915	I686-V690 HydrophobicContact CG2-CG2 4.07Å; I686-V690 VanDerWaalsContact O-CG2 3.3Å; I686-V690 WeakPolarHBondContact O-CG2 3.49Å; I686-V690 PolarHBondContact O-N 3.23Å; V690-A693 WeakPolarHBondContact O-CB 3.35Å; V690-A693 PolarHBondContact O-N 3.04Å; V690-F694 HydrophobicContact CG1-CD2 3.93Å; V690-F694 HydrophobicContact CG1-CE2 3.68Å; V690-F694 VanDerWaalsContact O-CD2 3.23Å; V690-F694 WeakPolarHBondContact O-CD2 3.13Å; V690-F694 PolarHBondContact O-N 2.89Å; V690-Y744 HydrophobicContact CG2-CE1 4.16Å; V690-T915 HydrophobicContact CG1-CG2 4.29Å; V690-T915 HydrophobicContact CG2-CG2 3.96Å
691	L	87.5	Confident	86	Confident	39 Å²	39	21 Å²	21	20%	0.204	11%	0.105	C	C	.	.	H	α-helix	trans	-64.8	-38.2	176.5	-72.1	170.6	0	0	0	112.5	F282 V283 V286 I687 P688 A693 F694 L695	F282-L691 HydrophobicContact CD1-CD1 3.92Å; F282-L691 HydrophobicContact CE1-CB 4.02Å; F282-L691 HydrophobicContact CE1-CD1 3.77Å; V283-L691 HydrophobicContact CG2-CD1 4.05Å; V286-L691 HydrophobicContact CG1-CB 4.28Å; V286-L691 HydrophobicContact CG1-CD2 4.17Å; V286-L691 HydrophobicContact CG2-CB 4.26Å; I687-L691 HydrophobicContact CG2-CD1 3.76Å; I687-L691 HydrophobicContact CG2-CG 4.43Å; I687-L691 WeakPolarHBondContact O-CB 3.49Å; I687-L691 VanDerWaalsContact O-CG 3.28Å; I687-L691 WeakPolarHBondContact O-CG 3.36Å; I687-L691 PolarHBondContact O-N 3.24Å; P688-L691 PolarHBondContact O-N 3.32Å; L691-A693 VanDerWaalsContact C-N 3.32Å; L691-A693 PolarHBondContact O-N 3.19Å; L691-F694 PolarHBondContact O-N 2.84Å; L691-L695 PolarHBondContact O-N 3.3Å
692	M	86.9	Confident	86.2	Confident	1 Å²	1	20.1 Å²	20.1	1%	0.005	10%	0.102	C	C	.	.	H	α-helix	trans	-63.4	-37.5	172	-65.6	-40.2	-53.3	0	0	112.2	L250 F282 P688 T689 L695 S696 V716 S719 L720 F723	L250-M692 HydrophobicContact CD2-CE 3.78Å; L250-M692 HydrophobicContact CD2-SD 3.66Å; L250-M692 HydrophobicContact CG-SD 4.46Å; F282-M692 HydrophobicContact CZ-SD 3.98Å; P688-M692 WeakPolarHBondContact O-CG 3.28Å; P688-M692 PolarHBondContact O-N 2.83Å; T689-M692 PolarHBondContact O-N 2.8Å; M692-L695 HydrophobicContact CE-CB 4.41Å; M692-L695 HydrophobicContact CE-CD1 3.69Å; M692-L695 PolarHBondContact O-N 3.34Å; M692-L695 HydrophobicContact SD-CD1 4.08Å; M692-S696 PolarHBondContact O-N 2.73Å; M692-V716 HydrophobicContact CE-CB 4.17Å; M692-V716 HydrophobicContact CE-CG1 3.85Å; M692-V716 HydrophobicContact CE-CG2 3.78Å; M692-S719 WeakPolarHBondContact CE-OG 3.43Å; M692-L720 HydrophobicContact CB-CD2 3.98Å; M692-L720 HydrophobicContact CB-CG 4.49Å; M692-F723 HydrophobicContact CG-CE2 4.2Å
693	A	87.5	Confident	86.3	Confident	3 Å²	3	19 Å²	19	3%	0.025	10%	0.095	C	C	.	.	H	α-helix	trans	-61.4	-44.8	173.7	0	0	0	0	0	111.1	T689 V690 L691 L695 S696 M697 T748	T689-A693 PolarHBondContact O-N 3.49Å; V690-A693 WeakPolarHBondContact O-CB 3.35Å; V690-A693 PolarHBondContact O-N 3.04Å; L691-A693 VanDerWaalsContact C-N 3.32Å; L691-A693 PolarHBondContact O-N 3.19Å; A693-L695 PolarHBondContact O-N 2.85Å; A693-S696 WeakPolarHBondContact O-CB 3.29Å; A693-S696 PolarHBondContact O-N 2.84Å; A693-S696 PolarHBondContact O-OG 3.27Å; A693-M697 WeakPolarHBondContact O-CG 3.33Å; A693-M697 PolarHBondContact O-N 3.03Å; A693-T748 HydrophobicContact CB-CG2 3.96Å
694	F	88.2	Confident	86.6	Confident	56 Å²	56	18.7 Å²	18.7	25%	0.246	10%	0.095	C	C	.	.	H	α-helix	trans	-62	-38.6	173	-77.3	-71	0	0	0	113.6	V690 L691 S696 M697 M698 F908	V690-F694 HydrophobicContact CG1-CD2 3.93Å; V690-F694 HydrophobicContact CG1-CE2 3.68Å; V690-F694 VanDerWaalsContact O-CD2 3.23Å; V690-F694 WeakPolarHBondContact O-CD2 3.13Å; V690-F694 PolarHBondContact O-N 2.89Å; L691-F694 PolarHBondContact O-N 2.84Å; F694-S696 VanDerWaalsContact C-N 3.3Å; F694-S696 PolarHBondContact O-N 2.97Å; F694-M697 HydrophobicContact CB-CE 4.24Å; F694-M697 HydrophobicContact CD1-CE 3.25Å; F694-M697 HydrophobicContact CD1-SD 3.47Å; F694-M697 WeakPolarHBondContact CD1-SD 3.33Å; F694-M697 HydrophobicContact CD2-CE 4.37Å; F694-M697 HydrophobicContact CE1-CE 3.51Å; F694-M697 HydrophobicContact CE1-SD 3.87Å; F694-M697 HydrophobicContact CG-CE 3.72Å; F694-M697 HydrophobicContact CG-SD 4.33Å; F694-M697 HydrophobicContact CZ-CE 4.18Å; F694-M697 WeakPolarHBondContact O-CB 3.4Å; F694-M697 PolarHBondContact O-N 2.7Å; F694-M698 WeakPolarHBondContact O-CG 3.35Å; F694-M698 PolarHBondContact O-N 2.69Å; F694-F908 HydrophobicContact CE1-CE2 4.19Å
695	L	87.8	Confident	86.7	Confident	1 Å²	1	21 Å²	21	1%	0.005	11%	0.111	C	C	.	.	H	α-helix	trans	-61.5	-37	173	-75.7	179.6	0	0	0	112.6	L250 V286 I289 I290 L691 M692 A693 M697 M698 V716	L250-L695 HydrophobicContact CD2-CD1 3.59Å; V286-L695 HydrophobicContact CG1-CD1 4.16Å; V286-L695 HydrophobicContact CG1-CD2 4.11Å; V286-L695 HydrophobicContact CG1-CG 4.01Å; V286-L695 HydrophobicContact CG2-CD1 4.07Å; I289-L695 HydrophobicContact CB-CD2 4.04Å; I289-L695 HydrophobicContact CD1-CD1 4.16Å; I289-L695 HydrophobicContact CG2-CD2 3.64Å; I290-L695 HydrophobicContact CD1-CD2 4.3Å; I290-L695 HydrophobicContact CG1-CD2 3.75Å; L691-L695 PolarHBondContact O-N 3.3Å; M692-L695 HydrophobicContact CE-CB 4.41Å; M692-L695 HydrophobicContact CE-CD1 3.69Å; M692-L695 PolarHBondContact O-N 3.34Å; M692-L695 HydrophobicContact SD-CD1 4.08Å; A693-L695 PolarHBondContact O-N 2.85Å; L695-M697 VanDerWaalsContact C-N 3.29Å; L695-M697 PolarHBondContact O-N 2.79Å; L695-M698 PolarHBondContact O-N 3.14Å; L695-M698 VanDerWaalsContact O-N 3.15Å; L695-V716 HydrophobicContact CB-CG2 4.3Å
696	S	87.9	Confident	86.6	Confident	2 Å²	2	21.5 Å²	21.5	1%	0.014	12%	0.115	C	C	.	.	H	α-helix	trans	-62.8	-33.2	176.2	82.3	0	0	0	0	113.1	M692 A693 F694 V699	M692-S696 PolarHBondContact O-N 2.73Å; A693-S696 WeakPolarHBondContact O-CB 3.29Å; A693-S696 PolarHBondContact O-N 2.84Å; A693-S696 PolarHBondContact O-OG 3.27Å; F694-S696 VanDerWaalsContact C-N 3.3Å; F694-S696 PolarHBondContact O-N 2.97Å; S696-V699 WeakPolarHBondContact O-CB 3.38Å; S696-V699 WeakPolarHBondContact O-CG2 3.48Å
697	M	87.3	Confident	86.5	Confident	4 Å²	4	23 Å²	23	2%	0.02	14%	0.135	C	C	.	.	H	α-helix	trans	-67.9	-36.4	175.1	-50.3	170.8	-152.1	0	0	111.6	A693 F694 L695 V699 F700 F908 T911	A693-M697 WeakPolarHBondContact O-CG 3.33Å; A693-M697 PolarHBondContact O-N 3.03Å; F694-M697 HydrophobicContact CB-CE 4.24Å; F694-M697 HydrophobicContact CD1-CE 3.25Å; F694-M697 HydrophobicContact CD1-SD 3.47Å; F694-M697 WeakPolarHBondContact CD1-SD 3.33Å; F694-M697 HydrophobicContact CD2-CE 4.37Å; F694-M697 HydrophobicContact CE1-CE 3.51Å; F694-M697 HydrophobicContact CE1-SD 3.87Å; F694-M697 HydrophobicContact CG-CE 3.72Å; F694-M697 HydrophobicContact CG-SD 4.33Å; F694-M697 HydrophobicContact CZ-CE 4.18Å; F694-M697 WeakPolarHBondContact O-CB 3.4Å; F694-M697 PolarHBondContact O-N 2.7Å; L695-M697 VanDerWaalsContact C-N 3.29Å; L695-M697 PolarHBondContact O-N 2.79Å; M697-V699 PolarHBondContact O-N 2.96Å; M697-F700 PolarHBondContact O-N 2.92Å; M697-F700 VanDerWaalsContact O-N 3.15Å; M697-F908 HydrophobicContact SD-CB 4.44Å; M697-F908 HydrophobicContact SD-CD2 3.78Å; M697-T911 HydrophobicContact CE-CG2 3.95Å; M697-T911 WeakPolarHBondContact CE-OG1 3.41Å; M697-T911 HydrophobicContact CG-CG2 4.43Å; M697-T911 PolarHBondContact SD-OG1 3.38Å
698	M	86.7	Confident	86.5	Confident	51 Å²	51	21.1 Å²	21.1	25%	0.251	13%	0.125	S	C	.	.	H	α-helix	trans	-71.5	-13.1	-175.4	-64.5	-63	156.4	0	0	113.4	I290 I293 F694 L695 F700 Y701 L702	I290-M698 HydrophobicContact CG1-CG 4.39Å; I293-M698 HydrophobicContact CD1-CB 3.93Å; F694-M698 WeakPolarHBondContact O-CG 3.35Å; F694-M698 PolarHBondContact O-N 2.69Å; L695-M698 PolarHBondContact O-N 3.14Å; L695-M698 VanDerWaalsContact O-N 3.15Å; M698-F700 PolarHBondContact O-N 3.27Å; M698-Y701 WeakPolarHBondContact O-CA 3.29Å; M698-Y701 WeakPolarHBondContact O-CB 3.43Å; M698-Y701 PolarHBondContact O-N 3.3Å; M698-L702 PolarHBondContact O-N 2.66Å
699	V	90.3	Very high	86.7	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-39.4	167	-179.2	0	0	0	0	111.5	S696 M697 Y701 L702 K709 L712 T713 T755 T759	S696-V699 WeakPolarHBondContact O-CB 3.38Å; S696-V699 WeakPolarHBondContact O-CG2 3.48Å; M697-V699 PolarHBondContact O-N 2.96Å; V699-Y701 PolarHBondContact O-N 2.97Å; V699-L702 PolarHBondContact O-N 2.84Å; V699-K709 HydrophobicContact CG1-CB 4.47Å; V699-K709 HydrophobicContact CG1-CG 4.42Å; V699-K709 VanDerWaalsContact O-CE 3.23Å; V699-K709 WeakPolarHBondContact O-CE 3.28Å; V699-K709 PolarHBondContact O-NZ 2.9Å; V699-L712 HydrophobicContact CG2-CD2 3.84Å; V699-L712 HydrophobicContact CG2-CG 3.96Å; V699-T713 VanDerWaalsContact CG1-OG1 3.3Å; V699-T713 WeakPolarHBondContact CG1-OG1 3.13Å; V699-T755 HydrophobicContact CB-CG2 4.4Å; V699-T755 HydrophobicContact CG1-CG2 4.36Å; V699-T759 HydrophobicContact CG1-CG2 3.7Å
700	F	90.8	Very high	86.9	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-5	176.4	-59.2	-67.7	0	0	0	113.6	M697 M698 T755 V758 T759 I762 D900 L903 L904 F907	M697-F700 PolarHBondContact O-N 2.92Å; M697-F700 VanDerWaalsContact O-N 3.15Å; M698-F700 PolarHBondContact O-N 3.27Å; F700-T755 HydrophobicContact CE1-CG2 4.42Å; F700-T755 HydrophobicContact CE2-CG2 3.9Å; F700-T755 HydrophobicContact CZ-CG2 3.71Å; F700-V758 HydrophobicContact CE1-CG1 4.19Å; F700-T759 HydrophobicContact CD1-CG2 4.45Å; F700-T759 HydrophobicContact CE1-CG2 4.04Å; F700-I762 HydrophobicContact CD1-CD1 4.11Å; F700-I762 HydrophobicContact CE1-CD1 4.08Å; F700-D900 WeakPolarHBondContact CA-OD1 3.44Å; F700-L903 HydrophobicContact CD1-CB 4Å; F700-L903 HydrophobicContact CE1-CB 3.96Å; F700-L903 HydrophobicContact CE1-CD1 4.19Å; F700-L903 HydrophobicContact CG-CB 4.41Å; F700-L903 HydrophobicContact CZ-CB 4.33Å; F700-L904 HydrophobicContact CB-CB 3.8Å; F700-L904 HydrophobicContact CB-CD1 4.4Å; F700-L904 HydrophobicContact CB-CG 4.35Å; F700-F907 HydrophobicContact CD2-CB 4.42Å; F700-F907 HydrophobicContact CD2-CG 4.43Å; F700-F907 HydrophobicContact CE2-CB 4.05Å; F700-F907 AromaticContact CE2-CD1 3.94Å; F700-F907 HydrophobicContact CE2-CD1 3.94Å; F700-F907 AromaticContact CE2-CD2 3.73Å; F700-F907 HydrophobicContact CE2-CD2 3.73Å; F700-F907 HydrophobicContact CE2-CE1 4.33Å; F700-F907 HydrophobicContact CE2-CE2 4.14Å; F700-F907 AromaticContact CE2-CG 3.61Å; F700-F907 HydrophobicContact CE2-CG 3.61Å; F700-F907 HydrophobicContact CE2-CZ 4.42Å; F700-F907 AromaticContact CZ-CD2 3.94Å; F700-F907 HydrophobicContact CZ-CD2 3.94Å; F700-F907 HydrophobicContact CZ-CE1 4.48Å; F700-F907 AromaticContact CZ-CE2 3.92Å; F700-F907 HydrophobicContact CZ-CE2 3.92Å; F700-F907 HydrophobicContact CZ-CG 4.25Å; F700-F907 HydrophobicContact CZ-CZ 4.19Å
701	Y	88.4	Confident	86.9	Confident	81 Å²	81	25 Å²	25	32%	0.318	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-32	172.2	-166.3	-79.4	0	0	0	112	I293 N297 M698 V699 R901 L904	I293-Y701 HydrophobicContact CG2-CD1 3.91Å; N297-Y701 HydrophobicContact CB-CD1 4.08Å; N297-Y701 HydrophobicContact CB-CE1 3.6Å; N297-Y701 WeakPolarHBondContact ND2-CE1 3.22Å; N297-Y701 PolarHBondContact ND2-OH 3.22Å; M698-Y701 WeakPolarHBondContact O-CA 3.29Å; M698-Y701 WeakPolarHBondContact O-CB 3.43Å; M698-Y701 PolarHBondContact O-N 3.3Å; V699-Y701 PolarHBondContact O-N 2.97Å; Y701-R901 PolarHBondContact O-NH2 3.27Å; Y701-L904 HydrophobicContact CD2-CD1 3.99Å; Y701-L904 HydrophobicContact CG-CD1 4.46Å
702	L	87.4	Confident	86.9	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	14%	0.136	C	C	.	.	S	Bend	trans	-63.1	140.8	177.5	-168.9	70.5	0	0	0	110.8	I243 I293 L296 M698 V699 E708 K709	I243-L702 HydrophobicContact CD1-CD1 3.62Å; I243-L702 HydrophobicContact CD1-CD2 3.8Å; I243-L702 HydrophobicContact CD1-CG 4.41Å; I293-L702 HydrophobicContact CB-CD1 4.46Å; I293-L702 HydrophobicContact CG1-CD1 4.25Å; I293-L702 HydrophobicContact CG2-CB 4.22Å; I293-L702 HydrophobicContact CG2-CD1 4.2Å; L296-L702 HydrophobicContact CB-CD1 4.07Å; L296-L702 HydrophobicContact CD1-CD1 4.09Å; M698-L702 PolarHBondContact O-N 2.66Å; V699-L702 PolarHBondContact O-N 2.84Å; L702-E708 HydrophobicContact CD2-CB 4.21Å; L702-K709 HydrophobicContact CB-CG 4.44Å; L702-K709 HydrophobicContact CD2-CG 4Å; L702-K709 HydrophobicContact CG-CG 4.49Å; L702-K709 WeakPolarHBondContact O-CE 3.21Å; L702-K709 PolarHBondContact O-NZ 2.86Å; L702-K709 VanDerWaalsContact O-NZ 3.08Å
703	P	85.7	Confident	87	Confident	14 Å²	14	23.2 Å²	23.2	9%	0.091	14%	0.136	C	C	.	.			trans	-79.3	137.3	175.4	29	-30.5	0	0	0	111.6	F300 C705 A706	F300-P703 HydrophobicContact CB-CB 4.33Å; F300-P703 HydrophobicContact CB-CG 3.77Å; F300-P703 HydrophobicContact CD2-CG 4.13Å; F300-P703 HydrophobicContact CG-CG 4.32Å; P703-C705 PolarHBondContact O-N 2.94Å; P703-A706 WeakPolarHBondContact O-CB 3.36Å; P703-A706 PolarHBondContact O-N 2.95Å
704	A	85.4	Confident	87.2	Confident	14 Å²	14	26.9 Å²	26.9	12%	0.116	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-59.3	-20	178.3	0	0	0	0	0	114	A706 F766	A704-A706 PolarHBondContact O-N 3.3Å; A704-F766 HydrophobicContact CB-CB 4.33Å; A704-F766 HydrophobicContact CB-CD1 4.15Å; A704-F766 HydrophobicContact CB-CD2 3.97Å; A704-F766 HydrophobicContact CB-CE2 4.32Å; A704-F766 HydrophobicContact CB-CG 3.88Å
705	C	80.6	Confident	87.2	Confident	67 Å²	67	25.7 Å²	25.7	45%	0.453	15%	0.151	S	C	.	.	G	3₁₀ helix	trans	-55.9	-26.5	171.7	-52.2	0	0	0	0	114.1	F300 P703 F766	F300-C705 HydrophobicContact CB-CB 4.38Å; F300-C705 HydrophobicContact CD1-CB 3.95Å; F300-C705 HydrophobicContact CE1-CB 4.43Å; F300-C705 HydrophobicContact CG-CB 4.16Å; P703-C705 PolarHBondContact O-N 2.94Å; C705-F766 HydrophobicContact CB-CZ 4.48Å; C705-F766 VanDerWaalsContact SG-CZ 3.5Å
706	A	80.1	Confident	87.2	Confident	13 Å²	13	25.7 Å²	25.7	11%	0.107	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-82.8	-7	-170	0	0	0	0	0	114.6	F300 P703 A704 E708	F300-A706 HydrophobicContact CD2-CB 4Å; F300-A706 HydrophobicContact CE2-CB 3.69Å; F300-A706 HydrophobicContact CZ-CB 4.46Å; P703-A706 WeakPolarHBondContact O-CB 3.36Å; P703-A706 PolarHBondContact O-N 2.95Å; A704-A706 PolarHBondContact O-N 3.3Å; A706-E708 PolarHBondContact O-N 2.84Å
707	G	83.6	Confident	87.3	Confident	48 Å²	48	27 Å²	27	50%	0.495	16%	0.158	S	C	.	.	S	Bend	trans	76.5	-47.9	-174	0	0	0	0	0	114.1	K709	G707-K709 PolarHBondContact O-N 3.37Å
708	E	85.3	Confident	87.4	Confident	20 Å²	20	31 Å²	31	9%	0.093	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	6.4	-164.5	-61.2	-45.1	124.6	0	0	118.4	S240 I243 T244 L702 A706 I710 T711 L712	S240-E708 WeakPolarHBondContact CB-OE1 3.5Å; S240-E708 WeakPolarHBondContact O-CG 3.4Å; I243-E708 HydrophobicContact CB-CB 4.2Å; I243-E708 HydrophobicContact CB-CG 4.25Å; I243-E708 HydrophobicContact CD1-CB 4.02Å; I243-E708 HydrophobicContact CG2-CB 4.3Å; T244-E708 PolarHBondContact OG1-OE2 2.87Å; L702-E708 HydrophobicContact CD2-CB 4.21Å; A706-E708 PolarHBondContact O-N 2.84Å; E708-I710 PolarHBondContact O-N 2.9Å; E708-T711 WeakPolarHBondContact OE2-CB 3.26Å; E708-T711 WeakPolarHBondContact OE2-CG2 3.11Å; E708-T711 PolarHBondContact OE2-OG1 2.71Å; E708-L712 VanDerWaalsContact O-CB 3.25Å; E708-L712 WeakPolarHBondContact O-CB 3.4Å; E708-L712 PolarHBondContact O-N 2.9Å
709	K	89.2	Confident	87.4	Confident	2 Å²	2	28.7 Å²	28.7	1%	0.009	17%	0.168	C	C	.	.	H	α-helix	trans	-59.5	-45.5	177.1	-82	-159.3	174	-167.1	0	112.7	V699 L702 G707 T713 I763 D900	V699-K709 HydrophobicContact CG1-CB 4.47Å; V699-K709 HydrophobicContact CG1-CG 4.42Å; V699-K709 VanDerWaalsContact O-CE 3.23Å; V699-K709 WeakPolarHBondContact O-CE 3.28Å; V699-K709 PolarHBondContact O-NZ 2.9Å; L702-K709 HydrophobicContact CB-CG 4.44Å; L702-K709 HydrophobicContact CD2-CG 4Å; L702-K709 HydrophobicContact CG-CG 4.49Å; L702-K709 WeakPolarHBondContact O-CE 3.21Å; L702-K709 PolarHBondContact O-NZ 2.86Å; L702-K709 VanDerWaalsContact O-NZ 3.08Å; G707-K709 PolarHBondContact O-N 3.37Å; K709-T713 PolarHBondContact O-N 2.76Å; K709-T713 PolarHBondContact O-OG1 3.14Å; K709-I763 HydrophobicContact CB-CD1 4.25Å; K709-D900 IonicContact NZ-OD1 2.69Å; K709-D900 PolarHBondContact NZ-OD1 2.72Å; K709-D900 IonicContact NZ-OD2 3.71Å; K709-D900 PolarHBondContact NZ-OD2 3.18Å
710	I	90	Very high	87.3	Confident	66 Å²	66	29 Å²	29	34%	0.338	17%	0.169	S	C	.	.	H	α-helix	trans	-71.9	-45.9	-176.9	-59.3	-179.1	0	0	0	109.4	E708 L712 T713 L714 V760 I763	E708-I710 PolarHBondContact O-N 2.9Å; I710-L712 PolarHBondContact O-N 3.36Å; I710-T713 PolarHBondContact O-N 3.48Å; I710-L714 HydrophobicContact CG2-CD1 3.71Å; I710-L714 HydrophobicContact CG2-CG 4.11Å; I710-L714 WeakPolarHBondContact O-CB 3.34Å; I710-L714 WeakPolarHBondContact O-CG 3.49Å; I710-L714 PolarHBondContact O-N 3.41Å; I710-V760 HydrophobicContact CD1-CG2 4.39Å; I710-I763 HydrophobicContact CD1-CD1 3.77Å; I710-I763 HydrophobicContact CG1-CD1 3.66Å
711	T	88	Confident	87.1	Confident	43 Å²	43	31.4 Å²	31.4	26%	0.264	18%	0.184	S	C	.	.	H	α-helix	trans	-53.4	-52.1	176.2	-33.1	0	0	0	0	112.2	T244 E708 T713 L714 N715	T244-T711 HydrophobicContact CG2-CG2 4.37Å; E708-T711 WeakPolarHBondContact OE2-CB 3.26Å; E708-T711 WeakPolarHBondContact OE2-CG2 3.11Å; E708-T711 PolarHBondContact OE2-OG1 2.71Å; T711-T713 VanDerWaalsContact C-N 3.35Å; T711-T713 PolarHBondContact O-N 2.95Å; T711-L714 PolarHBondContact O-N 3.22Å; T711-N715 WeakPolarHBondContact O-CB 3.29Å; T711-N715 VanDerWaalsContact O-CG 3.32Å; T711-N715 PolarHBondContact O-N 3.09Å
712	L	87.3	Confident	87	Confident	1 Å²	1	28.9 Å²	28.9	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-58.6	-46.1	178.4	177.6	60.2	0	0	0	111.3	I243 V247 I289 I293 V699 E708 I710 V716	I243-L712 HydrophobicContact CG2-CB 4.09Å; I243-L712 HydrophobicContact CG2-CD1 4.11Å; V247-L712 HydrophobicContact CG2-CD1 3.61Å; I289-L712 HydrophobicContact CG2-CD1 4.3Å; I293-L712 HydrophobicContact CD1-CD2 3.74Å; I293-L712 HydrophobicContact CG1-CD2 4.45Å; V699-L712 HydrophobicContact CG2-CD2 3.84Å; V699-L712 HydrophobicContact CG2-CG 3.96Å; E708-L712 VanDerWaalsContact O-CB 3.25Å; E708-L712 WeakPolarHBondContact O-CB 3.4Å; E708-L712 PolarHBondContact O-N 2.9Å; I710-L712 PolarHBondContact O-N 3.36Å; L712-V716 HydrophobicContact CD1-CG2 4.26Å; L712-V716 VanDerWaalsContact O-CG2 3.23Å; L712-V716 WeakPolarHBondContact O-CG2 3.06Å; L712-V716 PolarHBondContact O-N 3.04Å
713	T	90.3	Very high	86.8	Confident	1 Å²	1	29 Å²	29	1%	0.006	18%	0.177	C	C	.	.	H	α-helix	trans	-67.7	-44.9	-176.9	-43.7	0	0	0	0	111.9	V699 K709 I710 T711 V716 L717 T755 I756	V699-T713 VanDerWaalsContact CG1-OG1 3.3Å; V699-T713 WeakPolarHBondContact CG1-OG1 3.13Å; K709-T713 PolarHBondContact O-N 2.76Å; K709-T713 PolarHBondContact O-OG1 3.14Å; I710-T713 PolarHBondContact O-N 3.48Å; T711-T713 VanDerWaalsContact C-N 3.35Å; T711-T713 PolarHBondContact O-N 2.95Å; T713-V716 PolarHBondContact O-N 2.86Å; T713-L717 PolarHBondContact O-N 2.75Å; T713-T755 HydrophobicContact CG2-CG2 3.81Å; T713-I756 HydrophobicContact CG2-CB 4.49Å; T713-I756 HydrophobicContact CG2-CD1 4.31Å; T713-I756 HydrophobicContact CG2-CG1 3.38Å
714	L	91	Very high	86.7	Confident	81 Å²	81	31.8 Å²	31.8	42%	0.424	19%	0.191	S	C	.	.	H	α-helix	trans	-63.1	-41.1	178.1	-70.9	177	0	0	0	112.3	I710 T711 L717 L718 I756	I710-L714 HydrophobicContact CG2-CD1 3.71Å; I710-L714 HydrophobicContact CG2-CG 4.11Å; I710-L714 WeakPolarHBondContact O-CB 3.34Å; I710-L714 WeakPolarHBondContact O-CG 3.49Å; I710-L714 PolarHBondContact O-N 3.41Å; T711-L714 PolarHBondContact O-N 3.22Å; L714-L717 WeakPolarHBondContact O-CB 3.34Å; L714-L717 PolarHBondContact O-N 2.85Å; L714-L718 PolarHBondContact O-N 2.96Å; L714-I756 HydrophobicContact CD2-CD1 4.01Å
715	N	87.4	Confident	86.7	Confident	30 Å²	30	35.4 Å²	35.4	16%	0.16	21%	0.208	C	C	.	.	H	α-helix	trans	-70.6	-36.2	178.9	-71.1	3.1	0	0	0	111.9	V247 N248 T711 L718 S719	V247-N715 HydrophobicContact CG1-CB 3.41Å; V247-N715 VanDerWaalsContact CG1-CB 3.41Å; N248-N715 PolarHBondContact OD1-ND2 3.21Å; T711-N715 WeakPolarHBondContact O-CB 3.29Å; T711-N715 VanDerWaalsContact O-CG 3.32Å; T711-N715 PolarHBondContact O-N 3.09Å; N715-L718 PolarHBondContact O-N 3.02Å; N715-S719 PolarHBondContact O-N 3.34Å
716	V	88.3	Confident	86.8	Confident	1 Å²	1	33 Å²	33	1%	0.006	19%	0.191	C	C	.	.	H	α-helix	trans	-62.4	-43.5	170.4	174.7	0	0	0	0	110.3	M692 L695 L712 T713 L718 S719 L720 N752	M692-V716 HydrophobicContact CE-CB 4.17Å; M692-V716 HydrophobicContact CE-CG1 3.85Å; M692-V716 HydrophobicContact CE-CG2 3.78Å; L695-V716 HydrophobicContact CB-CG2 4.3Å; L712-V716 HydrophobicContact CD1-CG2 4.26Å; L712-V716 VanDerWaalsContact O-CG2 3.23Å; L712-V716 WeakPolarHBondContact O-CG2 3.06Å; L712-V716 PolarHBondContact O-N 3.04Å; T713-V716 PolarHBondContact O-N 2.86Å; V716-L718 PolarHBondContact O-N 2.97Å; V716-S719 PolarHBondContact O-N 2.9Å; V716-S719 PolarHBondContact O-OG 3.24Å; V716-L720 HydrophobicContact CG1-CD1 4.12Å; V716-L720 WeakPolarHBondContact O-CG 3.02Å; V716-L720 PolarHBondContact O-N 3.23Å; V716-N752 WeakPolarHBondContact CG1-ND2 3.36Å
717	L	90.4	Very high	86.9	Confident	31 Å²	31	32.8 Å²	32.8	16%	0.162	19%	0.188	C	C	.	.	H	α-helix	trans	-57.6	-46.5	174.6	-173.6	71.4	0	0	0	111.9	T713 L714 S719 L720 V721 F749 N752 I753 I756	T713-L717 PolarHBondContact O-N 2.75Å; L714-L717 WeakPolarHBondContact O-CB 3.34Å; L714-L717 PolarHBondContact O-N 2.85Å; L717-S719 VanDerWaalsContact C-N 3.34Å; L717-S719 PolarHBondContact O-N 3.05Å; L717-L720 PolarHBondContact O-N 3.01Å; L717-V721 WeakPolarHBondContact O-CG2 3.4Å; L717-V721 PolarHBondContact O-N 3.15Å; L717-F749 HydrophobicContact CD1-CD2 3.62Å; L717-F749 HydrophobicContact CD1-CE2 3.65Å; L717-F749 HydrophobicContact CG-CE2 4.4Å; L717-N752 HydrophobicContact CD1-CB 4.05Å; L717-I753 HydrophobicContact CD1-CG1 4.32Å; L717-I756 HydrophobicContact CB-CD1 4.47Å; L717-I756 HydrophobicContact CD2-CD1 3.76Å
718	L	89.9	Confident	86.8	Confident	86 Å²	86	34.3 Å²	34.3	45%	0.45	19%	0.191	S	C	.	.	H	α-helix	trans	-59.5	-43.8	178.4	-179.6	58.7	0	0	0	111.7	L251 L714 N715 V716 L720 V721 V722	L251-L718 HydrophobicContact CD1-CG 4.47Å; L251-L718 HydrophobicContact CD2-CD2 3.75Å; L251-L718 HydrophobicContact CD2-CG 4.35Å; L714-L718 PolarHBondContact O-N 2.96Å; N715-L718 PolarHBondContact O-N 3.02Å; V716-L718 PolarHBondContact O-N 2.97Å; L718-L720 VanDerWaalsContact C-N 3.35Å; L718-L720 PolarHBondContact O-N 2.83Å; L718-V721 PolarHBondContact O-N 2.91Å; L718-V722 WeakPolarHBondContact O-CG2 2.82Å; L718-V722 PolarHBondContact O-N 2.84Å
719	S	86.4	Confident	86.7	Confident	3 Å²	3	40 Å²	40	2%	0.021	22%	0.215	C	C	.	.	H	α-helix	trans	-63.8	-37	176.5	73.6	0	0	0	0	113	M692 N715 V716 L717 V722 F723	M692-S719 WeakPolarHBondContact CE-OG 3.43Å; N715-S719 PolarHBondContact O-N 3.34Å; V716-S719 PolarHBondContact O-N 2.9Å; V716-S719 PolarHBondContact O-OG 3.24Å; L717-S719 VanDerWaalsContact C-N 3.34Å; L717-S719 PolarHBondContact O-N 3.05Å; S719-V722 WeakPolarHBondContact O-CB 3.31Å; S719-V722 PolarHBondContact O-N 3.21Å; S719-F723 VanDerWaalsContact O-CD2 3.24Å; S719-F723 WeakPolarHBondContact O-CD2 3.24Å; S719-F723 PolarHBondContact O-N 3.44Å
720	L	87.3	Confident	86.3	Confident	6 Å²	6	42 Å²	42	3%	0.031	23%	0.225	C	C	.	.	H	α-helix	trans	-66	-38.4	175.9	-71.4	166.4	0	0	0	111.7	M692 V716 L717 L718 V722 F723 L724 T748 N752	M692-L720 HydrophobicContact CB-CD2 3.98Å; M692-L720 HydrophobicContact CB-CG 4.49Å; V716-L720 HydrophobicContact CG1-CD1 4.12Å; V716-L720 WeakPolarHBondContact O-CG 3.02Å; V716-L720 PolarHBondContact O-N 3.23Å; L717-L720 PolarHBondContact O-N 3.01Å; L718-L720 VanDerWaalsContact C-N 3.35Å; L718-L720 PolarHBondContact O-N 2.83Å; L720-V722 VanDerWaalsContact C-N 3.34Å; L720-F723 PolarHBondContact O-N 2.68Å; L720-L724 PolarHBondContact O-N 2.88Å; L720-T748 HydrophobicContact CD1-CG2 3.92Å; L720-T748 HydrophobicContact CD2-CG2 3.81Å; L720-N752 HydrophobicContact CD1-CB 4.24Å
721	V	88.3	Confident	86	Confident	51 Å²	51	39.5 Å²	39.5	31%	0.309	21%	0.213	S	C	.	.	H	α-helix	trans	-63.9	-39.5	172.4	174	0	0	0	0	111.1	L717 L718 F723 L724 L725 F749	L717-V721 WeakPolarHBondContact O-CG2 3.4Å; L717-V721 PolarHBondContact O-N 3.15Å; L718-V721 PolarHBondContact O-N 2.91Å; V721-F723 PolarHBondContact O-N 2.9Å; V721-L724 PolarHBondContact O-N 2.84Å; V721-L725 HydrophobicContact CG1-CD1 4.25Å; V721-L725 WeakPolarHBondContact O-CG 3.28Å; V721-L725 PolarHBondContact O-N 2.99Å; V721-F749 HydrophobicContact CG2-CD2 4.28Å; V721-F749 HydrophobicContact CG2-CE2 3.73Å
722	V	85.9	Confident	85.7	Confident	28 Å²	28	38 Å²	38	17%	0.17	20%	0.204	C	C	.	.	H	α-helix	trans	-63.3	-39.6	175.5	169.7	0	0	0	0	111.8	V254 L258 L718 S719 L720 L725 L726	V254-V722 HydrophobicContact CG1-CG1 3.77Å; L258-V722 HydrophobicContact CD1-CG1 3.55Å; L258-V722 HydrophobicContact CG-CG1 4.46Å; L718-V722 WeakPolarHBondContact O-CG2 2.82Å; L718-V722 PolarHBondContact O-N 2.84Å; S719-V722 WeakPolarHBondContact O-CB 3.31Å; S719-V722 PolarHBondContact O-N 3.21Å; L720-V722 VanDerWaalsContact C-N 3.34Å; V722-L725 PolarHBondContact O-N 3.23Å; V722-L726 PolarHBondContact O-N 2.67Å
723	F	83.1	Confident	85.4	Confident	3 Å²	3	44.1 Å²	44.1	1%	0.013	24%	0.244	C	C	.	.	H	α-helix	trans	-67.5	-38.8	172	-78.9	-67.1	0	0	0	113.1	V254 L685 P688 T689 M692 S719 L720 V721 L725 L726 V727	V254-F723 HydrophobicContact CB-CE2 4.48Å; V254-F723 HydrophobicContact CB-CZ 4.35Å; V254-F723 HydrophobicContact CG1-CD2 4.35Å; V254-F723 HydrophobicContact CG1-CE1 4.18Å; V254-F723 HydrophobicContact CG1-CE2 3.83Å; V254-F723 HydrophobicContact CG1-CZ 3.73Å; V254-F723 HydrophobicContact CG2-CE2 3.71Å; V254-F723 HydrophobicContact CG2-CZ 3.73Å; L685-F723 HydrophobicContact CD1-CD1 4.43Å; P688-F723 HydrophobicContact CB-CE1 3.95Å; P688-F723 HydrophobicContact CB-CE2 4.23Å; P688-F723 HydrophobicContact CB-CZ 3.47Å; P688-F723 VanDerWaalsContact CB-CZ 3.47Å; P688-F723 HydrophobicContact CG-CZ 4.45Å; T689-F723 HydrophobicContact CG2-CB 4.05Å; T689-F723 HydrophobicContact CG2-CD1 4.14Å; T689-F723 HydrophobicContact CG2-CD2 4.11Å; T689-F723 HydrophobicContact CG2-CG 3.85Å; M692-F723 HydrophobicContact CG-CE2 4.2Å; S719-F723 VanDerWaalsContact O-CD2 3.24Å; S719-F723 WeakPolarHBondContact O-CD2 3.24Å; S719-F723 PolarHBondContact O-N 3.44Å; L720-F723 PolarHBondContact O-N 2.68Å; V721-F723 PolarHBondContact O-N 2.9Å; F723-L725 VanDerWaalsContact C-N 3.28Å; F723-L725 PolarHBondContact O-N 3.17Å; F723-L726 WeakPolarHBondContact O-CB 3.37Å; F723-L726 PolarHBondContact O-N 2.93Å; F723-V727 PolarHBondContact O-N 2.91Å
724	L	84	Confident	84.8	Confident	72 Å²	72	46 Å²	46	38%	0.377	26%	0.256	S	S	.	.	H	α-helix	trans	-60.6	-39.1	175.5	-171	67	0	0	0	111.7	L720 V721 L726 V727 S728 L745	L720-L724 PolarHBondContact O-N 2.88Å; V721-L724 PolarHBondContact O-N 2.84Å; L724-L726 VanDerWaalsContact C-N 3.26Å; L724-L726 PolarHBondContact O-N 2.87Å; L724-V727 PolarHBondContact O-N 2.88Å; L724-S728 PolarHBondContact O-N 3.35Å; L724-L745 HydrophobicContact CD1-CB 4.13Å; L724-L745 HydrophobicContact CD1-CD1 4.09Å
725	L	85.2	Confident	84.2	Confident	90 Å²	90	48.3 Å²	48.3	47%	0.471	28%	0.278	S	S	.	.	H	α-helix	trans	-71.7	-10.1	174.7	-69.9	172.6	0	0	0	114.8	V721 V722 F723 K729	V721-L725 HydrophobicContact CG1-CD1 4.25Å; V721-L725 WeakPolarHBondContact O-CG 3.28Å; V721-L725 PolarHBondContact O-N 2.99Å; V722-L725 PolarHBondContact O-N 3.23Å; F723-L725 VanDerWaalsContact C-N 3.28Å; F723-L725 PolarHBondContact O-N 3.17Å; L725-K729 VanDerWaalsContact O-CD 3.23Å; L725-K729 WeakPolarHBondContact O-CD 3.18Å; L725-K729 WeakPolarHBondContact O-CE 3.25Å; L725-K729 WeakPolarHBondContact O-CG 3.41Å
726	L	82.1	Confident	83.7	Confident	18 Å²	18	51.4 Å²	51.4	9%	0.094	30%	0.302	C	S	.	.	H	α-helix	trans	-82.7	-50.3	165.3	174.3	64.9	0	0	0	110	L258 L685 V722 F723 L724 S728 K729 I730	L258-L726 HydrophobicContact CD2-CB 3.88Å; L258-L726 HydrophobicContact CD2-CD1 4.14Å; L258-L726 HydrophobicContact CD2-CD2 3.59Å; L258-L726 HydrophobicContact CD2-CG 4.05Å; L685-L726 HydrophobicContact CD1-CD2 3.84Å; V722-L726 PolarHBondContact O-N 2.67Å; F723-L726 WeakPolarHBondContact O-CB 3.37Å; F723-L726 PolarHBondContact O-N 2.93Å; L724-L726 VanDerWaalsContact C-N 3.26Å; L724-L726 PolarHBondContact O-N 2.87Å; L726-S728 VanDerWaalsContact C-N 3.29Å; L726-S728 PolarHBondContact O-N 2.97Å; L726-K729 PolarHBondContact O-N 2.77Å; L726-I730 HydrophobicContact CD1-CD1 3.82Å; L726-I730 HydrophobicContact CD1-CG1 4.23Å; L726-I730 HydrophobicContact CD2-CD1 4.34Å; L726-I730 HydrophobicContact CG-CD1 3.83Å; L726-I730 PolarHBondContact O-N 2.78Å
727	V	83	Confident	83.5	Confident	8 Å²	8	53.1 Å²	53.1	5%	0.048	31%	0.313	C	S	.	.	H	α-helix	trans	-58.1	-43.2	-178.2	179	0	0	0	0	111.2	L685 F723 L724 K729 I730 L731 L745	L685-V727 HydrophobicContact CD1-CG2 3.73Å; L685-V727 HydrophobicContact CD2-CG2 3.85Å; L685-V727 HydrophobicContact CG-CG2 4.32Å; F723-V727 PolarHBondContact O-N 2.91Å; L724-V727 PolarHBondContact O-N 2.88Å; V727-K729 PolarHBondContact O-N 3.27Å; V727-I730 PolarHBondContact O-N 2.88Å; V727-L731 HydrophobicContact CG1-CD1 3.68Å; V727-L731 HydrophobicContact CG1-CG 4.24Å; V727-L731 PolarHBondContact O-N 2.76Å; V727-L731 VanDerWaalsContact O-N 3.09Å; V727-L745 HydrophobicContact CB-CD1 4.35Å; V727-L745 HydrophobicContact CG2-CD1 3.63Å
728	S	80.8	Confident	83.2	Confident	79 Å²	79	56.8 Å²	56.8	55%	0.552	33%	0.331	S	S	*	.	H	α-helix	trans	-70.3	6.9	177.2	82.8	0	0	0	0	115.2	L724 L726	L724-S728 PolarHBondContact O-N 3.35Å; L726-S728 VanDerWaalsContact C-N 3.29Å; L726-S728 PolarHBondContact O-N 2.97Å
729	K	82.9	Confident	83.1	Confident	140 Å²	140	53.5 Å²	53.5	61%	0.609	32%	0.315	S	S	*	.	H	α-helix	trans	-120.4	-15.5	174.5	-68.2	176.7	-172.3	158.2	0	113.3	L725 L726 V727	L725-K729 VanDerWaalsContact O-CD 3.23Å; L725-K729 WeakPolarHBondContact O-CD 3.18Å; L725-K729 WeakPolarHBondContact O-CE 3.25Å; L725-K729 WeakPolarHBondContact O-CG 3.41Å; L726-K729 PolarHBondContact O-N 2.77Å; V727-K729 PolarHBondContact O-N 3.27Å
730	I	82	Confident	83.1	Confident	43 Å²	43	54.2 Å²	54.2	22%	0.221	32%	0.319	C	S	.	.	H	α-helix	trans	-90	-46	173.7	-63.6	172	0	0	0	109.4	F609 Y681 L726 V727	F609-I730 HydrophobicContact CZ-CG2 4.14Å; Y681-I730 HydrophobicContact CE1-CD1 4.5Å; Y681-I730 HydrophobicContact CE1-CG2 4.25Å; L726-I730 HydrophobicContact CD1-CD1 3.82Å; L726-I730 HydrophobicContact CD1-CG1 4.23Å; L726-I730 HydrophobicContact CD2-CD1 4.34Å; L726-I730 HydrophobicContact CG-CD1 3.83Å; L726-I730 PolarHBondContact O-N 2.78Å; V727-I730 PolarHBondContact O-N 2.88Å
731	L	82.3	Confident	82.9	Confident	15 Å²	15	54.4 Å²	54.4	8%	0.079	32%	0.32	C	S	.	.	S	Bend	trans	-85.1	148.8	-175.9	-59.5	-177.6	0	0	0	112.3	V606 F609 V727 P739	V606-L731 HydrophobicContact CG1-CD2 4.37Å; F609-L731 HydrophobicContact CB-CD2 4.49Å; F609-L731 HydrophobicContact CD1-CD1 4.11Å; F609-L731 HydrophobicContact CD1-CD2 3.86Å; F609-L731 HydrophobicContact CD1-CG 4.46Å; F609-L731 HydrophobicContact CD2-CD2 3.7Å; F609-L731 HydrophobicContact CE1-CD1 4.47Å; F609-L731 HydrophobicContact CE1-CD2 3.93Å; F609-L731 HydrophobicContact CE1-CG 4.46Å; F609-L731 HydrophobicContact CE2-CD2 3.76Å; F609-L731 HydrophobicContact CG-CD1 4.49Å; F609-L731 HydrophobicContact CG-CD2 3.74Å; F609-L731 HydrophobicContact CZ-CD2 3.87Å; V727-L731 HydrophobicContact CG1-CD1 3.68Å; V727-L731 HydrophobicContact CG1-CG 4.24Å; V727-L731 PolarHBondContact O-N 2.76Å; V727-L731 VanDerWaalsContact O-N 3.09Å; L731-P739 HydrophobicContact CD1-CB 3.91Å; L731-P739 HydrophobicContact CD1-CG 3.61Å
732	P	81.6	Confident	82.8	Confident	11 Å²	11	53 Å²	53	7%	0.071	31%	0.313	C	S	.	.			trans	-62.4	154.9	171	26.3	-34.8	0	0	0	111.9	E519 V606 T734	E519-P732 VanDerWaalsContact O-CB 3.27Å; E519-P732 WeakPolarHBondContact O-CB 3.26Å; E519-P732 WeakPolarHBondContact O-CD 3.33Å; E519-P732 VanDerWaalsContact O-CG 3.23Å; E519-P732 WeakPolarHBondContact O-CG 3.31Å; V606-P732 HydrophobicContact CG1-CG 3.98Å; P732-T734 HydrophobicContact CB-CG2 4.13Å; P732-T734 HydrophobicContact CG-CG2 4.09Å; P732-T734 PolarHBondContact O-N 2.97Å
733	P	81	Confident	82.8	Confident	130 Å²	130	55.2 Å²	55.2	84%	0.844	32%	0.321	S	S	*	.			trans	-78.6	46.8	174.4	35.2	-36.7	0	0	0	112.3
734	T	79	Confident	83.1	Confident	41 Å²	41	55.6 Å²	55.6	25%	0.252	32%	0.322	S	S	.	.			trans	-74.4	140.1	178	42	0	0	0	0	112.2	P732	P732-T734 HydrophobicContact CB-CG2 4.13Å; P732-T734 HydrophobicContact CG-CG2 4.09Å; P732-T734 PolarHBondContact O-N 2.97Å
735	S	77.5	Confident	83.3	Confident	128 Å²	128	52.4 Å²	52.4	90%	0.895	31%	0.305	S	S	*	.	S	Bend	trans	-106.2	1.2	179	57.9	0	0	0	0	114.6
736	S	77.4	Confident	83.3	Confident	96 Å²	96	52.6 Å²	52.6	67%	0.671	31%	0.306	S	S	*	.	S	Bend	trans	-71.4	-54.4	-178.5	43.4	0	0	0	0	112.9
737	T	83	Confident	83.6	Confident	37 Å²	37	54.6 Å²	54.6	23%	0.227	32%	0.317	C	S	.	.			trans	-128.1	136.8	-179.5	49.9	0	0	0	0	109.8	D605 E607	D605-T737 PolarHBondContact OD1-OG1 3.42Å; E607-T737 HydrophobicContact CB-CG2 4.41Å
738	I	84.2	Confident	83.9	Confident	107 Å²	107	54.6 Å²	54.6	55%	0.549	32%	0.317	S	S	.	.			trans	-85.4	120.6	171	-59.4	178.8	0	0	0	107.5	A742 K743	I738-A742 HydrophobicContact CG2-CB 4.1Å; I738-K743 HydrophobicContact CB-CG 4.42Å; I738-K743 HydrophobicContact CG2-CG 3.93Å; I738-K743 WeakPolarHBondContact O-CE 3.41Å; I738-K743 PolarHBondContact O-NZ 2.92Å
739	P	87.5	Confident	84.4	Confident	18 Å²	18	53.8 Å²	53.8	12%	0.117	30%	0.303	C	S	.	.			trans	-61.7	142	-177.3	21.1	-30	0	0	0	111.4	V606 L731 M741 A742 K743	V606-P739 HydrophobicContact CB-CB 4.18Å; V606-P739 HydrophobicContact CG2-CB 4.1Å; V606-P739 HydrophobicContact CG2-CG 4.23Å; V606-P739 WeakPolarHBondContact O-CA 3.48Å; V606-P739 VanDerWaalsContact O-CB 3.22Å; V606-P739 WeakPolarHBondContact O-CB 2.99Å; L731-P739 HydrophobicContact CD1-CB 3.91Å; L731-P739 HydrophobicContact CD1-CG 3.61Å; P739-M741 PolarHBondContact O-N 3.27Å; P739-M741 VanDerWaalsContact O-N 3.17Å; P739-A742 HydrophobicContact CG-CB 3.75Å; P739-A742 WeakPolarHBondContact O-CA 3.41Å; P739-A742 WeakPolarHBondContact O-CB 3.2Å; P739-A742 PolarHBondContact O-N 3.17Å; P739-K743 PolarHBondContact O-N 2.99Å
740	L	86.4	Confident	84.7	Confident	17 Å²	17	51.3 Å²	51.3	9%	0.089	30%	0.297	C	S	.	.	H	α-helix	trans	-54.4	-36.7	-178	-177.6	63.3	0	0	0	112.3	E607 Y608 K743 Y744 I918 A922	E607-L740 WeakPolarHBondContact O-CB 2.9Å; E607-L740 PolarHBondContact O-N 3.33Å; Y608-L740 HydrophobicContact CD1-CD2 4.45Å; L740-K743 HydrophobicContact CD1-CD 4.44Å; L740-K743 WeakPolarHBondContact O-CB 3.16Å; L740-K743 PolarHBondContact O-N 3.09Å; L740-Y744 PolarHBondContact O-N 3.27Å; L740-I918 HydrophobicContact CD1-CB 4.42Å; L740-I918 HydrophobicContact CD1-CG1 4.19Å; L740-I918 HydrophobicContact CD1-CG2 3.88Å; L740-I918 HydrophobicContact CD2-CG2 4.38Å; L740-I918 HydrophobicContact CG-CG2 3.89Å; L740-A922 HydrophobicContact CD2-CB 3.8Å
741	M	84.4	Confident	85.1	Confident	11 Å²	11	50.3 Å²	50.3	5%	0.054	29%	0.291	C	S	.	.	H	α-helix	trans	-67.8	-32.8	174.5	-165.4	58.1	-167	0	0	113.5	L685 I686 T689 P739 Y744 L745	L685-M741 HydrophobicContact CD2-CE 4.34Å; L685-M741 HydrophobicContact CD2-CG 3.85Å; L685-M741 HydrophobicContact CG-CE 4.07Å; I686-M741 HydrophobicContact CG1-CE 4.32Å; I686-M741 HydrophobicContact CG1-SD 4.16Å; T689-M741 HydrophobicContact CG2-CE 4.2Å; T689-M741 WeakPolarHBondContact OG1-CE 3.37Å; P739-M741 PolarHBondContact O-N 3.27Å; P739-M741 VanDerWaalsContact O-N 3.17Å; M741-Y744 HydrophobicContact CE-CD1 4.01Å; M741-Y744 PolarHBondContact O-N 3.39Å; M741-Y744 HydrophobicContact SD-CD1 4.27Å; M741-L745 HydrophobicContact CE-CG 4.41Å; M741-L745 WeakPolarHBondContact O-CG 3.5Å; M741-L745 PolarHBondContact O-N 3.04Å
742	A	85	Confident	85.5	Confident	21 Å²	21	49.6 Å²	49.6	17%	0.174	29%	0.288	C	S	.	.	H	α-helix	trans	-74	-35.3	171.5	0	0	0	0	0	111.8	I738 P739 Y744 L745 L746	I738-A742 HydrophobicContact CG2-CB 4.1Å; P739-A742 HydrophobicContact CG-CB 3.75Å; P739-A742 WeakPolarHBondContact O-CA 3.41Å; P739-A742 WeakPolarHBondContact O-CB 3.2Å; P739-A742 PolarHBondContact O-N 3.17Å; A742-Y744 VanDerWaalsContact C-N 3.28Å; A742-Y744 PolarHBondContact O-N 2.97Å; A742-L745 PolarHBondContact O-N 3.43Å; A742-L746 VanDerWaalsContact O-CB 3.25Å; A742-L746 WeakPolarHBondContact O-CB 3.01Å; A742-L746 PolarHBondContact O-N 3.02Å
743	K	87.4	Confident	86	Confident	75 Å²	75	52.5 Å²	52.5	33%	0.326	30%	0.302	S	S	.	.	H	α-helix	trans	-56.9	-42.8	169.5	-61.5	173.8	179.7	134.1	0	110.3	E607 I738 P739 L740 L747	E607-K743 IonicContact OE1-NZ 2.64Å; E607-K743 PolarHBondContact OE1-NZ 3.1Å; I738-K743 HydrophobicContact CB-CG 4.42Å; I738-K743 HydrophobicContact CG2-CG 3.93Å; I738-K743 WeakPolarHBondContact O-CE 3.41Å; I738-K743 PolarHBondContact O-NZ 2.92Å; P739-K743 PolarHBondContact O-N 2.99Å; L740-K743 HydrophobicContact CD1-CD 4.44Å; L740-K743 WeakPolarHBondContact O-CB 3.16Å; L740-K743 PolarHBondContact O-N 3.09Å; K743-L747 WeakPolarHBondContact O-CB 3.17Å; K743-L747 PolarHBondContact O-N 2.86Å
744	Y	88.6	Confident	86.5	Confident	10 Å²	10	50.3 Å²	50.3	4%	0.039	28%	0.282	C	S	.	.	H	α-helix	trans	-65.7	-47.5	175.3	-173.9	-115.5	0	0	0	114	V690 L740 M741 A742 L746 L747 T748 T915 I918	V690-Y744 HydrophobicContact CG2-CE1 4.16Å; L740-Y744 PolarHBondContact O-N 3.27Å; M741-Y744 HydrophobicContact CE-CD1 4.01Å; M741-Y744 PolarHBondContact O-N 3.39Å; M741-Y744 HydrophobicContact SD-CD1 4.27Å; A742-Y744 VanDerWaalsContact C-N 3.28Å; A742-Y744 PolarHBondContact O-N 2.97Å; Y744-L746 PolarHBondContact O-N 3.4Å; Y744-L747 PolarHBondContact O-N 3.03Å; Y744-T748 WeakPolarHBondContact O-CB 3.36Å; Y744-T748 PolarHBondContact O-N 3.21Å; Y744-T748 PolarHBondContact O-OG1 2.86Å; Y744-T915 HydrophobicContact CE2-CG2 4.26Å; Y744-T915 WeakPolarHBondContact CE2-OG1 3.41Å; Y744-T915 PolarHBondContact OH-OG1 3.4Å; Y744-I918 HydrophobicContact CD2-CD1 3.77Å; Y744-I918 HydrophobicContact CD2-CG2 4.38Å; Y744-I918 HydrophobicContact CG-CD1 4.42Å
745	L	87.5	Confident	87.1	Confident	6 Å²	6	48.4 Å²	48.4	3%	0.031	27%	0.27	C	S	.	.	H	α-helix	trans	-64.1	-40.3	178.9	-75.6	173.7	0	0	0	111.8	T689 L724 V727 M741 A742 T748 F749	T689-L745 HydrophobicContact CG2-CD2 3.74Å; L724-L745 HydrophobicContact CD1-CB 4.13Å; L724-L745 HydrophobicContact CD1-CD1 4.09Å; V727-L745 HydrophobicContact CB-CD1 4.35Å; V727-L745 HydrophobicContact CG2-CD1 3.63Å; M741-L745 HydrophobicContact CE-CG 4.41Å; M741-L745 WeakPolarHBondContact O-CG 3.5Å; M741-L745 PolarHBondContact O-N 3.04Å; A742-L745 PolarHBondContact O-N 3.43Å; L745-T748 PolarHBondContact O-N 3.22Å; L745-F749 VanDerWaalsContact O-CB 3.24Å; L745-F749 WeakPolarHBondContact O-CB 3.5Å; L745-F749 PolarHBondContact O-N 2.97Å
746	L	86.7	Confident	87.8	Confident	94 Å²	94	44 Å²	44	49%	0.492	24%	0.237	S	C	.	.	H	α-helix	trans	-64.3	-44.4	175.7	-179.1	61.3	0	0	0	111.8	A742 Y744 T748 F749 L750	A742-L746 VanDerWaalsContact O-CB 3.25Å; A742-L746 WeakPolarHBondContact O-CB 3.01Å; A742-L746 PolarHBondContact O-N 3.02Å; Y744-L746 PolarHBondContact O-N 3.4Å; L746-T748 VanDerWaalsContact C-N 3.34Å; L746-T748 PolarHBondContact O-N 3.22Å; L746-F749 PolarHBondContact O-N 2.91Å; L746-L750 HydrophobicContact CD1-CD1 4.21Å; L746-L750 HydrophobicContact CD1-CG 4.25Å; L746-L750 HydrophobicContact CG-CD1 4.11Å; L746-L750 WeakPolarHBondContact O-CB 3.35Å; L746-L750 VanDerWaalsContact O-CG 3.29Å; L746-L750 WeakPolarHBondContact O-CG 3.42Å; L746-L750 PolarHBondContact O-N 3.41Å
747	L	88.4	Confident	88.6	Confident	60 Å²	60	44.7 Å²	44.7	31%	0.314	23%	0.232	S	C	.	.	H	α-helix	trans	-57.6	-47.3	173.6	175.7	62.4	0	0	0	111.1	K743 Y744 F749 L750 L751 I918	K743-L747 WeakPolarHBondContact O-CB 3.17Å; K743-L747 PolarHBondContact O-N 2.86Å; Y744-L747 PolarHBondContact O-N 3.03Å; L747-F749 PolarHBondContact O-N 2.92Å; L747-L750 PolarHBondContact O-N 3Å; L747-L751 HydrophobicContact CD1-CD1 3.98Å; L747-L751 HydrophobicContact CD1-CG 4.22Å; L747-L751 HydrophobicContact CG-CD1 3.98Å; L747-L751 WeakPolarHBondContact O-CB 3.47Å; L747-L751 VanDerWaalsContact O-CG 3.26Å; L747-L751 WeakPolarHBondContact O-CG 3.04Å; L747-L751 PolarHBondContact O-N 3.43Å; L747-I918 HydrophobicContact CD2-CD1 4.23Å
748	T	88.8	Confident	89	Confident	8 Å²	8	44.3 Å²	44.3	5%	0.049	23%	0.23	C	C	.	.	H	α-helix	trans	-65.9	-38.8	-179.3	-53.9	0	0	0	0	112	A693 L720 Y744 L745 L746 N752	A693-T748 HydrophobicContact CB-CG2 3.96Å; L720-T748 HydrophobicContact CD1-CG2 3.92Å; L720-T748 HydrophobicContact CD2-CG2 3.81Å; Y744-T748 WeakPolarHBondContact O-CB 3.36Å; Y744-T748 PolarHBondContact O-N 3.21Å; Y744-T748 PolarHBondContact O-OG1 2.86Å; L745-T748 PolarHBondContact O-N 3.22Å; L746-T748 VanDerWaalsContact C-N 3.34Å; L746-T748 PolarHBondContact O-N 3.22Å; T748-N752 WeakPolarHBondContact O-CB 3.33Å; T748-N752 PolarHBondContact O-N 3.48Å
749	F	90.1	Very high	89.4	Confident	61 Å²	61	39.3 Å²	39.3	27%	0.268	20%	0.204	S	C	.	.	H	α-helix	trans	-64.8	-46.4	175.2	179.4	-103.2	0	0	0	112.1	L717 V721 L745 L746 L747 N752 I753	L717-F749 HydrophobicContact CD1-CD2 3.62Å; L717-F749 HydrophobicContact CD1-CE2 3.65Å; L717-F749 HydrophobicContact CG-CE2 4.4Å; V721-F749 HydrophobicContact CG2-CD2 4.28Å; V721-F749 HydrophobicContact CG2-CE2 3.73Å; L745-F749 VanDerWaalsContact O-CB 3.24Å; L745-F749 WeakPolarHBondContact O-CB 3.5Å; L745-F749 PolarHBondContact O-N 2.97Å; L746-F749 PolarHBondContact O-N 2.91Å; L747-F749 PolarHBondContact O-N 2.92Å; F749-N752 PolarHBondContact O-N 2.92Å; F749-I753 HydrophobicContact CD1-CD1 3.87Å; F749-I753 HydrophobicContact CE1-CD1 3.48Å; F749-I753 VanDerWaalsContact CE1-CD1 3.48Å; F749-I753 HydrophobicContact CE2-CD1 4.45Å; F749-I753 HydrophobicContact CZ-CD1 3.81Å; F749-I753 WeakPolarHBondContact O-CG1 3.49Å; F749-I753 PolarHBondContact O-N 2.85Å
750	L	90.9	Very high	89.6	Confident	89 Å²	89	42 Å²	42	47%	0.466	22%	0.22	S	C	.	.	H	α-helix	trans	-63.5	-43.8	176	-70.7	171.4	0	0	0	111.9	L746 L747 N752 I753 I754	L746-L750 HydrophobicContact CD1-CD1 4.21Å; L746-L750 HydrophobicContact CD1-CG 4.25Å; L746-L750 HydrophobicContact CG-CD1 4.11Å; L746-L750 WeakPolarHBondContact O-CB 3.35Å; L746-L750 VanDerWaalsContact O-CG 3.29Å; L746-L750 WeakPolarHBondContact O-CG 3.42Å; L746-L750 PolarHBondContact O-N 3.41Å; L747-L750 PolarHBondContact O-N 3Å; L750-N752 VanDerWaalsContact C-N 3.3Å; L750-N752 PolarHBondContact O-N 3Å; L750-I753 PolarHBondContact O-N 2.95Å; L750-I754 WeakPolarHBondContact O-CG1 3.27Å; L750-I754 PolarHBondContact O-N 2.87Å
751	L	90.4	Very high	89.9	Confident	21 Å²	21	46 Å²	46	11%	0.11	24%	0.241	C	C	.	.	H	α-helix	trans	-60.7	-39.2	174.7	-72.4	170.7	0	0	0	111.7	L747 I754 T755 F907 V910 T911	L747-L751 HydrophobicContact CD1-CD1 3.98Å; L747-L751 HydrophobicContact CD1-CG 4.22Å; L747-L751 HydrophobicContact CG-CD1 3.98Å; L747-L751 WeakPolarHBondContact O-CB 3.47Å; L747-L751 VanDerWaalsContact O-CG 3.26Å; L747-L751 WeakPolarHBondContact O-CG 3.04Å; L747-L751 PolarHBondContact O-N 3.43Å; L751-I754 PolarHBondContact O-N 2.83Å; L751-T755 PolarHBondContact O-N 2.76Å; L751-T755 PolarHBondContact O-OG1 2.72Å; L751-T755 VanDerWaalsContact O-OG1 3.11Å; L751-F907 HydrophobicContact CD2-CD1 4.49Å; L751-F907 HydrophobicContact CD2-CE1 4.19Å; L751-V910 HydrophobicContact CD1-CG1 4.11Å; L751-V910 HydrophobicContact CD2-CG1 3.9Å; L751-T911 HydrophobicContact CD1-CG2 3.87Å
752	N	90.2	Very high	90.3	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-64.9	-43.2	176.3	-165.3	-61.4	0	0	0	112.1	V716 L717 L720 T748 F749 L750 I754 T755 I756	V716-N752 WeakPolarHBondContact CG1-ND2 3.36Å; L717-N752 HydrophobicContact CD1-CB 4.05Å; L720-N752 HydrophobicContact CD1-CB 4.24Å; T748-N752 WeakPolarHBondContact O-CB 3.33Å; T748-N752 PolarHBondContact O-N 3.48Å; F749-N752 PolarHBondContact O-N 2.92Å; L750-N752 VanDerWaalsContact C-N 3.3Å; L750-N752 PolarHBondContact O-N 3Å; N752-I754 VanDerWaalsContact C-N 3.32Å; N752-I754 PolarHBondContact O-N 3.2Å; N752-T755 CarbonylContact O-C 3.55Å; N752-T755 WeakPolarHBondContact O-CA 3.41Å; N752-T755 WeakPolarHBondContact O-CB 3.33Å; N752-T755 PolarHBondContact O-N 3.07Å; N752-T755 VanDerWaalsContact O-N 3.08Å; N752-I756 WeakPolarHBondContact O-CG1 3.44Å; N752-I756 PolarHBondContact O-N 3.2Å
753	I	91.5	Very high	90.6	Very high	72 Å²	72	46.2 Å²	46.2	37%	0.369	24%	0.239	S	C	.	.	H	α-helix	trans	-58.8	-42.6	174.3	-69.9	168	0	0	0	111.5	L717 F749 L750 T755 I756 L757	L717-I753 HydrophobicContact CD1-CG1 4.32Å; F749-I753 HydrophobicContact CD1-CD1 3.87Å; F749-I753 HydrophobicContact CE1-CD1 3.48Å; F749-I753 VanDerWaalsContact CE1-CD1 3.48Å; F749-I753 HydrophobicContact CE2-CD1 4.45Å; F749-I753 HydrophobicContact CZ-CD1 3.81Å; F749-I753 WeakPolarHBondContact O-CG1 3.49Å; F749-I753 PolarHBondContact O-N 2.85Å; L750-I753 PolarHBondContact O-N 2.95Å; I753-T755 VanDerWaalsContact C-N 3.35Å; I753-I756 PolarHBondContact O-N 2.91Å; I753-L757 PolarHBondContact O-N 3.31Å; I753-L757 VanDerWaalsContact O-N 3.11Å
754	I	92	Very high	90.9	Very high	85 Å²	85	46.6 Å²	46.6	44%	0.436	25%	0.245	S	C	.	.	H	α-helix	trans	-64.9	-40.6	175.7	-59.4	164.4	0	0	0	110.1	L750 L751 N752 I756 L757 V758 F907	L750-I754 WeakPolarHBondContact O-CG1 3.27Å; L750-I754 PolarHBondContact O-N 2.87Å; L751-I754 PolarHBondContact O-N 2.83Å; N752-I754 VanDerWaalsContact C-N 3.32Å; N752-I754 PolarHBondContact O-N 3.2Å; I754-I756 VanDerWaalsContact C-N 3.34Å; I754-I756 PolarHBondContact O-N 3.03Å; I754-L757 PolarHBondContact O-N 3.3Å; I754-V758 HydrophobicContact CG2-CG2 4.02Å; I754-V758 VanDerWaalsContact O-CB 3.32Å; I754-V758 WeakPolarHBondContact O-CB 3.49Å; I754-V758 VanDerWaalsContact O-CG2 3.24Å; I754-V758 WeakPolarHBondContact O-CG2 3.44Å; I754-V758 PolarHBondContact O-N 2.85Å; I754-F907 HydrophobicContact CB-CZ 4.34Å; I754-F907 HydrophobicContact CG2-CZ 3.89Å
755	T	91.8	Very high	91	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-58.6	-40.5	173.2	-64.3	0	0	0	0	112.3	V699 F700 T713 L751 N752 I753 T759 F907	V699-T755 HydrophobicContact CB-CG2 4.4Å; V699-T755 HydrophobicContact CG1-CG2 4.36Å; F700-T755 HydrophobicContact CE1-CG2 4.42Å; F700-T755 HydrophobicContact CE2-CG2 3.9Å; F700-T755 HydrophobicContact CZ-CG2 3.71Å; T713-T755 HydrophobicContact CG2-CG2 3.81Å; L751-T755 PolarHBondContact O-N 2.76Å; L751-T755 PolarHBondContact O-OG1 2.72Å; L751-T755 VanDerWaalsContact O-OG1 3.11Å; N752-T755 CarbonylContact O-C 3.55Å; N752-T755 WeakPolarHBondContact O-CA 3.41Å; N752-T755 WeakPolarHBondContact O-CB 3.33Å; N752-T755 PolarHBondContact O-N 3.07Å; N752-T755 VanDerWaalsContact O-N 3.08Å; I753-T755 VanDerWaalsContact C-N 3.35Å; T755-T759 HydrophobicContact CG2-CG2 4.14Å; T755-T759 VanDerWaalsContact O-CB 3.31Å; T755-T759 WeakPolarHBondContact O-CB 3.35Å; T755-T759 WeakPolarHBondContact O-CG2 3.19Å; T755-T759 PolarHBondContact O-N 2.68Å; T755-T759 PolarHBondContact O-OG1 3.01Å; T755-F907 WeakPolarHBondContact OG1-CE1 3.41Å
756	I	92.2	Very high	91.1	Very high	37 Å²	37	48.1 Å²	48.1	19%	0.19	25%	0.253	C	S	.	.	H	α-helix	trans	-61.5	-51.5	174.9	-64.9	168	0	0	0	110.6	T713 L714 L717 N752 I753 I754 V758 T759 V760	T713-I756 HydrophobicContact CG2-CB 4.49Å; T713-I756 HydrophobicContact CG2-CD1 4.31Å; T713-I756 HydrophobicContact CG2-CG1 3.38Å; L714-I756 HydrophobicContact CD2-CD1 4.01Å; L717-I756 HydrophobicContact CB-CD1 4.47Å; L717-I756 HydrophobicContact CD2-CD1 3.76Å; N752-I756 WeakPolarHBondContact O-CG1 3.44Å; N752-I756 PolarHBondContact O-N 3.2Å; I753-I756 PolarHBondContact O-N 2.91Å; I754-I756 VanDerWaalsContact C-N 3.34Å; I754-I756 PolarHBondContact O-N 3.03Å; I756-V758 VanDerWaalsContact C-N 3.34Å; I756-V758 PolarHBondContact O-N 3.23Å; I756-T759 PolarHBondContact O-N 2.82Å; I756-T759 PolarHBondContact O-OG1 2.95Å; I756-V760 WeakPolarHBondContact O-CG2 3.37Å; I756-V760 PolarHBondContact O-N 2.85Å; I756-V760 VanDerWaalsContact O-N 3.09Å
757	L	92.8	Very high	91.2	Very high	110 Å²	110	50.7 Å²	50.7	58%	0.576	26%	0.26	S	S	*	.	H	α-helix	trans	-61.3	-44.4	-178.1	-159.1	165.2	0	0	0	111	I753 I754 V760 L761	I753-L757 PolarHBondContact O-N 3.31Å; I753-L757 VanDerWaalsContact O-N 3.11Å; I754-L757 PolarHBondContact O-N 3.3Å; L757-V760 PolarHBondContact O-N 3.43Å; L757-L761 HydrophobicContact CD2-CD1 3.87Å; L757-L761 HydrophobicContact CD2-CG 4.38Å; L757-L761 WeakPolarHBondContact O-CG 3.39Å; L757-L761 PolarHBondContact O-N 3.42Å
758	V	92.2	Very high	91.3	Very high	29 Å²	29	51 Å²	51	18%	0.176	26%	0.257	C	S	.	.	H	α-helix	trans	-70.8	-36.5	-179.8	174	0	0	0	0	112.5	F700 I754 I756 L761 I762 L903	F700-V758 HydrophobicContact CE1-CG1 4.19Å; I754-V758 HydrophobicContact CG2-CG2 4.02Å; I754-V758 VanDerWaalsContact O-CB 3.32Å; I754-V758 WeakPolarHBondContact O-CB 3.49Å; I754-V758 VanDerWaalsContact O-CG2 3.24Å; I754-V758 WeakPolarHBondContact O-CG2 3.44Å; I754-V758 PolarHBondContact O-N 2.85Å; I756-V758 VanDerWaalsContact C-N 3.34Å; I756-V758 PolarHBondContact O-N 3.23Å; V758-L761 WeakPolarHBondContact O-CB 3.43Å; V758-L761 PolarHBondContact O-N 3.39Å; V758-I762 HydrophobicContact CG1-CD1 4.13Å; V758-I762 WeakPolarHBondContact O-CG1 3.48Å; V758-I762 PolarHBondContact O-N 2.97Å; V758-L903 HydrophobicContact CG1-CD1 3.29Å; V758-L903 HydrophobicContact CG1-CD2 4.05Å; V758-L903 HydrophobicContact CG1-CG 4.28Å
759	T	91.9	Very high	90.9	Very high	1 Å²	1	51 Å²	51	1%	0.006	26%	0.259	C	S	.	.	H	α-helix	trans	-68.3	-35.9	175.8	50.5	0	0	0	0	112.5	V699 F700 T755 I756 L761 I762 I763	V699-T759 HydrophobicContact CG1-CG2 3.7Å; F700-T759 HydrophobicContact CD1-CG2 4.45Å; F700-T759 HydrophobicContact CE1-CG2 4.04Å; T755-T759 HydrophobicContact CG2-CG2 4.14Å; T755-T759 VanDerWaalsContact O-CB 3.31Å; T755-T759 WeakPolarHBondContact O-CB 3.35Å; T755-T759 WeakPolarHBondContact O-CG2 3.19Å; T755-T759 PolarHBondContact O-N 2.68Å; T755-T759 PolarHBondContact O-OG1 3.01Å; I756-T759 PolarHBondContact O-N 2.82Å; I756-T759 PolarHBondContact O-OG1 2.95Å; T759-L761 VanDerWaalsContact C-N 3.31Å; T759-L761 PolarHBondContact O-N 2.86Å; T759-I762 PolarHBondContact O-N 2.96Å; T759-I763 WeakPolarHBondContact O-CB 3.35Å; T759-I763 WeakPolarHBondContact O-CD1 3.46Å; T759-I763 VanDerWaalsContact O-CG1 3.26Å; T759-I763 WeakPolarHBondContact O-CG1 3.29Å; T759-I763 PolarHBondContact O-N 3.14Å
760	V	93.4	Very high	90.5	Very high	74 Å²	74	49.9 Å²	49.9	45%	0.448	26%	0.258	S	S	.	.	H	α-helix	trans	-60.3	-40.5	170	171.5	0	0	0	0	111.3	I710 I756 L757 I763 N764	I710-V760 HydrophobicContact CD1-CG2 4.39Å; I756-V760 WeakPolarHBondContact O-CG2 3.37Å; I756-V760 PolarHBondContact O-N 2.85Å; I756-V760 VanDerWaalsContact O-N 3.09Å; L757-V760 PolarHBondContact O-N 3.43Å; V760-I763 PolarHBondContact O-N 2.78Å; V760-N764 WeakPolarHBondContact O-CB 3.45Å; V760-N764 PolarHBondContact O-N 2.91Å
761	L	92.6	Very high	90.3	Very high	101 Å²	101	51 Å²	51	53%	0.529	27%	0.269	S	S	.	.	H	α-helix	trans	-65.7	-42.1	174.4	-67.9	172.4	0	0	0	112.6	L757 V758 T759 I763 N764 V765	L757-L761 HydrophobicContact CD2-CD1 3.87Å; L757-L761 HydrophobicContact CD2-CG 4.38Å; L757-L761 WeakPolarHBondContact O-CG 3.39Å; L757-L761 PolarHBondContact O-N 3.42Å; V758-L761 WeakPolarHBondContact O-CB 3.43Å; V758-L761 PolarHBondContact O-N 3.39Å; T759-L761 VanDerWaalsContact C-N 3.31Å; T759-L761 PolarHBondContact O-N 2.86Å; L761-I763 VanDerWaalsContact C-N 3.33Å; L761-I763 PolarHBondContact O-N 2.82Å; L761-N764 PolarHBondContact O-N 3.34Å; L761-V765 WeakPolarHBondContact O-CG2 3.48Å; L761-V765 PolarHBondContact O-N 2.92Å
762	I	92	Very high	90.2	Very high	3 Å²	3	54.6 Å²	54.6	2%	0.015	29%	0.292	C	S	.	.	H	α-helix	trans	-59.9	-44.4	174.5	-67.9	161	0	0	0	110.8	F700 V758 T759 V765 F766 A896 I899 D900 L903	F700-I762 HydrophobicContact CD1-CD1 4.11Å; F700-I762 HydrophobicContact CE1-CD1 4.08Å; V758-I762 HydrophobicContact CG1-CD1 4.13Å; V758-I762 WeakPolarHBondContact O-CG1 3.48Å; V758-I762 PolarHBondContact O-N 2.97Å; T759-I762 PolarHBondContact O-N 2.96Å; I762-V765 PolarHBondContact O-N 3.17Å; I762-F766 WeakPolarHBondContact O-CB 3.42Å; I762-F766 PolarHBondContact O-N 2.54Å; I762-A896 HydrophobicContact CG2-CB 4.37Å; I762-I899 HydrophobicContact CD1-CG2 4.44Å; I762-I899 HydrophobicContact CG1-CG2 3.87Å; I762-D900 HydrophobicContact CD1-CB 4.47Å; I762-L903 HydrophobicContact CD1-CD1 3.75Å; I762-L903 HydrophobicContact CG1-CD1 4.36Å
763	I	91.9	Very high	90.1	Very high	34 Å²	34	58.1 Å²	58.1	17%	0.174	31%	0.308	C	S	.	.	H	α-helix	trans	-64.7	-42.2	178.9	-70.7	165.5	0	0	0	110.7	K709 I710 T759 V760 L761 V765 F766 F767	K709-I763 HydrophobicContact CB-CD1 4.25Å; I710-I763 HydrophobicContact CD1-CD1 3.77Å; I710-I763 HydrophobicContact CG1-CD1 3.66Å; T759-I763 WeakPolarHBondContact O-CB 3.35Å; T759-I763 WeakPolarHBondContact O-CD1 3.46Å; T759-I763 VanDerWaalsContact O-CG1 3.26Å; T759-I763 WeakPolarHBondContact O-CG1 3.29Å; T759-I763 PolarHBondContact O-N 3.14Å; V760-I763 PolarHBondContact O-N 2.78Å; L761-I763 VanDerWaalsContact C-N 3.33Å; L761-I763 PolarHBondContact O-N 2.82Å; I763-V765 VanDerWaalsContact C-N 3.35Å; I763-V765 PolarHBondContact O-N 3.18Å; I763-F766 PolarHBondContact O-N 2.03Å; I763-F767 HydrophobicContact CG2-CD2 3.85Å; I763-F767 HydrophobicContact CG2-CE2 3.95Å; I763-F767 WeakPolarHBondContact O-CD2 3.48Å; I763-F767 PolarHBondContact O-N 2.76Å; I763-F767 VanDerWaalsContact O-N 3.16Å
764	N	92.4	Very high	89.9	Confident	84 Å²	84	66 Å²	66	45%	0.449	33%	0.333	S	S	.	.	H	α-helix	trans	-57.5	-46.1	172.9	-177.8	-78.8	0	0	0	111.8	V760 L761 R768	V760-N764 WeakPolarHBondContact O-CB 3.45Å; V760-N764 PolarHBondContact O-N 2.91Å; L761-N764 PolarHBondContact O-N 3.34Å; N764-R768 WeakPolarHBondContact O-CG 3.49Å; N764-R768 PolarHBondContact OD1-NE 2.75Å; N764-R768 PolarHBondContact OD1-NH2 3.09Å
765	V	90.6	Very high	89.7	Confident	21 Å²	21	63.8 Å²	63.8	13%	0.127	32%	0.321	C	S	.	.	H	α-helix	trans	-66.3	-40.1	178.1	174.5	0	0	0	0	111.9	L761 I762 I763 F767 R768 W892 V895 A896 I899	L761-V765 WeakPolarHBondContact O-CG2 3.48Å; L761-V765 PolarHBondContact O-N 2.92Å; I762-V765 PolarHBondContact O-N 3.17Å; I763-V765 VanDerWaalsContact C-N 3.35Å; I763-V765 PolarHBondContact O-N 3.18Å; V765-F767 VanDerWaalsContact C-N 3.35Å; V765-F767 PolarHBondContact O-N 2.88Å; V765-R768 PolarHBondContact O-N 2.83Å; V765-W892 HydrophobicContact CG1-CE3 3.94Å; V765-W892 HydrophobicContact CG1-CZ3 4.18Å; V765-V895 HydrophobicContact CG1-CG1 4.03Å; V765-A896 HydrophobicContact CG1-CB 4.16Å; V765-I899 HydrophobicContact CG1-CD1 4.4Å
766	F	89.9	Confident	89.6	Confident	27 Å²	27	66.2 Å²	66.2	12%	0.118	34%	0.337	C	S	.	.	H	α-helix	trans	-62.6	-36.6	-179.6	177.5	-92.5	0	0	0	113.3	A704 C705 I762 I763 K893 A896	A704-F766 HydrophobicContact CB-CB 4.33Å; A704-F766 HydrophobicContact CB-CD1 4.15Å; A704-F766 HydrophobicContact CB-CD2 3.97Å; A704-F766 HydrophobicContact CB-CE2 4.32Å; A704-F766 HydrophobicContact CB-CG 3.88Å; C705-F766 HydrophobicContact CB-CZ 4.48Å; C705-F766 VanDerWaalsContact SG-CZ 3.5Å; I762-F766 WeakPolarHBondContact O-CB 3.42Å; I762-F766 PolarHBondContact O-N 2.54Å; I763-F766 PolarHBondContact O-N 2.03Å; F766-K893 HydrophobicContact CD2-CB 4.3Å; F766-K893 HydrophobicContact CD2-CG 4.03Å; F766-K893 HydrophobicContact CE2-CB 4.13Å; F766-K893 HydrophobicContact CE2-CD 4.4Å; F766-K893 HydrophobicContact CE2-CG 3.7Å; F766-K893 HydrophobicContact CZ-CG 4.2Å; F766-A896 HydrophobicContact CB-CB 3.8Å; F766-A896 HydrophobicContact CD2-CB 4.22Å
767	F	89.2	Confident	89.3	Confident	148 Å²	148	71 Å²	71	65%	0.649	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	7.7	179.9	-75.1	-67.2	0	0	0	114.6	I763 V765	I763-F767 HydrophobicContact CG2-CD2 3.85Å; I763-F767 HydrophobicContact CG2-CE2 3.95Å; I763-F767 WeakPolarHBondContact O-CD2 3.48Å; I763-F767 PolarHBondContact O-N 2.76Å; I763-F767 VanDerWaalsContact O-N 3.16Å; V765-F767 VanDerWaalsContact C-N 3.35Å; V765-F767 PolarHBondContact O-N 2.88Å
768	R	89.3	Confident	89.2	Confident	65 Å²	65	73.6 Å²	73.6	25%	0.245	36%	0.361	C	S	.	.			trans	-69.6	133.7	174.6	-66.7	-179.6	-175.2	-167.3	-2.9	111.4	N764 V765 H773 W892	N764-R768 WeakPolarHBondContact O-CG 3.49Å; N764-R768 PolarHBondContact OD1-NE 2.75Å; N764-R768 PolarHBondContact OD1-NH2 3.09Å; V765-R768 PolarHBondContact O-N 2.83Å; R768-H773 HydrophobicContact CB-CB 4.26Å; R768-H773 HydrophobicContact CG-CB 4.37Å; R768-W892 HydrophobicContact CB-CB 4.45Å; R768-W892 HydrophobicContact CB-CD2 3.73Å; R768-W892 HydrophobicContact CB-CE3 4.18Å; R768-W892 HydrophobicContact CB-CG 3.87Å; R768-W892 HydrophobicContact CB-CZ2 4.45Å
769	G	82.3	Confident	89.1	Confident	9 Å²	9	72.8 Å²	72.8	9%	0.093	36%	0.356	C	S	.	.			trans	-121.8	159.8	175.6	0	0	0	0	0	111.5	T771 T772 H773	G769-T771 PolarHBondContact O-N 2.93Å; G769-T772 PolarHBondContact O-N 2.75Å; G769-T772 PolarHBondContact O-OG1 3.15Å; G769-H773 PolarHBondContact O-N 2.77Å
770	P	81.6	Confident	88.9	Confident	38 Å²	38	77.4 Å²	77.4	25%	0.247	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-22.5	-177.6	25.9	-34.7	0	0	0	113.7	Y885 I888	P770-Y885 HydrophobicContact CG-CD1 4.42Å; P770-Y885 HydrophobicContact CG-CD2 3.44Å; P770-Y885 VanDerWaalsContact CG-CD2 3.44Å; P770-Y885 HydrophobicContact CG-CE1 4.41Å; P770-Y885 HydrophobicContact CG-CE2 3.45Å; P770-Y885 VanDerWaalsContact CG-CE2 3.45Å; P770-Y885 HydrophobicContact CG-CG 3.94Å; P770-I888 HydrophobicContact CB-CB 4.25Å; P770-I888 HydrophobicContact CB-CD1 4.08Å; P770-I888 HydrophobicContact CB-CG2 3.92Å; P770-I888 HydrophobicContact CG-CB 4.47Å; P770-I888 HydrophobicContact CG-CG2 4.5Å
771	T	85.1	Confident	88.5	Confident	113 Å²	113	79.7 Å²	79.7	69%	0.693	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-23.7	173.2	41.1	0	0	0	0	114.2	G769 Y885	G769-T771 PolarHBondContact O-N 2.93Å; T771-Y885 HydrophobicContact CG2-CE2 4.03Å
772	T	88.9	Confident	88.3	Confident	96 Å²	96	77.2 Å²	77.2	59%	0.589	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.1	-33	-177.9	60.3	0	0	0	0	113.2	G769	G769-T772 PolarHBondContact O-N 2.75Å; G769-T772 PolarHBondContact O-OG1 3.15Å
773	H	89.3	Confident	88.1	Confident	73 Å²	73	78.8 Å²	78.8	34%	0.338	38%	0.375	S	S	.	.			trans	-140	118.9	-174	-66	79.8	0	0	0	112.4	R768 G769 W892	R768-H773 HydrophobicContact CB-CB 4.26Å; R768-H773 HydrophobicContact CG-CB 4.37Å; G769-H773 PolarHBondContact O-N 2.77Å; H773-W892 HydrophobicContact CB-CZ2 3.87Å; H773-W892 PolarHBondContact O-NE1 2.72Å
774	R	86.4	Confident	87.7	Confident	237 Å²	237	77.4 Å²	77.4	89%	0.894	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-76.7	129.8	164.3	-66	-177.2	176.7	-173.2	-1.7	109.3	P776	R774-P776 WeakPolarHBondContact O-CD 3.44Å
775	M	86.8	Confident	87.2	Confident	39 Å²	39	75.8 Å²	75.8	19%	0.192	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-71.5	122.5	178.6	179	171.3	56.2	0	0	110.9	V779 R780 L784 D891 W892	M775-V779 HydrophobicContact CG-CB 4.24Å; M775-V779 HydrophobicContact CG-CG1 4.14Å; M775-V779 HydrophobicContact SD-CG1 4.41Å; M775-R780 HydrophobicContact CE-CB 4.09Å; M775-R780 HydrophobicContact CE-CG 4.05Å; M775-R780 HydrophobicContact SD-CB 4.24Å; M775-L784 HydrophobicContact CE-CD1 3.9Å; M775-L784 HydrophobicContact SD-CD1 3.96Å; M775-D891 HydrophobicContact CE-CB 4.21Å; M775-D891 HydrophobicContact SD-CB 4.43Å; M775-W892 HydrophobicContact CB-CZ2 3.95Å; M775-W892 HydrophobicContact CG-CZ2 4.49Å
776	P	89.6	Confident	86.8	Confident	51 Å²	51	80.5 Å²	80.5	33%	0.331	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-65	146.6	174.5	-20.1	32.4	0	0	0	112	R774 W778 V779 R780	R774-P776 WeakPolarHBondContact O-CD 3.44Å; P776-W778 HydrophobicContact CB-CG 4.28Å; P776-W778 PolarHBondContact O-N 3.03Å; P776-V779 HydrophobicContact CB-CB 4.46Å; P776-V779 HydrophobicContact CB-CG2 4.05Å; P776-V779 HydrophobicContact CG-CG2 3.91Å; P776-V779 WeakPolarHBondContact O-CB 3.34Å; P776-V779 PolarHBondContact O-N 3.07Å; P776-V779 VanDerWaalsContact O-N 3.13Å; P776-R780 PolarHBondContact O-N 3.37Å; P776-R780 VanDerWaalsContact O-N 3.08Å
777	Q	87.6	Confident	86.7	Confident	137 Å²	137	79.9 Å²	79.9	64%	0.64	38%	0.376	S	S	*	.	H	α-helix	trans	-64.9	-27.8	-179.3	-57.3	-65	2.2	0	0	112.8	R780 H781	Q777-R780 WeakPolarHBondContact O-CB 3.25Å; Q777-R780 PolarHBondContact O-N 3.13Å; Q777-H781 PolarHBondContact O-N 2.7Å
778	W	91	Very high	86.4	Confident	166 Å²	166	73 Å²	73	63%	0.629	35%	0.346	S	S	*	.	H	α-helix	trans	-67.3	-43.8	173.2	73.6	-101.6	0	0	0	111.6	P776 R780 H781 T782 F783	P776-W778 HydrophobicContact CB-CG 4.28Å; P776-W778 PolarHBondContact O-N 3.03Å; W778-R780 VanDerWaalsContact C-N 3.28Å; W778-R780 PolarHBondContact O-N 2.75Å; W778-H781 PolarHBondContact O-N 2.93Å; W778-T782 WeakPolarHBondContact O-CB 3.48Å; W778-T782 PolarHBondContact O-N 2.87Å; W778-T782 PolarHBondContact O-OG1 3.11Å; W778-T782 VanDerWaalsContact O-OG1 3.13Å; W778-F783 AromaticContact CZ3-CE2 4Å; W778-F783 HydrophobicContact CZ3-CE2 4Å
779	V	90	Very high	86	Confident	11 Å²	11	77.7 Å²	77.7	7%	0.067	37%	0.368	C	S	.	.	H	α-helix	trans	-58.3	-44.5	174.8	174.9	0	0	0	0	110.1	M775 P776 F783 W892 V895	M775-V779 HydrophobicContact CG-CB 4.24Å; M775-V779 HydrophobicContact CG-CG1 4.14Å; M775-V779 HydrophobicContact SD-CG1 4.41Å; P776-V779 HydrophobicContact CB-CB 4.46Å; P776-V779 HydrophobicContact CB-CG2 4.05Å; P776-V779 HydrophobicContact CG-CG2 3.91Å; P776-V779 WeakPolarHBondContact O-CB 3.34Å; P776-V779 PolarHBondContact O-N 3.07Å; P776-V779 VanDerWaalsContact O-N 3.13Å; V779-F783 HydrophobicContact CB-CD2 4.47Å; V779-F783 HydrophobicContact CG1-CD2 3.94Å; V779-F783 WeakPolarHBondContact O-CB 3.31Å; V779-F783 PolarHBondContact O-N 3.09Å; V779-W892 HydrophobicContact CG1-CZ3 4.48Å; V779-V895 HydrophobicContact CG1-CG1 4.14Å; V779-V895 HydrophobicContact CG1-CG2 4.13Å
780	R	86.5	Confident	86.1	Confident	99 Å²	99	82.4 Å²	82.4	37%	0.374	39%	0.389	S	S	.	.	H	α-helix	trans	-55.8	-53.1	176.1	-173.3	-174.6	179.7	157.7	1.2	111.3	M775 P776 Q777 W778 L784	M775-R780 HydrophobicContact CE-CB 4.09Å; M775-R780 HydrophobicContact CE-CG 4.05Å; M775-R780 HydrophobicContact SD-CB 4.24Å; P776-R780 PolarHBondContact O-N 3.37Å; P776-R780 VanDerWaalsContact O-N 3.08Å; Q777-R780 WeakPolarHBondContact O-CB 3.25Å; Q777-R780 PolarHBondContact O-N 3.13Å; W778-R780 VanDerWaalsContact C-N 3.28Å; W778-R780 PolarHBondContact O-N 2.75Å; R780-L784 HydrophobicContact CG-CD1 3.99Å; R780-L784 WeakPolarHBondContact O-CA 3.25Å; R780-L784 WeakPolarHBondContact O-CB 3.26Å; R780-L784 PolarHBondContact O-N 2.92Å
781	H	85.9	Confident	86.1	Confident	122 Å²	122	81.4 Å²	81.4	57%	0.565	38%	0.382	S	S	*	.	I	π-helix	trans	-66.2	-50.2	-177.8	-168.6	62.3	0	0	0	112.3	Q777 W778 D785 F786	Q777-H781 PolarHBondContact O-N 2.7Å; W778-H781 PolarHBondContact O-N 2.93Å; H781-D785 WeakPolarHBondContact O-CB 3.32Å; H781-D785 PolarHBondContact O-N 2.96Å; H781-F786 PolarHBondContact O-N 2.93Å
782	T	87.8	Confident	85.8	Confident	49 Å²	49	84.5 Å²	84.5	30%	0.301	39%	0.39	S	S	.	.	I	π-helix	trans	-62.9	-54	-177.9	-57.6	0	0	0	0	111.7	W778 L787	W778-T782 WeakPolarHBondContact O-CB 3.48Å; W778-T782 PolarHBondContact O-N 2.87Å; W778-T782 PolarHBondContact O-OG1 3.11Å; W778-T782 VanDerWaalsContact O-OG1 3.13Å; T782-L787 WeakPolarHBondContact O-CB 3.09Å; T782-L787 PolarHBondContact O-N 2.95Å
783	F	88.3	Confident	85.1	Confident	36 Å²	36	82.3 Å²	82.3	16%	0.158	37%	0.374	C	S	.	.	I	π-helix	trans	-93.5	-16.8	-169	-65.3	-76.9	0	0	0	115	W778 V779 L787 P788 V895 V898 I899	W778-F783 AromaticContact CZ3-CE2 4Å; W778-F783 HydrophobicContact CZ3-CE2 4Å; V779-F783 HydrophobicContact CB-CD2 4.47Å; V779-F783 HydrophobicContact CG1-CD2 3.94Å; V779-F783 WeakPolarHBondContact O-CB 3.31Å; V779-F783 PolarHBondContact O-N 3.09Å; F783-L787 HydrophobicContact CD1-CD2 4.09Å; F783-L787 HydrophobicContact CE1-CD2 4.21Å; F783-P788 WeakPolarHBondContact O-CD 2.99Å; F783-P788 WeakPolarHBondContact O-CG 2.95Å; F783-V895 HydrophobicContact CB-CB 4.32Å; F783-V895 HydrophobicContact CB-CG1 3.92Å; F783-V895 HydrophobicContact CB-CG2 3.92Å; F783-V895 HydrophobicContact CD2-CG1 4.2Å; F783-V895 HydrophobicContact CG-CG1 3.97Å; F783-V898 HydrophobicContact CD1-CG1 4.14Å; F783-I899 HydrophobicContact CD1-CD1 4.39Å; F783-I899 HydrophobicContact CD1-CG1 3.75Å; F783-I899 HydrophobicContact CE1-CD1 4.09Å; F783-I899 HydrophobicContact CE1-CG1 3.43Å; F783-I899 VanDerWaalsContact CE1-CG1 3.43Å; F783-I899 HydrophobicContact CZ-CD1 4.3Å; F783-I899 HydrophobicContact CZ-CG1 4.09Å
784	L	83	Confident	84	Confident	4 Å²	4	88.7 Å²	88.7	2%	0.021	40%	0.401	C	S	.	.	I	π-helix	trans	-105.3	-24.8	177.5	-48.9	-179.6	0	0	0	113.7	M775 R780 D891 Y894 V895	M775-L784 HydrophobicContact CE-CD1 3.9Å; M775-L784 HydrophobicContact SD-CD1 3.96Å; R780-L784 HydrophobicContact CG-CD1 3.99Å; R780-L784 WeakPolarHBondContact O-CA 3.25Å; R780-L784 WeakPolarHBondContact O-CB 3.26Å; R780-L784 PolarHBondContact O-N 2.92Å; L784-D891 HydrophobicContact CD1-CB 4.12Å; L784-Y894 HydrophobicContact CD2-CD1 3.6Å; L784-Y894 HydrophobicContact CD2-CE1 4.34Å; L784-Y894 HydrophobicContact CD2-CG 4.49Å; L784-V895 HydrophobicContact CD2-CG2 3.59Å; L784-V895 HydrophobicContact CG-CG2 4.22Å
785	D	81.7	Confident	83.1	Confident	50 Å²	50	80.6 Å²	80.6	27%	0.267	37%	0.371	S	S	.	.	I	π-helix	trans	-121.5	-30.1	-171.7	-53.8	-36.9	0	0	0	114.3	H781 K789 R795	H781-D785 WeakPolarHBondContact O-CB 3.32Å; H781-D785 PolarHBondContact O-N 2.96Å; D785-K789 WeakPolarHBondContact O-CD 3.32Å; D785-K789 WeakPolarHBondContact O-CE 3.41Å; D785-K789 PolarHBondContact O-NZ 3.15Å; D785-R795 IonicContact OD1-NH1 3.6Å; D785-R795 PolarHBondContact OD1-NH1 3.32Å; D785-R795 VanDerWaalsContact OD1-NH1 3.09Å
786	F	83.5	Confident	81.9	Confident	120 Å²	120	81.1 Å²	81.1	53%	0.526	38%	0.377	S	S	.	.	I	π-helix	trans	-94.5	-67.8	177.4	177	-99.3	0	0	0	112.5	H781 P788 K789 M790	H781-F786 PolarHBondContact O-N 2.93Å; F786-P788 VanDerWaalsContact C-CD 3.48Å; F786-K789 WeakPolarHBondContact O-CB 3.49Å; F786-K789 PolarHBondContact O-N 3.26Å; F786-M790 PolarHBondContact O-N 3.15Å
787	L	86.7	Confident	80.3	Confident	15 Å²	15	88.4 Å²	88.4	8%	0.079	40%	0.403	C	S	.	.	H	α-helix	trans	-57.3	-38.7	-173.4	-138.9	78.3	0	0	0	113.8	T782 F783 K789 M790 L791 V898 L902	T782-L787 WeakPolarHBondContact O-CB 3.09Å; T782-L787 PolarHBondContact O-N 2.95Å; F783-L787 HydrophobicContact CD1-CD2 4.09Å; F783-L787 HydrophobicContact CE1-CD2 4.21Å; L787-K789 VanDerWaalsContact C-N 3.27Å; L787-K789 PolarHBondContact O-N 3.16Å; L787-M790 HydrophobicContact CD1-CE 4.3Å; L787-M790 HydrophobicContact CG-CE 4.48Å; L787-M790 WeakPolarHBondContact O-CB 3.36Å; L787-M790 PolarHBondContact O-N 3.45Å; L787-M790 VanDerWaalsContact O-N 3.16Å; L787-L791 HydrophobicContact CD2-CD1 4.03Å; L787-L791 HydrophobicContact CG-CD1 4.1Å; L787-L791 WeakPolarHBondContact O-CB 3.5Å; L787-L791 WeakPolarHBondContact O-CG 3.42Å; L787-L791 PolarHBondContact O-N 3.36Å; L787-V898 HydrophobicContact CB-CG1 3.88Å; L787-V898 HydrophobicContact CD2-CG1 3.64Å; L787-V898 HydrophobicContact CG-CG1 4.29Å; L787-L902 HydrophobicContact CD1-CD1 4.42Å; L787-L902 HydrophobicContact CD2-CB 3.99Å; L787-L902 HydrophobicContact CD2-CD1 4.12Å; L787-L902 HydrophobicContact CD2-CD2 4.08Å; L787-L902 HydrophobicContact CD2-CG 4.26Å; L787-L902 HydrophobicContact CG-CD1 4.46Å
788	P	83	Confident	78.8	Confident	4 Å²	4	87.5 Å²	87.5	3%	0.026	39%	0.394	C	S	.	.	H	α-helix	trans	-60.5	-32.5	175.9	-28.4	38.8	0	0	0	114	F783 F786 L791 M792 M793 Y894 V898	F783-P788 WeakPolarHBondContact O-CD 2.99Å; F783-P788 WeakPolarHBondContact O-CG 2.95Å; F786-P788 VanDerWaalsContact C-CD 3.48Å; P788-L791 CarbonylContact O-C 3.57Å; P788-M792 PolarHBondContact O-N 3.25Å; P788-M793 HydrophobicContact CB-CB 4.18Å; P788-M793 PolarHBondContact O-N 3.15Å; P788-Y894 HydrophobicContact CB-CE1 4.34Å; P788-Y894 HydrophobicContact CG-CE1 3.78Å; P788-V898 HydrophobicContact CG-CG1 4.35Å; P788-V898 HydrophobicContact CG-CG2 3.98Å
789	K	80.9	Confident	76.7	Confident	162 Å²	162	84.8 Å²	84.8	70%	0.704	40%	0.395	S	S	*	.	H	α-helix	trans	-68.8	-42	176	-64.1	174.2	-175.2	140.3	0	110.9	D785 F786 L787 M792	D785-K789 WeakPolarHBondContact O-CD 3.32Å; D785-K789 WeakPolarHBondContact O-CE 3.41Å; D785-K789 PolarHBondContact O-NZ 3.15Å; F786-K789 WeakPolarHBondContact O-CB 3.49Å; F786-K789 PolarHBondContact O-N 3.26Å; L787-K789 VanDerWaalsContact C-N 3.27Å; L787-K789 PolarHBondContact O-N 3.16Å; K789-M792 PolarHBondContact O-N 3.43Å
790	M	84.7	Confident	74.3	Confident	108 Å²	108	87.6 Å²	87.6	53%	0.532	42%	0.415	S	S	.	.	H	α-helix	trans	-62.6	-43.4	175.2	-168.1	-166.9	82	0	0	111.7	F786 L787 M792 L902	F786-M790 PolarHBondContact O-N 3.15Å; L787-M790 HydrophobicContact CD1-CE 4.3Å; L787-M790 HydrophobicContact CG-CE 4.48Å; L787-M790 WeakPolarHBondContact O-CB 3.36Å; L787-M790 PolarHBondContact O-N 3.45Å; L787-M790 VanDerWaalsContact O-N 3.16Å; M790-M792 PolarHBondContact O-N 2.98Å; M790-L902 HydrophobicContact CE-CD1 3.73Å
791	L	82.5	Confident	72	Confident	17 Å²	17	90 Å²	90	9%	0.089	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	13.3	179.9	-59.4	173.9	0	0	0	113.7	L787 P788 M793 V898 L902 Y905	L787-L791 HydrophobicContact CD2-CD1 4.03Å; L787-L791 HydrophobicContact CG-CD1 4.1Å; L787-L791 WeakPolarHBondContact O-CB 3.5Å; L787-L791 WeakPolarHBondContact O-CG 3.42Å; L787-L791 PolarHBondContact O-N 3.36Å; P788-L791 CarbonylContact O-C 3.57Å; L791-M793 HydrophobicContact CB-CG 4.03Å; L791-M793 VanDerWaalsContact O-CG 3.28Å; L791-M793 WeakPolarHBondContact O-CG 3.19Å; L791-M793 PolarHBondContact O-N 3.34Å; L791-V898 HydrophobicContact CD1-CG1 4.2Å; L791-L902 HydrophobicContact CD1-CB 4.25Å; L791-L902 HydrophobicContact CD2-CD1 4.44Å; L791-Y905 HydrophobicContact CD2-CD2 3.72Å; L791-Y905 HydrophobicContact CD2-CE2 3.87Å
792	M	78.7	Confident	69.4	Low	178 Å²	178	91.1 Å²	91.1	88%	0.877	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	24.3	-177.9	-57.9	-167	-179.6	0	0	115.7	P788 K789 M790	P788-M792 PolarHBondContact O-N 3.25Å; K789-M792 PolarHBondContact O-N 3.43Å; M790-M792 PolarHBondContact O-N 2.98Å
793	M	74	Confident	66.8	Low	51 Å²	51	94.4 Å²	94.4	25%	0.251	46%	0.456	S	S	.	.			trans	-88.6	118.9	-177.4	-59.5	-149	167.9	0	0	112.3	P788 L791 R795 R901	P788-M793 HydrophobicContact CB-CB 4.18Å; P788-M793 PolarHBondContact O-N 3.15Å; L791-M793 HydrophobicContact CB-CG 4.03Å; L791-M793 VanDerWaalsContact O-CG 3.28Å; L791-M793 WeakPolarHBondContact O-CG 3.19Å; L791-M793 PolarHBondContact O-N 3.34Å; M793-R795 PolarHBondContact O-N 3.46Å; M793-R901 HydrophobicContact CE-CB 3.6Å; M793-R901 HydrophobicContact CE-CG 3.58Å
794	K	66.2	Low	64.3	Low	206 Å²	206	101.7 Å²	101.7	90%	0.896	49%	0.491	S	S	*	.			trans	-81.9	104.5	173.1	-67.8	-178.3	-179.8	177	0	109.9
795	R	67.1	Low	62	Low	68 Å²	68	111.7 Å²	111.7	26%	0.257	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-56.8	137.9	170.9	-169.3	179.7	-180	-176.7	0.7	110.2	D785 M793 K797 D891 Y894	D785-R795 IonicContact OD1-NH1 3.6Å; D785-R795 PolarHBondContact OD1-NH1 3.32Å; D785-R795 VanDerWaalsContact OD1-NH1 3.09Å; M793-R795 PolarHBondContact O-N 3.46Å; R795-K797 PolarHBondContact O-N 2.75Å; R795-D891 IonicContact CZ-OD1 3.21Å; R795-D891 IonicContact NH2-OD1 2.73Å; R795-D891 PolarHBondContact NH2-OD1 2.9Å; R795-Y894 WeakPolarHBondContact CA-OH 3.33Å; R795-Y894 HydrophobicContact CB-CE1 4.49Å; R795-Y894 HydrophobicContact CG-CE1 4.26Å; R795-Y894 HydrophobicContact CG-CE2 4.45Å; R795-Y894 PolarHBondContact N-OH 3.49Å
796	P	61.9	Low	59.4	Low	50 Å²	50	112.9 Å²	112.9	33%	0.325	55%	0.553	S	S	.	*	P	Polyproline II helix	trans	-55.5	136.2	168.3	-23.7	34	0	0	0	110.4	R798	P796-R798 PolarHBondContact O-N 3.24Å
797	K	56.4	Low	57	Low	204 Å²	204	112.9 Å²	112.9	89%	0.887	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-66.7	117.5	171.2	-70.9	-170.5	176.6	-170.3	0	108	R795 V799	R795-K797 PolarHBondContact O-N 2.75Å; K797-V799 PolarHBondContact O-N 3.26Å
798	R	54.5	Low	54.4	Low	118 Å²	118	120 Å²	120	45%	0.445	60%	0.598	S	S	.	*	P	Polyproline II helix	trans	-58.2	137.5	157.8	-63.6	-167.3	-167.2	-178.4	5.7	107.6	P796 S800 D891	P796-R798 PolarHBondContact O-N 3.24Å; R798-S800 PolarHBondContact O-N 3.4Å; R798-D891 IonicContact CZ-OD1 2.85Å; R798-D891 IonicContact CZ-OD2 3.36Å; R798-D891 IonicContact NE-OD1 3.14Å; R798-D891 IonicContact NH2-OD1 2.79Å; R798-D891 PolarHBondContact NH2-OD1 2.86Å; R798-D891 IonicContact NH2-OD2 3.22Å; R798-D891 PolarHBondContact NH2-OD2 2.84Å
799	V	48.6	Very low	51.9	Low	108 Å²	108	127.3 Å²	127.3	66%	0.655	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-64.2	125	165.7	-178.2	0	0	0	0	106.7	K797	K797-V799 PolarHBondContact O-N 3.26Å
800	S	37.8	Very low	49.7	Very low	70 Å²	70	125.1 Å²	125.1	49%	0.49	64%	0.637	S	S	.	*	P	Polyproline II helix	trans	-58.9	140.7	171.9	14	0	0	0	0	109.1	R798 E802	R798-S800 PolarHBondContact O-N 3.4Å; S800-E802 PolarHBondContact O-N 3.06Å; S800-E802 PolarHBondContact OG-OE1 3.49Å
801	K	39.2	Very low	47.2	Very low	151 Å²	151	128.9 Å²	128.9	66%	0.657	65%	0.651	S	S	*	*			trans	-70.9	73.4	160	-72.1	-171.3	176.2	-174.3	0	108.2	P803 E884	K801-P803 WeakPolarHBondContact O-CD 3.36Å; K801-E884 WeakPolarHBondContact CE-OE1 3.39Å; K801-E884 IonicContact NZ-OE1 2.88Å; K801-E884 PolarHBondContact NZ-OE1 3.29Å
802	E	31.1	Very low	45.1	Very low	144 Å²	144	137.2 Å²	137.2	67%	0.673	69%	0.689	S	S	*	*			trans	-72.4	117.9	167.6	-86.6	164	-136.1	0	0	108	S800 H804	S800-E802 PolarHBondContact O-N 3.06Å; S800-E802 PolarHBondContact OG-OE1 3.49Å; E802-H804 PolarHBondContact O-N 2.98Å; E802-H804 VanDerWaalsContact O-N 3.12Å
803	P	32.6	Very low	42.7	Very low	118 Å²	118	140.1 Å²	140.1	77%	0.766	69%	0.69	S	S	*	*			trans	-74	105.5	177.6	29.7	-31.9	0	0	0	108.7	K801 Y805	K801-P803 WeakPolarHBondContact O-CD 3.36Å; P803-Y805 PolarHBondContact O-N 3.04Å
804	H	35.6	Very low	40.9	Very low	190 Å²	190	146.7 Å²	146.7	88%	0.88	72%	0.72	S	S	*	*			trans	-73	67.5	165.5	-96.9	-21.9	0	0	0	110.6	E802	E802-H804 PolarHBondContact O-N 2.98Å; E802-H804 VanDerWaalsContact O-N 3.12Å
805	Y	35.1	Very low	39.3	Very low	213 Å²	213	146 Å²	146	84%	0.835	72%	0.717	S	S	*	*			trans	-107.4	102.9	158.8	-111.9	-93.7	0	0	0	107.2	P803	P803-Y805 PolarHBondContact O-N 3.04Å
806	G	28.5	Very low	37.8	Very low	75 Å²	75	148.7 Å²	148.7	77%	0.773	74%	0.743	S	S	*	*			trans	-140.4	20.7	-167.2	0	0	0	0	0	114.4
807	V	32.8	Very low	36.5	Very low	121 Å²	121	153 Å²	153	73%	0.733	77%	0.768	S	S	*	*	S	Bend	trans	-136.6	118.8	178.3	-175.9	0	0	0	0	109.6
808	M	31.3	Very low	35.2	Very low	163 Å²	163	154.7 Å²	154.7	80%	0.803	77%	0.769	S	S	*	*			trans	54.8	64.4	160.9	-61.7	176.2	67.2	0	0	118.6
809	D	31.5	Very low	34.2	Very low	159 Å²	159	154.9 Å²	154.9	85%	0.85	78%	0.784	S	S	*	*			trans	-105.9	70.1	148.2	-172.6	13.8	0	0	0	110.1
810	T	33	Very low	33.4	Very low	115 Å²	115	155.4 Å²	155.4	71%	0.706	79%	0.787	S	S	*	*			trans	-134.2	6.2	-175.9	25.2	0	0	0	0	114.4
811	F	33.8	Very low	33.2	Very low	187 Å²	187	158.9 Å²	158.9	82%	0.82	81%	0.805	S	S	*	*	S	Bend	trans	-141.4	78.3	176.8	-91.4	-87.5	0	0	0	111.5
812	H	36.8	Very low	32.9	Very low	192 Å²	192	154.7 Å²	154.7	89%	0.889	81%	0.805	S	S	*	*			trans	-178.3	58.1	145	-95.4	-58.4	0	0	0	112.9
813	R	28.9	Very low	32.9	Very low	240 Å²	240	157.5 Å²	157.5	91%	0.906	82%	0.818	S	S	*	*			trans	-114.5	38.3	172.5	-151.9	-178	-179	-177.2	2.1	114.6
814	H	37.3	Very low	32.9	Very low	189 Å²	189	156.3 Å²	156.3	88%	0.875	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-84.5	120.9	166.3	-91.2	-88.9	0	0	0	110.8
815	K	31.2	Very low	32.8	Very low	190 Å²	190	152.1 Å²	152.1	83%	0.826	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-73.7	130.3	178.1	-58.5	170.7	-177.5	172	0	110.3
816	P	35.3	Very low	32.6	Very low	125 Å²	125	150.8 Å²	150.8	81%	0.812	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-70.7	140.4	155.7	30.3	-31.7	0	0	0	109.7
817	V	34.7	Very low	32.8	Very low	140 Å²	140	155.3 Å²	155.3	85%	0.848	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-87	150.8	178.4	174.9	0	0	0	0	110.2
818	R	29	Very low	32.8	Very low	240 Å²	240	153.2 Å²	153.2	91%	0.906	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-81.2	135.7	-179.3	-77.8	177.6	165.9	173.1	-5.8	113.4
819	T	34.4	Very low	32.9	Very low	123 Å²	123	152.7 Å²	152.7	76%	0.755	79%	0.793	S	S	*	*			trans	-147.4	112.1	149.7	25.9	0	0	0	0	106
820	T	32.2	Very low	33	Very low	118 Å²	118	149.6 Å²	149.6	72%	0.724	78%	0.784	S	S	*	*				56.5	127.9	92.3	60.6	0	0	0	0	113.1
821	T	32.6	Very low	33.2	Very low	143 Å²	143	149.9 Å²	149.9	88%	0.877	79%	0.786	S	S	*	*			cis	-167.1	168.5	18.9	-6.4	0	0	0	0	112.2
822	G	32.6	Very low	33.2	Very low	63 Å²	63	149.8 Å²	149.8	65%	0.649	79%	0.788	S	S	*	*			trans	106.7	117.4	169.3	0	0	0	0	0	113.9
823	Q	32.1	Very low	33.4	Very low	204 Å²	204	145.7 Å²	145.7	95%	0.953	78%	0.779	S	S	*	*				77.4	137.5	69	-76.3	-173.4	-2.2	0	0	113.9
824	S	32.6	Very low	33.9	Very low	93 Å²	93	140.1 Å²	140.1	65%	0.65	77%	0.774	S	S	*	*			cis	-170.4	135.8	-8.5	172.4	0	0	0	0	112.2
825	S	33.1	Very low	33.9	Very low	102 Å²	102	135.3 Å²	135.3	71%	0.713	77%	0.767	S	S	*	*			trans	55.4	172	154.3	66.9	0	0	0	0	117.6
826	K	30.9	Very low	34	Very low	184 Å²	184	133.6 Å²	133.6	80%	0.8	77%	0.772	S	S	*	*			cis	-152.8	-173.5	-16.2	-123.3	169.6	-178.9	-177.7	0	105.8
827	F	33.4	Very low	33.8	Very low	170 Å²	170	132.7 Å²	132.7	75%	0.746	77%	0.766	S	S	*	*			cis	-152.2	-170.7	14.6	-167.4	-121.6	0	0	0	111.4
828	S	33	Very low	33.4	Very low	78 Å²	78	134.8 Å²	134.8	55%	0.545	77%	0.769	S	S	.	*			trans	-91.2	-179.4	178.1	-12.8	0	0	0	0	113.2
829	D	31.7	Very low	33.4	Very low	151 Å²	151	134.5 Å²	134.5	81%	0.807	77%	0.768	S	S	*	*			cis	-166.9	172.9	-11.5	-153.9	-6.4	0	0	0	112
830	S	35.2	Very low	33.1	Very low	95 Å²	95	133.1 Å²	133.1	66%	0.664	76%	0.763	S	S	*	*			trans	95.4	137.6	136.2	80.7	0	0	0	0	123.8
831	T	35.9	Very low	33	Very low	121 Å²	121	134.1 Å²	134.1	74%	0.742	77%	0.768	S	S	*	*			trans	89.7	73.9	145.2	-32.4	0	0	0	0	122.1
832	E	34.1	Very low	32.9	Very low	184 Å²	184	133 Å²	133	86%	0.86	76%	0.756	S	S	*	*				72.1	165.3	120.3	-78.3	-149.6	142.4	0	0	123.4
833	P	41.5	Very low	32.6	Very low	107 Å²	107	135 Å²	135	70%	0.695	75%	0.752	S	S	*	*			trans	-115.1	-159	-143.1	49.6	-41.8	0	0	0	112.9
834	P	40	Very low	32.6	Very low	123 Å²	123	134 Å²	134	80%	0.799	75%	0.747	S	S	*	*			cis	-134.8	154.1	-4.1	40.3	-22.7	0	0	0	117.7
835	A	36.3	Very low	32.3	Very low	88 Å²	88	139.2 Å²	139.2	73%	0.727	75%	0.752	S	S	*	*			trans	-158.5	159	153.5	0	0	0	0	0	109.7
836	V	34.1	Very low	32	Very low	154 Å²	154	142.3 Å²	142.3	93%	0.933	76%	0.76	S	S	*	*			trans	-120.5	91.6	173.1	-178.4	0	0	0	0	110.2
837	P	29.8	Very low	32	Very low	106 Å²	106	138.1 Å²	138.1	69%	0.688	75%	0.754	S	S	*	*			trans	-90.1	124.1	173.9	-0.4	20.5	0	0	0	111.1	R839	P837-R839 PolarHBondContact O-N 2.98Å; P837-R839 VanDerWaalsContact O-N 3.14Å
838	M	27.4	Very low	32.1	Very low	184 Å²	184	136 Å²	136	91%	0.906	75%	0.751	S	S	*	*			trans	12.8	89.7	139.8	-167.9	171.2	-172.4	0	0	115.7	S840	M838-S840 PolarHBondContact O-N 3.3Å
839	R	28.2	Very low	32.2	Very low	234 Å²	234	135 Å²	135	88%	0.883	75%	0.753	S	S	*	*			trans	-72	98.7	178.8	-157	174.5	-163.7	169.1	5.6	110	P837	P837-R839 PolarHBondContact O-N 2.98Å; P837-R839 VanDerWaalsContact O-N 3.14Å
840	S	29.2	Very low	32.3	Very low	94 Å²	94	136.7 Å²	136.7	66%	0.657	75%	0.754	S	S	*	*			trans	-62.9	163.4	179	47.5	0	0	0	0	112.8	M838 I842	M838-S840 PolarHBondContact O-N 3.3Å; S840-I842 PolarHBondContact O-N 2.89Å; S840-I842 VanDerWaalsContact O-N 3.14Å
841	V	28.6	Very low	32.7	Very low	138 Å²	138	136.3 Å²	136.3	84%	0.836	75%	0.748	S	S	*	*			trans	-55	114.8	176.2	178.8	0	0	0	0	109.9
842	I	31	Very low	32.7	Very low	121 Å²	121	137.6 Å²	137.6	62%	0.621	74%	0.74	S	S	*	*			trans	-88.2	108.4	164.8	-65.4	179.1	0	0	0	106.6	S840 H844	S840-I842 PolarHBondContact O-N 2.89Å; S840-I842 VanDerWaalsContact O-N 3.14Å; I842-H844 PolarHBondContact O-N 3.14Å
843	D	26.9	Very low	33.2	Very low	104 Å²	104	135.9 Å²	135.9	56%	0.556	73%	0.731	S	S	*	*			trans	-75.8	108	-177	-166.3	-4.2	0	0	0	110.4	R845	D843-R845 PolarHBondContact O-N 3.25Å; D843-R845 VanDerWaalsContact OD1-CB 3.23Å; D843-R845 WeakPolarHBondContact OD1-CB 3.27Å; D843-R845 WeakPolarHBondContact OD1-CD 3.47Å; D843-R845 WeakPolarHBondContact OD1-CG 3.32Å; D843-R845 PolarHBondContact OD1-N 2.69Å
844	H	31.5	Very low	33.3	Very low	183 Å²	183	134.1 Å²	134.1	85%	0.847	72%	0.722	S	S	*	*			trans	-83.4	19.6	174.3	-103	-63.1	0	0	0	113.4	I842 N846	I842-H844 PolarHBondContact O-N 3.14Å; H844-N846 PolarHBondContact O-N 3.06Å; H844-N846 VanDerWaalsContact O-N 3.14Å
845	R	27.2	Very low	33.5	Very low	202 Å²	202	132.9 Å²	132.9	76%	0.762	71%	0.708	S	S	*	*			trans	-75.3	83.2	159.6	-70.6	169	156.5	179.1	-6.3	111.2	D843	D843-R845 PolarHBondContact O-N 3.25Å; D843-R845 VanDerWaalsContact OD1-CB 3.23Å; D843-R845 WeakPolarHBondContact OD1-CB 3.27Å; D843-R845 WeakPolarHBondContact OD1-CD 3.47Å; D843-R845 WeakPolarHBondContact OD1-CG 3.32Å; D843-R845 PolarHBondContact OD1-N 2.69Å
846	N	26.8	Very low	34.1	Very low	167 Å²	167	131.9 Å²	131.9	89%	0.893	70%	0.7	S	S	*	*			trans	-175.8	91.5	151.5	-95.8	-33	0	0	0	112	H844	H844-N846 PolarHBondContact O-N 3.06Å; H844-N846 VanDerWaalsContact O-N 3.14Å
847	S	31.3	Very low	34.6	Very low	96 Å²	96	131.3 Å²	131.3	67%	0.671	69%	0.691	S	S	*	*	S	Bend	trans	-162.4	-54.1	152.4	178.4	0	0	0	0	109.6
848	D	35.2	Very low	35.3	Very low	125 Å²	125	132.9 Å²	132.9	67%	0.668	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	2.9	-162.9	-46.9	-38.3	0	0	0	114.1	F850 T851	D848-F850 VanDerWaalsContact C-N 3.31Å; D848-F850 PolarHBondContact O-N 2.93Å; D848-T851 PolarHBondContact O-OG1 3.06Å
849	G	34	Very low	36.2	Very low	58 Å²	58	131.1 Å²	131.1	60%	0.598	67%	0.674	S	S	*	*	H	α-helix	trans	-77	-8.4	179.5	0	0	0	0	0	115.3
850	F	35.3	Very low	37.3	Very low	187 Å²	187	126.3 Å²	126.3	82%	0.82	67%	0.673	S	S	*	*	H	α-helix	trans	-86.5	-22	-170.6	-152.7	-98.6	0	0	0	114.1	D848	D848-F850 VanDerWaalsContact C-N 3.31Å; D848-F850 PolarHBondContact O-N 2.93Å
851	T	42.4	Very low	38.6	Very low	87 Å²	87	125.8 Å²	125.8	53%	0.534	66%	0.662	S	S	.	*	H	α-helix	trans	-79.5	-43.7	177.3	29.3	0	0	0	0	112.7	D848 H853 S854 L855	D848-T851 PolarHBondContact O-OG1 3.06Å; T851-H853 PolarHBondContact O-N 3.04Å; T851-S854 PolarHBondContact O-N 3.18Å; T851-S854 PolarHBondContact O-OG 2.98Å; T851-L855 PolarHBondContact O-N 3.22Å
852	Y	36.6	Very low	40.5	Very low	148 Å²	148	122 Å²	122	58%	0.58	64%	0.642	S	S	*	*	H	α-helix	trans	-63.6	-38.1	-177.1	-74.8	-80.6	0	0	0	113.5	S854 A856	Y852-S854 VanDerWaalsContact C-N 3.33Å; Y852-S854 PolarHBondContact O-N 2.75Å; Y852-A856 PolarHBondContact O-N 3.12Å
853	H	44.3	Very low	42.4	Very low	147 Å²	147	125.3 Å²	125.3	68%	0.681	65%	0.647	S	S	*	*	H	α-helix	trans	-78.2	-15	-173.6	-132.8	-49.8	0	0	0	114.6	T851	T851-H853 PolarHBondContact O-N 3.04Å
854	S	44	Very low	44.5	Very low	70 Å²	70	126.1 Å²	126.1	49%	0.49	65%	0.647	S	S	.	*	H	α-helix	trans	-89.1	-41.3	175.6	53.7	0	0	0	0	112.2	T851 Y852 A856 N857	T851-S854 PolarHBondContact O-N 3.18Å; T851-S854 PolarHBondContact O-OG 2.98Å; Y852-S854 VanDerWaalsContact C-N 3.33Å; Y852-S854 PolarHBondContact O-N 2.75Å; S854-A856 VanDerWaalsContact C-N 3.3Å; S854-A856 PolarHBondContact O-N 3.26Å; S854-N857 PolarHBondContact O-N 2.98Å
855	L	44.4	Very low	46.3	Very low	97 Å²	97	119 Å²	119	51%	0.508	62%	0.62	S	S	.	*	H	α-helix	trans	-62	-35.1	175	-77.8	162	0	0	0	112.8	T851 N857 Q858	T851-L855 PolarHBondContact O-N 3.22Å; L855-N857 PolarHBondContact O-N 2.6Å; L855-N857 VanDerWaalsContact O-N 3.17Å; L855-Q858 PolarHBondContact O-N 3.2Å
856	A	48.6	Very low	48.4	Very low	68 Å²	68	112.5 Å²	112.5	56%	0.562	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-19.1	178.6	0	0	0	0	0	114.7	Y852 S854	Y852-A856 PolarHBondContact O-N 3.12Å; S854-A856 VanDerWaalsContact C-N 3.3Å; S854-A856 PolarHBondContact O-N 3.26Å
857	N	43.8	Very low	50.8	Low	141 Å²	141	109.9 Å²	109.9	75%	0.754	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	-5	-176.4	-90.8	-11.7	0	0	0	114.8	S854 L855	S854-N857 PolarHBondContact O-N 2.98Å; L855-N857 PolarHBondContact O-N 2.6Å; L855-N857 VanDerWaalsContact O-N 3.17Å
858	Q	45.5	Very low	53	Low	140 Å²	140	107.7 Å²	107.7	65%	0.654	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.9	-19.9	-175.3	-76.8	-176.6	-32.5	0	0	115.3	L855	L855-Q858 PolarHBondContact O-N 3.2Å
859	Y	46.2	Very low	54.9	Low	146 Å²	146	104 Å²	104	57%	0.573	55%	0.553	S	S	*	*			trans	-139.3	117.8	-179.8	-58.3	-78.8	0	0	0	111	L861	Y859-L861 PolarHBondContact O-N 3.11Å
860	P	50.9	Low	57	Low	133 Å²	133	107.4 Å²	107.4	86%	0.864	55%	0.553	S	S	*	*			trans	-76.8	77.2	176.1	32.6	-34.5	0	0	0	110.2	S862	P860-S862 PolarHBondContact O-N 2.73Å
861	L	56.4	Low	59.2	Low	84 Å²	84	100.7 Å²	100.7	44%	0.44	53%	0.532	S	S	.	.			trans	-54.8	136	156.3	-154.4	82	0	0	0	107	Y859 A865 I869	Y859-L861 PolarHBondContact O-N 3.11Å; L861-A865 HydrophobicContact CD2-CB 3.93Å; L861-A865 HydrophobicContact CG-CB 3.91Å; L861-I869 HydrophobicContact CD2-CD1 4.04Å
862	S	68.7	Low	61	Low	58 Å²	58	99 Å²	99	41%	0.406	52%	0.52	S	S	.	.			trans	-59.8	146.5	-173.9	112.8	0	0	0	0	110.4	P860 E864 A865 C866	P860-S862 PolarHBondContact O-N 2.73Å; S862-E864 VanDerWaalsContact CB-OE2 3.31Å; S862-E864 WeakPolarHBondContact CB-OE2 3.43Å; S862-E864 PolarHBondContact O-N 2.76Å; S862-E864 PolarHBondContact OG-N 3.26Å; S862-E864 PolarHBondContact OG-OE2 3.01Å; S862-A865 WeakPolarHBondContact O-CA 3.46Å; S862-A865 WeakPolarHBondContact O-CB 3.48Å; S862-A865 PolarHBondContact O-N 3.39Å; S862-A865 PolarHBondContact OG-N 3.28Å; S862-C866 PolarHBondContact O-N 2.95Å
863	R	69.9	Low	63	Low	191 Å²	191	98.1 Å²	98.1	72%	0.721	52%	0.521	S	S	*	.	H	α-helix	trans	-62.2	-21.1	-176.9	-166	177.9	-176.3	-166.4	2.9	111.9	K867	R863-K867 WeakPolarHBondContact O-CD 3.43Å; R863-K867 WeakPolarHBondContact O-CG 3.36Å
864	E	71.9	Confident	64.9	Low	121 Å²	121	99 Å²	99	57%	0.565	52%	0.519	S	S	*	.	H	α-helix	trans	-79.1	-38.2	174.3	-54.2	62.6	-131.6	0	0	111	S862 A868	S862-E864 VanDerWaalsContact CB-OE2 3.31Å; S862-E864 WeakPolarHBondContact CB-OE2 3.43Å; S862-E864 PolarHBondContact O-N 2.76Å; S862-E864 PolarHBondContact OG-N 3.26Å; S862-E864 PolarHBondContact OG-OE2 3.01Å; E864-A868 WeakPolarHBondContact O-CB 3.48Å; E864-A868 PolarHBondContact O-N 2.9Å
865	A	68.3	Low	66.9	Low	34 Å²	34	99.4 Å²	99.4	28%	0.281	52%	0.515	S	S	.	.	H	α-helix	trans	-69.3	-43.1	176.9	0	0	0	0	0	112.6	L861 S862 K867 A868 I869	L861-A865 HydrophobicContact CD2-CB 3.93Å; L861-A865 HydrophobicContact CG-CB 3.91Å; S862-A865 WeakPolarHBondContact O-CA 3.46Å; S862-A865 WeakPolarHBondContact O-CB 3.48Å; S862-A865 PolarHBondContact O-N 3.39Å; S862-A865 PolarHBondContact OG-N 3.28Å; A865-K867 PolarHBondContact O-N 3.02Å; A865-A868 WeakPolarHBondContact O-CB 3.43Å; A865-A868 PolarHBondContact O-N 2.72Å; A865-A868 VanDerWaalsContact O-N 3.15Å; A865-I869 PolarHBondContact O-N 2.87Å
866	C	71.7	Confident	68.6	Low	65 Å²	65	95.5 Å²	95.5	44%	0.439	50%	0.497	S	S	.	.	H	α-helix	trans	-59	-47.1	172.6	-69.2	0	0	0	0	111.5	S862 A868 I869 E870	S862-C866 PolarHBondContact O-N 2.95Å; C866-A868 VanDerWaalsContact C-N 3.26Å; C866-A868 PolarHBondContact O-N 3.2Å; C866-I869 PolarHBondContact O-N 3.41Å; C866-E870 WeakPolarHBondContact O-CB 3.35Å; C866-E870 PolarHBondContact O-N 3.3Å
867	K	76.9	Confident	70.2	Confident	112 Å²	112	97.2 Å²	97.2	49%	0.487	49%	0.493	S	S	.	.	H	α-helix	trans	-60.6	-32.9	174.7	-75.2	173.4	-179.5	-179.6	0	113.2	R863 A865 A871	R863-K867 WeakPolarHBondContact O-CD 3.43Å; R863-K867 WeakPolarHBondContact O-CG 3.36Å; A865-K867 PolarHBondContact O-N 3.02Å; K867-A871 WeakPolarHBondContact O-CB 3.27Å; K867-A871 PolarHBondContact O-N 2.79Å
868	A	77.4	Confident	72.3	Confident	50 Å²	50	95.9 Å²	95.9	41%	0.413	48%	0.482	S	S	.	.	H	α-helix	trans	-70.2	-38.8	177.4	0	0	0	0	0	111.8	E864 A865 C866 I872	E864-A868 WeakPolarHBondContact O-CB 3.48Å; E864-A868 PolarHBondContact O-N 2.9Å; A865-A868 WeakPolarHBondContact O-CB 3.43Å; A865-A868 PolarHBondContact O-N 2.72Å; A865-A868 VanDerWaalsContact O-N 3.15Å; C866-A868 VanDerWaalsContact C-N 3.26Å; C866-A868 PolarHBondContact O-N 3.2Å; A868-I872 WeakPolarHBondContact O-CB 3.48Å; A868-I872 WeakPolarHBondContact O-CD1 3.41Å; A868-I872 WeakPolarHBondContact O-CG1 3.27Å; A868-I872 PolarHBondContact O-N 2.95Å
869	I	76.1	Confident	74	Confident	46 Å²	46	90.8 Å²	90.8	24%	0.236	46%	0.459	C	S	.	.	H	α-helix	trans	-66	-50.6	173.8	-63.6	170.7	0	0	0	110	A407 L861 A865 C866 A871 I872 E873	A407-I869 HydrophobicContact CB-CG1 4.4Å; L861-I869 HydrophobicContact CD2-CD1 4.04Å; A865-I869 PolarHBondContact O-N 2.87Å; C866-I869 PolarHBondContact O-N 3.41Å; I869-A871 VanDerWaalsContact C-N 3.28Å; I869-A871 PolarHBondContact O-N 2.92Å; I869-I872 PolarHBondContact O-N 2.59Å; I869-E873 PolarHBondContact O-N 2.93Å
870	E	78	Confident	75.8	Confident	130 Å²	130	89.2 Å²	89.2	61%	0.607	45%	0.452	S	S	*	.	H	α-helix	trans	-54.4	-42	175.8	-176.8	-177.3	-165.1	0	0	112.1	C866 Y874	C866-E870 WeakPolarHBondContact O-CB 3.35Å; C866-E870 PolarHBondContact O-N 3.3Å; E870-Y874 VanDerWaalsContact O-CB 3.31Å; E870-Y874 WeakPolarHBondContact O-CB 3.3Å; E870-Y874 PolarHBondContact O-N 2.91Å
871	A	80.4	Confident	77.4	Confident	47 Å²	47	86.7 Å²	86.7	39%	0.388	43%	0.434	S	S	.	.	H	α-helix	trans	-69.4	-36.9	175.7	0	0	0	0	0	113.3	K867 I869 I875	K867-A871 WeakPolarHBondContact O-CB 3.27Å; K867-A871 PolarHBondContact O-N 2.79Å; I869-A871 VanDerWaalsContact C-N 3.28Å; I869-A871 PolarHBondContact O-N 2.92Å; A871-I875 WeakPolarHBondContact O-CB 3.07Å; A871-I875 WeakPolarHBondContact O-CD1 3.32Å; A871-I875 WeakPolarHBondContact O-CG1 3.49Å; A871-I875 PolarHBondContact O-N 3.09Å
872	I	81	Confident	78.7	Confident	52 Å²	52	85.7 Å²	85.7	27%	0.267	43%	0.429	S	S	.	.	H	α-helix	trans	-67	-43.5	176.1	-75.1	165.1	0	0	0	110.6	I414 A868 I869 I875 A876	I414-I872 HydrophobicContact CD1-CG2 4.19Å; A868-I872 WeakPolarHBondContact O-CB 3.48Å; A868-I872 WeakPolarHBondContact O-CD1 3.41Å; A868-I872 WeakPolarHBondContact O-CG1 3.27Å; A868-I872 PolarHBondContact O-N 2.95Å; I869-I872 PolarHBondContact O-N 2.59Å; I872-I875 PolarHBondContact O-N 2.77Å; I872-A876 WeakPolarHBondContact O-CB 2.95Å; I872-A876 PolarHBondContact O-N 3.02Å
873	E	78.6	Confident	79.3	Confident	128 Å²	128	86.4 Å²	86.4	60%	0.598	43%	0.426	S	S	*	.	H	α-helix	trans	-62.1	-48.4	175.8	-171.6	-174.3	169.3	0	0	111.2	I869 I875 A876 E877	I869-E873 PolarHBondContact O-N 2.93Å; E873-I875 VanDerWaalsContact C-N 3.33Å; E873-I875 PolarHBondContact O-N 2.73Å; E873-A876 PolarHBondContact O-N 2.97Å; E873-A876 VanDerWaalsContact O-N 3.13Å; E873-E877 PolarHBondContact O-N 2.88Å
874	Y	85	Confident	79.9	Confident	165 Å²	165	81.5 Å²	81.5	65%	0.647	41%	0.412	S	S	*	.	H	α-helix	trans	-58	-42.5	175.4	179.9	-94.1	0	0	0	112.5	E870 H878	E870-Y874 VanDerWaalsContact O-CB 3.31Å; E870-Y874 WeakPolarHBondContact O-CB 3.3Å; E870-Y874 PolarHBondContact O-N 2.91Å; Y874-H878 WeakPolarHBondContact O-CB 3.3Å; Y874-H878 PolarHBondContact O-N 2.83Å
875	I	84.7	Confident	80.6	Confident	80 Å²	80	80 Å²	80	41%	0.41	40%	0.402	S	S	.	.	H	α-helix	trans	-64.4	-43.6	175.5	-71.6	164.3	0	0	0	110.7	I414 A871 I872 E873 H878 L879	I414-I875 HydrophobicContact CD1-CB 4.34Å; I414-I875 HydrophobicContact CD1-CG2 3.78Å; I414-I875 HydrophobicContact CG1-CG2 4.14Å; A871-I875 WeakPolarHBondContact O-CB 3.07Å; A871-I875 WeakPolarHBondContact O-CD1 3.32Å; A871-I875 WeakPolarHBondContact O-CG1 3.49Å; A871-I875 PolarHBondContact O-N 3.09Å; I872-I875 PolarHBondContact O-N 2.77Å; E873-I875 VanDerWaalsContact C-N 3.33Å; E873-I875 PolarHBondContact O-N 2.73Å; I875-H878 PolarHBondContact O-N 3.26Å; I875-L879 HydrophobicContact CG2-CD1 3.93Å; I875-L879 HydrophobicContact CG2-CG 4.32Å; I875-L879 WeakPolarHBondContact O-CB 3.28Å; I875-L879 VanDerWaalsContact O-CG 3.26Å; I875-L879 WeakPolarHBondContact O-CG 3.47Å; I875-L879 PolarHBondContact O-N 3.05Å
876	A	80	Confident	81.3	Confident	14 Å²	14	81.2 Å²	81.2	12%	0.116	40%	0.402	C	S	.	.	H	α-helix	trans	-62.6	-46.9	180	0	0	0	0	0	112.1	I872 E873 L879 R880	I872-A876 WeakPolarHBondContact O-CB 2.95Å; I872-A876 PolarHBondContact O-N 3.02Å; E873-A876 PolarHBondContact O-N 2.97Å; E873-A876 VanDerWaalsContact O-N 3.13Å; A876-L879 PolarHBondContact O-N 3.27Å; A876-R880 WeakPolarHBondContact O-CB 3.43Å; A876-R880 PolarHBondContact O-N 3.37Å
877	E	83.3	Confident	81.8	Confident	105 Å²	105	79.9 Å²	79.9	49%	0.491	39%	0.393	S	S	.	.	H	α-helix	trans	-71.7	-31.9	179.1	-170.5	58.4	-157.6	0	0	112.4	E873 R880 T881	E873-E877 PolarHBondContact O-N 2.88Å; E877-R880 PolarHBondContact O-N 2.76Å; E877-R880 IonicContact OE1-NE 2.68Å; E877-R880 WeakPolarHBondContact OE2-CD 3.46Å; E877-R880 IonicContact OE2-NE 2.68Å; E877-T881 WeakPolarHBondContact O-CB 3.38Å; E877-T881 PolarHBondContact O-N 2.75Å; E877-T881 PolarHBondContact O-OG1 3Å
878	H	86.5	Confident	82.3	Confident	112 Å²	112	77.6 Å²	77.6	52%	0.519	39%	0.385	S	S	.	.	H	α-helix	trans	-64.9	-45.9	171.6	-173.5	76.6	0	0	0	111.9	Y874 I875 R880 T881 D882	Y874-H878 WeakPolarHBondContact O-CB 3.3Å; Y874-H878 PolarHBondContact O-N 2.83Å; I875-H878 PolarHBondContact O-N 3.26Å; H878-R880 PolarHBondContact O-N 3.08Å; H878-T881 WeakPolarHBondContact O-CB 3.46Å; H878-T881 PolarHBondContact O-N 3Å; H878-D882 PolarHBondContact O-N 3.13Å
879	L	83.2	Confident	82.7	Confident	34 Å²	34	80 Å²	80	18%	0.178	38%	0.384	C	S	.	.	H	α-helix	trans	-63.5	-40	175.7	-70.9	175.8	0	0	0	112	I414 I875 A876 T881 D882 E883	I414-L879 HydrophobicContact CG1-CD1 4.02Å; I414-L879 HydrophobicContact CG2-CD1 4.42Å; I875-L879 HydrophobicContact CG2-CD1 3.93Å; I875-L879 HydrophobicContact CG2-CG 4.32Å; I875-L879 WeakPolarHBondContact O-CB 3.28Å; I875-L879 VanDerWaalsContact O-CG 3.26Å; I875-L879 WeakPolarHBondContact O-CG 3.47Å; I875-L879 PolarHBondContact O-N 3.05Å; A876-L879 PolarHBondContact O-N 3.27Å; L879-T881 VanDerWaalsContact C-N 3.33Å; L879-D882 PolarHBondContact O-N 3.27Å; L879-E883 PolarHBondContact O-N 2.93Å
880	R	82.2	Confident	83	Confident	112 Å²	112	81.5 Å²	81.5	42%	0.423	39%	0.39	S	S	.	.	H	α-helix	trans	-60.8	-42.5	173	-176.6	-159.9	178.8	109.1	-20.1	111.7	A876 E877 H878 E883 E884	A876-R880 WeakPolarHBondContact O-CB 3.43Å; A876-R880 PolarHBondContact O-N 3.37Å; E877-R880 PolarHBondContact O-N 2.76Å; E877-R880 IonicContact OE1-NE 2.68Å; E877-R880 WeakPolarHBondContact OE2-CD 3.46Å; E877-R880 IonicContact OE2-NE 2.68Å; H878-R880 PolarHBondContact O-N 3.08Å; R880-E883 PolarHBondContact O-N 3.14Å; R880-E884 PolarHBondContact O-N 2.96Å
881	T	85.6	Confident	83.5	Confident	80 Å²	80	75.8 Å²	75.8	49%	0.491	36%	0.363	S	S	.	.	H	α-helix	trans	-64.2	-40.8	177.5	-60.4	0	0	0	0	111.5	E877 H878 L879 E884 Y885	E877-T881 WeakPolarHBondContact O-CB 3.38Å; E877-T881 PolarHBondContact O-N 2.75Å; E877-T881 PolarHBondContact O-OG1 3Å; H878-T881 WeakPolarHBondContact O-CB 3.46Å; H878-T881 PolarHBondContact O-N 3Å; L879-T881 VanDerWaalsContact C-N 3.33Å; T881-E884 PolarHBondContact O-N 3.08Å; T881-Y885 WeakPolarHBondContact O-CB 3.43Å; T881-Y885 PolarHBondContact O-N 3.41Å
882	D	83.5	Confident	83.9	Confident	63 Å²	63	73.8 Å²	73.8	34%	0.337	35%	0.346	S	S	.	.	H	α-helix	trans	-70.2	-39.7	173	-168.4	54.3	0	0	0	112.3	H878 L879 E884 Y885 Q886	H878-D882 PolarHBondContact O-N 3.13Å; L879-D882 PolarHBondContact O-N 3.27Å; D882-E884 VanDerWaalsContact C-N 3.27Å; D882-E884 PolarHBondContact O-N 2.97Å; D882-Y885 PolarHBondContact O-N 3.17Å; D882-Y885 VanDerWaalsContact O-N 3.1Å; D882-Q886 WeakPolarHBondContact O-CG 3.23Å; D882-Q886 PolarHBondContact O-N 3.22Å; D882-Q886 PolarHBondContact OD1-NE2 3.07Å; D882-Q886 PolarHBondContact OD2-NE2 3.22Å
883	E	81.1	Confident	84.3	Confident	73 Å²	73	74.1 Å²	74.1	34%	0.341	35%	0.345	S	S	.	.	H	α-helix	trans	-55.4	-41.7	172.9	-79.3	-160.2	167.4	0	0	111.5	H417 R420 L879 R880 S887	H417-E883 IonicContact CE1-OE1 2.9Å; H417-E883 IonicContact CG-OE1 3.21Å; H417-E883 IonicContact ND1-OE1 2.7Å; H417-E883 PolarHBondContact ND1-OE1 3.04Å; R420-E883 IonicContact NH1-OE1 3.35Å; R420-E883 PolarHBondContact NH1-OE1 3.05Å; R420-E883 IonicContact NH1-OE2 2.68Å; R420-E883 PolarHBondContact NH1-OE2 3.23Å; R420-E883 VanDerWaalsContact NH1-OE2 3.16Å; L879-E883 PolarHBondContact O-N 2.93Å; R880-E883 PolarHBondContact O-N 3.14Å; E883-S887 VanDerWaalsContact O-CB 3.26Å; E883-S887 WeakPolarHBondContact O-CB 3.15Å; E883-S887 PolarHBondContact O-N 3.24Å
884	E	83.4	Confident	84.7	Confident	88 Å²	88	69.4 Å²	69.4	41%	0.411	32%	0.322	S	S	.	.	H	α-helix	trans	-69.5	-40.1	174.7	-69.8	-165.8	-161.2	0	0	112.9	K801 R880 T881 D882 S887 I888	K801-E884 WeakPolarHBondContact CE-OE1 3.39Å; K801-E884 IonicContact NZ-OE1 2.88Å; K801-E884 PolarHBondContact NZ-OE1 3.29Å; R880-E884 PolarHBondContact O-N 2.96Å; T881-E884 PolarHBondContact O-N 3.08Å; D882-E884 VanDerWaalsContact C-N 3.27Å; D882-E884 PolarHBondContact O-N 2.97Å; E884-S887 PolarHBondContact O-N 3.38Å; E884-I888 WeakPolarHBondContact O-CG1 3.37Å; E884-I888 PolarHBondContact O-N 2.83Å; E884-I888 VanDerWaalsContact O-N 3.15Å
885	Y	85.9	Confident	84.9	Confident	90 Å²	90	61.7 Å²	61.7	35%	0.353	29%	0.292	S	S	.	.	H	α-helix	trans	-62.3	-49.3	175.9	-171.8	-80.2	0	0	0	111.9	P770 T771 T881 D882 S887 I888 R889	P770-Y885 HydrophobicContact CG-CD1 4.42Å; P770-Y885 HydrophobicContact CG-CD2 3.44Å; P770-Y885 VanDerWaalsContact CG-CD2 3.44Å; P770-Y885 HydrophobicContact CG-CE1 4.41Å; P770-Y885 HydrophobicContact CG-CE2 3.45Å; P770-Y885 VanDerWaalsContact CG-CE2 3.45Å; P770-Y885 HydrophobicContact CG-CG 3.94Å; T771-Y885 HydrophobicContact CG2-CE2 4.03Å; T881-Y885 WeakPolarHBondContact O-CB 3.43Å; T881-Y885 PolarHBondContact O-N 3.41Å; D882-Y885 PolarHBondContact O-N 3.17Å; D882-Y885 VanDerWaalsContact O-N 3.1Å; Y885-S887 VanDerWaalsContact C-N 3.34Å; Y885-I888 PolarHBondContact O-N 2.9Å; Y885-R889 WeakPolarHBondContact O-CB 3.2Å; Y885-R889 PolarHBondContact O-N 2.8Å; Y885-R889 VanDerWaalsContact O-N 3.11Å
886	Q	83	Confident	85.2	Confident	60 Å²	60	57.9 Å²	57.9	28%	0.28	27%	0.273	S	S	.	.	H	α-helix	trans	-63.6	-39.8	176.3	-58.4	-53.7	-24.8	0	0	110.6	D882 I888 R889 E890	D882-Q886 WeakPolarHBondContact O-CG 3.23Å; D882-Q886 PolarHBondContact O-N 3.22Å; D882-Q886 PolarHBondContact OD1-NE2 3.07Å; D882-Q886 PolarHBondContact OD2-NE2 3.22Å; Q886-I888 PolarHBondContact O-N 2.91Å; Q886-R889 CarbonylContact O-C 3.51Å; Q886-R889 WeakPolarHBondContact O-CB 3.13Å; Q886-R889 PolarHBondContact O-N 2.87Å; Q886-E890 WeakPolarHBondContact O-CB 3.29Å; Q886-E890 WeakPolarHBondContact O-CG 2.96Å; Q886-E890 PolarHBondContact O-N 3.21Å
887	S	82.7	Confident	85.5	Confident	37 Å²	37	60.8 Å²	60.8	26%	0.259	29%	0.285	S	S	.	.	H	α-helix	trans	-59.2	-44.3	178.1	-176.8	0	0	0	0	112.9	E883 E884 Y885 E890 D891	E883-S887 VanDerWaalsContact O-CB 3.26Å; E883-S887 WeakPolarHBondContact O-CB 3.15Å; E883-S887 PolarHBondContact O-N 3.24Å; E884-S887 PolarHBondContact O-N 3.38Å; Y885-S887 VanDerWaalsContact C-N 3.34Å; S887-E890 PolarHBondContact O-N 2.96Å; S887-D891 PolarHBondContact O-N 2.92Å
888	I	85.9	Confident	85.8	Confident	63 Å²	63	55.8 Å²	55.8	32%	0.323	26%	0.262	S	S	.	.	H	α-helix	trans	-69.5	-36.8	178.3	-61.2	163.8	0	0	0	110.8	P770 E884 Y885 Q886 E890 D891 W892	P770-I888 HydrophobicContact CB-CB 4.25Å; P770-I888 HydrophobicContact CB-CD1 4.08Å; P770-I888 HydrophobicContact CB-CG2 3.92Å; P770-I888 HydrophobicContact CG-CB 4.47Å; P770-I888 HydrophobicContact CG-CG2 4.5Å; E884-I888 WeakPolarHBondContact O-CG1 3.37Å; E884-I888 PolarHBondContact O-N 2.83Å; E884-I888 VanDerWaalsContact O-N 3.15Å; Y885-I888 PolarHBondContact O-N 2.9Å; Q886-I888 PolarHBondContact O-N 2.91Å; I888-E890 VanDerWaalsContact C-N 3.35Å; I888-D891 PolarHBondContact O-N 2.99Å; I888-W892 PolarHBondContact O-N 2.84Å; I888-W892 VanDerWaalsContact O-N 3.14Å
889	R	86.1	Confident	86	Confident	101 Å²	101	52.1 Å²	52.1	38%	0.381	25%	0.245	S	C	.	.	H	α-helix	trans	-65.8	-35.7	173.9	-175.6	-173.9	178.4	-152.3	7.8	112	Y885 Q886 K893	Y885-R889 WeakPolarHBondContact O-CB 3.2Å; Y885-R889 PolarHBondContact O-N 2.8Å; Y885-R889 VanDerWaalsContact O-N 3.11Å; Q886-R889 CarbonylContact O-C 3.51Å; Q886-R889 WeakPolarHBondContact O-CB 3.13Å; Q886-R889 PolarHBondContact O-N 2.87Å; R889-K893 VanDerWaalsContact O-CG 3.27Å; R889-K893 WeakPolarHBondContact O-CG 3.28Å; R889-K893 PolarHBondContact O-N 2.83Å; R889-K893 VanDerWaalsContact O-N 3.08Å
890	E	84	Confident	86.3	Confident	78 Å²	78	50.9 Å²	50.9	36%	0.364	24%	0.239	S	C	.	.	H	α-helix	trans	-68.7	-39.1	172.8	-73.7	-143.8	132.1	0	0	112.3	Q886 S887 I888 W892 K893 Y894	Q886-E890 WeakPolarHBondContact O-CB 3.29Å; Q886-E890 WeakPolarHBondContact O-CG 2.96Å; Q886-E890 PolarHBondContact O-N 3.21Å; S887-E890 PolarHBondContact O-N 2.96Å; I888-E890 VanDerWaalsContact C-N 3.35Å; E890-W892 PolarHBondContact O-N 2.67Å; E890-K893 PolarHBondContact O-N 3.31Å; E890-Y894 VanDerWaalsContact O-CB 3.31Å; E890-Y894 WeakPolarHBondContact O-CB 3.46Å; E890-Y894 PolarHBondContact O-N 2.9Å
891	D	87.8	Confident	86.7	Confident	10 Å²	10	47.2 Å²	47.2	5%	0.053	23%	0.225	C	C	.	.	H	α-helix	trans	-58.7	-47.6	172.1	-67.1	-56.2	0	0	0	110.9	M775 L784 R795 R798 S887 I888 K893 Y894 V895	M775-D891 HydrophobicContact CE-CB 4.21Å; M775-D891 HydrophobicContact SD-CB 4.43Å; L784-D891 HydrophobicContact CD1-CB 4.12Å; R795-D891 IonicContact CZ-OD1 3.21Å; R795-D891 IonicContact NH2-OD1 2.73Å; R795-D891 PolarHBondContact NH2-OD1 2.9Å; R798-D891 IonicContact CZ-OD1 2.85Å; R798-D891 IonicContact CZ-OD2 3.36Å; R798-D891 IonicContact NE-OD1 3.14Å; R798-D891 IonicContact NH2-OD1 2.79Å; R798-D891 PolarHBondContact NH2-OD1 2.86Å; R798-D891 IonicContact NH2-OD2 3.22Å; R798-D891 PolarHBondContact NH2-OD2 2.84Å; S887-D891 PolarHBondContact O-N 2.92Å; I888-D891 PolarHBondContact O-N 2.99Å; D891-K893 PolarHBondContact O-N 2.84Å; D891-Y894 CarbonylContact O-C 3.46Å; D891-Y894 WeakPolarHBondContact O-CB 3.47Å; D891-Y894 PolarHBondContact O-N 2.97Å; D891-Y894 VanDerWaalsContact O-N 3.12Å; D891-V895 WeakPolarHBondContact O-CG2 3.41Å; D891-V895 PolarHBondContact O-N 2.85Å
892	W	89.5	Confident	86.9	Confident	5 Å²	5	45.6 Å²	45.6	2%	0.019	21%	0.213	C	C	.	.	H	α-helix	trans	-61.1	-43.2	178.1	-83	120.7	0	0	0	112.8	V765 R768 H773 M775 V779 I888 E890 Y894 V895 A896	V765-W892 HydrophobicContact CG1-CE3 3.94Å; V765-W892 HydrophobicContact CG1-CZ3 4.18Å; R768-W892 HydrophobicContact CB-CB 4.45Å; R768-W892 HydrophobicContact CB-CD2 3.73Å; R768-W892 HydrophobicContact CB-CE3 4.18Å; R768-W892 HydrophobicContact CB-CG 3.87Å; R768-W892 HydrophobicContact CB-CZ2 4.45Å; H773-W892 HydrophobicContact CB-CZ2 3.87Å; H773-W892 PolarHBondContact O-NE1 2.72Å; M775-W892 HydrophobicContact CB-CZ2 3.95Å; M775-W892 HydrophobicContact CG-CZ2 4.49Å; V779-W892 HydrophobicContact CG1-CZ3 4.48Å; I888-W892 PolarHBondContact O-N 2.84Å; I888-W892 VanDerWaalsContact O-N 3.14Å; E890-W892 PolarHBondContact O-N 2.67Å; W892-Y894 VanDerWaalsContact C-N 3.3Å; W892-Y894 PolarHBondContact O-N 2.8Å; W892-V895 PolarHBondContact O-N 3.12Å; W892-A896 PolarHBondContact O-N 2.89Å
893	K	87.8	Confident	87.3	Confident	58 Å²	58	43.9 Å²	43.9	25%	0.252	20%	0.204	S	C	.	.	H	α-helix	trans	-60.2	-38.8	172.4	-70.4	169.2	179.9	170.7	0	112.1	F766 R889 E890 D891 A896 M897	F766-K893 HydrophobicContact CD2-CB 4.3Å; F766-K893 HydrophobicContact CD2-CG 4.03Å; F766-K893 HydrophobicContact CE2-CB 4.13Å; F766-K893 HydrophobicContact CE2-CD 4.4Å; F766-K893 HydrophobicContact CE2-CG 3.7Å; F766-K893 HydrophobicContact CZ-CG 4.2Å; R889-K893 VanDerWaalsContact O-CG 3.27Å; R889-K893 WeakPolarHBondContact O-CG 3.28Å; R889-K893 PolarHBondContact O-N 2.83Å; R889-K893 VanDerWaalsContact O-N 3.08Å; E890-K893 PolarHBondContact O-N 3.31Å; D891-K893 PolarHBondContact O-N 2.84Å; K893-A896 PolarHBondContact O-N 2.89Å; K893-M897 WeakPolarHBondContact O-CB 3.4Å; K893-M897 PolarHBondContact O-N 3.12Å
894	Y	87	Confident	87.8	Confident	30 Å²	30	41.7 Å²	41.7	12%	0.118	19%	0.194	C	C	.	.	H	α-helix	trans	-70.4	-40.6	178.1	-169.5	-89.2	0	0	0	111.6	L784 P788 R795 E890 D891 W892 A896 M897 V898	L784-Y894 HydrophobicContact CD2-CD1 3.6Å; L784-Y894 HydrophobicContact CD2-CE1 4.34Å; L784-Y894 HydrophobicContact CD2-CG 4.49Å; P788-Y894 HydrophobicContact CB-CE1 4.34Å; P788-Y894 HydrophobicContact CG-CE1 3.78Å; R795-Y894 WeakPolarHBondContact CA-OH 3.33Å; R795-Y894 HydrophobicContact CB-CE1 4.49Å; R795-Y894 HydrophobicContact CG-CE1 4.26Å; R795-Y894 HydrophobicContact CG-CE2 4.45Å; R795-Y894 PolarHBondContact N-OH 3.49Å; E890-Y894 VanDerWaalsContact O-CB 3.31Å; E890-Y894 WeakPolarHBondContact O-CB 3.46Å; E890-Y894 PolarHBondContact O-N 2.9Å; D891-Y894 CarbonylContact O-C 3.46Å; D891-Y894 WeakPolarHBondContact O-CB 3.47Å; D891-Y894 PolarHBondContact O-N 2.97Å; D891-Y894 VanDerWaalsContact O-N 3.12Å; W892-Y894 VanDerWaalsContact C-N 3.3Å; W892-Y894 PolarHBondContact O-N 2.8Å; Y894-A896 VanDerWaalsContact C-N 3.34Å; Y894-A896 PolarHBondContact O-N 3.49Å; Y894-M897 PolarHBondContact O-N 2.68Å; Y894-V898 HydrophobicContact CD1-CG2 3.76Å; Y894-V898 HydrophobicContact CE1-CG2 3.52Å; Y894-V898 WeakPolarHBondContact O-CB 3.28Å; Y894-V898 VanDerWaalsContact O-CG2 3.23Å; Y894-V898 WeakPolarHBondContact O-CG2 3.31Å; Y894-V898 PolarHBondContact O-N 2.99Å
895	V	90.1	Very high	88.1	Confident	2 Å²	2	43.7 Å²	43.7	1%	0.012	20%	0.199	C	C	.	.	H	α-helix	trans	-56.4	-48.4	170.4	172.9	0	0	0	0	110.4	V765 V779 F783 L784 D891 W892 M897 V898 I899	V765-V895 HydrophobicContact CG1-CG1 4.03Å; V779-V895 HydrophobicContact CG1-CG1 4.14Å; V779-V895 HydrophobicContact CG1-CG2 4.13Å; F783-V895 HydrophobicContact CB-CB 4.32Å; F783-V895 HydrophobicContact CB-CG1 3.92Å; F783-V895 HydrophobicContact CB-CG2 3.92Å; F783-V895 HydrophobicContact CD2-CG1 4.2Å; F783-V895 HydrophobicContact CG-CG1 3.97Å; L784-V895 HydrophobicContact CD2-CG2 3.59Å; L784-V895 HydrophobicContact CG-CG2 4.22Å; D891-V895 WeakPolarHBondContact O-CG2 3.41Å; D891-V895 PolarHBondContact O-N 2.85Å; W892-V895 PolarHBondContact O-N 3.12Å; V895-M897 PolarHBondContact O-N 2.8Å; V895-V898 PolarHBondContact O-N 3Å; V895-I899 HydrophobicContact CG1-CD1 3.75Å; V895-I899 HydrophobicContact CG1-CG1 4.47Å; V895-I899 VanDerWaalsContact O-CG1 3.31Å; V895-I899 WeakPolarHBondContact O-CG1 3.32Å; V895-I899 PolarHBondContact O-N 2.77Å
896	A	90	Very high	88.4	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.008	20%	0.204	C	C	.	.	H	α-helix	trans	-59	-46.1	177.1	0	0	0	0	0	112	I762 V765 F766 W892 K893 Y894 V898 I899 D900	I762-A896 HydrophobicContact CG2-CB 4.37Å; V765-A896 HydrophobicContact CG1-CB 4.16Å; F766-A896 HydrophobicContact CB-CB 3.8Å; F766-A896 HydrophobicContact CD2-CB 4.22Å; W892-A896 PolarHBondContact O-N 2.89Å; K893-A896 PolarHBondContact O-N 2.89Å; Y894-A896 VanDerWaalsContact C-N 3.34Å; Y894-A896 PolarHBondContact O-N 3.49Å; A896-V898 VanDerWaalsContact C-N 3.34Å; A896-V898 PolarHBondContact O-N 3.18Å; A896-I899 PolarHBondContact O-N 3.37Å; A896-D900 WeakPolarHBondContact O-CB 3.42Å; A896-D900 PolarHBondContact O-N 3.08Å
897	M	86.2	Confident	88.8	Confident	75 Å²	75	41.4 Å²	41.4	37%	0.369	19%	0.193	S	C	.	.	H	α-helix	trans	-62.9	-36.3	176.9	-174.4	-178.6	-65	0	0	113	P302 K893 Y894 V895 D900 R901	P302-M897 HydrophobicContact CG-CE 4.36Å; K893-M897 WeakPolarHBondContact O-CB 3.4Å; K893-M897 PolarHBondContact O-N 3.12Å; Y894-M897 PolarHBondContact O-N 2.68Å; V895-M897 PolarHBondContact O-N 2.8Å; M897-D900 WeakPolarHBondContact O-CB 3.48Å; M897-R901 WeakPolarHBondContact O-CB 3.5Å; M897-R901 WeakPolarHBondContact O-CG 3.37Å; M897-R901 PolarHBondContact O-N 3.27Å; M897-R901 VanDerWaalsContact O-N 3.12Å
898	V	89.6	Confident	89.2	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-70.8	-38.9	177.6	166.7	0	0	0	0	111.4	F783 L787 P788 L791 Y894 V895 A896 R901 L902	F783-V898 HydrophobicContact CD1-CG1 4.14Å; L787-V898 HydrophobicContact CB-CG1 3.88Å; L787-V898 HydrophobicContact CD2-CG1 3.64Å; L787-V898 HydrophobicContact CG-CG1 4.29Å; P788-V898 HydrophobicContact CG-CG1 4.35Å; P788-V898 HydrophobicContact CG-CG2 3.98Å; L791-V898 HydrophobicContact CD1-CG1 4.2Å; Y894-V898 HydrophobicContact CD1-CG2 3.76Å; Y894-V898 HydrophobicContact CE1-CG2 3.52Å; Y894-V898 WeakPolarHBondContact O-CB 3.28Å; Y894-V898 VanDerWaalsContact O-CG2 3.23Å; Y894-V898 WeakPolarHBondContact O-CG2 3.31Å; Y894-V898 PolarHBondContact O-N 2.99Å; V895-V898 PolarHBondContact O-N 3Å; A896-V898 VanDerWaalsContact C-N 3.34Å; A896-V898 PolarHBondContact O-N 3.18Å; V898-R901 PolarHBondContact O-N 3.36Å; V898-L902 PolarHBondContact O-N 3.01Å
899	I	90.5	Very high	89.5	Confident	34 Å²	34	42.8 Å²	42.8	17%	0.174	20%	0.204	C	C	.	.	H	α-helix	trans	-62.4	-51.6	172.7	-69.2	164.2	0	0	0	110.3	I762 V765 F783 V895 A896 R901 L902 L903	I762-I899 HydrophobicContact CD1-CG2 4.44Å; I762-I899 HydrophobicContact CG1-CG2 3.87Å; V765-I899 HydrophobicContact CG1-CD1 4.4Å; F783-I899 HydrophobicContact CD1-CD1 4.39Å; F783-I899 HydrophobicContact CD1-CG1 3.75Å; F783-I899 HydrophobicContact CE1-CD1 4.09Å; F783-I899 HydrophobicContact CE1-CG1 3.43Å; F783-I899 VanDerWaalsContact CE1-CG1 3.43Å; F783-I899 HydrophobicContact CZ-CD1 4.3Å; F783-I899 HydrophobicContact CZ-CG1 4.09Å; V895-I899 HydrophobicContact CG1-CD1 3.75Å; V895-I899 HydrophobicContact CG1-CG1 4.47Å; V895-I899 VanDerWaalsContact O-CG1 3.31Å; V895-I899 WeakPolarHBondContact O-CG1 3.32Å; V895-I899 PolarHBondContact O-N 2.77Å; A896-I899 PolarHBondContact O-N 3.37Å; I899-R901 PolarHBondContact O-N 3.39Å; I899-L902 WeakPolarHBondContact O-CB 3.29Å; I899-L902 PolarHBondContact O-N 2.93Å; I899-L903 HydrophobicContact CG2-CD1 3.58Å; I899-L903 HydrophobicContact CG2-CG 4.5Å; I899-L903 WeakPolarHBondContact O-CD1 3.33Å; I899-L903 WeakPolarHBondContact O-CG 3.5Å; I899-L903 PolarHBondContact O-N 2.95Å
900	D	91	Very high	89.7	Confident	8 Å²	8	41.4 Å²	41.4	4%	0.043	21%	0.207	C	C	.	.	H	α-helix	trans	-49.6	-43.4	177.2	-153.4	29	0	0	0	111.7	F700 K709 I762 A896 M897 L903 L904	F700-D900 WeakPolarHBondContact CA-OD1 3.44Å; K709-D900 IonicContact NZ-OD1 2.69Å; K709-D900 PolarHBondContact NZ-OD1 2.72Å; K709-D900 IonicContact NZ-OD2 3.71Å; K709-D900 PolarHBondContact NZ-OD2 3.18Å; I762-D900 HydrophobicContact CD1-CB 4.47Å; A896-D900 WeakPolarHBondContact O-CB 3.42Å; A896-D900 PolarHBondContact O-N 3.08Å; M897-D900 WeakPolarHBondContact O-CB 3.48Å; D900-L903 PolarHBondContact O-N 2.54Å; D900-L904 PolarHBondContact O-N 3.38Å
901	R	89.2	Confident	90.1	Very high	35 Å²	35	38 Å²	38	13%	0.132	19%	0.192	C	C	.	.	H	α-helix	trans	-81.5	-31.4	-175.5	-65.4	-78.7	165.9	176.5	-4.8	113.5	Y701 M793 M897 V898 I899 L903 Y905	Y701-R901 PolarHBondContact O-NH2 3.27Å; M793-R901 HydrophobicContact CE-CB 3.6Å; M793-R901 HydrophobicContact CE-CG 3.58Å; M897-R901 WeakPolarHBondContact O-CB 3.5Å; M897-R901 WeakPolarHBondContact O-CG 3.37Å; M897-R901 PolarHBondContact O-N 3.27Å; M897-R901 VanDerWaalsContact O-N 3.12Å; V898-R901 PolarHBondContact O-N 3.36Å; I899-R901 PolarHBondContact O-N 3.39Å; R901-L903 VanDerWaalsContact C-N 3.33Å; R901-Y905 WeakPolarHBondContact O-CD2 3.2Å
902	L	91	Very high	90.2	Very high	47 Å²	47	40.9 Å²	40.9	25%	0.246	21%	0.207	C	C	.	.	H	α-helix	trans	-58.8	-49.4	166.2	179.4	76.3	0	0	0	110.2	L787 M790 L791 V898 I899 L904 Y905 I906	L787-L902 HydrophobicContact CD1-CD1 4.42Å; L787-L902 HydrophobicContact CD2-CB 3.99Å; L787-L902 HydrophobicContact CD2-CD1 4.12Å; L787-L902 HydrophobicContact CD2-CD2 4.08Å; L787-L902 HydrophobicContact CD2-CG 4.26Å; L787-L902 HydrophobicContact CG-CD1 4.46Å; M790-L902 HydrophobicContact CE-CD1 3.73Å; L791-L902 HydrophobicContact CD1-CB 4.25Å; L791-L902 HydrophobicContact CD2-CD1 4.44Å; V898-L902 PolarHBondContact O-N 3.01Å; I899-L902 WeakPolarHBondContact O-CB 3.29Å; I899-L902 PolarHBondContact O-N 2.93Å; L902-L904 PolarHBondContact O-N 2.89Å; L902-Y905 PolarHBondContact O-N 3.08Å; L902-I906 HydrophobicContact CD1-CD1 4.32Å; L902-I906 HydrophobicContact CD2-CD1 4.06Å; L902-I906 HydrophobicContact CG-CD1 3.8Å; L902-I906 WeakPolarHBondContact O-CG1 3.39Å; L902-I906 PolarHBondContact O-N 3.36Å; L902-I906 VanDerWaalsContact O-N 3.11Å
903	L	91.6	Very high	90.2	Very high	26 Å²	26	42.8 Å²	42.8	14%	0.136	23%	0.228	C	C	.	.	H	α-helix	trans	-65.8	-38.6	-175.8	-69.6	159.8	0	0	0	112	F700 V758 I762 I899 D900 R901 Y905 I906 F907	F700-L903 HydrophobicContact CD1-CB 4Å; F700-L903 HydrophobicContact CE1-CB 3.96Å; F700-L903 HydrophobicContact CE1-CD1 4.19Å; F700-L903 HydrophobicContact CG-CB 4.41Å; F700-L903 HydrophobicContact CZ-CB 4.33Å; V758-L903 HydrophobicContact CG1-CD1 3.29Å; V758-L903 HydrophobicContact CG1-CD2 4.05Å; V758-L903 HydrophobicContact CG1-CG 4.28Å; I762-L903 HydrophobicContact CD1-CD1 3.75Å; I762-L903 HydrophobicContact CG1-CD1 4.36Å; I899-L903 HydrophobicContact CG2-CD1 3.58Å; I899-L903 HydrophobicContact CG2-CG 4.5Å; I899-L903 WeakPolarHBondContact O-CD1 3.33Å; I899-L903 WeakPolarHBondContact O-CG 3.5Å; I899-L903 PolarHBondContact O-N 2.95Å; D900-L903 PolarHBondContact O-N 2.54Å; R901-L903 VanDerWaalsContact C-N 3.33Å; L903-Y905 VanDerWaalsContact C-N 3.28Å; L903-Y905 PolarHBondContact O-N 3.45Å; L903-I906 PolarHBondContact O-N 2.91Å; L903-F907 HydrophobicContact CB-CD2 4.42Å; L903-F907 HydrophobicContact CD2-CD2 4.46Å; L903-F907 HydrophobicContact CD2-CE2 4.12Å; L903-F907 WeakPolarHBondContact O-CB 3.33Å; L903-F907 WeakPolarHBondContact O-CD2 3.48Å; L903-F907 PolarHBondContact O-N 3.19Å
904	L	91	Very high	90.3	Very high	27 Å²	27	40.9 Å²	40.9	14%	0.141	22%	0.224	C	C	.	.	H	α-helix	trans	-50.6	-48	172.1	-172.6	155.7	0	0	0	111.7	F700 Y701 D900 L902 F908	F700-L904 HydrophobicContact CB-CB 3.8Å; F700-L904 HydrophobicContact CB-CD1 4.4Å; F700-L904 HydrophobicContact CB-CG 4.35Å; Y701-L904 HydrophobicContact CD2-CD1 3.99Å; Y701-L904 HydrophobicContact CG-CD1 4.46Å; D900-L904 PolarHBondContact O-N 3.38Å; L902-L904 PolarHBondContact O-N 2.89Å; L904-F908 WeakPolarHBondContact O-CB 3.46Å; L904-F908 PolarHBondContact O-N 2.85Å
905	Y	90.3	Very high	90.4	Very high	131 Å²	131	40 Å²	40	51%	0.514	22%	0.222	S	C	.	.	H	α-helix	trans	-70	-39.6	179.4	-65.5	-62.3	0	0	0	113	L791 R901 L902 L903 G909	L791-Y905 HydrophobicContact CD2-CD2 3.72Å; L791-Y905 HydrophobicContact CD2-CE2 3.87Å; R901-Y905 WeakPolarHBondContact O-CD2 3.2Å; L902-Y905 PolarHBondContact O-N 3.08Å; L903-Y905 VanDerWaalsContact C-N 3.28Å; L903-Y905 PolarHBondContact O-N 3.45Å; Y905-G909 PolarHBondContact O-N 3.2Å
906	I	91.6	Very high	90.3	Very high	88 Å²	88	43.1 Å²	43.1	45%	0.451	24%	0.241	S	C	.	.	H	α-helix	trans	-62.9	-52.8	177.1	-67.1	171	0	0	0	110.2	L902 L903 G909 V910	L902-I906 HydrophobicContact CD1-CD1 4.32Å; L902-I906 HydrophobicContact CD2-CD1 4.06Å; L902-I906 HydrophobicContact CG-CD1 3.8Å; L902-I906 WeakPolarHBondContact O-CG1 3.39Å; L902-I906 PolarHBondContact O-N 3.36Å; L902-I906 VanDerWaalsContact O-N 3.11Å; L903-I906 PolarHBondContact O-N 2.91Å; I906-G909 PolarHBondContact O-N 2.78Å; I906-V910 WeakPolarHBondContact O-CG2 3.44Å; I906-V910 PolarHBondContact O-N 2.84Å
907	F	91.8	Very high	90.2	Very high	14 Å²	14	44.8 Å²	44.8	6%	0.061	26%	0.258	C	S	.	.	H	α-helix	trans	-62.3	-47.9	-179.6	-86.7	-101.8	0	0	0	110.9	F700 L751 I754 T755 L903 G909 V910 T911	F700-F907 HydrophobicContact CD2-CB 4.42Å; F700-F907 HydrophobicContact CD2-CG 4.43Å; F700-F907 HydrophobicContact CE2-CB 4.05Å; F700-F907 AromaticContact CE2-CD1 3.94Å; F700-F907 HydrophobicContact CE2-CD1 3.94Å; F700-F907 AromaticContact CE2-CD2 3.73Å; F700-F907 HydrophobicContact CE2-CD2 3.73Å; F700-F907 HydrophobicContact CE2-CE1 4.33Å; F700-F907 HydrophobicContact CE2-CE2 4.14Å; F700-F907 AromaticContact CE2-CG 3.61Å; F700-F907 HydrophobicContact CE2-CG 3.61Å; F700-F907 HydrophobicContact CE2-CZ 4.42Å; F700-F907 AromaticContact CZ-CD2 3.94Å; F700-F907 HydrophobicContact CZ-CD2 3.94Å; F700-F907 HydrophobicContact CZ-CE1 4.48Å; F700-F907 AromaticContact CZ-CE2 3.92Å; F700-F907 HydrophobicContact CZ-CE2 3.92Å; F700-F907 HydrophobicContact CZ-CG 4.25Å; F700-F907 HydrophobicContact CZ-CZ 4.19Å; L751-F907 HydrophobicContact CD2-CD1 4.49Å; L751-F907 HydrophobicContact CD2-CE1 4.19Å; I754-F907 HydrophobicContact CB-CZ 4.34Å; I754-F907 HydrophobicContact CG2-CZ 3.89Å; T755-F907 WeakPolarHBondContact OG1-CE1 3.41Å; L903-F907 HydrophobicContact CB-CD2 4.42Å; L903-F907 HydrophobicContact CD2-CD2 4.46Å; L903-F907 HydrophobicContact CD2-CE2 4.12Å; L903-F907 WeakPolarHBondContact O-CB 3.33Å; L903-F907 WeakPolarHBondContact O-CD2 3.48Å; L903-F907 PolarHBondContact O-N 3.19Å; F907-G909 VanDerWaalsContact C-N 3.29Å; F907-G909 PolarHBondContact O-N 3.11Å; F907-V910 PolarHBondContact O-N 2.94Å; F907-V910 VanDerWaalsContact O-N 3.11Å; F907-T911 PolarHBondContact O-N 2.85Å; F907-T911 PolarHBondContact O-OG1 2.85Å
908	F	91.3	Very high	90.2	Very high	87 Å²	87	42.8 Å²	42.8	38%	0.382	25%	0.248	S	C	.	.	H	α-helix	trans	-52.5	-46.4	175.8	178.9	-95.4	0	0	0	112.1	F694 M697 L904 T911 L912	F694-F908 HydrophobicContact CE1-CE2 4.19Å; M697-F908 HydrophobicContact SD-CB 4.44Å; M697-F908 HydrophobicContact SD-CD2 3.78Å; L904-F908 WeakPolarHBondContact O-CB 3.46Å; L904-F908 PolarHBondContact O-N 2.85Å; F908-T911 WeakPolarHBondContact CA-OG1 3.36Å; F908-T911 PolarHBondContact O-OG1 2.92Å; F908-T911 VanDerWaalsContact O-OG1 3.06Å; F908-L912 HydrophobicContact CE1-CD2 3.87Å; F908-L912 HydrophobicContact CZ-CD2 4.01Å; F908-L912 WeakPolarHBondContact O-CB 3.25Å; F908-L912 PolarHBondContact O-N 2.84Å
909	G	91.2	Very high	89.9	Confident	42 Å²	42	45.7 Å²	45.7	43%	0.433	26%	0.264	S	S	.	.	H	α-helix	trans	-61.2	-47.4	176.3	0	0	0	0	0	113.2	Y905 I906 F907 G913	Y905-G909 PolarHBondContact O-N 3.2Å; I906-G909 PolarHBondContact O-N 2.78Å; F907-G909 VanDerWaalsContact C-N 3.29Å; F907-G909 PolarHBondContact O-N 3.11Å; G909-G913 PolarHBondContact O-N 2.98Å
910	V	92.1	Very high	89.6	Confident	71 Å²	71	49.7 Å²	49.7	43%	0.43	29%	0.285	S	S	.	.	H	α-helix	trans	-64.4	-43.7	178.9	172.4	0	0	0	0	111.8	L751 I906 F907 G914	L751-V910 HydrophobicContact CD1-CG1 4.11Å; L751-V910 HydrophobicContact CD2-CG1 3.9Å; I906-V910 WeakPolarHBondContact O-CG2 3.44Å; I906-V910 PolarHBondContact O-N 2.84Å; F907-V910 PolarHBondContact O-N 2.94Å; F907-V910 VanDerWaalsContact O-N 3.11Å; V910-G914 PolarHBondContact O-N 2.89Å
911	T	90.6	Very high	89.4	Confident	8 Å²	8	52.6 Å²	52.6	5%	0.049	31%	0.306	C	S	.	.	H	α-helix	trans	-73.3	-37.2	-179.3	47.3	0	0	0	0	113.2	M697 L751 F907 F908 T915	M697-T911 HydrophobicContact CE-CG2 3.95Å; M697-T911 WeakPolarHBondContact CE-OG1 3.41Å; M697-T911 HydrophobicContact CG-CG2 4.43Å; M697-T911 PolarHBondContact SD-OG1 3.38Å; L751-T911 HydrophobicContact CD1-CG2 3.87Å; F907-T911 PolarHBondContact O-N 2.85Å; F907-T911 PolarHBondContact O-OG1 2.85Å; F908-T911 WeakPolarHBondContact CA-OG1 3.36Å; F908-T911 PolarHBondContact O-OG1 2.92Å; F908-T911 VanDerWaalsContact O-OG1 3.06Å; T911-T915 VanDerWaalsContact O-CB 3.3Å; T911-T915 WeakPolarHBondContact O-CB 3.48Å; T911-T915 PolarHBondContact O-N 3.12Å; T911-T915 PolarHBondContact O-OG1 3.13Å
912	L	90.4	Very high	89.1	Confident	70 Å²	70	51.2 Å²	51.2	37%	0.366	30%	0.302	S	S	.	.	H	α-helix	trans	-69.3	-48.1	175.7	-179.9	63	0	0	0	109.8	F908 G914 T915 V916	F908-L912 HydrophobicContact CE1-CD2 3.87Å; F908-L912 HydrophobicContact CZ-CD2 4.01Å; F908-L912 WeakPolarHBondContact O-CB 3.25Å; F908-L912 PolarHBondContact O-N 2.84Å; L912-G914 PolarHBondContact O-N 3.44Å; L912-T915 PolarHBondContact O-N 3.37Å; L912-V916 HydrophobicContact CD1-CG2 4.1Å; L912-V916 WeakPolarHBondContact O-CB 3.45Å; L912-V916 WeakPolarHBondContact O-CG2 3.42Å; L912-V916 PolarHBondContact O-N 3.39Å
913	G	90.8	Very high	88.5	Confident	45 Å²	45	53.4 Å²	53.4	46%	0.464	32%	0.319	S	S	.	.	H	α-helix	trans	-60.7	-41.4	175.6	0	0	0	0	0	112.8	G909 G917	G909-G913 PolarHBondContact O-N 2.98Å; G913-G917 WeakPolarHBondContact O-CA 3.27Å; G913-G917 PolarHBondContact O-N 2.98Å
914	G	89.8	Confident	87.7	Confident	17 Å²	17	53.2 Å²	53.2	18%	0.175	32%	0.318	C	S	.	.	H	α-helix	trans	-65	-45	175.1	0	0	0	0	0	113.1	V910 L912 I918	V910-G914 PolarHBondContact O-N 2.89Å; L912-G914 PolarHBondContact O-N 3.44Å; G914-I918 VanDerWaalsContact O-CB 3.29Å; G914-I918 WeakPolarHBondContact O-CB 3.38Å; G914-I918 WeakPolarHBondContact O-CG1 3.33Å; G914-I918 PolarHBondContact O-N 3.48Å
915	T	88.6	Confident	87	Confident	13 Å²	13	53.4 Å²	53.4	8%	0.08	32%	0.32	C	S	.	.	H	α-helix	trans	-66.4	-45.9	178.7	-54.7	0	0	0	0	111.4	V690 Y744 T911 L912 L919	V690-T915 HydrophobicContact CG1-CG2 4.29Å; V690-T915 HydrophobicContact CG2-CG2 3.96Å; Y744-T915 HydrophobicContact CE2-CG2 4.26Å; Y744-T915 WeakPolarHBondContact CE2-OG1 3.41Å; Y744-T915 PolarHBondContact OH-OG1 3.4Å; T911-T915 VanDerWaalsContact O-CB 3.3Å; T911-T915 WeakPolarHBondContact O-CB 3.48Å; T911-T915 PolarHBondContact O-N 3.12Å; T911-T915 PolarHBondContact O-OG1 3.13Å; L912-T915 PolarHBondContact O-N 3.37Å; T915-L919 HydrophobicContact CG2-CD1 4.1Å; T915-L919 WeakPolarHBondContact O-CB 3.34Å; T915-L919 VanDerWaalsContact O-CG 3.32Å; T915-L919 WeakPolarHBondContact O-CG 3.35Å; T915-L919 PolarHBondContact O-N 3.21Å
916	V	87.6	Confident	86	Confident	67 Å²	67	54.8 Å²	54.8	41%	0.406	33%	0.329	S	S	.	.	H	α-helix	trans	-66.8	-45.4	177.5	172	0	0	0	0	111.2	L912 I918 L919 L920	L912-V916 HydrophobicContact CD1-CG2 4.1Å; L912-V916 WeakPolarHBondContact O-CB 3.45Å; L912-V916 WeakPolarHBondContact O-CG2 3.42Å; L912-V916 PolarHBondContact O-N 3.39Å; V916-I918 VanDerWaalsContact C-N 3.33Å; V916-I918 PolarHBondContact O-N 3.15Å; V916-L919 PolarHBondContact O-N 3.06Å; V916-L920 HydrophobicContact CG1-CD1 3.68Å; V916-L920 HydrophobicContact CG1-CG 4.22Å; V916-L920 WeakPolarHBondContact O-CB 3.29Å; V916-L920 VanDerWaalsContact O-CG 3.32Å; V916-L920 WeakPolarHBondContact O-CG 3.43Å; V916-L920 PolarHBondContact O-N 2.91Å
917	G	87.1	Confident	85	Confident	35 Å²	35	55.8 Å²	55.8	36%	0.361	33%	0.332	S	S	.	.	H	α-helix	trans	-61.7	-39.2	179.3	0	0	0	0	0	112.8	G913 S921	G913-G917 WeakPolarHBondContact O-CA 3.27Å; G913-G917 PolarHBondContact O-N 2.98Å; G917-S921 WeakPolarHBondContact O-CB 3.38Å; G917-S921 PolarHBondContact O-N 3.46Å; G917-S921 VanDerWaalsContact O-N 3.07Å; G917-S921 PolarHBondContact O-OG 2.84Å
918	I	86.6	Confident	84	Confident	33 Å²	33	64.2 Å²	64.2	17%	0.169	37%	0.369	C	S	.	.	H	α-helix	trans	-70.3	-44.4	176	-79.9	166	0	0	0	111.6	L740 Y744 L747 G914 V916 L920 S921	L740-I918 HydrophobicContact CD1-CB 4.42Å; L740-I918 HydrophobicContact CD1-CG1 4.19Å; L740-I918 HydrophobicContact CD1-CG2 3.88Å; L740-I918 HydrophobicContact CD2-CG2 4.38Å; L740-I918 HydrophobicContact CG-CG2 3.89Å; Y744-I918 HydrophobicContact CD2-CD1 3.77Å; Y744-I918 HydrophobicContact CD2-CG2 4.38Å; Y744-I918 HydrophobicContact CG-CD1 4.42Å; L747-I918 HydrophobicContact CD2-CD1 4.23Å; G914-I918 VanDerWaalsContact O-CB 3.29Å; G914-I918 WeakPolarHBondContact O-CB 3.38Å; G914-I918 WeakPolarHBondContact O-CG1 3.33Å; G914-I918 PolarHBondContact O-N 3.48Å; V916-I918 VanDerWaalsContact C-N 3.33Å; V916-I918 PolarHBondContact O-N 3.15Å; I918-L920 VanDerWaalsContact C-N 3.32Å; I918-L920 PolarHBondContact O-N 3.37Å; I918-S921 WeakPolarHBondContact O-CB 3.5Å; I918-S921 PolarHBondContact O-N 3.32Å; I918-S921 VanDerWaalsContact O-N 3.09Å
919	L	82.9	Confident	83.3	Confident	62 Å²	62	61.8 Å²	61.8	33%	0.325	36%	0.361	S	S	.	.	H	α-helix	trans	-62.7	-37.4	175.7	-72.1	171.3	0	0	0	112.3	T915 V916 S921 V925	T915-L919 HydrophobicContact CG2-CD1 4.1Å; T915-L919 WeakPolarHBondContact O-CB 3.34Å; T915-L919 VanDerWaalsContact O-CG 3.32Å; T915-L919 WeakPolarHBondContact O-CG 3.35Å; T915-L919 PolarHBondContact O-N 3.21Å; V916-L919 PolarHBondContact O-N 3.06Å; L919-S921 VanDerWaalsContact C-N 3.28Å; L919-S921 PolarHBondContact O-N 3.28Å; L919-V925 WeakPolarHBondContact O-CG2 3.38Å
920	L	85	Confident	82.7	Confident	118 Å²	118	64.7 Å²	64.7	62%	0.618	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-6	175.1	-65	178.2	0	0	0	114	V916 I918 F926	V916-L920 HydrophobicContact CG1-CD1 3.68Å; V916-L920 HydrophobicContact CG1-CG 4.22Å; V916-L920 WeakPolarHBondContact O-CB 3.29Å; V916-L920 VanDerWaalsContact O-CG 3.32Å; V916-L920 WeakPolarHBondContact O-CG 3.43Å; V916-L920 PolarHBondContact O-N 2.91Å; I918-L920 VanDerWaalsContact C-N 3.32Å; I918-L920 PolarHBondContact O-N 3.37Å; L920-F926 HydrophobicContact CD2-CE2 4.23Å
921	S	86.1	Confident	82.1	Confident	69 Å²	69	62 Å²	62	48%	0.483	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-18.7	174.8	-63.3	0	0	0	0	113	Y608 G917 I918 L919	Y608-S921 WeakPolarHBondContact CE1-O 3.37Å; G917-S921 WeakPolarHBondContact O-CB 3.38Å; G917-S921 PolarHBondContact O-N 3.46Å; G917-S921 VanDerWaalsContact O-N 3.07Å; G917-S921 PolarHBondContact O-OG 2.84Å; I918-S921 WeakPolarHBondContact O-CB 3.5Å; I918-S921 PolarHBondContact O-N 3.32Å; I918-S921 VanDerWaalsContact O-N 3.09Å; L919-S921 VanDerWaalsContact C-N 3.28Å; L919-S921 PolarHBondContact O-N 3.28Å
922	A	83.7	Confident	81.6	Confident	6 Å²	6	67.2 Å²	67.2	5%	0.05	37%	0.373	C	S	.	.	S	Bend	trans	-90.2	126	176.3	0	0	0	0	0	110.4	Y608 F611 L740 N924 V925	Y608-A922 HydrophobicContact CD1-CB 4.26Å; F611-A922 HydrophobicContact CB-CB 4.18Å; F611-A922 HydrophobicContact CD2-CB 4Å; F611-A922 HydrophobicContact CG-CB 4.32Å; L740-A922 HydrophobicContact CD2-CB 3.8Å; A922-N924 PolarHBondContact O-N 3.3Å; A922-V925 HydrophobicContact CB-CG2 3.52Å; A922-V925 WeakPolarHBondContact O-CG2 3.5Å
923	P	77.4	Confident	81.3	Confident	92 Å²	92	68.2 Å²	68.2	60%	0.597	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-38.8	-169.2	24.9	-33.8	0	0	0	112.9	V925	P923-V925 PolarHBondContact O-N 2.67Å
924	N	76.4	Confident	81	Confident	23 Å²	23	67.3 Å²	67.3	12%	0.123	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	14.6	-165.5	-61.3	-8.6	0	0	0	114	E613 R675 A922 F926 E927	E613-N924 PolarHBondContact OE1-ND2 2.99Å; R675-N924 PolarHBondContact NE-ND2 2.65Å; A922-N924 PolarHBondContact O-N 3.3Å; N924-F926 VanDerWaalsContact C-N 3.26Å; N924-F926 PolarHBondContact O-N 3.45Å; N924-E927 PolarHBondContact O-N 2.99Å
925	V	75.5	Confident	80.7	Confident	30 Å²	30	66.8 Å²	66.8	18%	0.182	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-26.6	-170.4	169.9	0	0	0	0	114	F611 L919 A922 P923	F611-V925 HydrophobicContact CD1-CB 4.44Å; F611-V925 HydrophobicContact CD1-CG2 3.83Å; F611-V925 HydrophobicContact CD2-CG2 3.83Å; F611-V925 HydrophobicContact CE1-CB 4.38Å; F611-V925 HydrophobicContact CE1-CG1 4.43Å; F611-V925 HydrophobicContact CE1-CG2 3.93Å; F611-V925 HydrophobicContact CE2-CG2 3.93Å; F611-V925 HydrophobicContact CG-CG2 3.79Å; F611-V925 HydrophobicContact CZ-CG2 3.98Å; L919-V925 WeakPolarHBondContact O-CG2 3.38Å; A922-V925 HydrophobicContact CB-CG2 3.52Å; A922-V925 WeakPolarHBondContact O-CG2 3.5Å; P923-V925 PolarHBondContact O-N 2.67Å
926	F	70.3	Confident	80.5	Confident	160 Å²	160	69.8 Å²	69.8	70%	0.702	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.9	4.5	179.7	-58.4	-70.8	0	0	0	113.4	L920 N924	L920-F926 HydrophobicContact CD2-CE2 4.23Å; N924-F926 VanDerWaalsContact C-N 3.26Å; N924-F926 PolarHBondContact O-N 3.45Å
927	E	70.4	Confident	80.4	Confident	109 Å²	109	73.7 Å²	73.7	51%	0.509	38%	0.378	S	S	.	.			trans	-96.7	109.9	-176.2	-160.6	-175.3	144	0	0	110.6	R675 N924	R675-E927 IonicContact CZ-OE1 3.74Å; R675-E927 IonicContact CZ-OE2 2.76Å; R675-E927 IonicContact NH1-OE1 3.98Å; R675-E927 PolarHBondContact NH1-OE1 2.91Å; R675-E927 IonicContact NH1-OE2 3.97Å; R675-E927 IonicContact NH2-OE1 2.74Å; R675-E927 PolarHBondContact NH2-OE1 2.93Å; R675-E927 VanDerWaalsContact NH2-OE1 3.14Å; R675-E927 IonicContact NH2-OE2 3.62Å; R675-E927 PolarHBondContact NH2-OE2 3.35Å; N924-E927 PolarHBondContact O-N 2.99Å
928	F	71.2	Confident	80.3	Confident	191 Å²	191	72.9 Å²	72.9	84%	0.838	37%	0.365	S	S	*	.			trans	-95.3	129.3	173.7	-64.9	-87.6	0	0	0	109.5
929	V	75.1	Confident	80	Confident	36 Å²	36	73.1 Å²	73.1	22%	0.218	37%	0.366	C	S	.	.			trans	-91	126.7	176.1	-178.1	0	0	0	0	109.4	D653 I655 V934	D653-V929 HydrophobicContact CB-CB 4.49Å; D653-V929 HydrophobicContact CB-CG1 4.28Å; I655-V929 HydrophobicContact CD1-CG1 4.42Å; I655-V929 HydrophobicContact CD1-CG2 4.06Å; V929-V934 HydrophobicContact CG1-CG2 3.86Å
930	D	79.1	Confident	80	Confident	103 Å²	103	74.4 Å²	74.4	55%	0.551	37%	0.373	S	S	*	.			trans	-88.3	103.2	160.1	-171.7	-33.1	0	0	0	108.3	Q932 E933 V934	D930-Q932 PolarHBondContact O-N 3.49Å; D930-Q932 WeakPolarHBondContact OD1-CB 3.45Å; D930-Q932 PolarHBondContact OD1-N 2.89Å; D930-E933 HydrophobicContact CB-CB 4.13Å; D930-E933 PolarHBondContact O-N 3.08Å; D930-E933 PolarHBondContact OD1-N 3.07Å; D930-V934 WeakPolarHBondContact O-CG2 3.43Å; D930-V934 PolarHBondContact O-N 2.87Å; D930-V934 VanDerWaalsContact O-N 3.09Å
931	Q	79.7	Confident	79.8	Confident	14 Å²	14	75.3 Å²	75.3	7%	0.065	37%	0.372	C	S	.	.	H	α-helix	trans	-69.5	-21.5	-174.7	-166.8	57.2	26.7	0	0	113.2	Y648 D653 I654 V935	Y648-Q931 HydrophobicContact CD1-CB 4.22Å; Y648-Q931 HydrophobicContact CD1-CG 3.51Å; Y648-Q931 HydrophobicContact CE1-CB 4.36Å; Y648-Q931 HydrophobicContact CE1-CG 3.83Å; Y648-Q931 HydrophobicContact CG-CG 4.49Å; D653-Q931 WeakPolarHBondContact OD1-CB 3.5Å; D653-Q931 WeakPolarHBondContact OD1-CG 3.42Å; D653-Q931 PolarHBondContact OD1-OE1 2.76Å; I654-Q931 PolarHBondContact O-NE2 2.9Å; I654-Q931 PolarHBondContact O-OE1 2.92Å; Q931-V935 HydrophobicContact CG-CG2 4.38Å; Q931-V935 WeakPolarHBondContact O-CB 3.47Å; Q931-V935 WeakPolarHBondContact O-CG2 3.38Å; Q931-V935 PolarHBondContact O-N 3.28Å; Q931-V935 VanDerWaalsContact O-N 3.09Å
932	Q	80.6	Confident	79.3	Confident	118 Å²	118	73.4 Å²	73.4	55%	0.551	36%	0.355	S	S	*	.	H	α-helix	trans	-74.1	-44.1	176.8	-174.8	169.7	-1.4	0	0	110.3	D930 N936	D930-Q932 PolarHBondContact O-N 3.49Å; D930-Q932 WeakPolarHBondContact OD1-CB 3.45Å; D930-Q932 PolarHBondContact OD1-N 2.89Å; Q932-N936 WeakPolarHBondContact O-CB 3.47Å; Q932-N936 PolarHBondContact O-N 3.03Å; Q932-N936 PolarHBondContact O-ND2 2.87Å
933	E	84.3	Confident	78.7	Confident	92 Å²	92	78.9 Å²	78.9	43%	0.43	37%	0.374	S	S	.	.	H	α-helix	trans	-61.3	-43.6	172.7	169.9	56.4	-158.6	0	0	112.1	D930 R937	D930-E933 HydrophobicContact CB-CB 4.13Å; D930-E933 PolarHBondContact O-N 3.08Å; D930-E933 PolarHBondContact OD1-N 3.07Å; E933-R937 WeakPolarHBondContact O-CB 3.47Å; E933-R937 PolarHBondContact O-N 3.25Å; E933-R937 IonicContact OE1-CZ 3.46Å; E933-R937 IonicContact OE1-NE 3.66Å; E933-R937 PolarHBondContact OE1-NE 3.36Å; E933-R937 IonicContact OE1-NH2 2.59Å; E933-R937 PolarHBondContact OE1-NH2 3.2Å
934	V	83.9	Confident	78	Confident	26 Å²	26	77.3 Å²	77.3	16%	0.158	38%	0.375	C	S	.	.	H	α-helix	trans	-65.3	-46.1	179.3	175	0	0	0	0	112.1	I654 V929 D930 R937 L938	I654-V934 VanDerWaalsContact O-CG1 3.28Å; I654-V934 WeakPolarHBondContact O-CG1 3.45Å; V929-V934 HydrophobicContact CG1-CG2 3.86Å; D930-V934 WeakPolarHBondContact O-CG2 3.43Å; D930-V934 PolarHBondContact O-N 2.87Å; D930-V934 VanDerWaalsContact O-N 3.09Å; V934-R937 PolarHBondContact O-N 2.73Å; V934-L938 HydrophobicContact CG1-CD1 4.03Å; V934-L938 HydrophobicContact CG1-CG 4.38Å; V934-L938 WeakPolarHBondContact O-CG 3.39Å; V934-L938 PolarHBondContact O-N 2.97Å
935	V	82.7	Confident	77	Confident	5 Å²	5	82.6 Å²	82.6	3%	0.03	40%	0.399	C	S	.	.	H	α-helix	trans	-65.4	-41.7	179.3	172.3	0	0	0	0	111.5	L643 Y646 Y648 Q931 R937 L938 L939	L643-V935 HydrophobicContact CB-CG1 4.09Å; Y646-V935 HydrophobicContact CD1-CG2 4.14Å; Y648-V935 HydrophobicContact CE1-CB 4.4Å; Y648-V935 HydrophobicContact CE1-CG2 4Å; Q931-V935 HydrophobicContact CG-CG2 4.38Å; Q931-V935 WeakPolarHBondContact O-CB 3.47Å; Q931-V935 WeakPolarHBondContact O-CG2 3.38Å; Q931-V935 PolarHBondContact O-N 3.28Å; Q931-V935 VanDerWaalsContact O-N 3.09Å; V935-R937 VanDerWaalsContact C-N 3.31Å; V935-R937 PolarHBondContact O-N 3.27Å; V935-L938 PolarHBondContact O-N 2.79Å; V935-L939 HydrophobicContact CG1-CD1 4.05Å; V935-L939 HydrophobicContact CG1-CG 4.43Å; V935-L939 WeakPolarHBondContact O-CG 3.4Å; V935-L939 PolarHBondContact O-N 2.89Å
936	N	84.1	Confident	75.5	Confident	76 Å²	76	88.6 Å²	88.6	41%	0.406	44%	0.442	S	S	.	.	H	α-helix	trans	-58.2	-43	174.5	-71.7	-14.5	0	0	0	111.9	Q932 L939 L940	Q932-N936 WeakPolarHBondContact O-CB 3.47Å; Q932-N936 PolarHBondContact O-N 3.03Å; Q932-N936 PolarHBondContact O-ND2 2.87Å; N936-L939 PolarHBondContact O-N 2.98Å; N936-L940 WeakPolarHBondContact O-CG 3.45Å; N936-L940 PolarHBondContact O-N 3.06Å; N936-L940 VanDerWaalsContact O-N 3.17Å
937	R	86	Confident	75.8	Confident	149 Å²	149	85 Å²	85	56%	0.562	43%	0.429	S	S	*	.	H	α-helix	trans	-65.1	-41.8	177.8	-171.2	-176.1	-57.9	173.2	2.8	112.7	E933 V934 V935 F941	E933-R937 WeakPolarHBondContact O-CB 3.47Å; E933-R937 PolarHBondContact O-N 3.25Å; E933-R937 IonicContact OE1-CZ 3.46Å; E933-R937 IonicContact OE1-NE 3.66Å; E933-R937 PolarHBondContact OE1-NE 3.36Å; E933-R937 IonicContact OE1-NH2 2.59Å; E933-R937 PolarHBondContact OE1-NH2 3.2Å; V934-R937 PolarHBondContact O-N 2.73Å; V935-R937 VanDerWaalsContact C-N 3.31Å; V935-R937 PolarHBondContact O-N 3.27Å; R937-F941 WeakPolarHBondContact O-CB 3.33Å; R937-F941 PolarHBondContact O-N 2.79Å
938	L	84.9	Confident	76	Confident	18 Å²	18	83.7 Å²	83.7	9%	0.094	42%	0.424	C	S	.	.	H	α-helix	trans	-64.6	-40.7	176.6	-69.5	173.2	0	0	0	111.5	L643 I654 V934 V935 F941 Y942	L643-L938 HydrophobicContact CD1-CB 4.2Å; L643-L938 HydrophobicContact CD1-CD1 3.8Å; I654-L938 HydrophobicContact CG2-CD1 4.4Å; V934-L938 HydrophobicContact CG1-CD1 4.03Å; V934-L938 HydrophobicContact CG1-CG 4.38Å; V934-L938 WeakPolarHBondContact O-CG 3.39Å; V934-L938 PolarHBondContact O-N 2.97Å; V935-L938 PolarHBondContact O-N 2.79Å; L938-F941 PolarHBondContact O-N 2.8Å; L938-Y942 HydrophobicContact CB-CD2 4.2Å; L938-Y942 HydrophobicContact CB-CE2 4.01Å; L938-Y942 HydrophobicContact CD2-CE2 3.89Å; L938-Y942 HydrophobicContact CG-CE2 4.45Å; L938-Y942 WeakPolarHBondContact O-CD2 3.44Å; L938-Y942 PolarHBondContact O-N 2.8Å
939	L	81.7	Confident	76.3	Confident	38 Å²	38	77.8 Å²	77.8	20%	0.199	40%	0.401	C	S	.	.	H	α-helix	trans	-61.1	-45.7	176.8	-73.8	169.6	0	0	0	112.4	L643 Q644 V935 N936 R943	L643-L939 HydrophobicContact CB-CD2 4.21Å; Q644-L939 HydrophobicContact CB-CD2 4.49Å; V935-L939 HydrophobicContact CG1-CD1 4.05Å; V935-L939 HydrophobicContact CG1-CG 4.43Å; V935-L939 WeakPolarHBondContact O-CG 3.4Å; V935-L939 PolarHBondContact O-N 2.89Å; N936-L939 PolarHBondContact O-N 2.98Å; L939-R943 WeakPolarHBondContact O-CB 3.38Å; L939-R943 WeakPolarHBondContact O-CG 3.25Å; L939-R943 PolarHBondContact O-N 3.38Å; L939-R943 VanDerWaalsContact O-N 3.15Å
940	L	81.2	Confident	76.4	Confident	90 Å²	90	80.2 Å²	80.2	47%	0.471	41%	0.412	S	S	.	.	H	α-helix	trans	-63.1	-43.3	175.5	-69.9	168.7	0	0	0	112	N936 G944 E945	N936-L940 WeakPolarHBondContact O-CG 3.45Å; N936-L940 PolarHBondContact O-N 3.06Å; N936-L940 VanDerWaalsContact O-N 3.17Å; L940-G944 PolarHBondContact O-N 3.06Å; L940-E945 HydrophobicContact CD2-CB 4.28Å; L940-E945 PolarHBondContact O-N 2.87Å; L940-E945 VanDerWaalsContact O-N 3.16Å
941	F	80.8	Confident	76.2	Confident	136 Å²	136	78.8 Å²	78.8	60%	0.596	40%	0.404	S	S	*	.	H	α-helix	trans	-64.4	-47.6	-179.6	-175.8	-97.8	0	0	0	112.3	R937 L938 R943 G944	R937-F941 WeakPolarHBondContact O-CB 3.33Å; R937-F941 PolarHBondContact O-N 2.79Å; L938-F941 PolarHBondContact O-N 2.8Å; F941-R943 VanDerWaalsContact C-N 3.33Å; F941-R943 PolarHBondContact O-N 3.5Å; F941-G944 PolarHBondContact O-N 3.01Å
942	Y	75.6	Confident	76	Confident	30 Å²	30	83.1 Å²	83.1	12%	0.118	43%	0.426	C	S	.	.	H	α-helix	trans	-75.5	-17.3	-178.5	-65.9	-51.3	0	0	0	114.1	A657 P658 L938	A657-Y942 PolarHBondContact N-OH 3.32Å; A657-Y942 VanDerWaalsContact N-OH 3.15Å; P658-Y942 WeakPolarHBondContact CD-OH 3.45Å; P658-Y942 VanDerWaalsContact N-OH 3.09Å; L938-Y942 HydrophobicContact CB-CD2 4.2Å; L938-Y942 HydrophobicContact CB-CE2 4.01Å; L938-Y942 HydrophobicContact CD2-CE2 3.89Å; L938-Y942 HydrophobicContact CG-CE2 4.45Å; L938-Y942 WeakPolarHBondContact O-CD2 3.44Å; L938-Y942 PolarHBondContact O-N 2.8Å
943	R	71.4	Confident	75.7	Confident	120 Å²	120	80.6 Å²	80.6	45%	0.453	42%	0.417	S	S	.	.	H	α-helix	trans	-86.3	-10	170.2	-70.8	-178	178	-170.4	-1.4	114.1	L939 F941 E945	L939-R943 WeakPolarHBondContact O-CB 3.38Å; L939-R943 WeakPolarHBondContact O-CG 3.25Å; L939-R943 PolarHBondContact O-N 3.38Å; L939-R943 VanDerWaalsContact O-N 3.15Å; F941-R943 VanDerWaalsContact C-N 3.33Å; F941-R943 PolarHBondContact O-N 3.5Å; R943-E945 VanDerWaalsContact C-N 3.31Å; R943-E945 HydrophobicContact CB-CG 3.98Å
944	G	62.6	Low	75	Confident	59 Å²	59	79.8 Å²	79.8	61%	0.608	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.6	23	-177.2	0	0	0	0	0	114.1	L940 F941 S946	L940-G944 PolarHBondContact O-N 3.06Å; F941-G944 PolarHBondContact O-N 3.01Å; G944-S946 VanDerWaalsContact C-N 3.27Å; G944-S946 PolarHBondContact O-N 3.09Å
945	E	56	Low	74.3	Confident	135 Å²	135	84.3 Å²	84.3	63%	0.631	44%	0.438	S	S	*	.			trans	-92.1	31.5	-177.9	-62.3	-176.5	131.6	0	0	112.5	L940 R943	L940-E945 HydrophobicContact CD2-CB 4.28Å; L940-E945 PolarHBondContact O-N 2.87Å; L940-E945 VanDerWaalsContact O-N 3.16Å; R943-E945 VanDerWaalsContact C-N 3.31Å; R943-E945 HydrophobicContact CB-CG 3.98Å
946	S	44.2	Very low	73.5	Confident	155 Å²	155	91.5 Å²	91.5	100%	1.084	48%	0.475	S	S	*	.			trans	-104.3	0	-171.2	67.9	0	0	0	0	114.8	G944	G944-S946 VanDerWaalsContact C-N 3.27Å; G944-S946 PolarHBondContact O-N 3.09Å

Retrieved 946 of 946 residues in 564.6 ms (Link to these results)

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