A0A3Q0KTY4_SCHMA Loading...

F-box domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KTY4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 887 aa.

						>A0A3Q0KTY4_SCHMA|A0A3Q0KTY4
MHSCLTLVDYTWKDSEESGTSTPKYTNHDHIIRLRRTARSLDGDTLMNSSLNQDATTETNGQFCRHLNDMLNRSLTQITDRDTTHHHRHQPQQHRRHHSSMLLLNNRRLPIYATKKQLLKRPDHIWVPVGHCRYLLERDLCTGEIQWNPEGNEILCTPRSLAEICMARLIRDWPCMLPTRRSSLRNIVSFLFSSRDIQSNTTQNFSTTTSSSTTSTSIIGPRRSASLSSRESRCKTSHCQSQNRKLTQNHSIKDDTNDDDDDDDSDKKKENTCTNTLPLTCHDLPVTVLINLLSEAILQRDCAAITGLIANWPCEQLIIKQLIPNEEYPLSLNYMTKPTFVLVSPDNGNRNTLVKGPSLLDGFILGLLTRQSGCKLKSVDFTGFEEDCRVSIELSRLPILWMKPENRNSESVRRHLMASLHIGIPRKRLEAYFSRISTIYAFHEADIGHGEQFDTVTIHLDCNMTVDEVALGLSLQTLTPFRFSCNRLLLQRLPEINFPPYSLIRLFDPLSITQFEMEDPTIGSSIAVVLPSAVGWLISLRNLRACSLPSCIPPPPDVVPNTPTSPTLPTTIVVSNTGGLQSNSSQQSNTMSLSSSSGSSPSSSSSSTSNTNNTVGANSSNNINTSTTSSSSMSSTTTTNNTLQNFVTPAFTSTVAACRLLNRALVSLRYLQRLGLARCHLTGQLKTLLGGLSQPLEYLNLQDCCLSSEDIHYLVHQWRPLHGLYELNLSRNNLSVVPEETLYELVQNVCLKPRGRLVCLSIAYTCLSTERLIDLLSLMAGMDPSHSLNENDEQENIDTQYTNKWMDKACTLRVLCIQSFIPPSQLQIHRILYRITRLTKLYKLHIFPAFYAFPGDTEEQQRELRYNQLIHSRHYLKQRCRSDIELL
					

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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	29.2	Very low	31.6	Very low	212 Å²	212	83.7 Å²	83.7	100%	1.044	45%	0.446	S	S	*	.				0	-8.8	0	-70.1	-161.2	-73.5	0	0	114.1	S3	M1-S3 PolarHBondContact O-N 3.17Å
2	H	26.2	Very low	31.3	Very low	184 Å²	184	91.6 Å²	91.6	85%	0.852	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	13.7	179.9	-71.9	-11.8	0	0	0	116.5
3	S	27.7	Very low	31.2	Very low	90 Å²	90	97.5 Å²	97.5	63%	0.629	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.3	4.8	-164	-46.8	0	0	0	0	114.9	M1	M1-S3 PolarHBondContact O-N 3.17Å
4	C	28.9	Very low	30.9	Very low	53 Å²	53	96.4 Å²	96.4	36%	0.358	48%	0.482	S	S	.	.	S	Bend	trans	-132.1	28.3	-165	-53.6	0	0	0	0	113.8
5	L	32.1	Very low	30.6	Very low	87 Å²	87	95.9 Å²	95.9	46%	0.455	49%	0.492	S	S	.	.			trans	-105.6	-16	-176.1	-73.8	170.9	0	0	0	114.6	L7 V8	L5-L7 PolarHBondContact O-N 3.25Å; L5-V8 PolarHBondContact O-N 2.85Å
6	T	40.3	Very low	30.3	Very low	53 Å²	53	101.9 Å²	101.9	33%	0.325	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-7.2	-174.7	47.1	0	0	0	0	116	Y10 R673 E726	T6-Y10 VanDerWaalsContact O-CD2 3.24Å; T6-Y10 WeakPolarHBondContact O-CD2 3.43Å; T6-R673 PolarHBondContact OG1-NH2 2.91Å; T6-E726 PolarHBondContact OG1-OE2 3.49Å
7	L	33.9	Very low	30.2	Very low	2 Å²	2	107.8 Å²	107.8	1%	0.01	54%	0.542	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-10.4	179.5	-136	145.2	0	0	0	112.7	L5 Y698 E726 N728 C759	L5-L7 PolarHBondContact O-N 3.25Å; L7-Y698 HydrophobicContact CD1-CE2 4.16Å; L7-E726 HydrophobicContact CD1-CB 3.95Å; L7-N728 HydrophobicContact CD1-CB 4.12Å; L7-N728 HydrophobicContact CD2-CB 3.81Å; L7-N728 HydrophobicContact CG-CB 4.06Å; L7-C759 HydrophobicContact CD1-CB 4.26Å
8	V	32.4	Very low	29.9	Very low	36 Å²	36	108.7 Å²	108.7	22%	0.218	56%	0.56	C	S	.	*	T	Hydrogen-bonded Turn	trans	-88	-48.8	176.7	-177.6	0	0	0	0	110.5	L5 Y10 T11	L5-V8 PolarHBondContact O-N 2.85Å; V8-Y10 VanDerWaalsContact C-N 3.3Å; V8-Y10 PolarHBondContact O-N 3.29Å; V8-T11 PolarHBondContact O-N 2.99Å; V8-T11 PolarHBondContact O-OG1 3.06Å
9	D	34	Very low	29.7	Very low	101 Å²	101	106.5 Å²	106.5	54%	0.54	57%	0.566	S	S	.	*	G	3₁₀ helix	trans	-63.6	-29	-168.1	-51.8	-43.4	0	0	0	114.3	T11	D9-T11 VanDerWaalsContact C-N 3.28Å; D9-T11 PolarHBondContact O-N 2.92Å
10	Y	31.6	Very low	29.6	Very low	73 Å²	73	107.6 Å²	107.6	29%	0.286	58%	0.577	S	S	.	*	G	3₁₀ helix	trans	-79.5	-3.4	178.3	-70.7	-91.7	0	0	0	114.3	T6 V8 E516	T6-Y10 VanDerWaalsContact O-CD2 3.24Å; T6-Y10 WeakPolarHBondContact O-CD2 3.43Å; V8-Y10 VanDerWaalsContact C-N 3.3Å; V8-Y10 PolarHBondContact O-N 3.29Å; Y10-E516 PolarHBondContact OH-OE1 2.78Å; Y10-E516 VanDerWaalsContact OH-OE1 3.09Å; Y10-E516 PolarHBondContact OH-OE2 3.05Å
11	T	30.8	Very low	29.4	Very low	30 Å²	30	107.5 Å²	107.5	18%	0.184	59%	0.585	C	S	.	*	G	3₁₀ helix	trans	-87.4	-7.2	178.3	64	0	0	0	0	113.8	V8 D9	V8-T11 PolarHBondContact O-N 2.99Å; V8-T11 PolarHBondContact O-OG1 3.06Å; D9-T11 VanDerWaalsContact C-N 3.28Å; D9-T11 PolarHBondContact O-N 2.92Å
12	W	28.5	Very low	29.1	Very low	178 Å²	178	104.2 Å²	104.2	67%	0.674	58%	0.577	S	S	*	*	S	Bend	trans	-134.6	14.5	-166.6	-98.8	78.7	0	0	0	116.1
13	K	30.2	Very low	29	Very low	169 Å²	169	99.6 Å²	99.6	74%	0.735	56%	0.564	S	S	*	*			trans	-97.6	6.6	-177.1	-116.6	-178.8	-177.8	-179.8	0	116.4
14	D	26.8	Very low	28.9	Very low	82 Å²	82	105.3 Å²	105.3	44%	0.439	58%	0.577	S	S	.	*	S	Bend	trans	-99.5	38.3	-175.1	-63	-22.3	0	0	0	113.2	R678 R731	D14-R678 VanDerWaalsContact CG-NH1 3.3Å; D14-R678 IonicContact OD1-CZ 2.89Å; D14-R678 IonicContact OD1-NH1 3.58Å; D14-R678 PolarHBondContact OD1-NH1 3.34Å; D14-R678 IonicContact OD2-NH1 2.67Å; D14-R678 PolarHBondContact OD2-NH1 3.34Å; D14-R731 IonicContact OD2-CZ 2.7Å; D14-R731 IonicContact OD2-NH1 2.81Å; D14-R731 PolarHBondContact OD2-NH1 2.79Å; D14-R731 IonicContact OD2-NH2 2.71Å
15	S	26.2	Very low	28.9	Very low	89 Å²	89	112.4 Å²	112.4	62%	0.622	60%	0.598	S	S	*	*	S	Bend	trans	-160.6	154.3	167.4	47.6	0	0	0	0	112.1
16	E	26.7	Very low	28.8	Very low	192 Å²	192	114 Å²	114	90%	0.897	61%	0.612	S	S	*	*	S	Bend	trans	66.1	47.4	177.3	-63.1	-166.2	-155.6	0	0	119.3
17	E	27.1	Very low	28.4	Very low	202 Å²	202	118.6 Å²	118.6	94%	0.944	63%	0.634	S	S	*	*			trans	-157.4	36.4	142.5	-122.6	173.9	-150	0	0	115.9
18	S	25.1	Very low	28.4	Very low	124 Å²	124	125.7 Å²	125.7	87%	0.867	67%	0.667	S	S	*	*			trans	-115.2	61.2	177.7	47.6	0	0	0	0	112.8
19	G	26.3	Very low	28.5	Very low	66 Å²	66	129.4 Å²	129.4	68%	0.68	69%	0.686	S	S	*	*			trans	-137.6	89.3	-170.1	0	0	0	0	0	116
20	T	27.5	Very low	28.5	Very low	128 Å²	128	131.6 Å²	131.6	79%	0.785	69%	0.692	S	S	*	*			trans	24.9	115.9	144.7	44	0	0	0	0	121
21	S	25.4	Very low	28.8	Very low	106 Å²	106	132.2 Å²	132.2	74%	0.741	70%	0.7	S	S	*	*	S	Bend	trans	32.7	103.2	138.5	60.6	0	0	0	0	118.8	P23	S21-P23 WeakPolarHBondContact O-CD 3.35Å
22	T	22.4	Very low	29.2	Very low	143 Å²	143	135.6 Å²	135.6	88%	0.877	72%	0.716	S	S	*	*			trans	-41.6	109.1	177.3	44.7	0	0	0	0	116.4
23	P	25	Very low	29.5	Very low	88 Å²	88	137 Å²	137	57%	0.571	72%	0.721	S	S	*	*			trans	-80.6	144.1	161.7	-5.9	25.7	0	0	0	110	S21 Y25	S21-P23 WeakPolarHBondContact O-CD 3.35Å; P23-Y25 HydrophobicContact CB-CD2 4.16Å; P23-Y25 HydrophobicContact CB-CE2 3.81Å; P23-Y25 HydrophobicContact CG-CE2 4.13Å; P23-Y25 PolarHBondContact O-N 3.11Å; P23-Y25 VanDerWaalsContact O-N 3.08Å
24	K	25.5	Very low	29.7	Very low	210 Å²	210	134.4 Å²	134.4	91%	0.913	71%	0.714	S	S	*	*			trans	-75.3	95.2	178.7	-66.5	174.3	-179.4	173.5	0	111
25	Y	28.5	Very low	30.1	Very low	201 Å²	201	138.9 Å²	138.9	79%	0.788	73%	0.725	S	S	*	*			trans	-90.9	144.6	169.6	-79.3	-78.1	0	0	0	112.5	P23	P23-Y25 HydrophobicContact CB-CD2 4.16Å; P23-Y25 HydrophobicContact CB-CE2 3.81Å; P23-Y25 HydrophobicContact CG-CE2 4.13Å; P23-Y25 PolarHBondContact O-N 3.11Å; P23-Y25 VanDerWaalsContact O-N 3.08Å
26	T	31.7	Very low	30.5	Very low	121 Å²	121	144 Å²	144	74%	0.742	73%	0.73	S	S	*	*			trans	-89.5	161.9	-167.5	46.6	0	0	0	0	113.2	H28	T26-H28 VanDerWaalsContact C-N 3.29Å; T26-H28 PolarHBondContact O-N 3.1Å
27	N	29.9	Very low	30.8	Very low	149 Å²	149	139.3 Å²	139.3	80%	0.797	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	52.3	-154.7	-154.7	-0.6	0	0	0	114.2
28	H	34.9	Very low	31.1	Very low	152 Å²	152	133.3 Å²	133.3	70%	0.704	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.5	-48.5	178.3	-101.7	39.2	0	0	0	115.3	T26 H30 I31	T26-H28 VanDerWaalsContact C-N 3.29Å; T26-H28 PolarHBondContact O-N 3.1Å; H28-H30 VanDerWaalsContact C-N 3.3Å; H28-H30 PolarHBondContact O-N 3.11Å; H28-I31 PolarHBondContact O-N 3.45Å; H28-I31 VanDerWaalsContact O-N 3.08Å
29	D	34.7	Very low	31.5	Very low	114 Å²	114	137.3 Å²	137.3	61%	0.61	70%	0.696	S	S	*	*	H	α-helix	trans	-63.6	-30.3	-170.7	-81.1	-46	0	0	0	114.9	I31 I32 R33	D29-I31 PolarHBondContact O-N 3.48Å; D29-I32 PolarHBondContact O-N 3.47Å; D29-I32 VanDerWaalsContact O-N 3.07Å; D29-R33 PolarHBondContact O-N 2.96Å; D29-R33 VanDerWaalsContact O-N 3.16Å
30	H	34.6	Very low	31.9	Very low	146 Å²	146	138.9 Å²	138.9	68%	0.676	70%	0.697	S	S	*	*	H	α-helix	trans	-57.8	-30.6	176.1	-98.2	-86	0	0	0	113.1	H28 I32 L34	H28-H30 VanDerWaalsContact C-N 3.3Å; H28-H30 PolarHBondContact O-N 3.11Å; H30-I32 VanDerWaalsContact C-N 3.32Å; H30-L34 WeakPolarHBondContact O-CB 3.44Å; H30-L34 PolarHBondContact O-N 3.13Å
31	I	37.9	Very low	32.2	Very low	87 Å²	87	140.6 Å²	140.6	45%	0.446	70%	0.7	S	S	.	*	H	α-helix	trans	-73.6	-26.6	-179.3	-60.2	177.5	0	0	0	111.3	H28 D29 R35	H28-I31 PolarHBondContact O-N 3.45Å; H28-I31 VanDerWaalsContact O-N 3.08Å; D29-I31 PolarHBondContact O-N 3.48Å; I31-R35 WeakPolarHBondContact O-CD 3.5Å; I31-R35 VanDerWaalsContact O-CG 3.26Å; I31-R35 WeakPolarHBondContact O-CG 3.43Å
32	I	39	Very low	32.4	Very low	101 Å²	101	142.7 Å²	142.7	52%	0.518	70%	0.703	S	S	.	*	H	α-helix	trans	-85.2	-42.9	179.3	-61.8	177.4	0	0	0	110.9	D29 H30 R35 R36	D29-I32 PolarHBondContact O-N 3.47Å; D29-I32 VanDerWaalsContact O-N 3.07Å; H30-I32 VanDerWaalsContact C-N 3.32Å; I32-R35 PolarHBondContact O-N 3.47Å; I32-R36 PolarHBondContact O-N 3.4Å
33	R	33.6	Very low	32.7	Very low	208 Å²	208	138.8 Å²	138.8	79%	0.785	69%	0.691	S	S	*	*	H	α-helix	trans	-63.6	-46.7	176.5	-91.8	-179	166	160.1	-4.3	112.6	D29 R35 R36 T37	D29-R33 PolarHBondContact O-N 2.96Å; D29-R33 VanDerWaalsContact O-N 3.16Å; R33-R35 PolarHBondContact O-N 3Å; R33-R36 PolarHBondContact O-N 3.22Å; R33-T37 PolarHBondContact O-N 2.88Å; R33-T37 PolarHBondContact O-OG1 3.27Å
34	L	34.9	Very low	33	Very low	113 Å²	113	142.2 Å²	142.2	59%	0.592	71%	0.705	S	S	*	*	H	α-helix	trans	-61.9	-26.2	177.1	-84.1	160.4	0	0	0	113.6	H30 A38	H30-L34 WeakPolarHBondContact O-CB 3.44Å; H30-L34 PolarHBondContact O-N 3.13Å; L34-A38 VanDerWaalsContact O-CB 3.22Å; L34-A38 WeakPolarHBondContact O-CB 3.47Å; L34-A38 PolarHBondContact O-N 3.42Å
35	R	36	Very low	33.1	Very low	176 Å²	176	138.6 Å²	138.6	66%	0.664	70%	0.7	S	S	*	*	H	α-helix	trans	-78.2	-14.2	175.5	-80.6	178.3	175.9	177.1	-0.3	114.7	I31 I32 R33	I31-R35 WeakPolarHBondContact O-CD 3.5Å; I31-R35 VanDerWaalsContact O-CG 3.26Å; I31-R35 WeakPolarHBondContact O-CG 3.43Å; I32-R35 PolarHBondContact O-N 3.47Å; R33-R35 PolarHBondContact O-N 3Å
36	R	34.1	Very low	33.1	Very low	196 Å²	196	136 Å²	136	74%	0.74	70%	0.699	S	S	*	*	H	α-helix	trans	-89.2	-47.4	174.1	-72.3	-172.2	176.9	178.8	-0.2	111.6	I32 R33 A38 R39 S40	I32-R36 PolarHBondContact O-N 3.4Å; R33-R36 PolarHBondContact O-N 3.22Å; R36-A38 VanDerWaalsContact C-N 3.35Å; R36-A38 PolarHBondContact O-N 3.37Å; R36-R39 PolarHBondContact O-N 3.21Å; R36-S40 PolarHBondContact O-N 3.5Å
37	T	32.7	Very low	33	Very low	94 Å²	94	138.6 Å²	138.6	58%	0.577	71%	0.705	S	S	*	*	H	α-helix	trans	-63.3	-38.7	175.8	36.8	0	0	0	0	112.5	R33 R39 S40	R33-T37 PolarHBondContact O-N 2.88Å; R33-T37 PolarHBondContact O-OG1 3.27Å; T37-R39 PolarHBondContact O-N 3.26Å; T37-R39 VanDerWaalsContact O-N 3.08Å; T37-S40 PolarHBondContact O-N 3.33Å
38	A	33	Very low	33	Very low	76 Å²	76	138.3 Å²	138.3	63%	0.628	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	8.7	173.7	0	0	0	0	0	115.1	L34 R36	L34-A38 VanDerWaalsContact O-CB 3.22Å; L34-A38 WeakPolarHBondContact O-CB 3.47Å; L34-A38 PolarHBondContact O-N 3.42Å; R36-A38 VanDerWaalsContact C-N 3.35Å; R36-A38 PolarHBondContact O-N 3.37Å
39	R	33.9	Very low	32.7	Very low	208 Å²	208	137 Å²	137	79%	0.785	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.6	5	171.6	-76.1	-173.5	169.3	-164.5	-3.9	113.4	R36 T37	R36-R39 PolarHBondContact O-N 3.21Å; T37-R39 PolarHBondContact O-N 3.26Å; T37-R39 VanDerWaalsContact O-N 3.08Å
40	S	35.6	Very low	32.3	Very low	100 Å²	100	136 Å²	136	70%	0.699	71%	0.714	S	S	*	*	S	Bend	trans	-100.9	8.4	-179	-166.6	0	0	0	0	113.4	R36 T37	R36-S40 PolarHBondContact O-N 3.5Å; T37-S40 PolarHBondContact O-N 3.33Å
41	L	32.1	Very low	31.9	Very low	163 Å²	163	136.5 Å²	136.5	85%	0.853	72%	0.72	S	S	*	*	S	Bend	trans	-117.9	-8.9	179.7	-85.2	157.2	0	0	0	113.4
42	D	30.9	Very low	31.6	Very low	151 Å²	151	138.5 Å²	138.5	81%	0.807	73%	0.732	S	S	*	*			trans	-102.4	87.4	166.2	-68.7	-48.4	0	0	0	107.7
43	G	28	Very low	31.2	Very low	60 Å²	60	141.3 Å²	141.3	62%	0.619	74%	0.743	S	S	*	*			trans	-146.3	35.6	-165	0	0	0	0	0	115	T45	G43-T45 PolarHBondContact O-N 3.14Å
44	D	31.1	Very low	31	Very low	160 Å²	160	138.2 Å²	138.2	86%	0.856	74%	0.742	S	S	*	*			trans	-61.7	115.5	174.1	-86.3	-35.3	0	0	0	111.1	L46	D44-L46 VanDerWaalsContact C-N 3.3Å; D44-L46 PolarHBondContact O-N 3.13Å
45	T	27.6	Very low	30.7	Very low	134 Å²	134	137.1 Å²	137.1	82%	0.822	75%	0.749	S	S	*	*			trans	-76.1	74.7	-176	-48.7	0	0	0	0	112.2	G43	G43-T45 PolarHBondContact O-N 3.14Å
46	L	28.9	Very low	30.4	Very low	146 Å²	146	134.8 Å²	134.8	76%	0.764	76%	0.755	S	S	*	*			trans	-110.4	74.6	167.3	-81.3	170.5	0	0	0	110.9	D44 N48	D44-L46 VanDerWaalsContact C-N 3.3Å; D44-L46 PolarHBondContact O-N 3.13Å; L46-N48 PolarHBondContact O-N 3.08Å; L46-N48 VanDerWaalsContact O-N 3.1Å
47	M	29.9	Very low	30.1	Very low	177 Å²	177	131.3 Å²	131.3	87%	0.872	76%	0.755	S	S	*	*			trans	-72.1	96.3	164.7	-82.4	-66.6	-175.6	0	0	109.6	S49	M47-S49 PolarHBondContact O-N 2.86Å; M47-S49 VanDerWaalsContact O-N 3.11Å
48	N	29	Very low	30	Very low	143 Å²	143	135 Å²	135	77%	0.765	77%	0.766	S	S	*	*			trans	-69.7	99.8	170.7	-74.4	-36.8	0	0	0	110.5	L46 S50	L46-N48 PolarHBondContact O-N 3.08Å; L46-N48 VanDerWaalsContact O-N 3.1Å; N48-S50 PolarHBondContact O-N 3.39Å
49	S	28.6	Very low	29.9	Very low	125 Å²	125	136.5 Å²	136.5	87%	0.874	77%	0.768	S	S	*	*			trans	-72.2	107.4	158.7	42.5	0	0	0	0	109	M47	M47-S49 PolarHBondContact O-N 2.86Å; M47-S49 VanDerWaalsContact O-N 3.11Å
50	S	26.2	Very low	29.8	Very low	93 Å²	93	134.5 Å²	134.5	65%	0.65	77%	0.773	S	S	*	*			trans	-97.6	152.3	173.9	55	0	0	0	0	110.6	N48	N48-S50 PolarHBondContact O-N 3.39Å
51	L	27.7	Very low	29.5	Very low	155 Å²	155	133.3 Å²	133.3	81%	0.812	78%	0.776	S	S	*	*			trans	70	117.9	-178.1	-54.6	132.8	0	0	0	111.9
52	N	29.9	Very low	29.4	Very low	129 Å²	129	134.9 Å²	134.9	69%	0.69	78%	0.779	S	S	*	*			cis	-152.9	165.6	38.1	-92.4	-34	0	0	0	114.4
53	Q	30.9	Very low	29.3	Very low	160 Å²	160	137 Å²	137	75%	0.748	78%	0.781	S	S	*	*			trans	64.2	106.7	147.8	-72.8	166.3	-27.5	0	0	120.7
54	D	30	Very low	29.4	Very low	144 Å²	144	140 Å²	140	77%	0.77	79%	0.791	S	S	*	*				65.9	95	117.6	-51.7	-22.4	0	0	0	121.8
55	A	28.1	Very low	29.3	Very low	90 Å²	90	144 Å²	144	74%	0.744	79%	0.794	S	S	*	*				82.6	160.6	121.4	0	0	0	0	0	121.9
56	T	31	Very low	29.4	Very low	127 Å²	127	145.6 Å²	145.6	78%	0.779	79%	0.792	S	S	*	*			trans	60.5	95.7	169	43.4	0	0	0	0	119.2
57	T	27	Very low	29.6	Very low	122 Å²	122	145.2 Å²	145.2	75%	0.748	79%	0.79	S	S	*	*				36.6	125.5	123.5	54.9	0	0	0	0	118.8
58	E	30.8	Very low	29.8	Very low	171 Å²	171	143.7 Å²	143.7	80%	0.799	79%	0.786	S	S	*	*				-168.4	152.3	76.5	-90.4	-170.5	157.3	0	0	115.6
59	T	31.2	Very low	30.1	Very low	109 Å²	109	142.1 Å²	142.1	67%	0.669	78%	0.777	S	S	*	*			trans	42.8	141	149.5	67.8	0	0	0	0	125.3
60	N	30.3	Very low	30.4	Very low	166 Å²	166	143 Å²	143	89%	0.888	77%	0.769	S	S	*	*			trans	71.9	144.7	146.1	-66	-26.1	0	0	0	121.1
61	G	30.4	Very low	30.7	Very low	74 Å²	74	146 Å²	146	76%	0.763	78%	0.777	S	S	*	*			trans	132.8	55.1	167.8	0	0	0	0	0	117.5	F63	G61-F63 PolarHBondContact O-N 3.32Å
62	Q	30	Very low	31.1	Very low	197 Å²	197	144.4 Å²	144.4	92%	0.921	77%	0.769	S	S	*	*			trans	-77.2	104.7	171.8	-76.2	-173.6	-10.2	0	0	112
63	F	28.1	Very low	31.2	Very low	196 Å²	196	148 Å²	148	86%	0.86	77%	0.773	S	S	*	*			trans	-136.8	179	167.7	-104.8	-95.3	0	0	0	111.4	G61	G61-F63 PolarHBondContact O-N 3.32Å
64	C	30.2	Very low	31.2	Very low	122 Å²	122	145.5 Å²	145.5	82%	0.824	77%	0.774	S	S	*	*			trans	69	50.7	173.5	-59.2	0	0	0	0	117.6
65	R	30.1	Very low	31.2	Very low	243 Å²	243	146.4 Å²	146.4	92%	0.917	78%	0.777	S	S	*	*			trans	-133.2	7.5	156.1	-74.8	-162.8	-179.6	-178.6	2.3	116.1
66	H	29.3	Very low	31.3	Very low	169 Å²	169	148.4 Å²	148.4	78%	0.782	78%	0.781	S	S	*	*			trans	-100	111.2	178.3	-116.1	-61.5	0	0	0	111.6
67	L	32.8	Very low	31.2	Very low	137 Å²	137	151 Å²	151	72%	0.717	78%	0.784	S	S	*	*	S	Bend	trans	-174.3	-46.5	149	-106.4	163.4	0	0	0	112	D69 M70	L67-D69 VanDerWaalsContact C-N 3.35Å; L67-D69 PolarHBondContact O-N 2.96Å; L67-M70 PolarHBondContact O-N 3.34Å
68	N	33.3	Very low	31.5	Very low	146 Å²	146	153 Å²	153	78%	0.781	79%	0.788	S	S	*	*	G	3₁₀ helix	trans	-68.7	-22.6	-173.8	-82.2	-14.3	0	0	0	115.6	M70 N72	N68-M70 VanDerWaalsContact C-N 3.28Å; N68-M70 PolarHBondContact O-N 3.18Å; N68-N72 PolarHBondContact O-ND2 3.25Å
69	D	36.4	Very low	31.5	Very low	109 Å²	109	150.5 Å²	150.5	58%	0.583	79%	0.785	S	S	*	*	G	3₁₀ helix	trans	-77.5	-10	-179.3	-79.1	-20.8	0	0	0	114.1	L67	L67-D69 VanDerWaalsContact C-N 3.35Å; L67-D69 PolarHBondContact O-N 2.96Å
70	M	33.7	Very low	31.6	Very low	144 Å²	144	150.6 Å²	150.6	71%	0.709	78%	0.781	S	S	*	*	G	3₁₀ helix	trans	-87	-19.2	-169.6	-155.4	163.2	70.8	0	0	114.3	L67 N68	L67-M70 PolarHBondContact O-N 3.34Å; N68-M70 VanDerWaalsContact C-N 3.28Å; N68-M70 PolarHBondContact O-N 3.18Å
71	L	33.9	Very low	31.7	Very low	156 Å²	156	152.3 Å²	152.3	82%	0.817	78%	0.775	S	S	*	*	S	Bend	trans	-94.6	-8.9	179.2	-78.8	168.7	0	0	0	114.6
72	N	35.9	Very low	31.8	Very low	121 Å²	121	154.8 Å²	154.8	65%	0.647	77%	0.771	S	S	*	*	S	Bend	trans	-99.4	10.8	-176	-74.6	-71.7	0	0	0	114.3	N68	N68-N72 PolarHBondContact O-ND2 3.25Å
73	R	32.2	Very low	32	Very low	205 Å²	205	151.1 Å²	151.1	77%	0.774	76%	0.763	S	S	*	*			trans	-112.1	8.2	-170	-74.4	-174.6	175.2	-106.9	2.6	116
74	S	29.6	Very low	32.2	Very low	108 Å²	108	146.9 Å²	146.9	76%	0.755	75%	0.753	S	S	*	*	S	Bend	trans	-97.7	7.8	-174.9	48.6	0	0	0	0	115.6
75	L	30.2	Very low	32.4	Very low	162 Å²	162	148.4 Å²	148.4	85%	0.848	75%	0.748	S	S	*	*	S	Bend	trans	-137.1	40.5	-174.5	-150.2	79.8	0	0	0	115.5
76	T	29.9	Very low	32.7	Very low	132 Å²	132	143.1 Å²	143.1	81%	0.81	73%	0.733	S	S	*	*			trans	-165.2	112	157.6	19.7	0	0	0	0	110.6
77	Q	30	Very low	32.9	Very low	182 Å²	182	141.9 Å²	141.9	85%	0.85	73%	0.727	S	S	*	*			trans	-146	163.3	161.9	-72.5	-167.7	-10.5	0	0	107.7
78	I	32.1	Very low	32.9	Very low	164 Å²	164	144.4 Å²	144.4	84%	0.841	73%	0.727	S	S	*	*			trans	71.5	110	-154.6	-48	170.6	0	0	0	108.4
79	T	32.6	Very low	33	Very low	119 Å²	119	145.1 Å²	145.1	73%	0.73	73%	0.726	S	S	*	*			cis	-145.4	170.9	10.1	3.5	0	0	0	0	112.3
80	D	32.6	Very low	32.6	Very low	111 Å²	111	148.3 Å²	148.3	59%	0.594	74%	0.737	S	S	*	*			trans	2.8	147.9	159.1	-67.9	-84.3	0	0	0	121.4
81	R	32.8	Very low	32.8	Very low	201 Å²	201	145.7 Å²	145.7	76%	0.758	73%	0.731	S	S	*	*			cis	-170.1	164.5	-8.1	-124.5	178.4	166.7	109.3	-13.1	109
82	D	31.4	Very low	32.7	Very low	126 Å²	126	145.8 Å²	145.8	67%	0.674	73%	0.727	S	S	*	*			trans	35.7	136.2	147.7	-51.3	-29.2	0	0	0	120.6
83	T	34.4	Very low	32.4	Very low	121 Å²	121	146.4 Å²	146.4	74%	0.742	73%	0.726	S	S	*	*			cis	-164.9	141.5	24.5	-8.8	0	0	0	0	113.8
84	T	32.7	Very low	32.3	Very low	107 Å²	107	143.4 Å²	143.4	66%	0.656	72%	0.72	S	S	*	*			trans	33.9	134	143	52.2	0	0	0	0	127.1
85	H	34.8	Very low	32.3	Very low	154 Å²	154	147 Å²	147	71%	0.713	72%	0.717	S	S	*	*			trans	64.5	154.8	140.2	-63.2	-53.9	0	0	0	120.6
86	H	36.5	Very low	32.1	Very low	131 Å²	131	148.5 Å²	148.5	61%	0.606	71%	0.712	S	S	*	*			cis	-162.7	145.9	-14.7	-119	-45.3	0	0	0	111
87	H	34.2	Very low	32.1	Very low	144 Å²	144	149.4 Å²	149.4	67%	0.667	71%	0.706	S	S	*	*			trans	57.7	163.2	146.8	-71.9	-37.5	0	0	0	120.3
88	R	32.8	Very low	32.1	Very low	189 Å²	189	149 Å²	149	71%	0.713	71%	0.705	S	S	*	*			cis	-156.8	165.7	-13.2	-132.3	167.1	150.7	159.6	-5.2	111.1
89	H	34.3	Very low	31.8	Very low	162 Å²	162	146.4 Å²	146.4	75%	0.75	70%	0.7	S	S	*	*			trans	76.5	156.6	154.7	-72.6	-60.9	0	0	0	122.9
90	Q	28.5	Very low	31.6	Very low	175 Å²	175	146.6 Å²	146.6	82%	0.818	71%	0.707	S	S	*	*			trans	-142.7	-166.4	-160.5	-133.5	-174.2	10.2	0	0	105
91	P	36.5	Very low	31.5	Very low	89 Å²	89	146.3 Å²	146.3	58%	0.578	70%	0.703	S	S	*	*			cis	-140.6	-161.2	-8.9	25.7	2.5	0	0	0	114.2
92	Q	32.1	Very low	31.4	Very low	159 Å²	159	144.4 Å²	144.4	74%	0.743	71%	0.707	S	S	*	*			trans	77.9	149.9	156.7	-53.2	-164.9	15.2	0	0	118.6
93	Q	30.5	Very low	31.7	Very low	134 Å²	134	146.5 Å²	146.5	63%	0.626	72%	0.717	S	S	*	*			cis	-160.9	170	-16.8	-112.8	-168.9	71.9	0	0	111.1
94	H	30.5	Very low	32	Very low	141 Å²	141	143.6 Å²	143.6	65%	0.653	70%	0.697	S	S	*	*			trans	71	155	164.3	-64.1	-5.7	0	0	0	117.9
95	R	28.5	Very low	32	Very low	184 Å²	184	144.4 Å²	144.4	69%	0.694	70%	0.697	S	S	*	*			cis	-158.8	145.1	-16	-113.5	175.3	-177.3	-176.2	1.9	110
96	R	26	Very low	32.1	Very low	193 Å²	193	145.1 Å²	145.1	73%	0.728	71%	0.706	S	S	*	*			trans	41.3	129.1	152.4	-58.5	176.1	176.6	172.2	-2.8	120.5
97	H	30.3	Very low	32.5	Very low	151 Å²	151	142.9 Å²	142.9	70%	0.699	69%	0.693	S	S	*	*				178.4	143	98.9	-99.4	-80	0	0	0	114.3
98	H	30.2	Very low	32.9	Very low	175 Å²	175	145.5 Å²	145.5	81%	0.81	70%	0.697	S	S	*	*			trans	53.1	142.9	163.2	-63.9	-64.7	0	0	0	123.5
99	S	26.4	Very low	33.2	Very low	108 Å²	108	142.6 Å²	142.6	76%	0.755	69%	0.694	S	S	*	*			trans	-113.5	142	-166.6	-30.6	0	0	0	0	112.8
100	S	27.1	Very low	33.3	Very low	123 Å²	123	135.9 Å²	135.9	86%	0.86	67%	0.665	S	S	*	*			trans	-172.8	33.5	147.5	55.3	0	0	0	0	115.6
101	M	30.3	Very low	33.8	Very low	106 Å²	106	135 Å²	135	52%	0.522	67%	0.665	S	S	.	*			trans	-146.4	84.3	-178.9	-93.5	-84.3	-79.8	0	0	111.5	L104 N105	M101-L104 HydrophobicContact CE-CB 3.97Å; M101-L104 HydrophobicContact CE-CD1 3.84Å; M101-L104 HydrophobicContact SD-CD1 3.84Å; M101-N105 PolarHBondContact O-ND2 3.5Å
102	L	30.5	Very low	33.9	Very low	161 Å²	161	136 Å²	136	84%	0.843	66%	0.657	S	S	*	*			trans	-117.4	21.2	-172.2	-79.8	176.3	0	0	0	115.9
103	L	38.2	Very low	33.8	Very low	169 Å²	169	131.4 Å²	131.4	89%	0.885	65%	0.647	S	S	*	*	S	Bend	trans	-128.2	2.9	172.9	-72.6	175	0	0	0	114.9
104	L	40.6	Very low	33.8	Very low	61 Å²	61	131.7 Å²	131.7	32%	0.319	66%	0.658	S	S	.	*	S	Bend	trans	-124.2	-10	-169.7	-73.9	170.6	0	0	0	116	M101 N106	M101-L104 HydrophobicContact CE-CB 3.97Å; M101-L104 HydrophobicContact CE-CD1 3.84Å; M101-L104 HydrophobicContact SD-CD1 3.84Å; L104-N106 VanDerWaalsContact C-N 3.3Å; L104-N106 PolarHBondContact O-N 2.87Å
105	N	33.9	Very low	34	Very low	123 Å²	123	134.4 Å²	134.4	66%	0.658	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-3.9	-166.2	-73.4	-5.6	0	0	0	116.6	M101	M101-N105 PolarHBondContact O-ND2 3.5Å
106	N	37.1	Very low	34.4	Very low	169 Å²	169	132.8 Å²	132.8	90%	0.904	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.7	8	-175.5	-73.3	-3.8	0	0	0	114.6	L104	L104-N106 VanDerWaalsContact C-N 3.3Å; L104-N106 PolarHBondContact O-N 2.87Å
107	R	43.4	Very low	35	Very low	85 Å²	85	132.6 Å²	132.6	32%	0.321	67%	0.673	S	S	.	*	P	Polyproline II helix	trans	-88.1	143.7	-175.3	-70.6	-175.3	167.2	-176.8	-10.4	113.1	E327	R107-E327 IonicContact CZ-OE1 3.52Å; R107-E327 IonicContact NH1-OE1 3.42Å; R107-E327 PolarHBondContact NH1-OE1 3.15Å; R107-E327 VanDerWaalsContact NH2-CD 3.29Å; R107-E327 IonicContact NH2-OE1 3.73Å; R107-E327 PolarHBondContact NH2-OE1 2.94Å; R107-E327 IonicContact NH2-OE2 3.99Å
108	R	43.6	Very low	35.6	Very low	199 Å²	199	131 Å²	131	75%	0.751	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-68.9	151.1	-179.3	-143.5	175.4	-170	-178.9	2.3	109.9
109	L	38.9	Very low	36.1	Very low	127 Å²	127	129.9 Å²	129.9	67%	0.665	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-71	137.8	177.3	-76.1	168.2	0	0	0	110.9
110	P	35.3	Very low	37	Very low	22 Å²	22	134.9 Å²	134.9	14%	0.143	68%	0.677	C	S	.	*	P	Polyproline II helix	trans	-62.7	151.5	175.8	-19.5	29.9	0	0	0	112.9	Y112 P158	P110-Y112 VanDerWaalsContact C-N 3.34Å; P110-Y112 HydrophobicContact CB-CD2 3.79Å; P110-Y112 HydrophobicContact CB-CE1 4.25Å; P110-Y112 HydrophobicContact CB-CE2 3.31Å; P110-Y112 HydrophobicContact CB-CG 4.44Å; P110-Y112 HydrophobicContact CG-CE2 4.2Å; P110-Y112 PolarHBondContact O-N 3.05Å; P110-P158 HydrophobicContact CB-CB 3.94Å; P110-P158 HydrophobicContact CG-CB 4.22Å
111	I	39.4	Very low	38.1	Very low	156 Å²	156	136.4 Å²	136.4	80%	0.8	66%	0.664	S	S	*	*	S	Bend	trans	-81.3	-9.9	-164	-63.7	171.8	0	0	0	113.4	A113	I111-A113 PolarHBondContact O-N 3.33Å
112	Y	39	Very low	39.2	Very low	109 Å²	109	137.2 Å²	137.2	43%	0.427	68%	0.677	S	S	.	*	S	Bend	trans	-69.1	1.3	-162.9	-27.7	-51.4	0	0	0	116.6	P110 P158 N291	P110-Y112 VanDerWaalsContact C-N 3.34Å; P110-Y112 HydrophobicContact CB-CD2 3.79Å; P110-Y112 HydrophobicContact CB-CE1 4.25Å; P110-Y112 HydrophobicContact CB-CE2 3.31Å; P110-Y112 HydrophobicContact CB-CG 4.44Å; P110-Y112 HydrophobicContact CG-CE2 4.2Å; P110-Y112 PolarHBondContact O-N 3.05Å; Y112-P158 HydrophobicContact CD2-CB 4.11Å; Y112-N291 HydrophobicContact CD1-CB 4.37Å; Y112-N291 HydrophobicContact CE1-CB 3.81Å; Y112-N291 WeakPolarHBondContact CE1-OD1 3.5Å; Y112-N291 HydrophobicContact CE2-CB 4.25Å
113	A	30.3	Very low	40.5	Very low	63 Å²	63	131.1 Å²	131.1	52%	0.521	65%	0.645	S	S	.	*	S	Bend	trans	-134	114.3	176.8	0	0	0	0	0	110.8	I111 K115 P158	I111-A113 PolarHBondContact O-N 3.33Å; A113-K115 PolarHBondContact O-N 2.95Å; A113-P158 HydrophobicContact CB-CG 3.95Å
114	T	30.6	Very low	41.3	Very low	141 Å²	141	125.3 Å²	125.3	87%	0.865	61%	0.613	S	S	*	*			trans	-68.8	119.1	172.9	35	0	0	0	0	110.1	K116	T114-K116 VanDerWaalsContact C-N 3.32Å; T114-K116 PolarHBondContact O-N 2.92Å
115	K	34.5	Very low	41.7	Very low	198 Å²	198	125.1 Å²	125.1	86%	0.861	61%	0.612	S	S	*	*			trans	-77.4	80.6	-176.8	-164.9	179.6	-173.7	-179.1	0	111.1	A113 Q117	A113-K115 PolarHBondContact O-N 2.95Å; K115-Q117 PolarHBondContact O-N 3.49Å; K115-Q117 VanDerWaalsContact O-N 3.15Å
116	K	36.6	Very low	42.5	Very low	150 Å²	150	124.9 Å²	124.9	65%	0.652	60%	0.602	S	S	*	*			trans	-52.1	114.1	175.9	-147.4	-178.8	-171.3	-177.1	0	109.6	T114 L118 E153	T114-K116 VanDerWaalsContact C-N 3.32Å; T114-K116 PolarHBondContact O-N 2.92Å; K116-L118 PolarHBondContact O-N 3.32Å; K116-L118 VanDerWaalsContact O-N 3.13Å; K116-E153 IonicContact NZ-OE1 2.82Å
117	Q	39.2	Very low	42.6	Very low	188 Å²	188	119.2 Å²	119.2	88%	0.879	57%	0.573	S	S	*	*			trans	-81.4	88.3	174.4	-70.9	-169	10.9	0	0	109.3	K115	K115-Q117 PolarHBondContact O-N 3.49Å; K115-Q117 VanDerWaalsContact O-N 3.15Å
118	L	41.9	Very low	42.5	Very low	118 Å²	118	120 Å²	120	62%	0.618	59%	0.589	S	S	*	*			trans	-66.6	141.1	163.3	-80	160	0	0	0	109.6	K116	K116-L118 PolarHBondContact O-N 3.32Å; K116-L118 VanDerWaalsContact O-N 3.13Å
119	L	42.3	Very low	42	Very low	151 Å²	151	114.5 Å²	114.5	79%	0.791	58%	0.578	S	S	*	*			trans	-59.3	139.3	177.9	-93.9	68	0	0	0	110.4	R121	L119-R121 PolarHBondContact O-N 3.06Å
120	K	43.5	Very low	42.4	Very low	214 Å²	214	111.4 Å²	111.4	93%	0.93	58%	0.576	S	S	*	*			trans	-67.2	100.2	164	-75.1	-177.4	172.8	-176	0	109.3
121	R	50.2	Low	42.7	Very low	155 Å²	155	117.9 Å²	117.9	59%	0.585	60%	0.604	S	S	*	*			trans	-84.3	149.7	153.7	-65.5	-174.6	177.7	162	-1.9	109.4	L119 D123	L119-R121 PolarHBondContact O-N 3.06Å; R121-D123 WeakPolarHBondContact CB-OD2 3.43Å; R121-D123 WeakPolarHBondContact CD-OD2 3.47Å; R121-D123 PolarHBondContact O-N 3.47Å
122	P	53.7	Low	42.6	Very low	123 Å²	123	112 Å²	112	80%	0.799	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	-17.8	177.4	28.5	-31	0	0	0	112.7	H124	P122-H124 VanDerWaalsContact C-N 3.27Å; P122-H124 PolarHBondContact O-N 3.48Å
123	D	58.8	Low	42.7	Very low	33 Å²	33	114.5 Å²	114.5	18%	0.176	59%	0.586	C	S	.	*	T	Hydrogen-bonded Turn	trans	-72.5	-15.1	-178.1	-15.4	-43.6	0	0	0	113.1	R121 R138 L140	R121-D123 WeakPolarHBondContact CB-OD2 3.43Å; R121-D123 WeakPolarHBondContact CD-OD2 3.47Å; R121-D123 PolarHBondContact O-N 3.47Å; D123-R138 WeakPolarHBondContact O-CB 3.38Å; D123-R138 PolarHBondContact O-N 3.29Å; D123-L140 HydrophobicContact CB-CD2 4.49Å
124	H	54.7	Low	43.5	Very low	47 Å²	47	115.5 Å²	115.5	22%	0.218	58%	0.576	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.7	120.2	-171.9	-76.1	125.1	0	0	0	113.6	P122 L135 E137	P122-H124 VanDerWaalsContact C-N 3.27Å; P122-H124 PolarHBondContact O-N 3.48Å; H124-L135 HydrophobicContact CB-CD1 3.8Å; H124-E137 VanDerWaalsContact CD2-CG 3.42Å; H124-E137 WeakPolarHBondContact CD2-CG 3.4Å; H124-E137 IonicContact CD2-OE1 2.67Å; H124-E137 IonicContact CE1-OE1 3.14Å; H124-E137 VanDerWaalsContact NE2-CG 3.32Å; H124-E137 WeakPolarHBondContact NE2-CG 3.34Å; H124-E137 IonicContact NE2-OE1 3.96Å; H124-E137 PolarHBondContact NE2-OE1 3.36Å
125	I	49.4	Very low	44.3	Very low	57 Å²	57	109.4 Å²	109.4	29%	0.292	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	128.5	178.2	-58.7	177.5	0	0	0	109.8	V127 L136 R138 I145	I125-V127 HydrophobicContact CG2-CG2 4.08Å; I125-L136 PolarHBondContact N-O 3.27Å; I125-L136 PolarHBondContact O-N 2.93Å; I125-R138 HydrophobicContact CD1-CB 4.25Å; I125-I145 HydrophobicContact CD1-CD1 3.71Å; I125-I145 HydrophobicContact CD1-CG1 4.08Å
126	W	50.3	Low	45.1	Very low	118 Å²	118	101.3 Å²	101.3	45%	0.447	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	115.3	172.3	-75.2	99.1	0	0	0	111	R133 Y134 L135 L155	W126-R133 HydrophobicContact CE3-CB 3.78Å; W126-R133 HydrophobicContact CZ3-CB 3.91Å; W126-Y134 CarbonylContact C-O 3.45Å; W126-Y134 WeakPolarHBondContact CA-O 3.47Å; W126-L135 HydrophobicContact CD2-CD1 4.03Å; W126-L135 HydrophobicContact CE3-CB 4.27Å; W126-L135 HydrophobicContact CE3-CD1 4.43Å; W126-L135 HydrophobicContact CH2-CB 3.99Å; W126-L135 HydrophobicContact CH2-CD1 4.22Å; W126-L135 HydrophobicContact CZ2-CB 4.43Å; W126-L135 HydrophobicContact CZ2-CD1 3.81Å; W126-L135 HydrophobicContact CZ3-CB 3.91Å; W126-L155 HydrophobicContact CH2-CD1 3.42Å; W126-L155 VanDerWaalsContact CH2-CD1 3.42Å; W126-L155 HydrophobicContact CH2-CG 3.97Å; W126-L155 HydrophobicContact CZ2-CD1 4.03Å; W126-L155 HydrophobicContact CZ3-CD1 4.09Å; W126-L155 HydrophobicContact CZ3-CG 4.38Å
127	V	38.2	Very low	46	Very low	49 Å²	49	96.7 Å²	96.7	30%	0.297	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	121.9	174	178.7	0	0	0	0	110.2	I125 V129 Y134 L136	I125-V127 HydrophobicContact CG2-CG2 4.08Å; V127-V129 HydrophobicContact CG1-CG2 3.92Å; V127-Y134 PolarHBondContact N-O 3.45Å; V127-Y134 PolarHBondContact O-N 3.04Å; V127-L136 HydrophobicContact CB-CD1 3.93Å; V127-L136 HydrophobicContact CG2-CD1 3.53Å; V127-L136 HydrophobicContact CG2-CG 4.48Å
128	P	41.6	Very low	46.7	Very low	101 Å²	101	93.8 Å²	93.8	66%	0.656	47%	0.466	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.2	124.5	170.2	31.6	-30.7	0	0	0	110.1
129	V	34.8	Very low	47.6	Very low	85 Å²	85	90.6 Å²	90.6	52%	0.515	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	118.5	168.2	-167.3	0	0	0	0	108.3	V127 H131 C132 Y134	V127-V129 HydrophobicContact CG1-CG2 3.92Å; V129-H131 PolarHBondContact O-N 3.1Å; V129-C132 PolarHBondContact N-O 2.72Å; V129-C132 VanDerWaalsContact N-O 3.12Å; V129-C132 PolarHBondContact O-N 3Å; V129-Y134 HydrophobicContact CB-CD2 3.95Å; V129-Y134 HydrophobicContact CB-CE2 3.61Å; V129-Y134 HydrophobicContact CG2-CD2 3.91Å; V129-Y134 HydrophobicContact CG2-CE2 4.05Å
130	G	46.4	Very low	48.6	Very low	61 Å²	61	89.7 Å²	89.7	63%	0.629	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.2	-117.7	-171.3	0	0	0	0	0	112
131	H	40.6	Very low	49.5	Very low	158 Å²	158	85.3 Å²	85.3	73%	0.731	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106	-0.2	-178.4	-54.7	-50.7	0	0	0	113.7	V129	V129-H131 PolarHBondContact O-N 3.1Å
132	C	38.2	Very low	50.5	Low	34 Å²	34	82.1 Å²	82.1	23%	0.23	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	144.6	179.2	-66.9	0	0	0	0	110.8	V129 Y134 I154	V129-C132 PolarHBondContact N-O 2.72Å; V129-C132 VanDerWaalsContact N-O 3.12Å; V129-C132 PolarHBondContact O-N 3Å; C132-Y134 HydrophobicContact CB-CD2 4.31Å; C132-Y134 HydrophobicContact CB-CE2 3.62Å; C132-I154 HydrophobicContact CB-CG2 4.28Å
133	R	41.8	Very low	50.5	Low	161 Å²	161	77.5 Å²	77.5	61%	0.608	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.5	118.3	165.7	-68.7	-173.8	176.9	-153.6	-3.1	108.6	W126	W126-R133 HydrophobicContact CE3-CB 3.78Å; W126-R133 HydrophobicContact CZ3-CB 3.91Å
134	Y	46.8	Very low	49.9	Very low	83 Å²	83	81.3 Å²	81.3	33%	0.325	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	123.8	173	-62.7	-102.1	0	0	0	107.2	W126 V127 V129 C132	W126-Y134 CarbonylContact C-O 3.45Å; W126-Y134 WeakPolarHBondContact CA-O 3.47Å; V127-Y134 PolarHBondContact N-O 3.45Å; V127-Y134 PolarHBondContact O-N 3.04Å; V129-Y134 HydrophobicContact CB-CD2 3.95Å; V129-Y134 HydrophobicContact CB-CE2 3.61Å; V129-Y134 HydrophobicContact CG2-CD2 3.91Å; V129-Y134 HydrophobicContact CG2-CE2 4.05Å; C132-Y134 HydrophobicContact CB-CD2 4.31Å; C132-Y134 HydrophobicContact CB-CE2 3.62Å
135	L	47.5	Very low	49.9	Very low	14 Å²	14	83.3 Å²	83.3	7%	0.073	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	145.5	153	-167.8	64.4	0	0	0	106.9	H124 W126 N152	H124-L135 HydrophobicContact CB-CD1 3.8Å; W126-L135 HydrophobicContact CD2-CD1 4.03Å; W126-L135 HydrophobicContact CE3-CB 4.27Å; W126-L135 HydrophobicContact CE3-CD1 4.43Å; W126-L135 HydrophobicContact CH2-CB 3.99Å; W126-L135 HydrophobicContact CH2-CD1 4.22Å; W126-L135 HydrophobicContact CZ2-CB 4.43Å; W126-L135 HydrophobicContact CZ2-CD1 3.81Å; W126-L135 HydrophobicContact CZ3-CB 3.91Å; L135-N152 VanDerWaalsContact C-OD1 3.24Å; L135-N152 WeakPolarHBondContact CB-OD1 3.43Å; L135-N152 PolarHBondContact O-ND2 2.82Å; L135-N152 VanDerWaalsContact O-ND2 3.17Å; L135-N152 PolarHBondContact O-OD1 2.9Å
136	L	51.8	Low	50	Low	28 Å²	28	85.5 Å²	85.5	15%	0.147	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	144	170.8	-63.4	174.9	0	0	0	108	I125 V127 I145 W147	I125-L136 PolarHBondContact N-O 3.27Å; I125-L136 PolarHBondContact O-N 2.93Å; V127-L136 HydrophobicContact CB-CD1 3.93Å; V127-L136 HydrophobicContact CG2-CD1 3.53Å; V127-L136 HydrophobicContact CG2-CG 4.48Å; L136-I145 HydrophobicContact CB-CG2 3.51Å; L136-I145 HydrophobicContact CD1-CG2 3.56Å; L136-I145 HydrophobicContact CG-CG2 4.11Å; L136-W147 HydrophobicContact CD2-CB 3.82Å; L136-W147 HydrophobicContact CD2-CG 4.24Å
137	E	54.3	Low	49.8	Very low	53 Å²	53	87.5 Å²	87.5	25%	0.248	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	131.1	175.9	-78.3	-177.9	151.4	0	0	109.2	H124 Q146 N148	H124-E137 VanDerWaalsContact CD2-CG 3.42Å; H124-E137 WeakPolarHBondContact CD2-CG 3.4Å; H124-E137 IonicContact CD2-OE1 2.67Å; H124-E137 IonicContact CE1-OE1 3.14Å; H124-E137 VanDerWaalsContact NE2-CG 3.32Å; H124-E137 WeakPolarHBondContact NE2-CG 3.34Å; H124-E137 IonicContact NE2-OE1 3.96Å; H124-E137 PolarHBondContact NE2-OE1 3.36Å; E137-Q146 PolarHBondContact N-O 3.3Å; E137-Q146 VanDerWaalsContact N-O 3.15Å; E137-Q146 PolarHBondContact O-N 2.8Å; E137-N148 WeakPolarHBondContact OE2-CB 3.26Å; E137-N148 PolarHBondContact OE2-ND2 2.84Å
138	R	54.2	Low	50.4	Low	126 Å²	126	87.9 Å²	87.9	48%	0.475	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	119.8	171.8	-165.1	-176.3	-163.7	-172.5	-0	108.5	D123 I125 L140 G143 E144 I145	D123-R138 WeakPolarHBondContact O-CB 3.38Å; D123-R138 PolarHBondContact O-N 3.29Å; I125-R138 HydrophobicContact CD1-CB 4.25Å; R138-L140 PolarHBondContact O-N 2.88Å; R138-G143 PolarHBondContact NE-O 2.69Å; R138-G143 PolarHBondContact NH2-O 3.41Å; R138-E144 CarbonylContact C-O 3.53Å; R138-E144 VanDerWaalsContact CA-O 3.26Å; R138-E144 WeakPolarHBondContact CA-O 3.2Å; R138-E144 VanDerWaalsContact CG-O 3.32Å; R138-E144 WeakPolarHBondContact CG-O 3.48Å; R138-I145 HydrophobicContact CG-CG1 4.25Å
139	D	59.9	Low	50.9	Low	51 Å²	51	87.2 Å²	87.2	27%	0.273	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-62.7	122.9	169.5	173.6	18.2	0	0	0	108.9	C141 T142 G143 E144	D139-C141 PolarHBondContact O-N 3.36Å; D139-C141 WeakPolarHBondContact OD1-CB 3.2Å; D139-C141 PolarHBondContact OD1-N 3.2Å; D139-T142 WeakPolarHBondContact CB-OG1 3.34Å; D139-T142 VanDerWaalsContact OD2-CB 3.26Å; D139-T142 WeakPolarHBondContact OD2-CB 3.19Å; D139-T142 WeakPolarHBondContact OD2-CG2 3.42Å; D139-T142 PolarHBondContact OD2-N 3.35Å; D139-T142 PolarHBondContact OD2-OG1 3.33Å; D139-G143 WeakPolarHBondContact O-CA 3.46Å; D139-G143 PolarHBondContact O-N 2.94Å; D139-E144 PolarHBondContact N-O 3.2Å
140	L	63.3	Low	51.8	Low	133 Å²	133	92.1 Å²	92.1	70%	0.696	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-19.3	179.7	-67	172.4	0	0	0	112.5	D123 R138	D123-L140 HydrophobicContact CB-CD2 4.49Å; R138-L140 PolarHBondContact O-N 2.88Å
141	C	62.4	Low	51.9	Low	121 Å²	121	90.6 Å²	90.6	82%	0.818	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-49.9	-178.4	-65.5	0	0	0	0	112.5	D139	D139-C141 PolarHBondContact O-N 3.36Å; D139-C141 WeakPolarHBondContact OD1-CB 3.2Å; D139-C141 PolarHBondContact OD1-N 3.2Å
142	T	71.6	Confident	52.3	Low	89 Å²	89	83.9 Å²	83.9	55%	0.546	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-22	178.3	61.6	0	0	0	0	113.8	D139 E144	D139-T142 WeakPolarHBondContact CB-OG1 3.34Å; D139-T142 VanDerWaalsContact OD2-CB 3.26Å; D139-T142 WeakPolarHBondContact OD2-CB 3.19Å; D139-T142 WeakPolarHBondContact OD2-CG2 3.42Å; D139-T142 PolarHBondContact OD2-N 3.35Å; D139-T142 PolarHBondContact OD2-OG1 3.33Å; T142-E144 PolarHBondContact O-N 2.8Å; T142-E144 WeakPolarHBondContact OG1-CB 3.46Å; T142-E144 WeakPolarHBondContact OG1-CG 3.39Å; T142-E144 PolarHBondContact OG1-N 3.26Å
143	G	54.3	Low	52.8	Low	26 Å²	26	86.9 Å²	86.9	27%	0.268	44%	0.435	S	S	.	.			trans	76.2	0.5	-170.2	0	0	0	0	0	114.4	R138 D139	R138-G143 PolarHBondContact NE-O 2.69Å; R138-G143 PolarHBondContact NH2-O 3.41Å; D139-G143 WeakPolarHBondContact O-CA 3.46Å; D139-G143 PolarHBondContact O-N 2.94Å
144	E	46.5	Very low	53	Low	113 Å²	113	85 Å²	85	53%	0.528	44%	0.436	S	S	.	.			trans	-63.6	155.7	174.5	-71.1	-168.2	161.4	0	0	112	R138 D139 T142 Q146	R138-E144 CarbonylContact C-O 3.53Å; R138-E144 VanDerWaalsContact CA-O 3.26Å; R138-E144 WeakPolarHBondContact CA-O 3.2Å; R138-E144 VanDerWaalsContact CG-O 3.32Å; R138-E144 WeakPolarHBondContact CG-O 3.48Å; D139-E144 PolarHBondContact N-O 3.2Å; T142-E144 PolarHBondContact O-N 2.8Å; T142-E144 WeakPolarHBondContact OG1-CB 3.46Å; T142-E144 WeakPolarHBondContact OG1-CG 3.39Å; T142-E144 PolarHBondContact OG1-N 3.26Å; E144-Q146 HydrophobicContact CB-CG 4.36Å; E144-Q146 PolarHBondContact OE2-NE2 3.31Å
145	I	53.4	Low	52.9	Low	88 Å²	88	85 Å²	85	45%	0.451	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	107.4	176.8	-57.3	175.2	0	0	0	107.5	I125 L136 R138	I125-I145 HydrophobicContact CD1-CD1 3.71Å; I125-I145 HydrophobicContact CD1-CG1 4.08Å; L136-I145 HydrophobicContact CB-CG2 3.51Å; L136-I145 HydrophobicContact CD1-CG2 3.56Å; L136-I145 HydrophobicContact CG-CG2 4.11Å; R138-I145 HydrophobicContact CG-CG1 4.25Å
146	Q	51.5	Low	52.8	Low	104 Å²	104	86.4 Å²	86.4	49%	0.486	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	141.5	-175.5	-61.8	-172.6	0.6	0	0	110.6	E137 E144 N148	E137-Q146 PolarHBondContact N-O 3.3Å; E137-Q146 VanDerWaalsContact N-O 3.15Å; E137-Q146 PolarHBondContact O-N 2.8Å; E144-Q146 HydrophobicContact CB-CG 4.36Å; E144-Q146 PolarHBondContact OE2-NE2 3.31Å; Q146-N148 PolarHBondContact O-N 3.34Å
147	W	47.6	Very low	52.9	Low	159 Å²	159	88 Å²	88	60%	0.602	46%	0.463	S	S	*	.			trans	-88.9	95.1	175.4	176.3	75.3	0	0	0	109.2	L136 P149	L136-W147 HydrophobicContact CD2-CB 3.82Å; L136-W147 HydrophobicContact CD2-CG 4.24Å; W147-P149 HydrophobicContact CH2-CB 3.84Å; W147-P149 HydrophobicContact CZ2-CB 4.27Å; W147-P149 HydrophobicContact CZ3-CB 4.01Å; W147-P149 WeakPolarHBondContact O-CD 3.26Å
148	N	51.1	Low	53	Low	58 Å²	58	86.4 Å²	86.4	31%	0.31	46%	0.457	S	S	.	.			trans	-79	111.9	174.1	-174.7	-4.5	0	0	0	110.8	E137 Q146 E150 G151 N152	E137-N148 WeakPolarHBondContact OE2-CB 3.26Å; E137-N148 PolarHBondContact OE2-ND2 2.84Å; Q146-N148 PolarHBondContact O-N 3.34Å; N148-E150 PolarHBondContact O-N 2.91Å; N148-E150 PolarHBondContact OD1-N 3.27Å; N148-G151 PolarHBondContact O-N 3.35Å; N148-N152 PolarHBondContact N-ND2 3.42Å; N148-N152 WeakPolarHBondContact O-CB 3.13Å; N148-N152 PolarHBondContact O-N 3.02Å; N148-N152 PolarHBondContact O-ND2 2.89Å
149	P	50.2	Low	53.4	Low	86 Å²	86	82.6 Å²	82.6	56%	0.558	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-25	-175.5	25.8	-34.6	0	0	0	113.7	W147	W147-P149 HydrophobicContact CH2-CB 3.84Å; W147-P149 HydrophobicContact CZ2-CB 4.27Å; W147-P149 HydrophobicContact CZ3-CB 4.01Å; W147-P149 WeakPolarHBondContact O-CD 3.26Å
150	E	54	Low	53.4	Low	188 Å²	188	81.5 Å²	81.5	88%	0.879	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-23.2	-177.4	-60.5	-171.6	164.7	0	0	113.3	N148	N148-E150 PolarHBondContact O-N 2.91Å; N148-E150 PolarHBondContact OD1-N 3.27Å
151	G	49.7	Very low	53.4	Low	30 Å²	30	79.7 Å²	79.7	31%	0.309	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-18.7	179.8	0	0	0	0	0	115.2	N148 E153	N148-G151 PolarHBondContact O-N 3.35Å; G151-E153 PolarHBondContact O-N 2.89Å
152	N	49	Very low	53.5	Low	16 Å²	16	74.2 Å²	74.2	9%	0.086	39%	0.393	C	S	.	.			trans	-99.7	70.9	-159.6	-69.8	-22.8	0	0	0	114.2	L135 N148 I154	L135-N152 VanDerWaalsContact C-OD1 3.24Å; L135-N152 WeakPolarHBondContact CB-OD1 3.43Å; L135-N152 PolarHBondContact O-ND2 2.82Å; L135-N152 VanDerWaalsContact O-ND2 3.17Å; L135-N152 PolarHBondContact O-OD1 2.9Å; N148-N152 PolarHBondContact N-ND2 3.42Å; N148-N152 WeakPolarHBondContact O-CB 3.13Å; N148-N152 PolarHBondContact O-N 3.02Å; N148-N152 PolarHBondContact O-ND2 2.89Å; N152-I154 PolarHBondContact O-N 3.43Å
153	E	47.1	Very low	53.2	Low	97 Å²	97	73.5 Å²	73.5	45%	0.453	38%	0.383	S	S	.	.			trans	-54	123.2	170	-79.9	-175	168.4	0	0	111.5	K116 G151 L155	K116-E153 IonicContact NZ-OE1 2.82Å; G151-E153 PolarHBondContact O-N 2.89Å; E153-L155 PolarHBondContact O-N 2.81Å; E153-L155 VanDerWaalsContact O-N 3.09Å
154	I	46	Very low	53.6	Low	121 Å²	121	76 Å²	76	62%	0.621	39%	0.39	S	S	*	.			trans	-75.2	99.4	178.4	-58.3	176.3	0	0	0	110.1	C132 N152 C156	C132-I154 HydrophobicContact CB-CG2 4.28Å; N152-I154 PolarHBondContact O-N 3.43Å; I154-C156 PolarHBondContact O-N 2.99Å
155	L	46.5	Very low	54.5	Low	85 Å²	85	71.6 Å²	71.6	45%	0.445	37%	0.371	S	S	.	.	B	Isolated β-bridge	trans	-83.2	98.6	176	-64.6	-172.8	0	0	0	112.1	W126 E153	W126-L155 HydrophobicContact CH2-CD1 3.42Å; W126-L155 VanDerWaalsContact CH2-CD1 3.42Å; W126-L155 HydrophobicContact CH2-CG 3.97Å; W126-L155 HydrophobicContact CZ2-CD1 4.03Å; W126-L155 HydrophobicContact CZ3-CD1 4.09Å; W126-L155 HydrophobicContact CZ3-CG 4.38Å; E153-L155 PolarHBondContact O-N 2.81Å; E153-L155 VanDerWaalsContact O-N 3.09Å
156	C	45.3	Very low	55.3	Low	43 Å²	43	67.5 Å²	67.5	29%	0.291	35%	0.35	S	S	.	.			trans	-90.2	153.6	165.4	-166.8	0	0	0	0	110.8	I154	I154-C156 PolarHBondContact O-N 2.99Å
157	T	53.9	Low	55.9	Low	61 Å²	61	64.6 Å²	64.6	37%	0.374	34%	0.344	S	S	.	.			trans	-78.6	147	171.2	88	0	0	0	0	110.2	R159 S160 L161	T157-R159 PolarHBondContact O-N 2.87Å; T157-R159 VanDerWaalsContact O-N 3.17Å; T157-S160 PolarHBondContact O-N 3.2Å; T157-S160 WeakPolarHBondContact OG1-CB 3.32Å; T157-S160 PolarHBondContact OG1-N 2.92Å; T157-S160 PolarHBondContact OG1-OG 3.01Å; T157-L161 PolarHBondContact O-N 2.88Å
158	P	55.9	Low	56.6	Low	19 Å²	19	62.9 Å²	62.9	12%	0.123	34%	0.337	C	S	.	.	H	α-helix	trans	-57.3	-33.4	179.5	-29	37.4	0	0	0	113.7	P110 Y112 A113 A162	P110-P158 HydrophobicContact CB-CB 3.94Å; P110-P158 HydrophobicContact CG-CB 4.22Å; Y112-P158 HydrophobicContact CD2-CB 4.11Å; A113-P158 HydrophobicContact CB-CG 3.95Å; P158-A162 WeakPolarHBondContact O-CB 3.41Å; P158-A162 PolarHBondContact O-N 2.96Å
159	R	62.7	Low	57.1	Low	47 Å²	47	63.4 Å²	63.4	18%	0.177	34%	0.34	C	S	.	.	H	α-helix	trans	-68.6	-46.3	174.6	-167.8	-172.2	-175.3	78.3	5.9	111.7	T157 L161 A162 E163 E295	T157-R159 PolarHBondContact O-N 2.87Å; T157-R159 VanDerWaalsContact O-N 3.17Å; R159-L161 VanDerWaalsContact C-N 3.3Å; R159-L161 PolarHBondContact O-N 3.42Å; R159-A162 PolarHBondContact O-N 2.6Å; R159-E163 WeakPolarHBondContact CG-OE1 3.43Å; R159-E163 IonicContact NE-OE1 3.74Å; R159-E163 PolarHBondContact NE-OE1 3.31Å; R159-E163 WeakPolarHBondContact O-CB 3.39Å; R159-E163 VanDerWaalsContact O-CG 3.3Å; R159-E163 WeakPolarHBondContact O-CG 3.43Å; R159-E163 PolarHBondContact O-N 2.58Å; R159-E295 IonicContact CZ-OE1 3.6Å; R159-E295 IonicContact NE-OE1 2.65Å; R159-E295 IonicContact NH1-OE1 2.73Å; R159-E295 PolarHBondContact NH1-OE1 3.45Å; R159-E295 IonicContact NH1-OE2 3.6Å; R159-E295 IonicContact NH2-OE1 3.64Å; R159-E295 PolarHBondContact NH2-OE1 3.01Å
160	S	60.1	Low	57.6	Low	27 Å²	27	59.5 Å²	59.5	19%	0.189	31%	0.314	C	S	.	.	H	α-helix	trans	-65.4	-33.3	176.9	-54.3	0	0	0	0	112.3	T157 E163 I164	T157-S160 PolarHBondContact O-N 3.2Å; T157-S160 WeakPolarHBondContact OG1-CB 3.32Å; T157-S160 PolarHBondContact OG1-N 2.92Å; T157-S160 PolarHBondContact OG1-OG 3.01Å; S160-E163 PolarHBondContact O-N 3.41Å; S160-I164 WeakPolarHBondContact O-CB 3.28Å; S160-I164 WeakPolarHBondContact O-CD1 3.46Å; S160-I164 WeakPolarHBondContact O-CG1 3.41Å; S160-I164 PolarHBondContact O-N 3.25Å
161	L	62.2	Low	57.8	Low	95 Å²	95	56.8 Å²	56.8	50%	0.497	30%	0.296	S	S	.	.	H	α-helix	trans	-65.2	-46.4	171	179.8	61.4	0	0	0	111	T157 R159 E163 I164 C165	T157-L161 PolarHBondContact O-N 2.88Å; R159-L161 VanDerWaalsContact C-N 3.3Å; R159-L161 PolarHBondContact O-N 3.42Å; L161-E163 VanDerWaalsContact C-N 3.34Å; L161-E163 PolarHBondContact O-N 3.41Å; L161-I164 PolarHBondContact O-N 3.38Å; L161-C165 PolarHBondContact O-N 3.38Å; L161-C165 PolarHBondContact O-SG 2.8Å
162	A	64.1	Low	57.9	Low	6 Å²	6	60 Å²	60	5%	0.05	31%	0.306	C	S	.	.	H	α-helix	trans	-61.6	-40.8	174.8	0	0	0	0	0	112.2	P158 R159 I164 C165 M166 L292 E295	P158-A162 WeakPolarHBondContact O-CB 3.41Å; P158-A162 PolarHBondContact O-N 2.96Å; R159-A162 PolarHBondContact O-N 2.6Å; A162-I164 PolarHBondContact O-N 3.03Å; A162-C165 PolarHBondContact O-N 2.82Å; A162-M166 HydrophobicContact CB-CE 4.34Å; A162-M166 WeakPolarHBondContact O-CB 3.38Å; A162-M166 WeakPolarHBondContact O-CE 3.46Å; A162-M166 WeakPolarHBondContact O-CG 3.35Å; A162-M166 PolarHBondContact O-N 3.4Å; A162-L292 HydrophobicContact CB-CD2 4.02Å; A162-E295 HydrophobicContact CB-CB 4.36Å; A162-E295 HydrophobicContact CB-CG 3.89Å
163	E	66.1	Low	58.3	Low	75 Å²	75	61 Å²	61	35%	0.35	31%	0.308	S	S	.	.	H	α-helix	trans	-60.9	-40.8	173.3	-73	162	-176.2	0	0	111.9	R159 S160 L161 A167 Q299	R159-E163 WeakPolarHBondContact CG-OE1 3.43Å; R159-E163 IonicContact NE-OE1 3.74Å; R159-E163 PolarHBondContact NE-OE1 3.31Å; R159-E163 WeakPolarHBondContact O-CB 3.39Å; R159-E163 VanDerWaalsContact O-CG 3.3Å; R159-E163 WeakPolarHBondContact O-CG 3.43Å; R159-E163 PolarHBondContact O-N 2.58Å; S160-E163 PolarHBondContact O-N 3.41Å; L161-E163 VanDerWaalsContact C-N 3.34Å; L161-E163 PolarHBondContact O-N 3.41Å; E163-A167 WeakPolarHBondContact O-CB 3.02Å; E163-A167 PolarHBondContact O-N 3.41Å; E163-Q299 PolarHBondContact OE1-NE2 2.86Å
164	I	63.1	Low	58.1	Low	78 Å²	78	61.1 Å²	61.1	40%	0.4	32%	0.317	S	S	.	.	H	α-helix	trans	-67.1	-44.7	174.5	-70.6	162.4	0	0	0	111.3	S160 L161 A162 A167 R168	S160-I164 WeakPolarHBondContact O-CB 3.28Å; S160-I164 WeakPolarHBondContact O-CD1 3.46Å; S160-I164 WeakPolarHBondContact O-CG1 3.41Å; S160-I164 PolarHBondContact O-N 3.25Å; L161-I164 PolarHBondContact O-N 3.38Å; A162-I164 PolarHBondContact O-N 3.03Å; I164-A167 PolarHBondContact O-N 3.06Å; I164-R168 WeakPolarHBondContact O-CB 3.39Å; I164-R168 PolarHBondContact O-N 3.43Å
165	C	65.9	Low	57.9	Low	21 Å²	21	55.9 Å²	55.9	14%	0.142	29%	0.291	C	S	.	.	H	α-helix	trans	-62.5	-44.5	176.4	-68.8	0	0	0	0	111.6	L161 A162 A167 L169 I170 L292	L161-C165 PolarHBondContact O-N 3.38Å; L161-C165 PolarHBondContact O-SG 2.8Å; A162-C165 PolarHBondContact O-N 2.82Å; C165-A167 VanDerWaalsContact C-N 3.35Å; C165-A167 PolarHBondContact O-N 3.45Å; C165-L169 HydrophobicContact CB-CD1 4.22Å; C165-L169 WeakPolarHBondContact O-CA 3.48Å; C165-L169 VanDerWaalsContact O-CB 3.31Å; C165-L169 WeakPolarHBondContact O-CB 3.47Å; C165-L169 PolarHBondContact O-N 2.81Å; C165-I170 PolarHBondContact O-N 3.47Å; C165-L292 HydrophobicContact CB-CD1 4.26Å; C165-L292 HydrophobicContact CB-CD2 3.71Å
166	M	69.8	Low	57.4	Low	2 Å²	2	59.4 Å²	59.4	1%	0.01	31%	0.308	C	S	.	.	I	π-helix	trans	-61.5	-43.5	173.4	-73	-174.7	-72.8	0	0	111.4	A162 I170 R171 E295 A296 A304	A162-M166 HydrophobicContact CB-CE 4.34Å; A162-M166 WeakPolarHBondContact O-CB 3.38Å; A162-M166 WeakPolarHBondContact O-CE 3.46Å; A162-M166 WeakPolarHBondContact O-CG 3.35Å; A162-M166 PolarHBondContact O-N 3.4Å; M166-I170 HydrophobicContact CG-CD1 3.88Å; M166-R171 WeakPolarHBondContact O-CB 3.24Å; M166-R171 VanDerWaalsContact O-CG 3.28Å; M166-R171 WeakPolarHBondContact O-CG 3.27Å; M166-R171 PolarHBondContact O-N 3.46Å; M166-E295 HydrophobicContact CE-CG 3.95Å; M166-A296 HydrophobicContact SD-CB 3.75Å; M166-A304 HydrophobicContact CB-CB 4.23Å; M166-A304 HydrophobicContact CG-CB 3.89Å; M166-A304 HydrophobicContact SD-CB 3.82Å
167	A	63.9	Low	57	Low	42 Å²	42	59.7 Å²	59.7	35%	0.347	31%	0.306	S	S	.	.	I	π-helix	trans	-72.8	-33.4	-177.4	0	0	0	0	0	115.3	E163 I164 C165	E163-A167 WeakPolarHBondContact O-CB 3.02Å; E163-A167 PolarHBondContact O-N 3.41Å; I164-A167 PolarHBondContact O-N 3.06Å; C165-A167 VanDerWaalsContact C-N 3.35Å; C165-A167 PolarHBondContact O-N 3.45Å
168	R	61.4	Low	55.9	Low	124 Å²	124	61.5 Å²	61.5	47%	0.468	32%	0.318	S	S	.	.	I	π-helix	trans	-118.5	-19.2	-172	-67.9	-170.1	179	-178.4	1	116.1	I164 V188	I164-R168 WeakPolarHBondContact O-CB 3.39Å; I164-R168 PolarHBondContact O-N 3.43Å; R168-V188 VanDerWaalsContact NH2-CG1 3.33Å
169	L	61.7	Low	54.9	Low	69 Å²	69	66 Å²	66	36%	0.361	35%	0.346	S	S	.	.	I	π-helix	trans	-106.5	-35.7	176.6	-56.9	176.4	0	0	0	111.7	C165	C165-L169 HydrophobicContact CB-CD1 4.22Å; C165-L169 WeakPolarHBondContact O-CA 3.48Å; C165-L169 VanDerWaalsContact O-CB 3.31Å; C165-L169 WeakPolarHBondContact O-CB 3.47Å; C165-L169 PolarHBondContact O-N 2.81Å
170	I	61.9	Low	53.5	Low	3 Å²	3	74.2 Å²	74.2	2%	0.015	38%	0.377	C	S	.	.	I	π-helix	trans	-93.9	-45.2	-175.7	-58.4	164.2	0	0	0	112.3	C165 M166 W173 L292 A304 L308	C165-I170 PolarHBondContact O-N 3.47Å; M166-I170 HydrophobicContact CG-CD1 3.88Å; I170-W173 VanDerWaalsContact O-CB 3.28Å; I170-W173 WeakPolarHBondContact O-CB 3.31Å; I170-L292 HydrophobicContact CD1-CB 4.29Å; I170-L292 HydrophobicContact CD1-CD1 4.18Å; I170-A304 HydrophobicContact CG2-CB 4.19Å; I170-L308 HydrophobicContact CD1-CD1 3.89Å; I170-L308 HydrophobicContact CD1-CD2 3.81Å; I170-L308 HydrophobicContact CD1-CG 3.86Å; I170-L308 HydrophobicContact CG1-CD2 4.2Å; I170-L308 HydrophobicContact CG1-CG 4.35Å; I170-L308 HydrophobicContact CG2-CG 4.11Å
171	R	57.8	Low	52.2	Low	132 Å²	132	83.1 Å²	83.1	50%	0.498	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-20.1	-177.9	-72.5	179.5	-170.7	169.5	1.2	115.5	M166 D301	M166-R171 WeakPolarHBondContact O-CB 3.24Å; M166-R171 VanDerWaalsContact O-CG 3.28Å; M166-R171 WeakPolarHBondContact O-CG 3.27Å; M166-R171 PolarHBondContact O-N 3.46Å; R171-D301 IonicContact CZ-OD2 2.65Å; R171-D301 VanDerWaalsContact CZ-OD2 3.29Å; R171-D301 IonicContact NE-OD1 2.69Å; R171-D301 IonicContact NE-OD2 3.06Å; R171-D301 PolarHBondContact NE-OD2 3.1Å; R171-D301 VanDerWaalsContact NE-OD2 3.14Å; R171-D301 VanDerWaalsContact NH2-CG 3.32Å; R171-D301 IonicContact NH2-OD1 3.26Å; R171-D301 IonicContact NH2-OD2 2.86Å; R171-D301 PolarHBondContact NH2-OD2 3.19Å
172	D	52.3	Low	50.6	Low	98 Å²	98	82.5 Å²	82.5	52%	0.524	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	3	173.4	-77.3	-50.2	0	0	0	112.1	R185	D172-R185 IonicContact OD1-NH2 3.26Å; D172-R185 PolarHBondContact OD1-NH2 2.76Å
173	W	55.7	Low	49.3	Very low	37 Å²	37	86.6 Å²	86.6	14%	0.14	44%	0.438	C	S	.	.	S	Bend	trans	-65.5	148.6	172.3	-155.1	-50.8	0	0	0	110.5	I170 C175 C281 N311	I170-W173 VanDerWaalsContact O-CB 3.28Å; I170-W173 WeakPolarHBondContact O-CB 3.31Å; W173-C175 PolarHBondContact O-N 3.26Å; W173-C281 HydrophobicContact CH2-CB 3.17Å; W173-C281 WeakPolarHBondContact CH2-SG 3.31Å; W173-C281 HydrophobicContact CZ2-CB 3.91Å; W173-C281 VanDerWaalsContact CZ2-SG 3.55Å; W173-C281 HydrophobicContact CZ3-CB 3.78Å; W173-N311 HydrophobicContact CH2-CB 3.21Å; W173-N311 HydrophobicContact CZ2-CB 3.1Å; W173-N311 VanDerWaalsContact CZ2-OD1 3.31Å; W173-N311 WeakPolarHBondContact CZ2-OD1 3.44Å; W173-N311 HydrophobicContact CZ3-CB 4.25Å; W173-N311 PolarHBondContact NE1-OD1 2.87Å; W173-N311 VanDerWaalsContact NE1-OD1 3.11Å
174	P	43.3	Very low	47.7	Very low	99 Å²	99	88.9 Å²	88.9	64%	0.643	45%	0.452	S	S	*	.	S	Bend	trans	-63.6	73.4	164	24.6	-34.4	0	0	0	113.6
175	C	43	Very low	46.3	Very low	11 Å²	11	92.6 Å²	92.6	7%	0.074	46%	0.461	C	S	.	.	S	Bend	trans	-124.3	133.8	147.3	59	0	0	0	0	106.6	W173 L177	W173-C175 PolarHBondContact O-N 3.26Å; C175-L177 PolarHBondContact O-N 3.13Å
176	M	36.1	Very low	44.6	Very low	159 Å²	159	96.9 Å²	96.9	78%	0.783	48%	0.483	S	S	*	.			trans	-78.7	37.3	-160	-72.8	-95.7	59.6	0	0	115.3
177	L	35.6	Very low	42.8	Very low	48 Å²	48	101.4 Å²	101.4	25%	0.251	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-65.4	128.7	179	-69.9	171.4	0	0	0	111.2	C175 T179 A303 T306	C175-L177 PolarHBondContact O-N 3.13Å; L177-T179 PolarHBondContact O-N 2.86Å; L177-A303 HydrophobicContact CD1-CB 3.89Å; L177-A303 WeakPolarHBondContact CD1-O 3.3Å; L177-T306 HydrophobicContact CD1-CG2 4.11Å; L177-T306 HydrophobicContact CD2-CG2 4.25Å; L177-T306 HydrophobicContact CG-CG2 4.45Å
178	P	32	Very low	41.3	Very low	99 Å²	99	102.1 Å²	102.1	64%	0.643	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-65.3	124.8	-173.7	23.4	-33.4	0	0	0	111.9	R180	P178-R180 PolarHBondContact O-N 2.85Å
179	T	34.9	Very low	39.9	Very low	114 Å²	114	99.3 Å²	99.3	70%	0.699	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-56.9	123.3	179.4	54.3	0	0	0	0	111.6	L177 R181	L177-T179 PolarHBondContact O-N 2.86Å; T179-R181 PolarHBondContact O-N 2.97Å
180	R	33.6	Very low	38.4	Very low	219 Å²	219	104.1 Å²	104.1	83%	0.826	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-61.7	125.8	171.1	-79.7	-167	175.7	-150.7	2.7	109.2	P178 S182	P178-R180 PolarHBondContact O-N 2.85Å; R180-S182 PolarHBondContact O-N 3.45Å; R180-S182 VanDerWaalsContact O-N 3.11Å
181	R	31.7	Very low	36.8	Very low	214 Å²	214	109 Å²	109	81%	0.808	55%	0.549	S	S	*	.			trans	-57	113.3	-173.4	-73.4	-178.9	173	175.6	-3.1	112.9	T179 S183	T179-R181 PolarHBondContact O-N 2.97Å; R181-S183 VanDerWaalsContact C-N 3.32Å; R181-S183 PolarHBondContact O-N 3.27Å
182	S	27.9	Very low	35.8	Very low	82 Å²	82	109.6 Å²	109.6	57%	0.573	56%	0.556	S	S	*	*	S	Bend	trans	55.4	-13.9	142.9	51.5	0	0	0	0	122.8	R180	R180-S182 PolarHBondContact O-N 3.45Å; R180-S182 VanDerWaalsContact O-N 3.11Å
183	S	37.1	Very low	34.6	Very low	93 Å²	93	109 Å²	109	65%	0.65	56%	0.56	S	S	*	*	H	α-helix	trans	-75.2	-45.2	-175.1	62.5	0	0	0	0	114.7	R181	R181-S183 VanDerWaalsContact C-N 3.32Å; R181-S183 PolarHBondContact O-N 3.27Å
184	L	33.1	Very low	33.2	Very low	123 Å²	123	112.4 Å²	112.4	64%	0.644	59%	0.588	S	S	*	*	H	α-helix	trans	-86.2	-30.6	-176.7	-94.9	165.3	0	0	0	114.2	N186 I187 V188	L184-N186 VanDerWaalsContact C-N 3.29Å; L184-N186 PolarHBondContact O-N 2.88Å; L184-I187 PolarHBondContact O-N 3.25Å; L184-V188 PolarHBondContact O-N 2.7Å; L184-V188 VanDerWaalsContact O-N 3.16Å
185	R	33.7	Very low	32.5	Very low	156 Å²	156	118.8 Å²	118.8	59%	0.589	60%	0.6	S	S	*	*	H	α-helix	trans	-61.3	-40.5	-176.4	-151.1	173.9	-152.5	157.9	15.5	111.2	D172 I187 V188 S189	D172-R185 IonicContact OD1-NH2 3.26Å; D172-R185 PolarHBondContact OD1-NH2 2.76Å; R185-I187 PolarHBondContact O-N 2.95Å; R185-V188 PolarHBondContact O-N 2.98Å; R185-S189 PolarHBondContact O-N 3.07Å; R185-S189 PolarHBondContact O-OG 2.83Å
186	N	31	Very low	31.9	Very low	111 Å²	111	125.5 Å²	125.5	59%	0.594	64%	0.635	S	S	*	*	H	α-helix	trans	-64.9	-36.4	178.9	-66	7.8	0	0	0	113	L184 F190	L184-N186 VanDerWaalsContact C-N 3.29Å; L184-N186 PolarHBondContact O-N 2.88Å; N186-F190 VanDerWaalsContact O-CB 3.29Å; N186-F190 WeakPolarHBondContact O-CB 3.36Å; N186-F190 PolarHBondContact O-N 2.92Å
187	I	30.5	Very low	31.6	Very low	97 Å²	97	124.9 Å²	124.9	50%	0.497	63%	0.633	S	S	.	*	H	α-helix	trans	-68.8	-41.2	177.4	-61.3	174.7	0	0	0	110.3	L184 R185 F190 L191	L184-I187 PolarHBondContact O-N 3.25Å; R185-I187 PolarHBondContact O-N 2.95Å; I187-F190 PolarHBondContact O-N 3.19Å; I187-L191 HydrophobicContact CG2-CD1 3.91Å; I187-L191 WeakPolarHBondContact O-CB 3.43Å; I187-L191 WeakPolarHBondContact O-CG 3.21Å; I187-L191 PolarHBondContact O-N 3.25Å
188	V	33.9	Very low	31.4	Very low	57 Å²	57	131.1 Å²	131.1	35%	0.345	66%	0.661	S	S	.	*	H	α-helix	trans	-68.8	-41.4	176.8	179.9	0	0	0	0	111.2	R168 L184 R185 L191 F192	R168-V188 VanDerWaalsContact NH2-CG1 3.33Å; L184-V188 PolarHBondContact O-N 2.7Å; L184-V188 VanDerWaalsContact O-N 3.16Å; R185-V188 PolarHBondContact O-N 2.98Å; V188-L191 PolarHBondContact O-N 2.85Å; V188-F192 HydrophobicContact CG1-CD2 3.91Å; V188-F192 HydrophobicContact CG1-CE2 4.33Å; V188-F192 WeakPolarHBondContact O-CD2 3.43Å; V188-F192 PolarHBondContact O-N 2.94Å; V188-F192 VanDerWaalsContact O-N 3.1Å
189	S	31.6	Very low	31.5	Very low	65 Å²	65	131.1 Å²	131.1	46%	0.455	66%	0.663	S	S	.	*	H	α-helix	trans	-61	-43.7	172.8	-66.6	0	0	0	0	111.9	R185 L191 F192 S193	R185-S189 PolarHBondContact O-N 3.07Å; R185-S189 PolarHBondContact O-OG 2.83Å; S189-L191 PolarHBondContact O-N 3.1Å; S189-F192 CarbonylContact O-C 3.54Å; S189-F192 PolarHBondContact O-N 3.08Å; S189-S193 WeakPolarHBondContact O-CB 3.46Å; S189-S193 PolarHBondContact O-N 2.86Å; S189-S193 VanDerWaalsContact O-N 3.16Å; S189-S193 PolarHBondContact O-OG 2.84Å
190	F	29	Very low	31.4	Very low	170 Å²	170	132.4 Å²	132.4	75%	0.746	67%	0.666	S	S	*	*	H	α-helix	trans	-64.1	-39.2	178.2	-173	-101.1	0	0	0	113	N186 I187	N186-F190 VanDerWaalsContact O-CB 3.29Å; N186-F190 WeakPolarHBondContact O-CB 3.36Å; N186-F190 PolarHBondContact O-N 2.92Å; I187-F190 PolarHBondContact O-N 3.19Å
191	L	29.6	Very low	31.3	Very low	104 Å²	104	128 Å²	128	55%	0.545	66%	0.664	S	S	.	*	H	α-helix	trans	-78.5	-14.4	179.5	-69.8	173.3	0	0	0	114.5	I187 V188 S189	I187-L191 HydrophobicContact CG2-CD1 3.91Å; I187-L191 WeakPolarHBondContact O-CB 3.43Å; I187-L191 WeakPolarHBondContact O-CG 3.21Å; I187-L191 PolarHBondContact O-N 3.25Å; V188-L191 PolarHBondContact O-N 2.85Å; S189-L191 PolarHBondContact O-N 3.1Å
192	F	36.3	Very low	31.4	Very low	145 Å²	145	123 Å²	123	64%	0.636	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.6	30.8	179.2	-68.7	-81.8	0	0	0	112.4	V188 S189	V188-F192 HydrophobicContact CG1-CD2 3.91Å; V188-F192 HydrophobicContact CG1-CE2 4.33Å; V188-F192 WeakPolarHBondContact O-CD2 3.43Å; V188-F192 PolarHBondContact O-N 2.94Å; V188-F192 VanDerWaalsContact O-N 3.1Å; S189-F192 CarbonylContact O-C 3.54Å; S189-F192 PolarHBondContact O-N 3.08Å
193	S	28.1	Very low	31.8	Very low	87 Å²	87	127 Å²	127	61%	0.608	67%	0.667	S	S	*	*			trans	-142.6	80.3	173	-66.4	0	0	0	0	110.7	S189	S189-S193 WeakPolarHBondContact O-CB 3.46Å; S189-S193 PolarHBondContact O-N 2.86Å; S189-S193 VanDerWaalsContact O-N 3.16Å; S189-S193 PolarHBondContact O-OG 2.84Å
194	S	26.3	Very low	31.7	Very low	107 Å²	107	129 Å²	129	75%	0.748	67%	0.67	S	S	*	*			trans	-159.7	131.9	170.6	-79.6	0	0	0	0	109
195	R	28.6	Very low	31.5	Very low	233 Å²	233	132.3 Å²	132.3	88%	0.879	68%	0.68	S	S	*	*			trans	70.5	132.7	-155.3	-54.4	178.5	179.4	172.7	-2	111.8
196	D	29.7	Very low	31.5	Very low	153 Å²	153	129.3 Å²	129.3	82%	0.818	68%	0.683	S	S	*	*			cis	-106.7	158.6	7	-70.2	-54	0	0	0	115
197	I	30.4	Very low	31.7	Very low	145 Å²	145	129.7 Å²	129.7	74%	0.744	69%	0.689	S	S	*	*			trans	-137.4	139.9	175.8	-77.8	174.9	0	0	0	106.9
198	Q	29.7	Very low	31.8	Very low	179 Å²	179	130.9 Å²	130.9	84%	0.836	70%	0.701	S	S	*	*			trans	71.5	131.3	-172.2	-59	152.5	21.1	0	0	112.5
199	S	34.3	Very low	32	Very low	99 Å²	99	133.7 Å²	133.7	69%	0.692	72%	0.718	S	S	*	*			cis	-152.4	151.4	44.3	53.2	0	0	0	0	116.3
200	N	32.6	Very low	32.2	Very low	141 Å²	141	135.4 Å²	135.4	75%	0.754	73%	0.731	S	S	*	*			trans	60.2	106.9	142.9	-58.8	-2	0	0	0	122.7
201	T	32.5	Very low	32.5	Very low	126 Å²	126	132.4 Å²	132.4	77%	0.773	73%	0.731	S	S	*	*				44.6	138.7	125.6	57.8	0	0	0	0	120.7
202	T	33.8	Very low	32.9	Very low	109 Å²	109	132.4 Å²	132.4	67%	0.669	74%	0.739	S	S	*	*				-167.3	128.8	53.7	-44.3	0	0	0	0	114.4
203	Q	36.4	Very low	32.9	Very low	166 Å²	166	131.2 Å²	131.2	78%	0.776	74%	0.744	S	S	*	*			trans	47.4	145.7	148.1	-61.8	174.9	-22	0	0	125.8
204	N	33.9	Very low	33.2	Very low	135 Å²	135	132.9 Å²	132.9	72%	0.722	75%	0.751	S	S	*	*			trans	101.8	115.2	156.8	-56	-35.2	0	0	0	116.5
205	F	30.6	Very low	33.7	Very low	193 Å²	193	132 Å²	132	85%	0.846	75%	0.745	S	S	*	*			cis	63.9	129.3	40.1	-69.7	-63.8	0	0	0	113.3
206	S	32.5	Very low	34	Very low	94 Å²	94	127 Å²	127	66%	0.657	74%	0.74	S	S	*	*			cis	-158	-166.4	-0.1	-70.8	0	0	0	0	109.3
207	T	35.1	Very low	34.2	Very low	118 Å²	118	124.1 Å²	124.1	72%	0.724	73%	0.732	S	S	*	*			cis	-163.9	140	6.9	-20.1	0	0	0	0	112
208	T	33.8	Very low	34.6	Very low	123 Å²	123	124.4 Å²	124.4	76%	0.755	73%	0.734	S	S	*	*			trans	58.1	167.2	151.7	42	0	0	0	0	120
209	T	36.6	Very low	35.1	Very low	115 Å²	115	124 Å²	124	71%	0.706	74%	0.735	S	S	*	*			cis	-156.1	153.9	16.9	-19.6	0	0	0	0	113
210	S	36	Very low	35	Very low	102 Å²	102	122.3 Å²	122.3	71%	0.713	73%	0.734	S	S	*	*			trans	29.2	150.1	142.9	59.2	0	0	0	0	123.4
211	S	36.8	Very low	35.4	Very low	107 Å²	107	121.7 Å²	121.7	75%	0.748	74%	0.738	S	S	*	*			cis	-167.2	162.5	11.7	30	0	0	0	0	114.8
212	S	36	Very low	35.5	Very low	103 Å²	103	126.3 Å²	126.3	72%	0.72	74%	0.741	S	S	*	*			trans	-21.1	162	158.1	58.3	0	0	0	0	120.5
213	T	36.4	Very low	35.6	Very low	120 Å²	120	131.1 Å²	131.1	74%	0.736	75%	0.747	S	S	*	*			cis	-154	153.1	43.1	45.2	0	0	0	0	118
214	T	34.7	Very low	35.7	Very low	123 Å²	123	128.2 Å²	128.2	76%	0.755	75%	0.745	S	S	*	*			trans	-17.5	161.3	140.5	39.4	0	0	0	0	119.9
215	S	37	Very low	35.6	Very low	89 Å²	89	126.3 Å²	126.3	62%	0.622	75%	0.748	S	S	*	*			cis	-176.7	168.7	-4.3	50.3	0	0	0	0	113.3
216	T	35.1	Very low	35.7	Very low	126 Å²	126	121.7 Å²	121.7	77%	0.773	74%	0.74	S	S	*	*			trans	62.2	149.7	146.6	45	0	0	0	0	121.1
217	S	34.5	Very low	35.8	Very low	94 Å²	94	125.2 Å²	125.2	66%	0.657	75%	0.75	S	S	*	*			cis	-179.6	170.3	-17.6	50.5	0	0	0	0	113.2
218	I	38.9	Very low	35.6	Very low	151 Å²	151	124.6 Å²	124.6	77%	0.774	75%	0.751	S	S	*	*			trans	76.1	148.4	158.5	-14.4	-177.4	0	0	0	121
219	I	38.7	Very low	35.5	Very low	169 Å²	169	123.7 Å²	123.7	87%	0.867	75%	0.749	S	S	*	*			trans	88.3	135.1	162	-51.8	-179.7	0	0	0	116.8
220	G	34.2	Very low	35.3	Very low	65 Å²	65	130.1 Å²	130.1	67%	0.67	76%	0.761	S	S	*	*			trans	-126.6	-129.8	-176.8	0	0	0	0	0	114.7
221	P	40.7	Very low	35	Very low	128 Å²	128	133.6 Å²	133.6	83%	0.831	77%	0.766	S	S	*	*				-123.6	156.2	-108.9	38.7	-29.8	0	0	0	115.8
222	R	34.7	Very low	34.9	Very low	223 Å²	223	134.4 Å²	134.4	84%	0.842	77%	0.771	S	S	*	*			trans	-165.3	128.9	158	-112.3	164.8	-171	-161.5	3.4	116.2
223	R	36.2	Very low	34.5	Very low	209 Å²	209	140.4 Å²	140.4	79%	0.789	78%	0.778	S	S	*	*			trans	62.6	117.7	135.1	-76.6	179.8	177.6	-167.1	-2.2	123.2
224	S	36.6	Very low	34.4	Very low	105 Å²	105	140.8 Å²	140.8	73%	0.734	78%	0.784	S	S	*	*				78.5	133.8	119.8	69.4	0	0	0	0	123.5
225	A	33	Very low	34.3	Very low	96 Å²	96	144 Å²	144	79%	0.793	79%	0.788	S	S	*	*			trans	70.4	150.9	146.9	0	0	0	0	0	118.2
226	S	32.6	Very low	33.9	Very low	95 Å²	95	146.1 Å²	146.1	66%	0.664	80%	0.797	S	S	*	*			cis	-171.8	154.6	-18.3	51.2	0	0	0	0	111.7
227	L	33.9	Very low	33.9	Very low	169 Å²	169	146 Å²	146	89%	0.885	80%	0.802	S	S	*	*			trans	70.6	152.7	152.6	-71.8	161.9	0	0	0	121.3
228	S	31.8	Very low	33.7	Very low	104 Å²	104	150 Å²	150	73%	0.727	81%	0.81	S	S	*	*			trans	86.3	94.7	149.8	-129.1	0	0	0	0	121.8
229	S	30.5	Very low	33.4	Very low	104 Å²	104	149.3 Å²	149.3	73%	0.727	82%	0.817	S	S	*	*				50.2	117.3	123.7	67	0	0	0	0	121.6
230	R	33.5	Very low	33.1	Very low	250 Å²	250	149.4 Å²	149.4	94%	0.943	81%	0.814	S	S	*	*				-157.5	140.4	124.3	-130.4	170.8	177.3	165.4	-1.8	112.7
231	E	30.1	Very low	32.9	Very low	176 Å²	176	150.8 Å²	150.8	82%	0.822	81%	0.813	S	S	*	*			trans	-88	154.5	168.8	-64.8	174.7	92.7	0	0	111.2
232	S	34.9	Very low	32.7	Very low	124 Å²	124	153.4 Å²	153.4	87%	0.867	81%	0.814	S	S	*	*			trans	-151.6	120.9	155.2	57.1	0	0	0	0	111.1
233	R	27.4	Very low	32.6	Very low	229 Å²	229	148.7 Å²	148.7	86%	0.864	81%	0.805	S	S	*	*			trans	-105	124.6	173.9	-77.9	177.5	168.4	179.8	-3.3	111.1
234	C	32.6	Very low	32.4	Very low	128 Å²	128	148.8 Å²	148.8	87%	0.865	81%	0.806	S	S	*	*			trans	-139.3	119.5	149	-79.1	0	0	0	0	106.8
235	K	33.1	Very low	32.1	Very low	189 Å²	189	152.9 Å²	152.9	82%	0.822	81%	0.81	S	S	*	*				76	87.7	63.1	-80.5	-165.4	169.2	-174.3	0	114.7
236	T	29.4	Very low	32.1	Very low	134 Å²	134	155.8 Å²	155.8	82%	0.822	81%	0.812	S	S	*	*				50.5	120	126.1	55.7	0	0	0	0	120.7
237	S	35.1	Very low	32.2	Very low	125 Å²	125	157.3 Å²	157.3	87%	0.874	82%	0.817	S	S	*	*			trans	-140.7	149.4	133.7	57.5	0	0	0	0	110.5
238	H	30	Very low	32	Very low	178 Å²	178	157.2 Å²	157.2	82%	0.824	81%	0.812	S	S	*	*			trans	-98	150.2	170	-104	-28.1	0	0	0	108.9
239	C	31.6	Very low	32.2	Very low	136 Å²	136	158.6 Å²	158.6	92%	0.919	81%	0.811	S	S	*	*			trans	-142.3	153.5	146.4	-110.8	0	0	0	0	109.1
240	Q	34.1	Very low	32.4	Very low	171 Å²	171	162.4 Å²	162.4	80%	0.799	82%	0.817	S	S	*	*			trans	-110.6	155.7	-165.6	-65.4	174.7	-38.4	0	0	112.9
241	S	30	Very low	32.4	Very low	93 Å²	93	155.7 Å²	155.7	65%	0.65	81%	0.808	S	S	*	*			trans	29	123.8	148.1	63.6	0	0	0	0	120
242	Q	36.2	Very low	32.8	Very low	183 Å²	183	153.9 Å²	153.9	86%	0.855	80%	0.803	S	S	*	*				177.5	173.7	101.5	-90.5	169.1	50	0	0	109.5
243	N	31.8	Very low	33	Very low	124 Å²	124	155.9 Å²	155.9	66%	0.663	80%	0.796	S	S	*	*			cis	-179.2	141.5	-48.3	-167.2	-1.3	0	0	0	106.2
244	R	32.5	Very low	33.5	Very low	211 Å²	211	150.3 Å²	150.3	80%	0.796	78%	0.783	S	S	*	*			trans	67.8	128	174.4	-66.9	170	-175.6	-163.3	-1.9	115.1
245	K	30.7	Very low	33.9	Very low	192 Å²	192	150.7 Å²	150.7	84%	0.835	78%	0.777	S	S	*	*				79.1	125.1	57.6	-81.1	-166.7	172.1	-167.6	0	113.2
246	L	33.2	Very low	34.4	Very low	156 Å²	156	146.7 Å²	146.7	82%	0.817	77%	0.768	S	S	*	*				164.2	157.5	129.8	-106.4	81.4	0	0	0	107.1
247	T	34.6	Very low	35	Very low	127 Å²	127	146.4 Å²	146.4	78%	0.779	76%	0.762	S	S	*	*			cis	-160.3	160.7	-47.4	12	0	0	0	0	106.5
248	Q	29.7	Very low	35.5	Very low	168 Å²	168	146.3 Å²	146.3	79%	0.785	75%	0.751	S	S	*	*			trans	-111	151.6	171.6	-138.9	-175.8	2	0	0	111.4
249	N	34.9	Very low	36.4	Very low	132 Å²	132	145.4 Å²	145.4	71%	0.706	75%	0.753	S	S	*	*			trans	82.2	114.2	163.8	-55.3	-20.2	0	0	0	118.9
250	H	34.7	Very low	37.1	Very low	185 Å²	185	146.1 Å²	146.1	86%	0.856	75%	0.748	S	S	*	*			trans	-33.4	162	150	-55.8	-75.8	0	0	0	114
251	S	34.1	Very low	37.8	Very low	108 Å²	108	146 Å²	146	76%	0.755	75%	0.752	S	S	*	*			cis	-171.3	-177	49.6	-165.8	0	0	0	0	113.7
252	I	39	Very low	38.6	Very low	139 Å²	139	149 Å²	149	71%	0.713	76%	0.761	S	S	*	*			trans	86.1	98.6	163.6	-58.1	177.5	0	0	0	116.4
253	K	37.6	Very low	39	Very low	166 Å²	166	147.6 Å²	147.6	72%	0.722	76%	0.759	S	S	*	*			trans	63.4	157.5	133.2	-64.9	-173.2	138.5	-70.5	0	119.7
254	D	38.4	Very low	39.7	Very low	111 Å²	111	148.6 Å²	148.6	59%	0.594	77%	0.765	S	S	*	*			cis	-129.1	175.9	-34.4	-72.4	-47.1	0	0	0	103.3
255	D	41.2	Very low	40	Very low	137 Å²	137	143.3 Å²	143.3	73%	0.733	76%	0.76	S	S	*	*			cis	-173.3	163.1	40.3	-126.8	-33.2	0	0	0	110.2
256	T	43.7	Very low	40.5	Very low	104 Å²	104	139.7 Å²	139.7	64%	0.638	75%	0.75	S	S	*	*			trans	47.7	121.7	153.8	58	0	0	0	0	123.9
257	N	41.7	Very low	40.7	Very low	128 Å²	128	140.4 Å²	140.4	68%	0.684	75%	0.747	S	S	*	*				73.2	148.1	128.1	-60.7	42.3	0	0	0	120
258	D	46	Very low	40.8	Very low	123 Å²	123	143.7 Å²	143.7	66%	0.658	75%	0.75	S	S	*	*			cis	-161.4	-169.9	-12.5	-100.4	-13.2	0	0	0	108.3
259	D	48.6	Very low	41	Very low	159 Å²	159	145.7 Å²	145.7	85%	0.85	76%	0.756	S	S	*	*			trans	81.9	97.9	167	-57.8	-25.7	0	0	0	117.2
260	D	46.8	Very low	41	Very low	152 Å²	152	147.6 Å²	147.6	81%	0.813	76%	0.761	S	S	*	*			trans	-73.1	165.8	165.7	-48.2	-89.2	0	0	0	112.6
261	D	48.1	Very low	40.8	Very low	168 Å²	168	146.6 Å²	146.6	90%	0.898	76%	0.762	S	S	*	*			trans	-162.8	146	141.6	-113.2	-24.1	0	0	0	111.3
262	D	48	Very low	40.7	Very low	156 Å²	156	148.1 Å²	148.1	83%	0.834	77%	0.767	S	S	*	*			trans	-90.5	-177.2	-157.7	-83	-53.7	0	0	0	117.9
263	D	43.9	Very low	40.2	Very low	153 Å²	153	146.7 Å²	146.7	82%	0.818	77%	0.768	S	S	*	*			trans	97.9	96.3	168.3	-81.3	-13.5	0	0	0	116.5
264	D	45.6	Very low	39.9	Very low	146 Å²	146	144.2 Å²	144.2	78%	0.781	77%	0.767	S	S	*	*			cis	87.2	161.9	47.6	-162.2	33.2	0	0	0	114.5
265	S	39.7	Very low	39.5	Very low	100 Å²	100	146.7 Å²	146.7	70%	0.699	78%	0.78	S	S	*	*			trans	85	79.2	177.8	74.9	0	0	0	0	118.8
266	D	41.2	Very low	39.2	Very low	116 Å²	116	145.9 Å²	145.9	62%	0.62	78%	0.78	S	S	*	*				91	109.3	117.3	-94.3	8	0	0	0	124.4
267	K	37.6	Very low	38.9	Very low	171 Å²	171	148.4 Å²	148.4	74%	0.743	79%	0.789	S	S	*	*				62.3	94.8	125.7	-64.7	176.1	-177.5	81.9	0	119.3
268	K	36.4	Very low	38.9	Very low	195 Å²	195	147.7 Å²	147.7	85%	0.848	79%	0.791	S	S	*	*				-150	125.9	121.7	-110.6	174.3	-173.3	-178.6	0	111.5
269	K	34.1	Very low	38.8	Very low	211 Å²	211	147.1 Å²	147.1	92%	0.917	79%	0.788	S	S	*	*			trans	-94.1	122.1	169.2	-78	-176.7	174.3	-179.9	0	108.9
270	E	35.2	Very low	39	Very low	171 Å²	171	142.4 Å²	142.4	80%	0.799	77%	0.765	S	S	*	*			trans	-124.8	153.1	164.2	-72.1	-169.5	158.6	0	0	110.2	T272	E270-T272 PolarHBondContact O-N 3.4Å
271	N	30.2	Very low	39.5	Very low	164 Å²	164	135.3 Å²	135.3	88%	0.877	73%	0.727	S	S	*	*			trans	-79.4	109.3	-166.4	-69.5	-32.4	0	0	0	112.6	C273	N271-C273 PolarHBondContact O-N 3.4Å
272	T	32.6	Very low	40.1	Very low	140 Å²	140	132 Å²	132	86%	0.859	71%	0.706	S	S	*	*			trans	-73.6	76.2	163.4	33.8	0	0	0	0	111.1	E270	E270-T272 PolarHBondContact O-N 3.4Å
273	C	28.3	Very low	41	Very low	110 Å²	110	129.2 Å²	129.2	74%	0.743	69%	0.691	S	S	*	*			trans	-61.4	136	166.6	-169.5	0	0	0	0	109.7	N271 N275	N271-C273 PolarHBondContact O-N 3.4Å; C273-N275 PolarHBondContact O-N 2.96Å
274	T	31	Very low	42.1	Very low	114 Å²	114	123.7 Å²	123.7	70%	0.699	66%	0.661	S	S	*	*			trans	-72	114.3	-169.9	50.2	0	0	0	0	112.4	T276	T274-T276 VanDerWaalsContact C-N 3.29Å; T274-T276 PolarHBondContact O-N 2.73Å
275	N	29.4	Very low	43.4	Very low	163 Å²	163	120.3 Å²	120.3	87%	0.872	65%	0.647	S	S	*	*			trans	-72.6	77	171.7	-79.6	-27.8	0	0	0	111.6	C273	C273-N275 PolarHBondContact O-N 2.96Å
276	T	35.4	Very low	45.2	Very low	120 Å²	120	118.4 Å²	118.4	74%	0.736	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-72	122.6	165.1	51.3	0	0	0	0	109.7	T274	T274-T276 VanDerWaalsContact C-N 3.29Å; T274-T276 PolarHBondContact O-N 2.73Å
277	L	36.6	Very low	46.9	Very low	156 Å²	156	117.3 Å²	117.3	82%	0.817	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-62.4	147.3	174.3	-76	92.5	0	0	0	111
278	P	42.6	Very low	48.7	Very low	113 Å²	113	111.9 Å²	111.9	73%	0.734	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-67.4	139.1	174.7	29.1	-34.8	0	0	0	111	T280	P278-T280 PolarHBondContact O-N 3.38Å
279	L	43.9	Very low	50.7	Low	111 Å²	111	102.7 Å²	102.7	58%	0.581	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-65.2	134.1	175.6	-77.3	84.6	0	0	0	111.2	D283	L279-D283 HydrophobicContact CB-CB 4.38Å; L279-D283 HydrophobicContact CD2-CB 4.25Å; L279-D283 HydrophobicContact CG-CB 4.25Å
280	T	53	Low	53.2	Low	60 Å²	60	95.8 Å²	95.8	37%	0.368	54%	0.543	S	S	.	.			trans	-98.4	178.1	168.8	73.8	0	0	0	0	110.2	P278 H282 D283	P278-T280 PolarHBondContact O-N 3.38Å; T280-H282 PolarHBondContact O-N 2.71Å; T280-H282 WeakPolarHBondContact OG1-CB 3.33Å; T280-H282 PolarHBondContact OG1-N 2.91Å; T280-H282 VanDerWaalsContact OG1-N 3.09Å; T280-D283 WeakPolarHBondContact CA-OD2 3.43Å; T280-D283 WeakPolarHBondContact CB-OD2 3.35Å; T280-D283 PolarHBondContact N-OD2 2.97Å; T280-D283 PolarHBondContact O-N 3.06Å; T280-D283 PolarHBondContact OG1-OD2 3.49Å
281	C	56	Low	55.4	Low	4 Å²	4	90.3 Å²	90.3	3%	0.027	52%	0.519	C	S	.	.	G	3₁₀ helix	trans	-66.8	-21.7	169	77.6	0	0	0	0	113.7	W173 D283 L284 L289 N311	W173-C281 HydrophobicContact CH2-CB 3.17Å; W173-C281 WeakPolarHBondContact CH2-SG 3.31Å; W173-C281 HydrophobicContact CZ2-CB 3.91Å; W173-C281 VanDerWaalsContact CZ2-SG 3.55Å; W173-C281 HydrophobicContact CZ3-CB 3.78Å; C281-D283 PolarHBondContact O-N 3.43Å; C281-L284 PolarHBondContact O-N 3.41Å; C281-L284 VanDerWaalsContact O-O 3.14Å; C281-L289 HydrophobicContact CB-CD1 3.87Å; C281-L289 HydrophobicContact CB-CD2 3.74Å; C281-L289 HydrophobicContact CB-CG 4.46Å; C281-N311 PolarHBondContact SG-O 2.89Å; C281-N311 VanDerWaalsContact SG-O 3.36Å
282	H	62.4	Low	57.9	Low	98 Å²	98	83 Å²	83	45%	0.454	48%	0.48	S	S	.	.	G	3₁₀ helix	trans	-70	-18	-178.4	-55.6	-40.9	0	0	0	110.9	T280	T280-H282 PolarHBondContact O-N 2.71Å; T280-H282 WeakPolarHBondContact OG1-CB 3.33Å; T280-H282 PolarHBondContact OG1-N 2.91Å; T280-H282 VanDerWaalsContact OG1-N 3.09Å
283	D	65.6	Low	60.6	Low	97 Å²	97	76.3 Å²	76.3	52%	0.519	44%	0.439	S	S	.	.	G	3₁₀ helix	trans	-92	-12	171.8	-45	-70.7	0	0	0	112.8	L279 T280 C281	L279-D283 HydrophobicContact CB-CB 4.38Å; L279-D283 HydrophobicContact CD2-CB 4.25Å; L279-D283 HydrophobicContact CG-CB 4.25Å; T280-D283 WeakPolarHBondContact CA-OD2 3.43Å; T280-D283 WeakPolarHBondContact CB-OD2 3.35Å; T280-D283 PolarHBondContact N-OD2 2.97Å; T280-D283 PolarHBondContact O-N 3.06Å; T280-D283 PolarHBondContact OG1-OD2 3.49Å; C281-D283 PolarHBondContact O-N 3.43Å
284	L	67.6	Low	63.5	Low	37 Å²	37	71.7 Å²	71.7	19%	0.194	41%	0.408	C	S	.	.	S	Bend	trans	-91	132.6	177.4	-68.7	178.5	0	0	0	111.1	C281 V286 L289	C281-L284 PolarHBondContact O-N 3.41Å; C281-L284 VanDerWaalsContact O-O 3.14Å; L284-V286 PolarHBondContact O-N 3.18Å; L284-L289 HydrophobicContact CB-CD1 4.43Å; L284-L289 HydrophobicContact CB-CD2 4.09Å; L284-L289 HydrophobicContact CB-CG 4.13Å; L284-L289 HydrophobicContact CD1-CD2 3.89Å
285	P	73.5	Confident	66	Low	75 Å²	75	66.5 Å²	66.5	49%	0.487	38%	0.375	S	S	.	.			trans	-57.3	139.6	173.8	-24.7	33.7	0	0	0	112.1	T287 V288 L289	P285-T287 PolarHBondContact O-N 3.49Å; P285-T287 VanDerWaalsContact O-N 3.08Å; P285-V288 HydrophobicContact CB-CG2 4.18Å; P285-V288 HydrophobicContact CG-CG2 4.28Å; P285-V288 WeakPolarHBondContact O-CA 3.45Å; P285-V288 WeakPolarHBondContact O-CB 3.22Å; P285-V288 PolarHBondContact O-N 3.07Å; P285-L289 PolarHBondContact O-N 2.91Å
286	V	77.1	Confident	68.7	Low	60 Å²	60	58.7 Å²	58.7	36%	0.364	33%	0.334	S	S	.	.	H	α-helix	trans	-52.5	-36	179.6	174.8	0	0	0	0	112.4	L284 V288 L289 I290 P313 C314	L284-V286 PolarHBondContact O-N 3.18Å; V286-V288 VanDerWaalsContact C-N 3.31Å; V286-V288 PolarHBondContact O-N 3.4Å; V286-L289 PolarHBondContact O-N 2.83Å; V286-I290 HydrophobicContact CG1-CD1 3.9Å; V286-I290 HydrophobicContact CG1-CG1 4.38Å; V286-I290 WeakPolarHBondContact O-CG1 3.3Å; V286-I290 PolarHBondContact O-N 2.9Å; V286-P313 HydrophobicContact CG2-CG 4.47Å; V286-C314 WeakPolarHBondContact CG1-SG 3.47Å; V286-C314 VanDerWaalsContact CG2-SG 3.57Å
287	T	76.8	Confident	71.2	Confident	93 Å²	93	53.1 Å²	53.1	57%	0.571	30%	0.299	S	S	*	.	H	α-helix	trans	-62.4	-34.4	175.2	49.6	0	0	0	0	113.1	P285 N291	P285-T287 PolarHBondContact O-N 3.49Å; P285-T287 VanDerWaalsContact O-N 3.08Å; T287-N291 PolarHBondContact O-N 3.15Å; T287-N291 PolarHBondContact O-ND2 2.89Å
288	V	75	Confident	73.5	Confident	57 Å²	57	46.4 Å²	46.4	35%	0.345	26%	0.264	S	S	.	.	H	α-helix	trans	-70.8	-41.6	174.2	179.9	0	0	0	0	110.1	P285 V286 N291 L292	P285-V288 HydrophobicContact CB-CG2 4.18Å; P285-V288 HydrophobicContact CG-CG2 4.28Å; P285-V288 WeakPolarHBondContact O-CA 3.45Å; P285-V288 WeakPolarHBondContact O-CB 3.22Å; P285-V288 PolarHBondContact O-N 3.07Å; V286-V288 VanDerWaalsContact C-N 3.31Å; V286-V288 PolarHBondContact O-N 3.4Å; V288-N291 PolarHBondContact O-N 2.92Å; V288-L292 HydrophobicContact CG1-CD1 3.85Å; V288-L292 HydrophobicContact CG1-CG 4.29Å; V288-L292 WeakPolarHBondContact O-CB 3.4Å; V288-L292 VanDerWaalsContact O-CG 3.31Å; V288-L292 WeakPolarHBondContact O-CG 3.37Å; V288-L292 PolarHBondContact O-N 3.43Å
289	L	79.6	Confident	75.4	Confident	3 Å²	3	43.8 Å²	43.8	2%	0.016	24%	0.242	C	C	.	.	H	α-helix	trans	-67.3	-37.4	178.9	-63.2	170.6	0	0	0	113.1	C281 L284 P285 V286 L292 L293 L308 W312 P313	C281-L289 HydrophobicContact CB-CD1 3.87Å; C281-L289 HydrophobicContact CB-CD2 3.74Å; C281-L289 HydrophobicContact CB-CG 4.46Å; L284-L289 HydrophobicContact CB-CD1 4.43Å; L284-L289 HydrophobicContact CB-CD2 4.09Å; L284-L289 HydrophobicContact CB-CG 4.13Å; L284-L289 HydrophobicContact CD1-CD2 3.89Å; P285-L289 PolarHBondContact O-N 2.91Å; V286-L289 PolarHBondContact O-N 2.83Å; L289-L292 PolarHBondContact O-N 3.15Å; L289-L293 WeakPolarHBondContact O-CB 3.46Å; L289-L293 PolarHBondContact O-N 2.81Å; L289-L308 HydrophobicContact CD2-CD2 3.86Å; L289-W312 HydrophobicContact CB-CH2 4.28Å; L289-W312 HydrophobicContact CB-CZ3 4.12Å; L289-P313 HydrophobicContact CD1-CG 3.57Å
290	I	84.8	Confident	77.4	Confident	65 Å²	65	41 Å²	41	33%	0.333	22%	0.224	S	C	.	.	H	α-helix	trans	-59.5	-50.3	170.5	-71.7	167.6	0	0	0	110.2	V286 L292 L293 S294 W312 L322	V286-I290 HydrophobicContact CG1-CD1 3.9Å; V286-I290 HydrophobicContact CG1-CG1 4.38Å; V286-I290 WeakPolarHBondContact O-CG1 3.3Å; V286-I290 PolarHBondContact O-N 2.9Å; I290-L292 PolarHBondContact O-N 2.78Å; I290-L293 PolarHBondContact O-N 3.13Å; I290-S294 PolarHBondContact O-N 3.15Å; I290-S294 PolarHBondContact O-OG 3.14Å; I290-W312 HydrophobicContact CG1-CH2 3.99Å; I290-W312 HydrophobicContact CG1-CZ2 4.06Å; I290-L322 HydrophobicContact CG2-CD2 4.03Å
291	N	81.8	Confident	78.9	Confident	57 Å²	57	39 Å²	39	31%	0.305	21%	0.212	S	C	.	.	H	α-helix	trans	-63.9	-38.9	179.2	-75.5	-49.2	0	0	0	112.9	Y112 T287 V288 S294 E295	Y112-N291 HydrophobicContact CD1-CB 4.37Å; Y112-N291 HydrophobicContact CE1-CB 3.81Å; Y112-N291 WeakPolarHBondContact CE1-OD1 3.5Å; Y112-N291 HydrophobicContact CE2-CB 4.25Å; T287-N291 PolarHBondContact O-N 3.15Å; T287-N291 PolarHBondContact O-ND2 2.89Å; V288-N291 PolarHBondContact O-N 2.92Å; N291-S294 PolarHBondContact O-N 2.93Å; N291-E295 PolarHBondContact O-N 3.29Å
292	L	83.6	Confident	80.3	Confident	9 Å²	9	39.5 Å²	39.5	5%	0.047	21%	0.214	C	C	.	.	H	α-helix	trans	-65.8	-38.1	174.8	-73	169.9	0	0	0	112	A162 C165 I170 V288 L289 I290 A296 L308	A162-L292 HydrophobicContact CB-CD2 4.02Å; C165-L292 HydrophobicContact CB-CD1 4.26Å; C165-L292 HydrophobicContact CB-CD2 3.71Å; I170-L292 HydrophobicContact CD1-CB 4.29Å; I170-L292 HydrophobicContact CD1-CD1 4.18Å; V288-L292 HydrophobicContact CG1-CD1 3.85Å; V288-L292 HydrophobicContact CG1-CG 4.29Å; V288-L292 WeakPolarHBondContact O-CB 3.4Å; V288-L292 VanDerWaalsContact O-CG 3.31Å; V288-L292 WeakPolarHBondContact O-CG 3.37Å; V288-L292 PolarHBondContact O-N 3.43Å; L289-L292 PolarHBondContact O-N 3.15Å; I290-L292 PolarHBondContact O-N 2.78Å; L292-A296 VanDerWaalsContact O-CB 3.3Å; L292-A296 WeakPolarHBondContact O-CB 3.42Å; L292-A296 PolarHBondContact O-N 3.26Å; L292-L308 HydrophobicContact CB-CD1 4.3Å
293	L	88.8	Confident	81.2	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-69.5	-40.6	175.3	-172.9	54.9	0	0	0	111.7	L289 I290 A296 I297 I305 L308 I309 W312 L317 L322 F363	L289-L293 WeakPolarHBondContact O-CB 3.46Å; L289-L293 PolarHBondContact O-N 2.81Å; I290-L293 PolarHBondContact O-N 3.13Å; L293-A296 PolarHBondContact O-N 3.49Å; L293-I297 HydrophobicContact CG-CD1 4.34Å; L293-I297 WeakPolarHBondContact O-CD1 3.26Å; L293-I297 VanDerWaalsContact O-CG1 3.25Å; L293-I297 WeakPolarHBondContact O-CG1 3.39Å; L293-I297 PolarHBondContact O-N 2.87Å; L293-I305 HydrophobicContact CD1-CB 4.38Å; L293-I305 HydrophobicContact CD1-CG1 4.11Å; L293-I305 HydrophobicContact CD1-CG2 4.26Å; L293-L308 HydrophobicContact CB-CD1 3.93Å; L293-L308 HydrophobicContact CD1-CB 4.26Å; L293-L308 HydrophobicContact CD1-CD1 3.98Å; L293-I309 HydrophobicContact CD2-CD1 3.89Å; L293-W312 HydrophobicContact CB-CH2 4.42Å; L293-W312 HydrophobicContact CB-CZ3 4.21Å; L293-W312 HydrophobicContact CD2-CE3 4.24Å; L293-W312 HydrophobicContact CD2-CH2 3.83Å; L293-W312 HydrophobicContact CD2-CZ3 3.63Å; L293-L317 HydrophobicContact CD2-CD1 4.33Å; L293-L317 HydrophobicContact CD2-CD2 4.04Å; L293-L322 HydrophobicContact CD2-CD1 3.53Å; L293-L322 HydrophobicContact CG-CD1 3.98Å; L293-F363 HydrophobicContact CD1-CE1 4.36Å
294	S	88.4	Confident	82.1	Confident	14 Å²	14	31.7 Å²	31.7	10%	0.098	18%	0.18	C	C	.	.	H	α-helix	trans	-60.3	-43.4	172.4	-71.7	0	0	0	0	112.8	I290 N291 I297 L298 L322	I290-S294 PolarHBondContact O-N 3.15Å; I290-S294 PolarHBondContact O-OG 3.14Å; N291-S294 PolarHBondContact O-N 2.93Å; S294-I297 PolarHBondContact O-N 3.2Å; S294-L298 WeakPolarHBondContact O-CB 3.31Å; S294-L298 PolarHBondContact O-N 2.89Å; S294-L322 VanDerWaalsContact CB-O 3.29Å; S294-L322 WeakPolarHBondContact CB-O 3.34Å; S294-L322 PolarHBondContact OG-O 3.29Å
295	E	83.4	Confident	83.1	Confident	4 Å²	4	29.9 Å²	29.9	2%	0.019	17%	0.171	C	C	.	.	H	α-helix	trans	-70.5	-36.1	174.7	-174.5	67.3	-136.9	0	0	111.5	R159 A162 M166 N291 I297 L298 Q299	R159-E295 IonicContact CZ-OE1 3.6Å; R159-E295 IonicContact NE-OE1 2.65Å; R159-E295 IonicContact NH1-OE1 2.73Å; R159-E295 PolarHBondContact NH1-OE1 3.45Å; R159-E295 IonicContact NH1-OE2 3.6Å; R159-E295 IonicContact NH2-OE1 3.64Å; R159-E295 PolarHBondContact NH2-OE1 3.01Å; A162-E295 HydrophobicContact CB-CB 4.36Å; A162-E295 HydrophobicContact CB-CG 3.89Å; M166-E295 HydrophobicContact CE-CG 3.95Å; N291-E295 PolarHBondContact O-N 3.29Å; E295-I297 VanDerWaalsContact C-N 3.32Å; E295-I297 PolarHBondContact O-N 3.24Å; E295-L298 CarbonylContact O-C 3.6Å; E295-L298 WeakPolarHBondContact O-CB 3.46Å; E295-L298 PolarHBondContact O-N 3.32Å; E295-L298 VanDerWaalsContact O-N 3.15Å; E295-Q299 HydrophobicContact CG-CG 4.31Å; E295-Q299 WeakPolarHBondContact O-CB 3.41Å; E295-Q299 VanDerWaalsContact O-CG 3.32Å; E295-Q299 WeakPolarHBondContact O-CG 3.27Å; E295-Q299 PolarHBondContact O-N 3.2Å; E295-Q299 WeakPolarHBondContact OE1-CG 3.32Å; E295-Q299 PolarHBondContact OE1-NE2 3.48Å
296	A	86.5	Confident	83.9	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-61.5	-39.3	173.3	0	0	0	0	0	112.2	M166 L292 L293 R300 D301 A304 I305	M166-A296 HydrophobicContact SD-CB 3.75Å; L292-A296 VanDerWaalsContact O-CB 3.3Å; L292-A296 WeakPolarHBondContact O-CB 3.42Å; L292-A296 PolarHBondContact O-N 3.26Å; L293-A296 PolarHBondContact O-N 3.49Å; A296-R300 WeakPolarHBondContact O-CA 3.35Å; A296-R300 PolarHBondContact O-N 3.49Å; A296-D301 PolarHBondContact O-N 3.48Å; A296-A304 HydrophobicContact CB-CB 3.9Å; A296-I305 HydrophobicContact CB-CG1 3.87Å
297	I	88.9	Confident	84.2	Confident	2 Å²	2	23.6 Å²	23.6	1%	0.01	13%	0.131	C	C	.	.	H	α-helix	trans	-62.4	-48.5	170.1	-67	159.9	0	0	0	110.5	L293 S294 E295 Q299 R300 I305 L322 L359 F363	L293-I297 HydrophobicContact CG-CD1 4.34Å; L293-I297 WeakPolarHBondContact O-CD1 3.26Å; L293-I297 VanDerWaalsContact O-CG1 3.25Å; L293-I297 WeakPolarHBondContact O-CG1 3.39Å; L293-I297 PolarHBondContact O-N 2.87Å; S294-I297 PolarHBondContact O-N 3.2Å; E295-I297 VanDerWaalsContact C-N 3.32Å; E295-I297 PolarHBondContact O-N 3.24Å; I297-Q299 VanDerWaalsContact C-N 3.25Å; I297-Q299 PolarHBondContact O-N 2.85Å; I297-R300 PolarHBondContact O-N 3.18Å; I297-I305 HydrophobicContact CG1-CD1 4.14Å; I297-L322 HydrophobicContact CD1-CB 3.67Å; I297-L322 HydrophobicContact CD1-CD1 4.15Å; I297-L359 HydrophobicContact CG2-CD1 4.21Å; I297-L359 HydrophobicContact CG2-CD2 4.38Å; I297-F363 HydrophobicContact CD1-CZ 4.02Å; I297-F363 HydrophobicContact CG1-CZ 4.06Å
298	L	85.2	Confident	84.8	Confident	16 Å²	16	19.3 Å²	19.3	8%	0.084	11%	0.105	C	C	.	.	H	α-helix	trans	-60.9	-31.5	179.7	-166.2	70.1	0	0	0	113.3	S294 E295 P324 E327	S294-L298 WeakPolarHBondContact O-CB 3.31Å; S294-L298 PolarHBondContact O-N 2.89Å; E295-L298 CarbonylContact O-C 3.6Å; E295-L298 WeakPolarHBondContact O-CB 3.46Å; E295-L298 PolarHBondContact O-N 3.32Å; E295-L298 VanDerWaalsContact O-N 3.15Å; L298-P324 HydrophobicContact CB-CG 4.23Å; L298-P324 HydrophobicContact CD1-CB 4.09Å; L298-P324 HydrophobicContact CD1-CG 4Å; L298-P324 HydrophobicContact CG-CG 4.5Å; L298-E327 HydrophobicContact CD1-CG 3.92Å
299	Q	81.6	Confident	85.6	Confident	58 Å²	58	16.7 Å²	16.7	27%	0.271	9%	0.089	S	C	.	.	H	α-helix	trans	-89.4	-8.9	175.8	-65.4	-166.2	16.8	0	0	113.5	E163 E295 I297 D301	E163-Q299 PolarHBondContact OE1-NE2 2.86Å; E295-Q299 HydrophobicContact CG-CG 4.31Å; E295-Q299 WeakPolarHBondContact O-CB 3.41Å; E295-Q299 VanDerWaalsContact O-CG 3.32Å; E295-Q299 WeakPolarHBondContact O-CG 3.27Å; E295-Q299 PolarHBondContact O-N 3.2Å; E295-Q299 WeakPolarHBondContact OE1-CG 3.32Å; E295-Q299 PolarHBondContact OE1-NE2 3.48Å; I297-Q299 VanDerWaalsContact C-N 3.25Å; I297-Q299 PolarHBondContact O-N 2.85Å; Q299-D301 HydrophobicContact CB-CB 4.49Å; Q299-D301 PolarHBondContact O-N 3.16Å
300	R	85.8	Confident	86.1	Confident	51 Å²	51	16.6 Å²	16.6	19%	0.192	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.6	35.8	-167.8	-61	-172.6	165	-108.2	-12.7	112.8	A296 I297 C302 Y334 K337 L359	A296-R300 WeakPolarHBondContact O-CA 3.35Å; A296-R300 PolarHBondContact O-N 3.49Å; I297-R300 PolarHBondContact O-N 3.18Å; R300-C302 VanDerWaalsContact C-N 3.32Å; R300-C302 PolarHBondContact O-N 3.23Å; R300-Y334 PolarHBondContact NH1-O 2.99Å; R300-Y334 PolarHBondContact NH2-O 2.62Å; R300-K337 PolarHBondContact NH1-O 3.18Å; R300-L359 HydrophobicContact CB-CD2 4.27Å; R300-L359 HydrophobicContact CG-CD1 4.49Å; R300-L359 HydrophobicContact CG-CD2 4.02Å; R300-L359 HydrophobicContact CG-CG 4.25Å
301	D	84.1	Confident	86.2	Confident	20 Å²	20	13.8 Å²	13.8	11%	0.107	7%	0.074	C	C	.	.			trans	-79.5	81.2	174.6	-173.2	4.5	0	0	0	110.7	R171 A296 Q299 A303 A304 I305	R171-D301 IonicContact CZ-OD2 2.65Å; R171-D301 VanDerWaalsContact CZ-OD2 3.29Å; R171-D301 IonicContact NE-OD1 2.69Å; R171-D301 IonicContact NE-OD2 3.06Å; R171-D301 PolarHBondContact NE-OD2 3.1Å; R171-D301 VanDerWaalsContact NE-OD2 3.14Å; R171-D301 VanDerWaalsContact NH2-CG 3.32Å; R171-D301 IonicContact NH2-OD1 3.26Å; R171-D301 IonicContact NH2-OD2 2.86Å; R171-D301 PolarHBondContact NH2-OD2 3.19Å; A296-D301 PolarHBondContact O-N 3.48Å; Q299-D301 HydrophobicContact CB-CB 4.49Å; Q299-D301 PolarHBondContact O-N 3.16Å; D301-A303 PolarHBondContact O-N 2.81Å; D301-A303 VanDerWaalsContact O-N 3.09Å; D301-A303 WeakPolarHBondContact OD1-CB 3.37Å; D301-A303 PolarHBondContact OD1-N 3.18Å; D301-A303 VanDerWaalsContact OD1-N 3.15Å; D301-A304 HydrophobicContact CB-CB 4.08Å; D301-A304 PolarHBondContact O-N 2.73Å; D301-A304 VanDerWaalsContact O-N 3.1Å; D301-A304 PolarHBondContact OD1-N 3.05Å; D301-A304 WeakPolarHBondContact OD2-CB 3.46Å; D301-I305 WeakPolarHBondContact O-CG1 3.42Å; D301-I305 PolarHBondContact O-N 3.23Å
302	C	85.6	Confident	86.6	Confident	13 Å²	13	11.3 Å²	11.3	9%	0.088	6%	0.06	C	C	.	.	H	α-helix	trans	-54.6	-27.8	178	-54.4	0	0	0	0	112.9	R300 T306 P357 S358	R300-C302 VanDerWaalsContact C-N 3.32Å; R300-C302 PolarHBondContact O-N 3.23Å; C302-T306 WeakPolarHBondContact O-CB 3.45Å; C302-T306 PolarHBondContact O-N 2.95Å; C302-T306 PolarHBondContact O-OG1 2.89Å; C302-P357 HydrophobicContact CB-CB 4.23Å; C302-P357 HydrophobicContact CB-CG 3.92Å; C302-S358 PolarHBondContact SG-O 3.1Å
303	A	82.3	Confident	86.7	Confident	31 Å²	31	11.9 Å²	11.9	26%	0.256	7%	0.065	S	C	.	.	H	α-helix	trans	-72.5	-43.2	177.8	0	0	0	0	0	111.9	L177 D301 T306 G307	L177-A303 HydrophobicContact CD1-CB 3.89Å; L177-A303 WeakPolarHBondContact CD1-O 3.3Å; D301-A303 PolarHBondContact O-N 2.81Å; D301-A303 VanDerWaalsContact O-N 3.09Å; D301-A303 WeakPolarHBondContact OD1-CB 3.37Å; D301-A303 PolarHBondContact OD1-N 3.18Å; D301-A303 VanDerWaalsContact OD1-N 3.15Å; A303-T306 PolarHBondContact O-N 3.49Å; A303-G307 PolarHBondContact O-N 3.36Å
304	A	83.2	Confident	86.8	Confident	0 Å²	0	13.6 Å²	13.6	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-66.2	-37.5	173.7	0	0	0	0	0	112	M166 I170 A296 D301 G307 L308	M166-A304 HydrophobicContact CB-CB 4.23Å; M166-A304 HydrophobicContact CG-CB 3.89Å; M166-A304 HydrophobicContact SD-CB 3.82Å; I170-A304 HydrophobicContact CG2-CB 4.19Å; A296-A304 HydrophobicContact CB-CB 3.9Å; D301-A304 HydrophobicContact CB-CB 4.08Å; D301-A304 PolarHBondContact O-N 2.73Å; D301-A304 VanDerWaalsContact O-N 3.1Å; D301-A304 PolarHBondContact OD1-N 3.05Å; D301-A304 WeakPolarHBondContact OD2-CB 3.46Å; A304-G307 PolarHBondContact O-N 2.94Å; A304-L308 WeakPolarHBondContact O-CB 3.45Å; A304-L308 WeakPolarHBondContact O-CG 3.22Å; A304-L308 PolarHBondContact O-N 3.48Å
305	I	89.7	Confident	87.1	Confident	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-59.2	-52.5	172.1	-64.3	170	0	0	0	110.3	L293 A296 I297 D301 G307 L308 I309 L359 F363	L293-I305 HydrophobicContact CD1-CB 4.38Å; L293-I305 HydrophobicContact CD1-CG1 4.11Å; L293-I305 HydrophobicContact CD1-CG2 4.26Å; A296-I305 HydrophobicContact CB-CG1 3.87Å; I297-I305 HydrophobicContact CG1-CD1 4.14Å; D301-I305 WeakPolarHBondContact O-CG1 3.42Å; D301-I305 PolarHBondContact O-N 3.23Å; I305-G307 PolarHBondContact O-N 2.93Å; I305-L308 PolarHBondContact O-N 3.05Å; I305-I309 HydrophobicContact CG2-CG1 4.16Å; I305-I309 WeakPolarHBondContact O-CB 3.5Å; I305-I309 VanDerWaalsContact O-CG1 3.22Å; I305-I309 WeakPolarHBondContact O-CG1 3.4Å; I305-I309 PolarHBondContact O-N 2.91Å; I305-L359 HydrophobicContact CD1-CD2 3.51Å; I305-F363 HydrophobicContact CD1-CE2 4.36Å; I305-F363 HydrophobicContact CG2-CD1 3.84Å; I305-F363 HydrophobicContact CG2-CD2 3.96Å; I305-F363 HydrophobicContact CG2-CE1 3.74Å; I305-F363 HydrophobicContact CG2-CE2 3.87Å; I305-F363 HydrophobicContact CG2-CG 3.93Å; I305-F363 HydrophobicContact CG2-CZ 3.76Å
306	T	88.7	Confident	87.5	Confident	3 Å²	3	23.9 Å²	23.9	2%	0.018	12%	0.123	C	C	.	.	H	α-helix	trans	-54.2	-50.3	177.6	-64.6	0	0	0	0	111.6	L177 C302 A303 L308 I309 A310 G362 L365	L177-T306 HydrophobicContact CD1-CG2 4.11Å; L177-T306 HydrophobicContact CD2-CG2 4.25Å; L177-T306 HydrophobicContact CG-CG2 4.45Å; C302-T306 WeakPolarHBondContact O-CB 3.45Å; C302-T306 PolarHBondContact O-N 2.95Å; C302-T306 PolarHBondContact O-OG1 2.89Å; A303-T306 PolarHBondContact O-N 3.49Å; T306-L308 PolarHBondContact O-N 2.95Å; T306-I309 PolarHBondContact O-N 3.47Å; T306-A310 WeakPolarHBondContact O-CB 3.27Å; T306-A310 PolarHBondContact O-N 3.06Å; T306-G362 WeakPolarHBondContact CA-O 3.49Å; T306-G362 PolarHBondContact OG1-O 3.48Å; T306-G362 VanDerWaalsContact OG1-O 3.11Å; T306-L365 HydrophobicContact CG2-CB 3.98Å
307	G	85	Confident	87.9	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-62.6	-41.2	-178.9	0	0	0	0	0	114	A303 A304 I305 N311	A303-G307 PolarHBondContact O-N 3.36Å; A304-G307 PolarHBondContact O-N 2.94Å; I305-G307 PolarHBondContact O-N 2.93Å; G307-N311 PolarHBondContact O-ND2 2.68Å
308	L	88.9	Confident	88.2	Confident	3 Å²	3	26.8 Å²	26.8	2%	0.016	14%	0.138	C	C	.	.	H	α-helix	trans	-67	-44.1	176.5	-76.3	166.8	0	0	0	112.4	I170 L289 L292 L293 A304 I305 T306 N311 W312	I170-L308 HydrophobicContact CD1-CD1 3.89Å; I170-L308 HydrophobicContact CD1-CD2 3.81Å; I170-L308 HydrophobicContact CD1-CG 3.86Å; I170-L308 HydrophobicContact CG1-CD2 4.2Å; I170-L308 HydrophobicContact CG1-CG 4.35Å; I170-L308 HydrophobicContact CG2-CG 4.11Å; L289-L308 HydrophobicContact CD2-CD2 3.86Å; L292-L308 HydrophobicContact CB-CD1 4.3Å; L293-L308 HydrophobicContact CB-CD1 3.93Å; L293-L308 HydrophobicContact CD1-CB 4.26Å; L293-L308 HydrophobicContact CD1-CD1 3.98Å; A304-L308 WeakPolarHBondContact O-CB 3.45Å; A304-L308 WeakPolarHBondContact O-CG 3.22Å; A304-L308 PolarHBondContact O-N 3.48Å; I305-L308 PolarHBondContact O-N 3.05Å; T306-L308 PolarHBondContact O-N 2.95Å; L308-N311 CarbonylContact O-C 3.46Å; L308-N311 PolarHBondContact O-N 3.02Å; L308-W312 PolarHBondContact O-N 2.92Å; L308-W312 VanDerWaalsContact O-N 3.13Å
309	I	92.4	Very high	88.6	Confident	2 Å²	2	26 Å²	26	1%	0.01	13%	0.134	C	C	.	.	H	α-helix	trans	-71.9	-38.5	-178.4	-63.3	-67	0	0	0	111.5	L293 I305 T306 N311 W312 L317 F363 L367 C374 L376	L293-I309 HydrophobicContact CD2-CD1 3.89Å; I305-I309 HydrophobicContact CG2-CG1 4.16Å; I305-I309 WeakPolarHBondContact O-CB 3.5Å; I305-I309 VanDerWaalsContact O-CG1 3.22Å; I305-I309 WeakPolarHBondContact O-CG1 3.4Å; I305-I309 PolarHBondContact O-N 2.91Å; T306-I309 PolarHBondContact O-N 3.47Å; I309-N311 PolarHBondContact O-N 3.47Å; I309-W312 PolarHBondContact O-N 2.86Å; I309-L317 HydrophobicContact CD1-CD2 3.25Å; I309-F363 HydrophobicContact CD1-CD1 3.7Å; I309-F363 HydrophobicContact CD1-CE1 3.76Å; I309-F363 HydrophobicContact CG1-CD1 3.68Å; I309-F363 HydrophobicContact CG1-CE1 3.97Å; I309-L367 HydrophobicContact CG2-CD2 4.31Å; I309-L367 HydrophobicContact CG2-CG 4.12Å; I309-C374 PolarHBondContact O-SG 2.67Å; I309-C374 VanDerWaalsContact O-SG 3.34Å; I309-L376 HydrophobicContact CG2-CD2 4.41Å
310	A	89	Confident	89	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-18.8	174.4	0	0	0	0	0	113.4	T306 G366 T369 R370 Q371 C374	T306-A310 WeakPolarHBondContact O-CB 3.27Å; T306-A310 PolarHBondContact O-N 3.06Å; A310-G366 VanDerWaalsContact CA-O 3.3Å; A310-G366 WeakPolarHBondContact CA-O 3.46Å; A310-G366 PolarHBondContact N-O 3.13Å; A310-T369 WeakPolarHBondContact CB-O 3.48Å; A310-R370 WeakPolarHBondContact O-CA 3.07Å; A310-Q371 PolarHBondContact O-N 2.91Å; A310-C374 VanDerWaalsContact O-CB 3.31Å; A310-C374 WeakPolarHBondContact O-CB 3.43Å
311	N	87.4	Confident	89.3	Confident	6 Å²	6	31.8 Å²	31.8	3%	0.032	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.4	22.2	-173.9	-66.1	-85.3	0	0	0	113.4	W173 C281 G307 L308 I309 Q371	W173-N311 HydrophobicContact CH2-CB 3.21Å; W173-N311 HydrophobicContact CZ2-CB 3.1Å; W173-N311 VanDerWaalsContact CZ2-OD1 3.31Å; W173-N311 WeakPolarHBondContact CZ2-OD1 3.44Å; W173-N311 HydrophobicContact CZ3-CB 4.25Å; W173-N311 PolarHBondContact NE1-OD1 2.87Å; W173-N311 VanDerWaalsContact NE1-OD1 3.11Å; C281-N311 PolarHBondContact SG-O 2.89Å; C281-N311 VanDerWaalsContact SG-O 3.36Å; G307-N311 PolarHBondContact O-ND2 2.68Å; L308-N311 CarbonylContact O-C 3.46Å; L308-N311 PolarHBondContact O-N 3.02Å; I309-N311 PolarHBondContact O-N 3.47Å; N311-Q371 VanDerWaalsContact OD1-CB 3.25Å; N311-Q371 WeakPolarHBondContact OD1-CB 3.34Å; N311-Q371 WeakPolarHBondContact OD1-CG 3.44Å
312	W	90.2	Very high	89.6	Confident	5 Å²	5	31.3 Å²	31.3	2%	0.019	16%	0.159	C	C	.	.			trans	-65.2	124.4	-169.5	-165.6	-105.7	0	0	0	112.3	L289 I290 L293 L308 I309 C314 L317 C374 K375 L376	L289-W312 HydrophobicContact CB-CH2 4.28Å; L289-W312 HydrophobicContact CB-CZ3 4.12Å; I290-W312 HydrophobicContact CG1-CH2 3.99Å; I290-W312 HydrophobicContact CG1-CZ2 4.06Å; L293-W312 HydrophobicContact CB-CH2 4.42Å; L293-W312 HydrophobicContact CB-CZ3 4.21Å; L293-W312 HydrophobicContact CD2-CE3 4.24Å; L293-W312 HydrophobicContact CD2-CH2 3.83Å; L293-W312 HydrophobicContact CD2-CZ3 3.63Å; L308-W312 PolarHBondContact O-N 2.92Å; L308-W312 VanDerWaalsContact O-N 3.13Å; I309-W312 PolarHBondContact O-N 2.86Å; W312-C314 PolarHBondContact O-N 3.26Å; W312-L317 HydrophobicContact CD2-CD2 4.5Å; W312-L317 HydrophobicContact CH2-CD1 4.12Å; W312-L317 HydrophobicContact CZ2-CD1 3.4Å; W312-L317 VanDerWaalsContact CZ2-CD1 3.4Å; W312-C374 PolarHBondContact N-SG 2.81Å; W312-C374 VanDerWaalsContact N-SG 3.42Å; W312-K375 PolarHBondContact O-N 2.88Å; W312-L376 HydrophobicContact CB-CB 4.27Å; W312-L376 HydrophobicContact CB-CD2 4.24Å
313	P	86.4	Confident	89.8	Confident	21 Å²	21	31.1 Å²	31.1	14%	0.136	16%	0.157	C	C	.	.			trans	-86	-1.7	-169.2	34.5	-37.9	0	0	0	114.7	V286 L289 K375	V286-P313 HydrophobicContact CG2-CG 4.47Å; L289-P313 HydrophobicContact CD1-CG 3.57Å; P313-K375 WeakPolarHBondContact O-CD 3.48Å
314	C	90.2	Very high	89.7	Confident	36 Å²	36	30.8 Å²	30.8	24%	0.243	15%	0.152	C	C	.	.	S	Bend	trans	-112.5	156.4	-178.8	-60.7	0	0	0	0	111.8	V286 W312 Q316 K375 L376	V286-C314 WeakPolarHBondContact CG1-SG 3.47Å; V286-C314 VanDerWaalsContact CG2-SG 3.57Å; W312-C314 PolarHBondContact O-N 3.26Å; C314-Q316 VanDerWaalsContact C-N 3.35Å; C314-Q316 PolarHBondContact O-N 3.17Å; C314-K375 CarbonylContact O-C 3.59Å; C314-L376 VanDerWaalsContact O-CA 3.26Å; C314-L376 WeakPolarHBondContact O-CA 3.48Å; C314-L376 PolarHBondContact O-N 3.35Å
315	E	93.4	Very high	89.6	Confident	101 Å²	101	37.3 Å²	37.3	47%	0.472	19%	0.187	S	C	.	.	S	Bend	trans	-76.5	-19.7	-177.3	-57	-158.2	145.9	0	0	114.4	K375 K377 S378	E315-K375 WeakPolarHBondContact CA-O 3.03Å; E315-K377 HydrophobicContact CB-CD 4.48Å; E315-K377 HydrophobicContact CG-CD 4.37Å; E315-K377 WeakPolarHBondContact O-CA 3.08Å; E315-K377 PolarHBondContact O-N 3.01Å; E315-K377 WeakPolarHBondContact OE1-CE 3.28Å; E315-K377 IonicContact OE1-NZ 3.31Å; E315-K377 PolarHBondContact OE1-NZ 3.23Å; E315-S378 PolarHBondContact O-N 3.47Å
316	Q	93.8	Very high	89.1	Confident	134 Å²	134	41.8 Å²	41.8	63%	0.626	21%	0.208	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-129.9	150.8	-174.9	-60	-172.5	-11.3	0	0	111.3	C314 S378	C314-Q316 VanDerWaalsContact C-N 3.35Å; C314-Q316 PolarHBondContact O-N 3.17Å; Q316-S378 WeakPolarHBondContact CA-O 3.43Å
317	L	94.5	Very high	88.8	Confident	8 Å²	8	43.2 Å²	43.2	4%	0.042	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	122.2	173.7	-171	62.2	0	0	0	111.3	L293 I309 W312 I319 L322 L376 S378 V379 D380	L293-L317 HydrophobicContact CD2-CD1 4.33Å; L293-L317 HydrophobicContact CD2-CD2 4.04Å; I309-L317 HydrophobicContact CD1-CD2 3.25Å; W312-L317 HydrophobicContact CD2-CD2 4.5Å; W312-L317 HydrophobicContact CH2-CD1 4.12Å; W312-L317 HydrophobicContact CZ2-CD1 3.4Å; W312-L317 VanDerWaalsContact CZ2-CD1 3.4Å; L317-I319 HydrophobicContact CD2-CD1 3.82Å; L317-I319 HydrophobicContact CG-CD1 3.97Å; L317-L322 HydrophobicContact CD1-CD1 3.77Å; L317-L322 HydrophobicContact CD1-CD2 4.16Å; L317-L322 HydrophobicContact CD1-CG 4.37Å; L317-L322 HydrophobicContact CD2-CD1 4.37Å; L317-L322 HydrophobicContact CG-CD1 4.12Å; L317-L376 HydrophobicContact CB-CD1 3.72Å; L317-S378 PolarHBondContact N-O 2.91Å; L317-V379 HydrophobicContact CB-CG1 4.45Å; L317-V379 CarbonylContact O-C 3.43Å; L317-V379 WeakPolarHBondContact O-CA 3.34Å; L317-D380 PolarHBondContact O-N 2.84Å
318	I	94.2	Very high	88.7	Confident	54 Å²	54	47.7 Å²	47.7	28%	0.277	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	102	-179.1	-56.4	172.6	0	0	0	109	K320 Q321 D380	I318-K320 VanDerWaalsContact C-N 3.3Å; I318-K320 PolarHBondContact O-N 2.71Å; I318-Q321 HydrophobicContact CB-CB 4.39Å; I318-Q321 HydrophobicContact CB-CG 4.13Å; I318-Q321 HydrophobicContact CG2-CB 4.35Å; I318-Q321 HydrophobicContact CG2-CG 3.75Å; I318-Q321 PolarHBondContact O-N 3.44Å; I318-D380 HydrophobicContact CB-CB 4.39Å; I318-D380 HydrophobicContact CG1-CB 4.14Å; I318-D380 HydrophobicContact CG2-CB 4.23Å
319	I	94.1	Very high	88.5	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-61.5	-38.9	-167.6	-55.8	-57	0	0	0	111.8	L317 Q321 L322 M335 F363 V379 D380 F381 F384	L317-I319 HydrophobicContact CD2-CD1 3.82Å; L317-I319 HydrophobicContact CG-CD1 3.97Å; I319-Q321 PolarHBondContact O-N 3.34Å; I319-L322 HydrophobicContact CD1-CD1 4.13Å; I319-L322 WeakPolarHBondContact O-CB 3.4Å; I319-L322 PolarHBondContact O-N 2.91Å; I319-M335 HydrophobicContact CG2-CE 3.88Å; I319-M335 HydrophobicContact CG2-SD 4.32Å; I319-F363 HydrophobicContact CD1-CD1 3.83Å; I319-F363 HydrophobicContact CD1-CE1 3.51Å; I319-F363 HydrophobicContact CD1-CZ 4.1Å; I319-F363 HydrophobicContact CG2-CE2 4.43Å; I319-F363 HydrophobicContact CG2-CZ 4.22Å; I319-V379 HydrophobicContact CD1-CG1 3.97Å; I319-V379 HydrophobicContact CG1-CG1 4.09Å; I319-D380 WeakPolarHBondContact CB-O 3.34Å; I319-D380 WeakPolarHBondContact CG1-O 3.38Å; I319-D380 PolarHBondContact N-O 3.44Å; I319-F381 HydrophobicContact CB-CD1 4.43Å; I319-F381 HydrophobicContact CD1-CE1 4.42Å; I319-F381 HydrophobicContact CG1-CD1 3.8Å; I319-F381 HydrophobicContact CG1-CE1 3.8Å; I319-F381 HydrophobicContact CG1-CG 4.22Å; I319-F381 HydrophobicContact CG1-CZ 4.24Å; I319-F384 HydrophobicContact CB-CE2 4.4Å; I319-F384 HydrophobicContact CG2-CE2 4.27Å; I319-F384 HydrophobicContact CG2-CZ 4.05Å
320	K	90.8	Very high	88.2	Confident	81 Å²	81	55.2 Å²	55.2	35%	0.352	28%	0.279	S	S	.	.	H	α-helix	trans	-63.9	-25	179.4	-171.2	163.5	-179.8	168.9	0	113.8	I318 Y328 G383 F384	I318-K320 VanDerWaalsContact C-N 3.3Å; I318-K320 PolarHBondContact O-N 2.71Å; K320-Y328 PolarHBondContact O-OH 3.06Å; K320-G383 PolarHBondContact NZ-O 3.16Å; K320-F384 HydrophobicContact CB-CE2 4.31Å; K320-F384 HydrophobicContact CB-CZ 4.47Å
321	Q	90.6	Very high	88	Confident	149 Å²	149	57.4 Å²	57.4	70%	0.696	30%	0.295	S	S	*	.	H	α-helix	trans	-80.4	-16.2	175.2	-65.8	178.8	4.6	0	0	113.1	I318 I319	I318-Q321 HydrophobicContact CB-CB 4.39Å; I318-Q321 HydrophobicContact CB-CG 4.13Å; I318-Q321 HydrophobicContact CG2-CB 4.35Å; I318-Q321 HydrophobicContact CG2-CG 3.75Å; I318-Q321 PolarHBondContact O-N 3.44Å; I319-Q321 PolarHBondContact O-N 3.34Å
322	L	90.8	Very high	87.9	Confident	10 Å²	10	62.3 Å²	62.3	5%	0.052	32%	0.32	C	S	.	.	H	α-helix	trans	-85.5	-17.2	178.5	-55.3	172.3	0	0	0	113.1	I290 L293 S294 I297 L317 I319 P324	I290-L322 HydrophobicContact CG2-CD2 4.03Å; L293-L322 HydrophobicContact CD2-CD1 3.53Å; L293-L322 HydrophobicContact CG-CD1 3.98Å; S294-L322 VanDerWaalsContact CB-O 3.29Å; S294-L322 WeakPolarHBondContact CB-O 3.34Å; S294-L322 PolarHBondContact OG-O 3.29Å; I297-L322 HydrophobicContact CD1-CB 3.67Å; I297-L322 HydrophobicContact CD1-CD1 4.15Å; L317-L322 HydrophobicContact CD1-CD1 3.77Å; L317-L322 HydrophobicContact CD1-CD2 4.16Å; L317-L322 HydrophobicContact CD1-CG 4.37Å; L317-L322 HydrophobicContact CD2-CD1 4.37Å; L317-L322 HydrophobicContact CG-CD1 4.12Å; I319-L322 HydrophobicContact CD1-CD1 4.13Å; I319-L322 WeakPolarHBondContact O-CB 3.4Å; I319-L322 PolarHBondContact O-N 2.91Å; L322-P324 VanDerWaalsContact O-CD 3.31Å; L322-P324 WeakPolarHBondContact O-CD 3.34Å
323	I	89.5	Confident	87.8	Confident	9 Å²	9	64.6 Å²	64.6	5%	0.046	33%	0.333	C	S	.	.	S	Bend	trans	-71.5	121.8	-177.2	-58.6	178.5	0	0	0	109.4	E327 Y328 L330 Y334 F384	I323-E327 HydrophobicContact CG2-CB 3.72Å; I323-E327 HydrophobicContact CG2-CG 4.3Å; I323-Y328 HydrophobicContact CB-CE2 3.99Å; I323-Y328 HydrophobicContact CG2-CD2 4.32Å; I323-Y328 HydrophobicContact CG2-CE2 3.73Å; I323-L330 HydrophobicContact CD1-CD1 4.21Å; I323-L330 HydrophobicContact CD1-CD2 4.05Å; I323-L330 HydrophobicContact CG2-CD2 3.91Å; I323-Y334 HydrophobicContact CD1-CD1 4.22Å; I323-Y334 HydrophobicContact CD1-CE1 3.86Å; I323-Y334 HydrophobicContact CG1-CE1 4.36Å; I323-F384 HydrophobicContact CD1-CE1 3.51Å; I323-F384 HydrophobicContact CD1-CZ 3.62Å
324	P	81.2	Confident	88.1	Confident	23 Å²	23	63.8 Å²	63.8	15%	0.149	33%	0.327	C	S	.	.			trans	-62.8	148.6	176.9	-25.1	38.3	0	0	0	112.4	L298 L322 E326 E327	L298-P324 HydrophobicContact CB-CG 4.23Å; L298-P324 HydrophobicContact CD1-CB 4.09Å; L298-P324 HydrophobicContact CD1-CG 4Å; L298-P324 HydrophobicContact CG-CG 4.5Å; L322-P324 VanDerWaalsContact O-CD 3.31Å; L322-P324 WeakPolarHBondContact O-CD 3.34Å; P324-E326 VanDerWaalsContact CB-OE2 3.27Å; P324-E326 WeakPolarHBondContact CB-OE2 3.3Å; P324-E326 PolarHBondContact O-N 3.29Å; P324-E327 PolarHBondContact O-N 3.35Å
325	N	80.6	Confident	88.2	Confident	138 Å²	138	62.2 Å²	62.2	74%	0.738	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-59.7	-23.8	-176.7	-65.5	-59.1	0	0	0	112.6	E327 Y328	N325-E327 PolarHBondContact O-N 2.89Å; N325-Y328 PolarHBondContact O-N 3.08Å
326	E	78.6	Confident	88.1	Confident	93 Å²	93	58.1 Å²	58.1	44%	0.435	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-68.2	-9.7	177	-64	77.7	-174.1	0	0	115	P324	P324-E326 VanDerWaalsContact CB-OE2 3.27Å; P324-E326 WeakPolarHBondContact CB-OE2 3.3Å; P324-E326 PolarHBondContact O-N 3.29Å
327	E	82.5	Confident	87.8	Confident	34 Å²	34	56.3 Å²	56.3	16%	0.159	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-98.8	-2.7	175.3	-67	-74.6	159.1	0	0	112.8	R107 L298 I323 P324 N325 P329 L330 Y334	R107-E327 IonicContact CZ-OE1 3.52Å; R107-E327 IonicContact NH1-OE1 3.42Å; R107-E327 PolarHBondContact NH1-OE1 3.15Å; R107-E327 VanDerWaalsContact NH2-CD 3.29Å; R107-E327 IonicContact NH2-OE1 3.73Å; R107-E327 PolarHBondContact NH2-OE1 2.94Å; R107-E327 IonicContact NH2-OE2 3.99Å; L298-E327 HydrophobicContact CD1-CG 3.92Å; I323-E327 HydrophobicContact CG2-CB 3.72Å; I323-E327 HydrophobicContact CG2-CG 4.3Å; P324-E327 PolarHBondContact O-N 3.35Å; N325-E327 PolarHBondContact O-N 2.89Å; E327-P329 CarbonylContact O-C 3.56Å; E327-P329 VanDerWaalsContact O-C 3.3Å; E327-L330 HydrophobicContact CB-CD2 4.42Å; E327-L330 WeakPolarHBondContact O-CA 3.44Å; E327-L330 PolarHBondContact O-N 3.33Å; E327-Y334 HydrophobicContact CB-CE2 4.16Å; E327-Y334 HydrophobicContact CG-CE2 4.38Å; E327-Y334 WeakPolarHBondContact CG-OH 3.46Å; E327-Y334 WeakPolarHBondContact OE2-CE2 3.19Å
328	Y	84	Confident	87.2	Confident	93 Å²	93	57.2 Å²	57.2	37%	0.365	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-93.5	138.2	179.2	-74	-90.8	0	0	0	112.2	K320 I323 N325 L330	K320-Y328 PolarHBondContact O-OH 3.06Å; I323-Y328 HydrophobicContact CB-CE2 3.99Å; I323-Y328 HydrophobicContact CG2-CD2 4.32Å; I323-Y328 HydrophobicContact CG2-CE2 3.73Å; N325-Y328 PolarHBondContact O-N 3.08Å; Y328-L330 HydrophobicContact CD1-CD2 3.99Å; Y328-L330 HydrophobicContact CD1-CG 3.94Å; Y328-L330 HydrophobicContact CD2-CD2 4.33Å; Y328-L330 HydrophobicContact CE1-CD1 4.09Å; Y328-L330 HydrophobicContact CE1-CD2 3.86Å; Y328-L330 HydrophobicContact CE1-CG 3.79Å; Y328-L330 HydrophobicContact CE2-CD2 4.24Å; Y328-L330 HydrophobicContact CG-CD2 4.23Å
329	P	83.4	Confident	86.2	Confident	127 Å²	127	56.6 Å²	56.6	83%	0.825	29%	0.293	S	S	*	.	S	Bend	cis	-69.6	138.4	-2.5	30.2	-35.4	0	0	0	112.3	E327	E327-P329 CarbonylContact O-C 3.56Å; E327-P329 VanDerWaalsContact O-C 3.3Å
330	L	86.1	Confident	85.1	Confident	37 Å²	37	62.2 Å²	62.2	19%	0.194	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-61.1	137.4	-177.3	-55	-179.4	0	0	0	110.3	I323 E327 Y328 Y334 F384	I323-L330 HydrophobicContact CD1-CD1 4.21Å; I323-L330 HydrophobicContact CD1-CD2 4.05Å; I323-L330 HydrophobicContact CG2-CD2 3.91Å; E327-L330 HydrophobicContact CB-CD2 4.42Å; E327-L330 WeakPolarHBondContact O-CA 3.44Å; E327-L330 PolarHBondContact O-N 3.33Å; Y328-L330 HydrophobicContact CD1-CD2 3.99Å; Y328-L330 HydrophobicContact CD1-CG 3.94Å; Y328-L330 HydrophobicContact CD2-CD2 4.33Å; Y328-L330 HydrophobicContact CE1-CD1 4.09Å; Y328-L330 HydrophobicContact CE1-CD2 3.86Å; Y328-L330 HydrophobicContact CE1-CG 3.79Å; Y328-L330 HydrophobicContact CE2-CD2 4.24Å; Y328-L330 HydrophobicContact CG-CD2 4.23Å; L330-Y334 HydrophobicContact CB-CD2 4.25Å; L330-Y334 HydrophobicContact CB-CG 4.3Å; L330-Y334 HydrophobicContact CD2-CD2 4.2Å; L330-Y334 HydrophobicContact CD2-CE2 4.26Å; L330-Y334 HydrophobicContact CD2-CG 4.37Å; L330-F384 HydrophobicContact CD1-CD1 4.17Å; L330-F384 HydrophobicContact CD1-CE1 4.13Å
331	S	85.4	Confident	83.8	Confident	46 Å²	46	60.3 Å²	60.3	32%	0.322	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-71.1	137.8	173.7	76.9	0	0	0	0	111.1	N333 Y334 K337	S331-N333 PolarHBondContact O-N 3.29Å; S331-Y334 WeakPolarHBondContact O-CA 3.35Å; S331-Y334 VanDerWaalsContact O-CB 3.3Å; S331-Y334 WeakPolarHBondContact O-CB 3.04Å; S331-Y334 PolarHBondContact O-N 3.22Å; S331-K337 PolarHBondContact OG-NZ 2.75Å; S331-K337 VanDerWaalsContact OG-NZ 3.13Å
332	L	85.4	Confident	82.4	Confident	108 Å²	108	58.5 Å²	58.5	57%	0.565	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-38.7	133.3	170.7	-179.6	62.6	0	0	0	112.9	E386	L332-E386 HydrophobicContact CD1-CB 3.88Å; L332-E386 WeakPolarHBondContact CD1-O 3.33Å
333	N	89	Confident	80.8	Confident	53 Å²	53	61 Å²	61	28%	0.283	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.2	35.9	-169.3	-57.1	-72.7	0	0	0	114.6	S331 M335 T336 K337 D387	S331-N333 PolarHBondContact O-N 3.29Å; N333-M335 VanDerWaalsContact C-N 3.29Å; N333-M335 PolarHBondContact O-N 2.95Å; N333-M335 VanDerWaalsContact O-N 3.1Å; N333-T336 PolarHBondContact O-N 3.43Å; N333-K337 WeakPolarHBondContact O-CA 3.49Å; N333-K337 WeakPolarHBondContact O-CB 3.27Å; N333-K337 PolarHBondContact O-N 3.12Å; N333-D387 VanDerWaalsContact CA-CG 3.45Å; N333-D387 WeakPolarHBondContact CA-OD2 3.37Å
334	Y	91.6	Very high	79.2	Confident	5 Å²	5	64 Å²	64	2%	0.02	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.4	-44.9	-170.2	-178	-97.5	0	0	0	115.5	R300 I323 E327 L330 S331 L359 F384 D387	R300-Y334 PolarHBondContact NH1-O 2.99Å; R300-Y334 PolarHBondContact NH2-O 2.62Å; I323-Y334 HydrophobicContact CD1-CD1 4.22Å; I323-Y334 HydrophobicContact CD1-CE1 3.86Å; I323-Y334 HydrophobicContact CG1-CE1 4.36Å; E327-Y334 HydrophobicContact CB-CE2 4.16Å; E327-Y334 HydrophobicContact CG-CE2 4.38Å; E327-Y334 WeakPolarHBondContact CG-OH 3.46Å; E327-Y334 WeakPolarHBondContact OE2-CE2 3.19Å; L330-Y334 HydrophobicContact CB-CD2 4.25Å; L330-Y334 HydrophobicContact CB-CG 4.3Å; L330-Y334 HydrophobicContact CD2-CD2 4.2Å; L330-Y334 HydrophobicContact CD2-CE2 4.26Å; L330-Y334 HydrophobicContact CD2-CG 4.37Å; S331-Y334 WeakPolarHBondContact O-CA 3.35Å; S331-Y334 VanDerWaalsContact O-CB 3.3Å; S331-Y334 WeakPolarHBondContact O-CB 3.04Å; S331-Y334 PolarHBondContact O-N 3.22Å; Y334-L359 HydrophobicContact CD1-CD1 4.11Å; Y334-L359 HydrophobicContact CE1-CD1 3.52Å; Y334-F384 HydrophobicContact CD1-CE1 4.09Å; Y334-D387 PolarHBondContact N-OD2 2.86Å
335	M	92.6	Very high	78	Confident	2 Å²	2	65 Å²	65	1%	0.01	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-40.8	-174.4	-70.4	-66.2	-69.3	0	0	111.7	I319 N333 S358 L359 L360 F363 F381 F384 D387 V390	I319-M335 HydrophobicContact CG2-CE 3.88Å; I319-M335 HydrophobicContact CG2-SD 4.32Å; N333-M335 VanDerWaalsContact C-N 3.29Å; N333-M335 PolarHBondContact O-N 2.95Å; N333-M335 VanDerWaalsContact O-N 3.1Å; M335-S358 VanDerWaalsContact O-CB 3.27Å; M335-S358 WeakPolarHBondContact O-CB 3.4Å; M335-S358 PolarHBondContact O-OG 3.12Å; M335-L359 HydrophobicContact CE-CB 4.43Å; M335-L359 PolarHBondContact O-N 2.96Å; M335-L359 VanDerWaalsContact O-N 3.09Å; M335-L359 HydrophobicContact SD-CB 4.24Å; M335-L359 HydrophobicContact SD-CD1 4.4Å; M335-L360 HydrophobicContact CB-CB 4.31Å; M335-L360 HydrophobicContact CE-CD1 4.15Å; M335-L360 PolarHBondContact O-N 3.43Å; M335-F363 HydrophobicContact CE-CD2 3.73Å; M335-F363 HydrophobicContact CE-CE2 3.71Å; M335-F381 HydrophobicContact CE-CD1 4.34Å; M335-F381 HydrophobicContact CE-CE1 4.34Å; M335-F384 HydrophobicContact CG-CD1 3.56Å; M335-F384 HydrophobicContact CG-CD2 4.48Å; M335-F384 HydrophobicContact CG-CE1 3.39Å; M335-F384 HydrophobicContact CG-CE2 4.35Å; M335-F384 HydrophobicContact CG-CG 4.1Å; M335-F384 HydrophobicContact CG-CZ 3.82Å; M335-F384 HydrophobicContact SD-CE1 3.8Å; M335-F384 HydrophobicContact SD-CZ 3.85Å; M335-D387 WeakPolarHBondContact CA-OD2 3.43Å; M335-D387 WeakPolarHBondContact CB-OD2 3.37Å; M335-D387 PolarHBondContact N-OD2 3.13Å; M335-V390 HydrophobicContact CB-CG2 4.08Å
336	T	90.9	Very high	76.9	Confident	16 Å²	16	66.1 Å²	66.1	10%	0.098	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-7.9	-176	68.2	0	0	0	0	114.4	N333 P338 S358 L360 D387 R389 V390 E393	N333-T336 PolarHBondContact O-N 3.43Å; T336-P338 WeakPolarHBondContact O-CD 3.45Å; T336-S358 VanDerWaalsContact C-CB 3.48Å; T336-S358 WeakPolarHBondContact O-CB 3.48Å; T336-L360 HydrophobicContact CG2-CB 4.42Å; T336-L360 HydrophobicContact CG2-CD2 3.69Å; T336-D387 WeakPolarHBondContact CB-OD1 3.46Å; T336-D387 VanDerWaalsContact CG2-OD1 3.26Å; T336-D387 WeakPolarHBondContact CG2-OD1 3.35Å; T336-D387 PolarHBondContact N-OD2 2.91Å; T336-D387 PolarHBondContact OG1-OD1 3.01Å; T336-D387 PolarHBondContact OG1-OD2 2.74Å; T336-R389 HydrophobicContact CG2-CB 3.68Å; T336-V390 HydrophobicContact CG2-CG2 4.13Å; T336-E393 HydrophobicContact CG2-CG 4.37Å
337	K	88.8	Confident	75.6	Confident	95 Å²	95	68.7 Å²	68.7	41%	0.413	37%	0.374	S	S	.	.	S	Bend	trans	-61.8	118.4	172.3	176.2	173.2	179.4	177.1	0	110.2	R300 S331 N333 S358	R300-K337 PolarHBondContact NH1-O 3.18Å; S331-K337 PolarHBondContact OG-NZ 2.75Å; S331-K337 VanDerWaalsContact OG-NZ 3.13Å; N333-K337 WeakPolarHBondContact O-CA 3.49Å; N333-K337 WeakPolarHBondContact O-CB 3.27Å; N333-K337 PolarHBondContact O-N 3.12Å; K337-S358 WeakPolarHBondContact O-CB 3.34Å
338	P	81.9	Confident	74.1	Confident	28 Å²	28	70.4 Å²	70.4	18%	0.182	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	148.4	-174.6	30.6	-36.9	0	0	0	112.2	T336 F340 K355 G356	T336-P338 WeakPolarHBondContact O-CD 3.45Å; P338-F340 HydrophobicContact CG-CE2 3.99Å; P338-F340 HydrophobicContact CG-CZ 3.97Å; P338-F340 PolarHBondContact O-N 3.04Å; P338-K355 HydrophobicContact CB-CD 4.12Å; P338-K355 VanDerWaalsContact CB-CE 3.49Å; P338-K355 HydrophobicContact CB-CG 3.45Å; P338-K355 VanDerWaalsContact CB-CG 3.45Å; P338-K355 HydrophobicContact CG-CD 4.24Å; P338-K355 HydrophobicContact CG-CG 3.77Å; P338-G356 VanDerWaalsContact CB-O 3.31Å; P338-G356 WeakPolarHBondContact CB-O 3.39Å
339	T	73.4	Confident	72.3	Confident	40 Å²	40	72.5 Å²	72.5	25%	0.245	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	111.4	170.5	-50.7	0	0	0	0	108.9	G356 P357	T339-G356 CarbonylContact O-C 3.21Å; T339-G356 WeakPolarHBondContact O-CA 3.09Å; T339-G356 PolarHBondContact O-N 3.2Å; T339-P357 WeakPolarHBondContact CB-O 3.5Å; T339-P357 PolarHBondContact N-O 3.38Å; T339-P357 PolarHBondContact OG1-O 3.4Å
340	F	69.9	Low	71.1	Confident	119 Å²	119	76.8 Å²	76.8	52%	0.522	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	124.5	178.1	-72.9	-76.9	0	0	0	111.2	P338 L353 K355	P338-F340 HydrophobicContact CG-CE2 3.99Å; P338-F340 HydrophobicContact CG-CZ 3.97Å; P338-F340 PolarHBondContact O-N 3.04Å; F340-L353 HydrophobicContact CB-CD1 3.92Å; F340-L353 HydrophobicContact CB-CD2 4.07Å; F340-L353 HydrophobicContact CB-CG 3.91Å; F340-L353 HydrophobicContact CD1-CD2 3.72Å; F340-L353 HydrophobicContact CD1-CG 3.89Å; F340-L353 HydrophobicContact CE1-CD2 4.35Å; F340-L353 HydrophobicContact CG-CD2 3.94Å; F340-L353 HydrophobicContact CG-CG 4.18Å; F340-K355 HydrophobicContact CE1-CB 4.25Å; F340-K355 HydrophobicContact CE1-CG 4.49Å
341	V	62.6	Low	69.9	Low	41 Å²	41	79.4 Å²	79.4	25%	0.248	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	125.9	-179.8	-177.3	0	0	0	0	108.9	V343 V354	V341-V343 HydrophobicContact CG1-CG2 4.24Å; V341-V343 PolarHBondContact O-N 3.27Å; V341-V354 PolarHBondContact N-O 3.06Å; V341-V354 PolarHBondContact O-N 3.36Å
342	L	61.2	Low	68.5	Low	111 Å²	111	80.7 Å²	80.7	58%	0.581	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.9	110.1	167.5	-73.3	169.8	0	0	0	108.8	N351 L353	L342-N351 HydrophobicContact CB-CB 4.43Å; L342-N351 HydrophobicContact CD2-CB 4.07Å; L342-L353 HydrophobicContact CD2-CD1 3.67Å; L342-L353 HydrophobicContact CG-CD1 4.03Å
343	V	58.5	Low	67.3	Low	62 Å²	62	80.8 Å²	80.8	38%	0.376	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	115.4	172.4	179.3	0	0	0	0	107.6	V341 P345 N351 T352 V354	V341-V343 HydrophobicContact CG1-CG2 4.24Å; V341-V343 PolarHBondContact O-N 3.27Å; V343-P345 WeakPolarHBondContact O-CD 3.4Å; V343-N351 CarbonylContact O-C 3.49Å; V343-N351 WeakPolarHBondContact O-CA 3.29Å; V343-T352 PolarHBondContact N-O 2.67Å; V343-T352 PolarHBondContact O-N 2.91Å; V343-T352 PolarHBondContact O-OG1 2.75Å; V343-V354 HydrophobicContact CB-CG2 3.86Å; V343-V354 HydrophobicContact CG2-CB 3.95Å; V343-V354 HydrophobicContact CG2-CG2 3.59Å
344	S	54.9	Low	66	Low	72 Å²	72	81.3 Å²	81.3	50%	0.503	44%	0.444	S	S	.	.			trans	-71.9	118.4	163.4	-57.9	0	0	0	0	107.8	N351	S344-N351 PolarHBondContact OG-OD1 3.17Å
345	P	56.5	Low	65	Low	45 Å²	45	88 Å²	88	29%	0.292	47%	0.473	S	S	.	.			trans	-65.3	143.6	169.1	28.8	-33.5	0	0	0	109.1	V343 N347 G348 R350	V343-P345 WeakPolarHBondContact O-CD 3.4Å; P345-N347 PolarHBondContact O-N 3.01Å; P345-G348 PolarHBondContact O-N 3.41Å; P345-R350 WeakPolarHBondContact CD-O 3.44Å
346	D	56.8	Low	63.9	Low	161 Å²	161	88.6 Å²	88.6	86%	0.861	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-21.3	-176.4	-63.4	-49.6	0	0	0	113.2	G348	D346-G348 PolarHBondContact O-N 3.31Å
347	N	52.7	Low	63.4	Low	148 Å²	148	90.3 Å²	90.3	79%	0.791	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	18.2	176.1	-65.5	-8	0	0	0	114.6	P345 N349	P345-N347 PolarHBondContact O-N 3.01Å; N347-N349 PolarHBondContact O-N 3.17Å
348	G	50.4	Low	63.4	Low	70 Å²	70	86 Å²	86	72%	0.722	47%	0.473	S	S	*	.			trans	68.7	-14.5	164.7	0	0	0	0	0	118	P345 D346	P345-G348 PolarHBondContact O-N 3.41Å; D346-G348 PolarHBondContact O-N 3.31Å
349	N	46.9	Very low	63.9	Low	137 Å²	137	84.6 Å²	84.6	73%	0.733	46%	0.464	S	S	*	.	S	Bend	trans	-99.6	103.1	-173.8	-98.7	-53.5	0	0	0	112.8	N347	N347-N349 PolarHBondContact O-N 3.17Å
350	R	56.8	Low	64.8	Low	216 Å²	216	82.7 Å²	82.7	82%	0.815	45%	0.453	S	S	*	.			trans	65.2	117.1	174	-56.6	177.6	178.3	172.2	0.4	115.3	P345 T352	P345-R350 WeakPolarHBondContact CD-O 3.44Å; R350-T352 PolarHBondContact O-N 2.94Å
351	N	61.2	Low	65.8	Low	92 Å²	92	78.4 Å²	78.4	49%	0.492	44%	0.435	S	S	.	.			trans	-58.2	126.2	168.4	-53.7	18.5	0	0	0	109.9	L342 V343 S344	L342-N351 HydrophobicContact CB-CB 4.43Å; L342-N351 HydrophobicContact CD2-CB 4.07Å; V343-N351 CarbonylContact O-C 3.49Å; V343-N351 WeakPolarHBondContact O-CA 3.29Å; S344-N351 PolarHBondContact OG-OD1 3.17Å
352	T	57.3	Low	67	Low	74 Å²	74	76.4 Å²	76.4	45%	0.454	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	139.5	173	54.8	0	0	0	0	109.6	V343 R350 V354	V343-T352 PolarHBondContact N-O 2.67Å; V343-T352 PolarHBondContact O-N 2.91Å; V343-T352 PolarHBondContact O-OG1 2.75Å; R350-T352 PolarHBondContact O-N 2.94Å; T352-V354 PolarHBondContact O-N 2.92Å
353	L	59.7	Low	68.6	Low	109 Å²	109	71.2 Å²	71.2	57%	0.571	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.6	97	175.8	-165.5	80.7	0	0	0	108.5	F340 L342	F340-L353 HydrophobicContact CB-CD1 3.92Å; F340-L353 HydrophobicContact CB-CD2 4.07Å; F340-L353 HydrophobicContact CB-CG 3.91Å; F340-L353 HydrophobicContact CD1-CD2 3.72Å; F340-L353 HydrophobicContact CD1-CG 3.89Å; F340-L353 HydrophobicContact CE1-CD2 4.35Å; F340-L353 HydrophobicContact CG-CD2 3.94Å; F340-L353 HydrophobicContact CG-CG 4.18Å; L342-L353 HydrophobicContact CD2-CD1 3.67Å; L342-L353 HydrophobicContact CG-CD1 4.03Å
354	V	62.3	Low	70.2	Confident	64 Å²	64	68.3 Å²	68.3	39%	0.388	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	135.8	-179.1	-179.2	0	0	0	0	109.6	V341 V343 T352 G356	V341-V354 PolarHBondContact N-O 3.06Å; V341-V354 PolarHBondContact O-N 3.36Å; V343-V354 HydrophobicContact CB-CG2 3.86Å; V343-V354 HydrophobicContact CG2-CB 3.95Å; V343-V354 HydrophobicContact CG2-CG2 3.59Å; T352-V354 PolarHBondContact O-N 2.92Å; V354-G356 PolarHBondContact O-N 3.22Å; V354-G356 VanDerWaalsContact O-N 3.13Å
355	K	68.6	Low	71.9	Confident	145 Å²	145	65.3 Å²	65.3	63%	0.63	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.4	102.2	170.3	-173.9	-162.9	170.8	-165.4	0	108.5	P338 F340	P338-K355 HydrophobicContact CB-CD 4.12Å; P338-K355 VanDerWaalsContact CB-CE 3.49Å; P338-K355 HydrophobicContact CB-CG 3.45Å; P338-K355 VanDerWaalsContact CB-CG 3.45Å; P338-K355 HydrophobicContact CG-CD 4.24Å; P338-K355 HydrophobicContact CG-CG 3.77Å; F340-K355 HydrophobicContact CE1-CB 4.25Å; F340-K355 HydrophobicContact CE1-CG 4.49Å
356	G	70.7	Confident	73.5	Confident	16 Å²	16	63.2 Å²	63.2	17%	0.165	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	-176.7	169.9	0	0	0	0	0	112.5	P338 T339 V354	P338-G356 VanDerWaalsContact CB-O 3.31Å; P338-G356 WeakPolarHBondContact CB-O 3.39Å; T339-G356 CarbonylContact O-C 3.21Å; T339-G356 WeakPolarHBondContact O-CA 3.09Å; T339-G356 PolarHBondContact O-N 3.2Å; V354-G356 PolarHBondContact O-N 3.22Å; V354-G356 VanDerWaalsContact O-N 3.13Å
357	P	80.8	Confident	75.2	Confident	52 Å²	52	55.6 Å²	55.6	34%	0.338	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	149.5	-179.6	25.7	-34.5	0	0	0	112.6	C302 T339 D361	C302-P357 HydrophobicContact CB-CB 4.23Å; C302-P357 HydrophobicContact CB-CG 3.92Å; T339-P357 WeakPolarHBondContact CB-O 3.5Å; T339-P357 PolarHBondContact N-O 3.38Å; T339-P357 PolarHBondContact OG1-O 3.4Å; P357-D361 HydrophobicContact CB-CB 3.89Å
358	S	88.9	Confident	77	Confident	3 Å²	3	48.7 Å²	48.7	2%	0.021	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	173	164.6	72.4	0	0	0	0	111	C302 M335 T336 K337 L360 D361	C302-S358 PolarHBondContact SG-O 3.1Å; M335-S358 VanDerWaalsContact O-CB 3.27Å; M335-S358 WeakPolarHBondContact O-CB 3.4Å; M335-S358 PolarHBondContact O-OG 3.12Å; T336-S358 VanDerWaalsContact C-CB 3.48Å; T336-S358 WeakPolarHBondContact O-CB 3.48Å; K337-S358 WeakPolarHBondContact O-CB 3.34Å; S358-L360 VanDerWaalsContact C-N 3.29Å; S358-L360 PolarHBondContact O-N 3.08Å; S358-L360 PolarHBondContact OG-N 3.28Å; S358-D361 WeakPolarHBondContact CA-OD2 3.44Å; S358-D361 VanDerWaalsContact CB-OD2 3.28Å; S358-D361 WeakPolarHBondContact CB-OD2 3.37Å; S358-D361 PolarHBondContact N-OD2 3Å; S358-D361 PolarHBondContact O-N 2.82Å; S358-D361 PolarHBondContact OG-N 3.25Å; S358-D361 PolarHBondContact OG-OD2 3Å
359	L	91.8	Very high	78.9	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-61.6	-42.2	173.7	-77.1	170.6	0	0	0	110.6	I297 R300 I305 Y334 M335 D361 G362 F363	I297-L359 HydrophobicContact CG2-CD1 4.21Å; I297-L359 HydrophobicContact CG2-CD2 4.38Å; R300-L359 HydrophobicContact CB-CD2 4.27Å; R300-L359 HydrophobicContact CG-CD1 4.49Å; R300-L359 HydrophobicContact CG-CD2 4.02Å; R300-L359 HydrophobicContact CG-CG 4.25Å; I305-L359 HydrophobicContact CD1-CD2 3.51Å; Y334-L359 HydrophobicContact CD1-CD1 4.11Å; Y334-L359 HydrophobicContact CE1-CD1 3.52Å; M335-L359 HydrophobicContact CE-CB 4.43Å; M335-L359 PolarHBondContact O-N 2.96Å; M335-L359 VanDerWaalsContact O-N 3.09Å; M335-L359 HydrophobicContact SD-CB 4.24Å; M335-L359 HydrophobicContact SD-CD1 4.4Å; L359-D361 VanDerWaalsContact C-N 3.31Å; L359-D361 PolarHBondContact O-N 3.14Å; L359-G362 PolarHBondContact O-N 3.26Å; L359-G362 VanDerWaalsContact O-N 3.14Å; L359-F363 WeakPolarHBondContact O-CD2 3.38Å; L359-F363 PolarHBondContact O-N 2.98Å
360	L	93.3	Very high	80.9	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-63.1	-35.4	-178.4	-168.7	59.9	0	0	0	112.8	M335 T336 S358 G362 F363 I364 F381 V390 E393 L394	M335-L360 HydrophobicContact CB-CB 4.31Å; M335-L360 HydrophobicContact CE-CD1 4.15Å; M335-L360 PolarHBondContact O-N 3.43Å; T336-L360 HydrophobicContact CG2-CB 4.42Å; T336-L360 HydrophobicContact CG2-CD2 3.69Å; S358-L360 VanDerWaalsContact C-N 3.29Å; S358-L360 PolarHBondContact O-N 3.08Å; S358-L360 PolarHBondContact OG-N 3.28Å; L360-G362 VanDerWaalsContact C-N 3.26Å; L360-G362 PolarHBondContact O-N 3.18Å; L360-F363 PolarHBondContact O-N 2.91Å; L360-F363 VanDerWaalsContact O-N 3.12Å; L360-I364 HydrophobicContact CD2-CD1 4.39Å; L360-I364 HydrophobicContact CG-CD1 3.93Å; L360-I364 HydrophobicContact CG-CG1 4.34Å; L360-I364 WeakPolarHBondContact O-CG1 3.48Å; L360-I364 PolarHBondContact O-N 3.09Å; L360-F381 HydrophobicContact CD1-CD1 3.84Å; L360-F381 HydrophobicContact CD1-CE1 3.5Å; L360-F381 VanDerWaalsContact CD1-CE1 3.5Å; L360-F381 HydrophobicContact CD1-CZ 4.29Å; L360-V390 HydrophobicContact CD2-CB 4.42Å; L360-V390 HydrophobicContact CD2-CG1 4.41Å; L360-V390 HydrophobicContact CD2-CG2 4.26Å; L360-E393 HydrophobicContact CD2-CB 3.67Å; L360-E393 HydrophobicContact CD2-CG 4.29Å; L360-L394 HydrophobicContact CD1-CD2 4.08Å; L360-L394 HydrophobicContact CD1-CG 4.37Å
361	D	89	Confident	82.2	Confident	28 Å²	28	33.8 Å²	33.8	15%	0.15	18%	0.182	C	C	.	.	H	α-helix	trans	-60.3	-37	176.1	-60.1	-51.5	0	0	0	111.4	P357 S358 L359 I364 L365	P357-D361 HydrophobicContact CB-CB 3.89Å; S358-D361 WeakPolarHBondContact CA-OD2 3.44Å; S358-D361 VanDerWaalsContact CB-OD2 3.28Å; S358-D361 WeakPolarHBondContact CB-OD2 3.37Å; S358-D361 PolarHBondContact N-OD2 3Å; S358-D361 PolarHBondContact O-N 2.82Å; S358-D361 PolarHBondContact OG-N 3.25Å; S358-D361 PolarHBondContact OG-OD2 3Å; L359-D361 VanDerWaalsContact C-N 3.31Å; L359-D361 PolarHBondContact O-N 3.14Å; D361-I364 PolarHBondContact O-N 3.07Å; D361-L365 WeakPolarHBondContact O-CB 3.31Å; D361-L365 VanDerWaalsContact O-CG 3.24Å; D361-L365 WeakPolarHBondContact O-CG 3.43Å; D361-L365 PolarHBondContact O-N 3.22Å
362	G	88.9	Confident	83.2	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-64.8	-38.7	174.3	0	0	0	0	0	113.3	T306 L359 L360 G366	T306-G362 WeakPolarHBondContact CA-O 3.49Å; T306-G362 PolarHBondContact OG1-O 3.48Å; T306-G362 VanDerWaalsContact OG1-O 3.11Å; L359-G362 PolarHBondContact O-N 3.26Å; L359-G362 VanDerWaalsContact O-N 3.14Å; L360-G362 VanDerWaalsContact C-N 3.26Å; L360-G362 PolarHBondContact O-N 3.18Å; G362-G366 PolarHBondContact O-N 3.37Å
363	F	94.3	Very high	84.4	Confident	2 Å²	2	33.6 Å²	33.6	1%	0.009	19%	0.194	C	C	.	.	H	α-helix	trans	-70.3	-40.7	173.9	-67.9	-79	0	0	0	112.2	L293 I297 I305 I309 I319 M335 L359 L360 G366 L367 F381	L293-F363 HydrophobicContact CD1-CE1 4.36Å; I297-F363 HydrophobicContact CD1-CZ 4.02Å; I297-F363 HydrophobicContact CG1-CZ 4.06Å; I305-F363 HydrophobicContact CD1-CE2 4.36Å; I305-F363 HydrophobicContact CG2-CD1 3.84Å; I305-F363 HydrophobicContact CG2-CD2 3.96Å; I305-F363 HydrophobicContact CG2-CE1 3.74Å; I305-F363 HydrophobicContact CG2-CE2 3.87Å; I305-F363 HydrophobicContact CG2-CG 3.93Å; I305-F363 HydrophobicContact CG2-CZ 3.76Å; I309-F363 HydrophobicContact CD1-CD1 3.7Å; I309-F363 HydrophobicContact CD1-CE1 3.76Å; I309-F363 HydrophobicContact CG1-CD1 3.68Å; I309-F363 HydrophobicContact CG1-CE1 3.97Å; I319-F363 HydrophobicContact CD1-CD1 3.83Å; I319-F363 HydrophobicContact CD1-CE1 3.51Å; I319-F363 HydrophobicContact CD1-CZ 4.1Å; I319-F363 HydrophobicContact CG2-CE2 4.43Å; I319-F363 HydrophobicContact CG2-CZ 4.22Å; M335-F363 HydrophobicContact CE-CD2 3.73Å; M335-F363 HydrophobicContact CE-CE2 3.71Å; L359-F363 WeakPolarHBondContact O-CD2 3.38Å; L359-F363 PolarHBondContact O-N 2.98Å; L360-F363 PolarHBondContact O-N 2.91Å; L360-F363 VanDerWaalsContact O-N 3.12Å; F363-G366 PolarHBondContact O-N 3.39Å; F363-L367 WeakPolarHBondContact O-CB 3.45Å; F363-L367 WeakPolarHBondContact O-CG 3.29Å; F363-L367 PolarHBondContact O-N 2.91Å; F363-F381 HydrophobicContact CB-CE1 4.01Å; F363-F381 HydrophobicContact CB-CZ 3.97Å; F363-F381 HydrophobicContact CD2-CE1 4.47Å; F363-F381 HydrophobicContact CG-CE1 4.14Å; F363-F381 HydrophobicContact CG-CZ 4.39Å
364	I	92.3	Very high	85.8	Confident	0 Å²	0	29 Å²	29	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62.9	-47.4	177.5	-75	172.9	0	0	0	110.4	L360 D361 L367 L368 E393 L394 L397 L400 Y440	L360-I364 HydrophobicContact CD2-CD1 4.39Å; L360-I364 HydrophobicContact CG-CD1 3.93Å; L360-I364 HydrophobicContact CG-CG1 4.34Å; L360-I364 WeakPolarHBondContact O-CG1 3.48Å; L360-I364 PolarHBondContact O-N 3.09Å; D361-I364 PolarHBondContact O-N 3.07Å; I364-L367 PolarHBondContact O-N 3.24Å; I364-L368 HydrophobicContact CG2-CD1 3.75Å; I364-L368 WeakPolarHBondContact O-CB 3.14Å; I364-L368 VanDerWaalsContact O-CG 3.26Å; I364-L368 WeakPolarHBondContact O-CG 3.5Å; I364-L368 PolarHBondContact O-N 2.76Å; I364-L368 VanDerWaalsContact O-N 3.08Å; I364-E393 HydrophobicContact CD1-CB 3.86Å; I364-L394 HydrophobicContact CG1-CD2 4.27Å; I364-L397 HydrophobicContact CB-CD2 4.39Å; I364-L397 HydrophobicContact CG1-CD2 4.33Å; I364-L397 HydrophobicContact CG2-CD2 3.96Å; I364-L400 HydrophobicContact CG2-CD1 4.16Å; I364-Y440 HydrophobicContact CG2-CE1 3.96Å
365	L	89.7	Confident	87.2	Confident	10 Å²	10	31.8 Å²	31.8	5%	0.052	18%	0.178	C	C	.	.	H	α-helix	trans	-61.8	-47	175.2	-69.4	172.1	0	0	0	111.1	T306 D361 L367 L368 T369 H443 I447	T306-L365 HydrophobicContact CG2-CB 3.98Å; D361-L365 WeakPolarHBondContact O-CB 3.31Å; D361-L365 VanDerWaalsContact O-CG 3.24Å; D361-L365 WeakPolarHBondContact O-CG 3.43Å; D361-L365 PolarHBondContact O-N 3.22Å; L365-L367 PolarHBondContact O-N 3.29Å; L365-L368 CarbonylContact O-C 3.58Å; L365-L368 WeakPolarHBondContact O-CA 3.26Å; L365-L368 PolarHBondContact O-N 2.68Å; L365-T369 WeakPolarHBondContact O-CG2 3.49Å; L365-T369 PolarHBondContact O-N 3.33Å; L365-T369 PolarHBondContact O-OG1 2.99Å; L365-T369 VanDerWaalsContact O-OG1 3.06Å; L365-H443 HydrophobicContact CD2-CB 3.66Å; L365-I447 HydrophobicContact CD2-CD1 4.49Å; L365-I447 HydrophobicContact CD2-CG1 4.4Å
366	G	90.1	Very high	88.4	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-58.6	-33.5	176.6	0	0	0	0	0	114.1	A310 G362 F363 L368 R370	A310-G366 VanDerWaalsContact CA-O 3.3Å; A310-G366 WeakPolarHBondContact CA-O 3.46Å; A310-G366 PolarHBondContact N-O 3.13Å; G362-G366 PolarHBondContact O-N 3.37Å; F363-G366 PolarHBondContact O-N 3.39Å; G366-L368 VanDerWaalsContact C-N 3.34Å; G366-R370 WeakPolarHBondContact O-CG 3.33Å
367	L	93.4	Very high	89.5	Confident	1 Å²	1	27.9 Å²	27.9	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-76.1	-19.1	173.8	-74.6	172.2	0	0	0	114.1	I309 F363 I364 L365 R370 L376 V379 F381 L397 V456 I458 F481	I309-L367 HydrophobicContact CG2-CD2 4.31Å; I309-L367 HydrophobicContact CG2-CG 4.12Å; F363-L367 WeakPolarHBondContact O-CB 3.45Å; F363-L367 WeakPolarHBondContact O-CG 3.29Å; F363-L367 PolarHBondContact O-N 2.91Å; I364-L367 PolarHBondContact O-N 3.24Å; L365-L367 PolarHBondContact O-N 3.29Å; L367-R370 WeakPolarHBondContact O-CD 3.42Å; L367-R370 WeakPolarHBondContact O-CG 3.43Å; L367-L376 HydrophobicContact CD2-CD2 4.15Å; L367-V379 HydrophobicContact CD2-CG2 4.1Å; L367-F381 HydrophobicContact CD1-CZ 4.5Å; L367-L397 HydrophobicContact CB-CD2 4.25Å; L367-L397 HydrophobicContact CD1-CD1 4.24Å; L367-V456 HydrophobicContact CD2-CG1 4.42Å; L367-I458 HydrophobicContact CD1-CD1 3.88Å; L367-F481 HydrophobicContact CB-CE1 4.3Å
368	L	91	Very high	90.3	Very high	3 Å²	3	26.4 Å²	26.4	2%	0.016	15%	0.148	C	C	.	.	H	α-helix	trans	-100.6	-11.9	179.4	-72.4	172.6	0	0	0	113.7	I364 L365 G366 L397 L400 W401 I447 G448 F481	I364-L368 HydrophobicContact CG2-CD1 3.75Å; I364-L368 WeakPolarHBondContact O-CB 3.14Å; I364-L368 VanDerWaalsContact O-CG 3.26Å; I364-L368 WeakPolarHBondContact O-CG 3.5Å; I364-L368 PolarHBondContact O-N 2.76Å; I364-L368 VanDerWaalsContact O-N 3.08Å; L365-L368 CarbonylContact O-C 3.58Å; L365-L368 WeakPolarHBondContact O-CA 3.26Å; L365-L368 PolarHBondContact O-N 2.68Å; G366-L368 VanDerWaalsContact C-N 3.34Å; L368-L397 HydrophobicContact CD1-CD2 4.17Å; L368-L397 HydrophobicContact CD2-CD2 4.19Å; L368-L397 HydrophobicContact CG-CD2 3.89Å; L368-L400 HydrophobicContact CD1-CB 3.73Å; L368-L400 HydrophobicContact CD1-CD1 3.89Å; L368-L400 HydrophobicContact CD1-CG 4.41Å; L368-L400 HydrophobicContact CD2-CB 4.23Å; L368-W401 HydrophobicContact CD2-CB 3.86Å; L368-I447 HydrophobicContact CB-CG1 4.17Å; L368-I447 HydrophobicContact CB-CG2 3.98Å; L368-I447 HydrophobicContact CD1-CD1 4.17Å; L368-I447 HydrophobicContact CD1-CG1 4.4Å; L368-I447 HydrophobicContact CD2-CG2 4.36Å; L368-G448 PolarHBondContact O-N 3.45Å; L368-F481 HydrophobicContact CD2-CE2 4.32Å; L368-F481 HydrophobicContact CD2-CZ 4.33Å
369	T	88.9	Confident	90.6	Very high	17 Å²	17	26.4 Å²	26.4	10%	0.104	15%	0.147	C	C	.	.	S	Bend	trans	-118	29.4	178.9	67.2	0	0	0	0	112.4	A310 L365 Q371 D446	A310-T369 WeakPolarHBondContact CB-O 3.48Å; L365-T369 WeakPolarHBondContact O-CG2 3.49Å; L365-T369 PolarHBondContact O-N 3.33Å; L365-T369 PolarHBondContact O-OG1 2.99Å; L365-T369 VanDerWaalsContact O-OG1 3.06Å; T369-Q371 PolarHBondContact O-N 3.03Å; T369-Q371 PolarHBondContact O-NE2 3.28Å; T369-D446 VanDerWaalsContact CG2-O 3.31Å; T369-D446 WeakPolarHBondContact CG2-O 3.21Å
370	R	88.8	Confident	90.8	Very high	21 Å²	21	28 Å²	28	8%	0.079	16%	0.156	C	C	.	.			trans	-62	130	-173.5	-69.6	176.4	63.6	127.7	-3.1	112.3	A310 G366 L367 C374 L376	A310-R370 WeakPolarHBondContact O-CA 3.07Å; G366-R370 WeakPolarHBondContact O-CG 3.33Å; L367-R370 WeakPolarHBondContact O-CD 3.42Å; L367-R370 WeakPolarHBondContact O-CG 3.43Å; R370-C374 HydrophobicContact CB-CB 4.48Å; R370-C374 PolarHBondContact NH2-O 3.48Å; R370-L376 VanDerWaalsContact CZ-O 3.26Å; R370-L376 PolarHBondContact NH1-O 2.73Å; R370-L376 PolarHBondContact NH2-O 3.13Å
371	Q	85.1	Confident	90.9	Very high	73 Å²	73	28.2 Å²	28.2	34%	0.341	16%	0.157	S	C	.	.			trans	-83.4	158.2	171.9	-56.8	-53	-60.7	0	0	110.9	A310 N311 T369 G373 C374	A310-Q371 PolarHBondContact O-N 2.91Å; N311-Q371 VanDerWaalsContact OD1-CB 3.25Å; N311-Q371 WeakPolarHBondContact OD1-CB 3.34Å; N311-Q371 WeakPolarHBondContact OD1-CG 3.44Å; T369-Q371 PolarHBondContact O-N 3.03Å; T369-Q371 PolarHBondContact O-NE2 3.28Å; Q371-G373 PolarHBondContact O-N 3.49Å; Q371-G373 VanDerWaalsContact O-N 3.08Å; Q371-C374 VanDerWaalsContact O-CB 3.26Å; Q371-C374 WeakPolarHBondContact O-CB 3.22Å; Q371-C374 PolarHBondContact O-N 2.98Å
372	S	81.9	Confident	91.1	Very high	136 Å²	136	28.6 Å²	28.6	95%	0.951	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-21.3	-176.2	53.9	0	0	0	0	114.8
373	G	82.8	Confident	91	Very high	25 Å²	25	29.4 Å²	29.4	26%	0.258	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-6.7	174	0	0	0	0	0	115.6	Q371 K375	Q371-G373 PolarHBondContact O-N 3.49Å; Q371-G373 VanDerWaalsContact O-N 3.08Å; G373-K375 PolarHBondContact O-N 3.41Å
374	C	89	Confident	90.7	Very high	12 Å²	12	30 Å²	30	8%	0.081	17%	0.171	C	C	.	.			trans	-77.8	109.7	-174.6	-175.5	0	0	0	0	112.3	I309 A310 W312 R370 Q371 L376	I309-C374 PolarHBondContact O-SG 2.67Å; I309-C374 VanDerWaalsContact O-SG 3.34Å; A310-C374 VanDerWaalsContact O-CB 3.31Å; A310-C374 WeakPolarHBondContact O-CB 3.43Å; W312-C374 PolarHBondContact N-SG 2.81Å; W312-C374 VanDerWaalsContact N-SG 3.42Å; R370-C374 HydrophobicContact CB-CB 4.48Å; R370-C374 PolarHBondContact NH2-O 3.48Å; Q371-C374 VanDerWaalsContact O-CB 3.26Å; Q371-C374 WeakPolarHBondContact O-CB 3.22Å; Q371-C374 PolarHBondContact O-N 2.98Å; C374-L376 PolarHBondContact O-N 3.28Å
375	K	91.2	Very high	90.1	Very high	124 Å²	124	35.3 Å²	35.3	54%	0.539	20%	0.196	S	C	.	.			trans	-87.4	-0.8	-173.4	-51.6	-168	-165.9	165.6	0	114.4	W312 P313 C314 E315 G373 K377	W312-K375 PolarHBondContact O-N 2.88Å; P313-K375 WeakPolarHBondContact O-CD 3.48Å; C314-K375 CarbonylContact O-C 3.59Å; E315-K375 WeakPolarHBondContact CA-O 3.03Å; G373-K375 PolarHBondContact O-N 3.41Å; K375-K377 PolarHBondContact O-N 3.46Å
376	L	93.5	Very high	89.7	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.221	C	C	.	.			trans	-64.4	113.8	-171	-175.9	59.8	0	0	0	112.6	I309 W312 C314 L317 L367 R370 C374 S378 V379	I309-L376 HydrophobicContact CG2-CD2 4.41Å; W312-L376 HydrophobicContact CB-CB 4.27Å; W312-L376 HydrophobicContact CB-CD2 4.24Å; C314-L376 VanDerWaalsContact O-CA 3.26Å; C314-L376 WeakPolarHBondContact O-CA 3.48Å; C314-L376 PolarHBondContact O-N 3.35Å; L317-L376 HydrophobicContact CB-CD1 3.72Å; L367-L376 HydrophobicContact CD2-CD2 4.15Å; R370-L376 VanDerWaalsContact CZ-O 3.26Å; R370-L376 PolarHBondContact NH1-O 2.73Å; R370-L376 PolarHBondContact NH2-O 3.13Å; C374-L376 PolarHBondContact O-N 3.28Å; L376-S378 VanDerWaalsContact CD1-O 3.22Å; L376-S378 WeakPolarHBondContact CD1-O 3.34Å; L376-V379 HydrophobicContact CD1-CG2 4.02Å; L376-V379 HydrophobicContact CD2-CG2 3.7Å; L376-V379 HydrophobicContact CG-CG2 3.8Å
377	K	95.2	Very high	89.6	Confident	78 Å²	78	41.1 Å²	41.1	34%	0.339	22%	0.223	S	C	.	.			trans	-110.8	-18.3	-178.5	-71	169.7	-175.6	170.6	0	113.4	E315 K375 V456 T457	E315-K377 HydrophobicContact CB-CD 4.48Å; E315-K377 HydrophobicContact CG-CD 4.37Å; E315-K377 WeakPolarHBondContact O-CA 3.08Å; E315-K377 PolarHBondContact O-N 3.01Å; E315-K377 WeakPolarHBondContact OE1-CE 3.28Å; E315-K377 IonicContact OE1-NZ 3.31Å; E315-K377 PolarHBondContact OE1-NZ 3.23Å; K375-K377 PolarHBondContact O-N 3.46Å; K377-V456 CarbonylContact O-C 3.6Å; K377-V456 WeakPolarHBondContact O-CA 3.39Å; K377-T457 PolarHBondContact O-N 3.04Å
378	S	96.3	Very high	89	Confident	22 Å²	22	43.5 Å²	43.5	15%	0.154	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	133.6	177	165.4	0	0	0	0	111	E315 Q316 L317 L376 T457 H459	E315-S378 PolarHBondContact O-N 3.47Å; Q316-S378 WeakPolarHBondContact CA-O 3.43Å; L317-S378 PolarHBondContact N-O 2.91Å; L376-S378 VanDerWaalsContact CD1-O 3.22Å; L376-S378 WeakPolarHBondContact CD1-O 3.34Å; S378-T457 CarbonylContact C-O 3.3Å; S378-T457 VanDerWaalsContact CA-O 3.3Å; S378-T457 WeakPolarHBondContact CA-O 3.46Å; S378-H459 PolarHBondContact OG-CD2 3.15Å; S378-H459 PolarHBondContact OG-NE2 3.08Å
379	V	96.8	Very high	88.9	Confident	3 Å²	3	49.6 Å²	49.6	2%	0.018	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	126.8	174.9	-162	0	0	0	0	109.4	L317 I319 L367 L376 F381 V456 T457 I458 H459	L317-V379 HydrophobicContact CB-CG1 4.45Å; L317-V379 CarbonylContact O-C 3.43Å; L317-V379 WeakPolarHBondContact O-CA 3.34Å; I319-V379 HydrophobicContact CD1-CG1 3.97Å; I319-V379 HydrophobicContact CG1-CG1 4.09Å; L367-V379 HydrophobicContact CD2-CG2 4.1Å; L376-V379 HydrophobicContact CD1-CG2 4.02Å; L376-V379 HydrophobicContact CD2-CG2 3.7Å; L376-V379 HydrophobicContact CG-CG2 3.8Å; V379-F381 HydrophobicContact CB-CD2 4.36Å; V379-F381 HydrophobicContact CB-CE2 3.83Å; V379-F381 HydrophobicContact CG1-CD2 3.97Å; V379-F381 HydrophobicContact CG1-CE2 3.34Å; V379-F381 HydrophobicContact CG1-CZ 3.77Å; V379-V456 HydrophobicContact CG2-CG1 4.17Å; V379-T457 PolarHBondContact N-O 2.95Å; V379-I458 HydrophobicContact CB-CD1 4.12Å; V379-I458 HydrophobicContact CG2-CD1 4.13Å; V379-H459 PolarHBondContact O-N 2.82Å
380	D	95.9	Very high	89	Confident	34 Å²	34	49.1 Å²	49.1	18%	0.182	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	110.4	-175.8	-177.4	8.8	0	0	0	112	L317 I318 I319 T382 H459	L317-D380 PolarHBondContact O-N 2.84Å; I318-D380 HydrophobicContact CB-CB 4.39Å; I318-D380 HydrophobicContact CG1-CB 4.14Å; I318-D380 HydrophobicContact CG2-CB 4.23Å; I319-D380 WeakPolarHBondContact CB-O 3.34Å; I319-D380 WeakPolarHBondContact CG1-O 3.38Å; I319-D380 PolarHBondContact N-O 3.44Å; D380-T382 VanDerWaalsContact OD1-CB 3.24Å; D380-T382 WeakPolarHBondContact OD1-CB 3.13Å; D380-T382 VanDerWaalsContact OD1-CG2 3.22Å; D380-T382 WeakPolarHBondContact OD1-CG2 3.4Å; D380-T382 PolarHBondContact OD1-N 3.31Å; D380-T382 PolarHBondContact OD1-OG1 3.06Å; D380-T382 PolarHBondContact OD2-OG1 3.46Å; D380-H459 HydrophobicContact CB-CB 4.23Å
381	F	95.4	Very high	89.1	Confident	3 Å²	3	48.2 Å²	48.2	1%	0.013	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	22.2	175.2	-61.8	-93.8	0	0	0	111.9	I319 M335 L360 F363 L367 V379 F384 V390 L394 I458 H459	I319-F381 HydrophobicContact CB-CD1 4.43Å; I319-F381 HydrophobicContact CD1-CE1 4.42Å; I319-F381 HydrophobicContact CG1-CD1 3.8Å; I319-F381 HydrophobicContact CG1-CE1 3.8Å; I319-F381 HydrophobicContact CG1-CG 4.22Å; I319-F381 HydrophobicContact CG1-CZ 4.24Å; M335-F381 HydrophobicContact CE-CD1 4.34Å; M335-F381 HydrophobicContact CE-CE1 4.34Å; L360-F381 HydrophobicContact CD1-CD1 3.84Å; L360-F381 HydrophobicContact CD1-CE1 3.5Å; L360-F381 VanDerWaalsContact CD1-CE1 3.5Å; L360-F381 HydrophobicContact CD1-CZ 4.29Å; F363-F381 HydrophobicContact CB-CE1 4.01Å; F363-F381 HydrophobicContact CB-CZ 3.97Å; F363-F381 HydrophobicContact CD2-CE1 4.47Å; F363-F381 HydrophobicContact CG-CE1 4.14Å; F363-F381 HydrophobicContact CG-CZ 4.39Å; L367-F381 HydrophobicContact CD1-CZ 4.5Å; V379-F381 HydrophobicContact CB-CD2 4.36Å; V379-F381 HydrophobicContact CB-CE2 3.83Å; V379-F381 HydrophobicContact CG1-CD2 3.97Å; V379-F381 HydrophobicContact CG1-CE2 3.34Å; V379-F381 HydrophobicContact CG1-CZ 3.77Å; F381-F384 WeakPolarHBondContact O-CD2 3.22Å; F381-V390 HydrophobicContact CB-CG1 4.18Å; F381-L394 HydrophobicContact CB-CD1 3.87Å; F381-L394 HydrophobicContact CD1-CD1 4.33Å; F381-L394 HydrophobicContact CD2-CD1 3.78Å; F381-L394 HydrophobicContact CD2-CD2 4.23Å; F381-L394 HydrophobicContact CE1-CD2 4.46Å; F381-L394 HydrophobicContact CE2-CD1 4.33Å; F381-L394 HydrophobicContact CE2-CD2 3.93Å; F381-L394 HydrophobicContact CG-CD1 3.76Å; F381-L394 HydrophobicContact CZ-CD2 4.06Å; F381-I458 HydrophobicContact CD2-CG2 3.93Å; F381-I458 HydrophobicContact CE2-CG2 4.18Å; F381-H459 PolarHBondContact N-O 3.21Å
382	T	92	Very high	89.3	Confident	37 Å²	37	45.7 Å²	45.7	23%	0.227	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	161.5	172.8	62.2	0	0	0	0	112.4	D380 H459 D461	D380-T382 VanDerWaalsContact OD1-CB 3.24Å; D380-T382 WeakPolarHBondContact OD1-CB 3.13Å; D380-T382 VanDerWaalsContact OD1-CG2 3.22Å; D380-T382 WeakPolarHBondContact OD1-CG2 3.4Å; D380-T382 PolarHBondContact OD1-N 3.31Å; D380-T382 PolarHBondContact OD1-OG1 3.06Å; D380-T382 PolarHBondContact OD2-OG1 3.46Å; T382-H459 HydrophobicContact CG2-CB 4.45Å; T382-D461 WeakPolarHBondContact CA-OD2 3.26Å
383	G	87	Confident	89.7	Confident	16 Å²	16	40 Å²	40	17%	0.165	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.4	14.2	176	0	0	0	0	0	115.2	K320 D461	K320-G383 PolarHBondContact NZ-O 3.16Å; G383-D461 PolarHBondContact N-OD2 3.43Å
384	F	88.5	Confident	90.3	Very high	14 Å²	14	38.8 Å²	38.8	6%	0.061	19%	0.191	C	C	.	.			trans	-101.5	49.7	170.7	-64.5	-87.6	0	0	0	111	I319 K320 I323 L330 Y334 M335 F381 E386 D387 V390	I319-F384 HydrophobicContact CB-CE2 4.4Å; I319-F384 HydrophobicContact CG2-CE2 4.27Å; I319-F384 HydrophobicContact CG2-CZ 4.05Å; K320-F384 HydrophobicContact CB-CE2 4.31Å; K320-F384 HydrophobicContact CB-CZ 4.47Å; I323-F384 HydrophobicContact CD1-CE1 3.51Å; I323-F384 HydrophobicContact CD1-CZ 3.62Å; L330-F384 HydrophobicContact CD1-CD1 4.17Å; L330-F384 HydrophobicContact CD1-CE1 4.13Å; Y334-F384 HydrophobicContact CD1-CE1 4.09Å; M335-F384 HydrophobicContact CG-CD1 3.56Å; M335-F384 HydrophobicContact CG-CD2 4.48Å; M335-F384 HydrophobicContact CG-CE1 3.39Å; M335-F384 HydrophobicContact CG-CE2 4.35Å; M335-F384 HydrophobicContact CG-CG 4.1Å; M335-F384 HydrophobicContact CG-CZ 3.82Å; M335-F384 HydrophobicContact SD-CE1 3.8Å; M335-F384 HydrophobicContact SD-CZ 3.85Å; F381-F384 WeakPolarHBondContact O-CD2 3.22Å; F384-E386 PolarHBondContact O-N 3.4Å; F384-E386 VanDerWaalsContact O-N 3.08Å; F384-D387 HydrophobicContact CB-CB 4.21Å; F384-D387 PolarHBondContact O-N 3.26Å; F384-V390 HydrophobicContact CB-CG2 4.41Å
385	E	79.1	Confident	90.4	Very high	112 Å²	112	38.3 Å²	38.3	52%	0.523	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-29.2	-165.5	-50.6	-176	179.5	0	0	114.1	R487	E385-R487 IonicContact OE1-NH1 3.32Å; E385-R487 PolarHBondContact OE1-NH1 2.65Å; E385-R487 IonicContact OE2-CZ 3.64Å; E385-R487 IonicContact OE2-NH1 3.41Å; E385-R487 PolarHBondContact OE2-NH1 2.86Å; E385-R487 IonicContact OE2-NH2 3.15Å
386	E	81.1	Confident	90.4	Very high	126 Å²	126	33 Å²	33	59%	0.589	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81	-21.6	176.1	-63.1	178.8	-155.6	0	0	113.6	L332 F384 C388	L332-E386 HydrophobicContact CD1-CB 3.88Å; L332-E386 WeakPolarHBondContact CD1-O 3.33Å; F384-E386 PolarHBondContact O-N 3.4Å; F384-E386 VanDerWaalsContact O-N 3.08Å; E386-C388 VanDerWaalsContact C-N 3.31Å; E386-C388 PolarHBondContact O-N 3.26Å; E386-C388 VanDerWaalsContact O-N 3.13Å
387	D	87.9	Confident	90.3	Very high	7 Å²	7	33 Å²	33	4%	0.037	16%	0.164	C	C	.	.			trans	-89.7	68.4	179.2	-162.5	-21.3	0	0	0	110.4	N333 Y334 M335 T336 F384 R389 V390	N333-D387 VanDerWaalsContact CA-CG 3.45Å; N333-D387 WeakPolarHBondContact CA-OD2 3.37Å; Y334-D387 PolarHBondContact N-OD2 2.86Å; M335-D387 WeakPolarHBondContact CA-OD2 3.43Å; M335-D387 WeakPolarHBondContact CB-OD2 3.37Å; M335-D387 PolarHBondContact N-OD2 3.13Å; T336-D387 WeakPolarHBondContact CB-OD1 3.46Å; T336-D387 VanDerWaalsContact CG2-OD1 3.26Å; T336-D387 WeakPolarHBondContact CG2-OD1 3.35Å; T336-D387 PolarHBondContact N-OD2 2.91Å; T336-D387 PolarHBondContact OG1-OD1 3.01Å; T336-D387 PolarHBondContact OG1-OD2 2.74Å; F384-D387 HydrophobicContact CB-CB 4.21Å; F384-D387 PolarHBondContact O-N 3.26Å; D387-R389 PolarHBondContact O-N 3.19Å; D387-V390 HydrophobicContact CB-CG2 3.82Å; D387-V390 WeakPolarHBondContact O-CB 3.19Å; D387-V390 WeakPolarHBondContact O-CG2 3.1Å; D387-V390 PolarHBondContact O-N 3.43Å
388	C	81.6	Confident	90.2	Very high	51 Å²	51	29.3 Å²	29.3	35%	0.345	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-10.5	-177.7	-68.3	0	0	0	0	114.5	E386 S391 N463	E386-C388 VanDerWaalsContact C-N 3.31Å; E386-C388 PolarHBondContact O-N 3.26Å; E386-C388 VanDerWaalsContact O-N 3.13Å; C388-S391 PolarHBondContact O-OG 3.05Å; C388-N463 WeakPolarHBondContact CB-ND2 3.13Å; C388-N463 PolarHBondContact SG-ND2 2.94Å
389	R	88.2	Confident	89.8	Confident	130 Å²	130	28.3 Å²	28.3	49%	0.491	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-15.8	176.7	-72.8	173.2	161.8	-90	-7.1	113.6	T336 D387 S391 I392 E393	T336-R389 HydrophobicContact CG2-CB 3.68Å; D387-R389 PolarHBondContact O-N 3.19Å; R389-S391 VanDerWaalsContact C-N 3.29Å; R389-S391 PolarHBondContact O-N 2.92Å; R389-I392 WeakPolarHBondContact O-CB 3.06Å; R389-I392 PolarHBondContact O-N 3.36Å; R389-E393 PolarHBondContact O-N 3.12Å
390	V	92	Very high	89.5	Confident	7 Å²	7	28.1 Å²	28.1	4%	0.042	14%	0.14	C	C	.	.	H	α-helix	trans	-57.4	-41.8	179.8	172.6	0	0	0	0	111.4	M335 T336 L360 F381 F384 D387 I392 L394	M335-V390 HydrophobicContact CB-CG2 4.08Å; T336-V390 HydrophobicContact CG2-CG2 4.13Å; L360-V390 HydrophobicContact CD2-CB 4.42Å; L360-V390 HydrophobicContact CD2-CG1 4.41Å; L360-V390 HydrophobicContact CD2-CG2 4.26Å; F381-V390 HydrophobicContact CB-CG1 4.18Å; F384-V390 HydrophobicContact CB-CG2 4.41Å; D387-V390 HydrophobicContact CB-CG2 3.82Å; D387-V390 WeakPolarHBondContact O-CB 3.19Å; D387-V390 WeakPolarHBondContact O-CG2 3.1Å; D387-V390 PolarHBondContact O-N 3.43Å; V390-I392 VanDerWaalsContact C-N 3.35Å; V390-I392 PolarHBondContact O-N 2.96Å; V390-L394 HydrophobicContact CG1-CD1 3.59Å; V390-L394 HydrophobicContact CG1-CG 4.3Å; V390-L394 VanDerWaalsContact O-CB 3.29Å; V390-L394 WeakPolarHBondContact O-CB 3.09Å; V390-L394 VanDerWaalsContact O-CG 3.27Å; V390-L394 WeakPolarHBondContact O-CG 3.35Å; V390-L394 PolarHBondContact O-N 3.39Å
391	S	91.1	Very high	89.2	Confident	2 Å²	2	28 Å²	28	1%	0.014	14%	0.137	C	C	.	.	H	α-helix	trans	-65.4	-35.3	175.4	59.5	0	0	0	0	113.4	C388 R389 S395 N463	C388-S391 PolarHBondContact O-OG 3.05Å; R389-S391 VanDerWaalsContact C-N 3.29Å; R389-S391 PolarHBondContact O-N 2.92Å; S391-S395 WeakPolarHBondContact O-CB 3.33Å; S391-S395 PolarHBondContact O-N 3.05Å; S391-N463 PolarHBondContact OG-O 3Å
392	I	89.4	Confident	88.9	Confident	20 Å²	20	28.8 Å²	28.8	10%	0.103	14%	0.141	C	C	.	.	H	α-helix	trans	-72.1	-41.4	-178.6	-53.9	174.7	0	0	0	111.4	R389 V390 S395 V466 V469	R389-I392 WeakPolarHBondContact O-CB 3.06Å; R389-I392 PolarHBondContact O-N 3.36Å; V390-I392 VanDerWaalsContact C-N 3.35Å; V390-I392 PolarHBondContact O-N 2.96Å; I392-S395 PolarHBondContact O-OG 3.26Å; I392-V466 HydrophobicContact CD1-CB 4.3Å; I392-V466 HydrophobicContact CD1-CG2 3.78Å; I392-V469 HydrophobicContact CB-CG2 4.34Å; I392-V469 HydrophobicContact CG1-CG2 3.71Å
393	E	90.5	Very high	88.5	Confident	17 Å²	17	31.3 Å²	31.3	8%	0.079	15%	0.148	C	C	.	.	H	α-helix	trans	-77	-42.1	178.6	-61.6	-57	152	0	0	111.4	T336 L360 I364 R389 S395 R396 Y440	T336-E393 HydrophobicContact CG2-CG 4.37Å; L360-E393 HydrophobicContact CD2-CB 3.67Å; L360-E393 HydrophobicContact CD2-CG 4.29Å; I364-E393 HydrophobicContact CD1-CB 3.86Å; R389-E393 PolarHBondContact O-N 3.12Å; E393-S395 VanDerWaalsContact C-N 3.31Å; E393-S395 PolarHBondContact O-N 3.34Å; E393-R396 WeakPolarHBondContact O-CB 3.36Å; E393-R396 PolarHBondContact O-N 2.84Å; E393-R396 VanDerWaalsContact O-N 3.08Å; E393-R396 IonicContact OE1-CZ 2.76Å; E393-R396 IonicContact OE1-NH1 2.73Å; E393-R396 PolarHBondContact OE1-NH1 3.44Å; E393-R396 IonicContact OE2-CZ 3.13Å; E393-R396 IonicContact OE2-NE 3.93Å; E393-R396 IonicContact OE2-NH1 2.7Å; E393-R396 PolarHBondContact OE2-NH1 2.8Å; E393-Y440 PolarHBondContact OE2-OH 3.35Å
394	L	94	Very high	88.2	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-65	-31.4	176.4	-70.3	174.3	0	0	0	113	L360 I364 F381 V390 R396 L397 I458 L460 F483	L360-L394 HydrophobicContact CD1-CD2 4.08Å; L360-L394 HydrophobicContact CD1-CG 4.37Å; I364-L394 HydrophobicContact CG1-CD2 4.27Å; F381-L394 HydrophobicContact CB-CD1 3.87Å; F381-L394 HydrophobicContact CD1-CD1 4.33Å; F381-L394 HydrophobicContact CD2-CD1 3.78Å; F381-L394 HydrophobicContact CD2-CD2 4.23Å; F381-L394 HydrophobicContact CE1-CD2 4.46Å; F381-L394 HydrophobicContact CE2-CD1 4.33Å; F381-L394 HydrophobicContact CE2-CD2 3.93Å; F381-L394 HydrophobicContact CG-CD1 3.76Å; F381-L394 HydrophobicContact CZ-CD2 4.06Å; V390-L394 HydrophobicContact CG1-CD1 3.59Å; V390-L394 HydrophobicContact CG1-CG 4.3Å; V390-L394 VanDerWaalsContact O-CB 3.29Å; V390-L394 WeakPolarHBondContact O-CB 3.09Å; V390-L394 VanDerWaalsContact O-CG 3.27Å; V390-L394 WeakPolarHBondContact O-CG 3.35Å; V390-L394 PolarHBondContact O-N 3.39Å; L394-R396 PolarHBondContact O-N 3.26Å; L394-R396 VanDerWaalsContact O-N 3.14Å; L394-L397 HydrophobicContact CD2-CD1 3.92Å; L394-L397 WeakPolarHBondContact O-CB 3.24Å; L394-L397 PolarHBondContact O-N 2.7Å; L394-I458 HydrophobicContact CD1-CG2 3.93Å; L394-I458 HydrophobicContact CD2-CG2 4.29Å; L394-L460 HydrophobicContact CD1-CB 4.32Å; L394-F483 WeakPolarHBondContact O-CZ 3.45Å
395	S	91.8	Very high	87.8	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.007	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-12.9	174.9	83.4	0	0	0	0	113.3	S391 I392 E393 P398 E468 G472	S391-S395 WeakPolarHBondContact O-CB 3.33Å; S391-S395 PolarHBondContact O-N 3.05Å; I392-S395 PolarHBondContact O-OG 3.26Å; E393-S395 VanDerWaalsContact C-N 3.31Å; E393-S395 PolarHBondContact O-N 3.34Å; S395-P398 VanDerWaalsContact O-CD 3.29Å; S395-P398 WeakPolarHBondContact O-CD 3.45Å; S395-E468 PolarHBondContact OG-O 3.25Å; S395-E468 VanDerWaalsContact OG-O 3.07Å; S395-G472 CarbonylContact O-C 3.55Å; S395-G472 WeakPolarHBondContact O-CA 3.38Å
396	R	90.7	Very high	87.9	Confident	14 Å²	14	39.4 Å²	39.4	5%	0.053	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-15.6	177.2	-63	170.8	180	160.5	4.6	113.2	E393 L394 P398 I399 L400 I436 E468	E393-R396 WeakPolarHBondContact O-CB 3.36Å; E393-R396 PolarHBondContact O-N 2.84Å; E393-R396 VanDerWaalsContact O-N 3.08Å; E393-R396 IonicContact OE1-CZ 2.76Å; E393-R396 IonicContact OE1-NH1 2.73Å; E393-R396 PolarHBondContact OE1-NH1 3.44Å; E393-R396 IonicContact OE2-CZ 3.13Å; E393-R396 IonicContact OE2-NE 3.93Å; E393-R396 IonicContact OE2-NH1 2.7Å; E393-R396 PolarHBondContact OE2-NH1 2.8Å; L394-R396 PolarHBondContact O-N 3.26Å; L394-R396 VanDerWaalsContact O-N 3.14Å; R396-P398 VanDerWaalsContact C-CD 3.49Å; R396-I399 HydrophobicContact CB-CG2 4.4Å; R396-I399 WeakPolarHBondContact O-CG2 3.32Å; R396-I399 PolarHBondContact O-N 2.71Å; R396-L400 HydrophobicContact CB-CD1 3.98Å; R396-L400 HydrophobicContact CB-CG 4.38Å; R396-L400 WeakPolarHBondContact O-CB 3.39Å; R396-L400 WeakPolarHBondContact O-CG 3.45Å; R396-L400 PolarHBondContact O-N 3.27Å; R396-I436 HydrophobicContact CG-CG1 4.19Å; R396-E468 IonicContact CZ-OE2 2.72Å; R396-E468 IonicContact NE-OE2 3.77Å; R396-E468 IonicContact NH2-OE2 3.79Å; R396-E468 PolarHBondContact NH2-OE2 2.72Å
397	L	92.8	Very high	87.8	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-50.6	-45.7	178.8	-77.8	167.8	0	0	0	114.2	I364 L367 L368 L394 W401 I458 F481	I364-L397 HydrophobicContact CB-CD2 4.39Å; I364-L397 HydrophobicContact CG1-CD2 4.33Å; I364-L397 HydrophobicContact CG2-CD2 3.96Å; L367-L397 HydrophobicContact CB-CD2 4.25Å; L367-L397 HydrophobicContact CD1-CD1 4.24Å; L368-L397 HydrophobicContact CD1-CD2 4.17Å; L368-L397 HydrophobicContact CD2-CD2 4.19Å; L368-L397 HydrophobicContact CG-CD2 3.89Å; L394-L397 HydrophobicContact CD2-CD1 3.92Å; L394-L397 WeakPolarHBondContact O-CB 3.24Å; L394-L397 PolarHBondContact O-N 2.7Å; L397-W401 WeakPolarHBondContact O-CB 3.46Å; L397-W401 PolarHBondContact O-N 2.82Å; L397-I458 HydrophobicContact CD1-CD1 4.38Å; L397-I458 HydrophobicContact CD1-CG1 4.2Å; L397-F481 HydrophobicContact CB-CD1 4.36Å; L397-F481 HydrophobicContact CB-CD2 4.1Å; L397-F481 HydrophobicContact CB-CE1 4.43Å; L397-F481 HydrophobicContact CB-CE2 4.19Å; L397-F481 HydrophobicContact CB-CG 4.2Å; L397-F481 HydrophobicContact CB-CZ 4.34Å; L397-F481 HydrophobicContact CD1-CD1 4.21Å; L397-F481 HydrophobicContact CD1-CE1 4.18Å; L397-F481 HydrophobicContact CD2-CE1 4.25Å; L397-F481 HydrophobicContact CD2-CZ 4.07Å
398	P	91.4	Very high	87.4	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-63.7	-45	-179.6	-23.9	36.9	0	0	0	112.8	S395 R396 W401 M402 L475 T479 F483	S395-P398 VanDerWaalsContact O-CD 3.29Å; S395-P398 WeakPolarHBondContact O-CD 3.45Å; R396-P398 VanDerWaalsContact C-CD 3.49Å; P398-W401 PolarHBondContact O-N 2.88Å; P398-M402 WeakPolarHBondContact O-CG 3.42Å; P398-M402 PolarHBondContact O-N 3.06Å; P398-L475 HydrophobicContact CB-CB 3.88Å; P398-T479 HydrophobicContact CB-CG2 3.65Å; P398-F483 HydrophobicContact CG-CE2 3.73Å; P398-F483 HydrophobicContact CG-CZ 4.02Å
399	I	88.8	Confident	87.3	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-75.7	-30.3	-177	-178.1	63.5	0	0	0	112.1	R396 M402 R407 Y432 F433 I436 L475	R396-I399 HydrophobicContact CB-CG2 4.4Å; R396-I399 WeakPolarHBondContact O-CG2 3.32Å; R396-I399 PolarHBondContact O-N 2.71Å; I399-M402 HydrophobicContact CD1-SD 4.06Å; I399-R407 HydrophobicContact CD1-CB 4.12Å; I399-R407 HydrophobicContact CD1-CG 3.75Å; I399-R407 PolarHBondContact O-NE 3.29Å; I399-Y432 HydrophobicContact CG2-CE1 4.43Å; I399-F433 HydrophobicContact CD1-CD1 4.09Å; I399-F433 HydrophobicContact CD1-CE1 3.58Å; I399-F433 HydrophobicContact CD1-CZ 3.98Å; I399-F433 HydrophobicContact CG1-CD1 4.03Å; I399-F433 HydrophobicContact CG1-CE1 3.84Å; I399-I436 HydrophobicContact CB-CD1 4.44Å; I399-I436 HydrophobicContact CG1-CD1 4.03Å; I399-I436 HydrophobicContact CG2-CD1 3.54Å; I399-L475 HydrophobicContact CB-CD1 4.03Å; I399-L475 HydrophobicContact CD1-CD1 4.42Å
400	L	89.5	Confident	87	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-67.5	-42.5	169.4	-71.9	168.5	0	0	0	112	I364 L368 R396 M402 R407 I436 Y440 H449	I364-L400 HydrophobicContact CG2-CD1 4.16Å; L368-L400 HydrophobicContact CD1-CB 3.73Å; L368-L400 HydrophobicContact CD1-CD1 3.89Å; L368-L400 HydrophobicContact CD1-CG 4.41Å; L368-L400 HydrophobicContact CD2-CB 4.23Å; R396-L400 HydrophobicContact CB-CD1 3.98Å; R396-L400 HydrophobicContact CB-CG 4.38Å; R396-L400 WeakPolarHBondContact O-CB 3.39Å; R396-L400 WeakPolarHBondContact O-CG 3.45Å; R396-L400 PolarHBondContact O-N 3.27Å; L400-M402 VanDerWaalsContact C-N 3.32Å; L400-M402 PolarHBondContact O-N 3.44Å; L400-R407 PolarHBondContact O-NH2 2.96Å; L400-R407 VanDerWaalsContact O-NH2 3.11Å; L400-I436 HydrophobicContact CD2-CG2 3.59Å; L400-I436 HydrophobicContact CG-CG2 4.15Å; L400-Y440 HydrophobicContact CD1-CD1 3.98Å; L400-Y440 HydrophobicContact CD1-CD2 4.02Å; L400-Y440 HydrophobicContact CD1-CE1 3.78Å; L400-Y440 HydrophobicContact CD1-CE2 3.84Å; L400-Y440 HydrophobicContact CD1-CG 4.1Å; L400-Y440 HydrophobicContact CD2-CD1 4.05Å; L400-Y440 HydrophobicContact CD2-CD2 3.72Å; L400-Y440 HydrophobicContact CD2-CE2 4.38Å; L400-Y440 HydrophobicContact CD2-CG 3.54Å; L400-Y440 HydrophobicContact CG-CD2 4.45Å; L400-Y440 HydrophobicContact CG-CG 4.49Å; L400-H449 PolarHBondContact O-CE1 3.45Å; L400-H449 PolarHBondContact O-ND1 3.47Å
401	W	91.1	Very high	86.5	Confident	32 Å²	32	34.5 Å²	34.5	12%	0.121	18%	0.176	C	C	.	.	H	α-helix	trans	-66	-33	176	177.3	86.7	0	0	0	112.6	L368 L397 P398 K403 H449 G450 E451 F453 L478 T479 P480 F481	L368-W401 HydrophobicContact CD2-CB 3.86Å; L397-W401 WeakPolarHBondContact O-CB 3.46Å; L397-W401 PolarHBondContact O-N 2.82Å; P398-W401 PolarHBondContact O-N 2.88Å; W401-K403 PolarHBondContact O-N 3Å; W401-H449 CarbonylContact O-C 3.5Å; W401-H449 WeakPolarHBondContact O-CA 3.34Å; W401-G450 PolarHBondContact O-N 3.19Å; W401-E451 WeakPolarHBondContact CZ2-O 3.41Å; W401-E451 PolarHBondContact NE1-O 2.76Å; W401-F453 AromaticContact CD1-CE1 3.77Å; W401-F453 AromaticContact NE1-CE1 3.56Å; W401-L478 WeakPolarHBondContact CZ3-O 3.42Å; W401-T479 HydrophobicContact CE3-CG2 3.57Å; W401-T479 HydrophobicContact CZ3-CG2 3.91Å; W401-P480 HydrophobicContact CD2-CG 4.26Å; W401-P480 VanDerWaalsContact CE2-CD 3.44Å; W401-P480 HydrophobicContact CZ2-CG 4.16Å; W401-F481 HydrophobicContact CB-CE2 3.9Å; W401-F481 HydrophobicContact CG-CE2 4.19Å
402	M	87.7	Confident	86.1	Confident	19 Å²	19	34.5 Å²	34.5	9%	0.094	18%	0.176	C	C	.	.	S	Bend	trans	-57.8	130.8	173.3	-74.5	176	69.9	0	0	111.5	P398 I399 L400 N406 R407 V412 L478 T479	P398-M402 WeakPolarHBondContact O-CG 3.42Å; P398-M402 PolarHBondContact O-N 3.06Å; I399-M402 HydrophobicContact CD1-SD 4.06Å; L400-M402 VanDerWaalsContact C-N 3.32Å; L400-M402 PolarHBondContact O-N 3.44Å; M402-N406 HydrophobicContact CE-CB 3.95Å; M402-N406 WeakPolarHBondContact CE-O 3.27Å; M402-R407 HydrophobicContact CB-CG 4.33Å; M402-R407 PolarHBondContact O-NE 3.17Å; M402-R407 PolarHBondContact O-NH2 3.05Å; M402-V412 HydrophobicContact CE-CG2 3.99Å; M402-L478 HydrophobicContact SD-CD1 4.49Å; M402-T479 HydrophobicContact CG-CG2 4.42Å
403	K	84.4	Confident	85.8	Confident	90 Å²	90	36.5 Å²	36.5	39%	0.391	18%	0.183	S	C	.	.			trans	-49.7	139.4	171.2	-66.1	-167.9	173.4	-164	0	111.5	W401 E405 N406 R407 H449	W401-K403 PolarHBondContact O-N 3Å; K403-E405 PolarHBondContact O-N 3.05Å; K403-E405 VanDerWaalsContact O-N 3.14Å; K403-N406 WeakPolarHBondContact O-CA 3.13Å; K403-N406 WeakPolarHBondContact O-CB 3.5Å; K403-N406 PolarHBondContact O-N 2.83Å; K403-R407 PolarHBondContact O-N 3.19Å; K403-H449 WeakPolarHBondContact CE-O 3.29Å; K403-H449 HydrophobicContact CG-CB 4.2Å; K403-H449 WeakPolarHBondContact CG-O 3.39Å
404	P	81.1	Confident	85.4	Confident	69 Å²	69	41.8 Å²	41.8	45%	0.448	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-49.9	-41.4	179.6	-30.2	35.9	0	0	0	113.6	N406 R407	P404-N406 PolarHBondContact O-N 3.43Å; P404-R407 PolarHBondContact O-N 2.84Å; P404-R407 VanDerWaalsContact O-N 3.1Å
405	E	80.1	Confident	84.8	Confident	154 Å²	154	44.2 Å²	44.2	72%	0.72	21%	0.213	S	C	*	.	G	3₁₀ helix	trans	-50	-38.4	173.6	-60.7	145.1	-122.3	0	0	113.6	K403	K403-E405 PolarHBondContact O-N 3.05Å; K403-E405 VanDerWaalsContact O-N 3.14Å
406	N	80.5	Confident	84.3	Confident	88 Å²	88	44.2 Å²	44.2	47%	0.471	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-87.5	-10.4	-174.9	-70.3	-34.8	0	0	0	113.2	M402 K403 P404 N408	M402-N406 HydrophobicContact CE-CB 3.95Å; M402-N406 WeakPolarHBondContact CE-O 3.27Å; K403-N406 WeakPolarHBondContact O-CA 3.13Å; K403-N406 WeakPolarHBondContact O-CB 3.5Å; K403-N406 PolarHBondContact O-N 2.83Å; P404-N406 PolarHBondContact O-N 3.43Å; N406-N408 PolarHBondContact O-N 2.99Å
407	R	79.5	Confident	83.7	Confident	27 Å²	27	47.1 Å²	47.1	10%	0.102	23%	0.228	C	C	.	.			trans	-76.9	33.7	178.6	-53.2	-167.4	-166.4	143.2	15.8	113.2	I399 L400 M402 K403 P404 S409 F433 E444 H449	I399-R407 HydrophobicContact CD1-CB 4.12Å; I399-R407 HydrophobicContact CD1-CG 3.75Å; I399-R407 PolarHBondContact O-NE 3.29Å; L400-R407 PolarHBondContact O-NH2 2.96Å; L400-R407 VanDerWaalsContact O-NH2 3.11Å; M402-R407 HydrophobicContact CB-CG 4.33Å; M402-R407 PolarHBondContact O-NE 3.17Å; M402-R407 PolarHBondContact O-NH2 3.05Å; K403-R407 PolarHBondContact O-N 3.19Å; P404-R407 PolarHBondContact O-N 2.84Å; P404-R407 VanDerWaalsContact O-N 3.1Å; R407-S409 PolarHBondContact O-N 3.29Å; R407-F433 WeakPolarHBondContact O-CD2 3.42Å; R407-F433 WeakPolarHBondContact O-CE2 3.36Å; R407-E444 IonicContact CZ-OE1 3.09Å; R407-E444 IonicContact CZ-OE2 2.73Å; R407-E444 IonicContact NH1-OE1 3.78Å; R407-E444 PolarHBondContact NH1-OE1 3.01Å; R407-E444 IonicContact NH1-OE2 3.17Å; R407-E444 PolarHBondContact NH1-OE2 2.95Å; R407-E444 IonicContact NH2-OE1 2.68Å; R407-E444 PolarHBondContact NH2-OE1 3.01Å; R407-E444 IonicContact NH2-OE2 2.71Å; R407-H449 PolarHBondContact NH2-CE1 3.28Å; R407-H449 PolarHBondContact NH2-ND1 2.85Å
408	N	80.3	Confident	83	Confident	80 Å²	80	50.2 Å²	50.2	43%	0.428	25%	0.254	S	S	.	.			trans	-74.4	123.3	176.8	179.3	-12	0	0	0	110.1	N406 E410 S411 V412	N406-N408 PolarHBondContact O-N 2.99Å; N408-E410 PolarHBondContact O-N 3.03Å; N408-E410 VanDerWaalsContact O-N 3.15Å; N408-E410 PolarHBondContact OD1-N 3.48Å; N408-S411 PolarHBondContact O-N 2.24Å; N408-V412 PolarHBondContact O-N 3.48Å
409	S	79.3	Confident	82.2	Confident	9 Å²	9	51.6 Å²	51.6	6%	0.063	26%	0.263	C	S	.	.	H	α-helix	trans	-52.6	-36.7	179.4	60.2	0	0	0	0	112.6	R407 R413 E430	R407-S409 PolarHBondContact O-N 3.29Å; S409-R413 WeakPolarHBondContact O-CB 3.42Å; S409-R413 PolarHBondContact O-N 3.3Å; S409-E430 PolarHBondContact OG-OE1 3.15Å
410	E	81.7	Confident	81.4	Confident	47 Å²	47	51.8 Å²	51.8	22%	0.22	26%	0.264	C	S	.	.	H	α-helix	trans	-77.1	-30.9	179.7	179.5	48	-142.7	0	0	113.5	N408 R413 R414	N408-E410 PolarHBondContact O-N 3.03Å; N408-E410 VanDerWaalsContact O-N 3.15Å; N408-E410 PolarHBondContact OD1-N 3.48Å; E410-R413 IonicContact OE1-CZ 3.72Å; E410-R413 IonicContact OE1-NE 3.86Å; E410-R413 IonicContact OE1-NH2 2.79Å; E410-R413 PolarHBondContact OE1-NH2 2.98Å; E410-R413 IonicContact OE2-CZ 3.25Å; E410-R413 VanDerWaalsContact OE2-CZ 3.25Å; E410-R413 IonicContact OE2-NE 2.76Å; E410-R413 PolarHBondContact OE2-NE 3.32Å; E410-R413 IonicContact OE2-NH2 2.93Å; E410-R413 PolarHBondContact OE2-NH2 3.26Å; E410-R414 PolarHBondContact O-N 3.11Å; E410-R414 PolarHBondContact O-NE 3.17Å; E410-R414 VanDerWaalsContact O-NE 3.15Å; E410-R414 PolarHBondContact O-NH2 3.19Å; E410-R414 WeakPolarHBondContact OE1-CD 3.43Å; E410-R414 IonicContact OE1-NE 2.97Å; E410-R414 PolarHBondContact OE1-NE 2.81Å
411	S	80.7	Confident	80.8	Confident	56 Å²	56	57.8 Å²	57.8	39%	0.392	29%	0.292	S	S	.	.	H	α-helix	trans	-72.2	-48.7	175.7	-157.4	0	0	0	0	110.6	N408 R414 H415	N408-S411 PolarHBondContact O-N 2.24Å; S411-R414 PolarHBondContact O-N 3.07Å; S411-H415 PolarHBondContact O-N 3.28Å
412	V	83.2	Confident	80	Confident	2 Å²	2	57 Å²	57	1%	0.012	29%	0.29	C	S	.	.	H	α-helix	trans	-64	-42.9	177.4	165.6	0	0	0	0	111.2	M402 N408 R414 H415 L416 L429 F433 L475	M402-V412 HydrophobicContact CE-CG2 3.99Å; N408-V412 PolarHBondContact O-N 3.48Å; V412-R414 VanDerWaalsContact C-N 3.26Å; V412-R414 PolarHBondContact O-N 3.16Å; V412-H415 PolarHBondContact O-N 3.44Å; V412-H415 VanDerWaalsContact O-N 3.11Å; V412-L416 HydrophobicContact CG1-CD1 3.44Å; V412-L416 VanDerWaalsContact CG1-CD1 3.44Å; V412-L416 HydrophobicContact CG1-CG 3.93Å; V412-L416 WeakPolarHBondContact O-CB 3.33Å; V412-L416 VanDerWaalsContact O-CG 3.24Å; V412-L416 WeakPolarHBondContact O-CG 3.15Å; V412-L416 PolarHBondContact O-N 2.87Å; V412-L429 HydrophobicContact CG1-CD2 4.41Å; V412-F433 HydrophobicContact CB-CE2 4.39Å; V412-F433 HydrophobicContact CB-CZ 3.8Å; V412-F433 HydrophobicContact CG1-CE1 4.47Å; V412-F433 HydrophobicContact CG1-CZ 3.73Å; V412-F433 HydrophobicContact CG2-CE2 4.46Å; V412-F433 HydrophobicContact CG2-CZ 3.86Å; V412-L475 HydrophobicContact CG1-CD1 4.37Å; V412-L475 HydrophobicContact CG1-CD2 3.8Å; V412-L475 HydrophobicContact CG2-CD2 4.43Å
413	R	82.9	Confident	79.1	Confident	62 Å²	62	59.1 Å²	59.1	23%	0.234	32%	0.316	C	S	.	.	H	α-helix	trans	-53.8	-41.7	174.8	-170.5	-175	70.1	79.4	6.2	112.5	S409 E410 L416 M417 L429	S409-R413 WeakPolarHBondContact O-CB 3.42Å; S409-R413 PolarHBondContact O-N 3.3Å; E410-R413 IonicContact OE1-CZ 3.72Å; E410-R413 IonicContact OE1-NE 3.86Å; E410-R413 IonicContact OE1-NH2 2.79Å; E410-R413 PolarHBondContact OE1-NH2 2.98Å; E410-R413 IonicContact OE2-CZ 3.25Å; E410-R413 VanDerWaalsContact OE2-CZ 3.25Å; E410-R413 IonicContact OE2-NE 2.76Å; E410-R413 PolarHBondContact OE2-NE 3.32Å; E410-R413 IonicContact OE2-NH2 2.93Å; E410-R413 PolarHBondContact OE2-NH2 3.26Å; R413-L416 PolarHBondContact O-N 3.13Å; R413-M417 HydrophobicContact CG-SD 4.42Å; R413-M417 PolarHBondContact NH1-SD 3.02Å; R413-M417 WeakPolarHBondContact O-CG 3.17Å; R413-M417 PolarHBondContact O-N 3.31Å; R413-L429 HydrophobicContact CB-CD1 3.54Å; R413-L429 HydrophobicContact CG-CD1 3.97Å
414	R	82.4	Confident	78.8	Confident	128 Å²	128	55.2 Å²	55.2	48%	0.483	30%	0.299	S	S	.	.	H	α-helix	trans	-66.2	-42.4	177.5	-81.9	179.6	-81.6	109.2	-5.3	112.5	E410 S411 V412 M417 A418	E410-R414 PolarHBondContact O-N 3.11Å; E410-R414 PolarHBondContact O-NE 3.17Å; E410-R414 VanDerWaalsContact O-NE 3.15Å; E410-R414 PolarHBondContact O-NH2 3.19Å; E410-R414 WeakPolarHBondContact OE1-CD 3.43Å; E410-R414 IonicContact OE1-NE 2.97Å; E410-R414 PolarHBondContact OE1-NE 2.81Å; S411-R414 PolarHBondContact O-N 3.07Å; V412-R414 VanDerWaalsContact C-N 3.26Å; V412-R414 PolarHBondContact O-N 3.16Å; R414-M417 PolarHBondContact O-N 2.9Å; R414-A418 PolarHBondContact O-N 3.41Å
415	H	81.4	Confident	78.7	Confident	50 Å²	50	55.5 Å²	55.5	23%	0.231	30%	0.301	C	S	.	.	H	α-helix	trans	-62.9	-43.5	173.8	-170.5	72	0	0	0	112	S411 V412 M417 A418 S419 T477 L478	S411-H415 PolarHBondContact O-N 3.28Å; V412-H415 PolarHBondContact O-N 3.44Å; V412-H415 VanDerWaalsContact O-N 3.11Å; H415-M417 PolarHBondContact O-N 3Å; H415-A418 WeakPolarHBondContact O-CB 3.41Å; H415-A418 PolarHBondContact O-N 3.47Å; H415-S419 WeakPolarHBondContact O-CB 3.39Å; H415-S419 PolarHBondContact O-N 3.43Å; H415-S419 PolarHBondContact O-OG 3.16Å; H415-T477 PolarHBondContact NE2-OG1 3.21Å; H415-T477 VanDerWaalsContact NE2-OG1 3.1Å; H415-L478 HydrophobicContact CB-CD1 4.33Å; H415-L478 VanDerWaalsContact CE1-CD2 3.49Å; H415-L478 WeakPolarHBondContact CE1-CD2 3.28Å
416	L	81.3	Confident	78.7	Confident	1 Å²	1	54.5 Å²	54.5	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-66.5	-36.7	179.8	-65.3	171.5	0	0	0	112.9	V412 R413 S419 L420 I424 L429 L471 S474 L475	V412-L416 HydrophobicContact CG1-CD1 3.44Å; V412-L416 VanDerWaalsContact CG1-CD1 3.44Å; V412-L416 HydrophobicContact CG1-CG 3.93Å; V412-L416 WeakPolarHBondContact O-CB 3.33Å; V412-L416 VanDerWaalsContact O-CG 3.24Å; V412-L416 WeakPolarHBondContact O-CG 3.15Å; V412-L416 PolarHBondContact O-N 2.87Å; R413-L416 PolarHBondContact O-N 3.13Å; L416-S419 PolarHBondContact O-OG 3.3Å; L416-L420 WeakPolarHBondContact O-CB 3Å; L416-L420 PolarHBondContact O-N 3.01Å; L416-I424 HydrophobicContact CB-CD1 3.69Å; L416-I424 HydrophobicContact CD1-CD1 3.97Å; L416-I424 HydrophobicContact CG-CD1 4.39Å; L416-L429 HydrophobicContact CD1-CD1 4.24Å; L416-L429 HydrophobicContact CD1-CD2 3.58Å; L416-L471 HydrophobicContact CD1-CD2 3.95Å; L416-S474 WeakPolarHBondContact CD2-OG 2.97Å; L416-L475 HydrophobicContact CD2-CD2 3.98Å; L416-L475 HydrophobicContact CD2-CG 4.32Å; L416-L475 HydrophobicContact CG-CD2 4.33Å
417	M	78.8	Confident	78.8	Confident	76 Å²	76	58.7 Å²	58.7	37%	0.374	31%	0.305	S	S	.	.	H	α-helix	trans	-67.3	-38.9	171.5	-73.3	-175	73	0	0	111.7	R413 R414 H415 H421 I422	R413-M417 HydrophobicContact CG-SD 4.42Å; R413-M417 PolarHBondContact NH1-SD 3.02Å; R413-M417 WeakPolarHBondContact O-CG 3.17Å; R413-M417 PolarHBondContact O-N 3.31Å; R414-M417 PolarHBondContact O-N 2.9Å; H415-M417 PolarHBondContact O-N 3Å; M417-H421 WeakPolarHBondContact O-CA 3.44Å; M417-H421 PolarHBondContact O-N 3.32Å; M417-H421 PolarHBondContact O-ND1 3.43Å; M417-H421 VanDerWaalsContact O-ND1 3.17Å; M417-I422 WeakPolarHBondContact CG-O 3.07Å
418	A	76.9	Confident	78.8	Confident	65 Å²	65	59.5 Å²	59.5	54%	0.537	31%	0.308	S	S	.	.	H	α-helix	trans	-64.8	-46.4	174.4	0	0	0	0	0	111.9	R414 H415 H421	R414-A418 PolarHBondContact O-N 3.41Å; H415-A418 WeakPolarHBondContact O-CB 3.41Å; H415-A418 PolarHBondContact O-N 3.47Å; A418-H421 PolarHBondContact O-CE1 3.41Å; A418-H421 PolarHBondContact O-ND1 3.4Å; A418-H421 VanDerWaalsContact O-ND1 3.12Å
419	S	73.8	Confident	78.9	Confident	28 Å²	28	55.7 Å²	55.7	20%	0.196	29%	0.288	C	S	.	.	H	α-helix	trans	-76.7	-45.4	-175.8	66.4	0	0	0	0	113.3	H415 L416 R505	H415-S419 WeakPolarHBondContact O-CB 3.39Å; H415-S419 PolarHBondContact O-N 3.43Å; H415-S419 PolarHBondContact O-OG 3.16Å; L416-S419 PolarHBondContact O-OG 3.3Å; S419-R505 WeakPolarHBondContact O-CD 3.4Å; S419-R505 PolarHBondContact O-NH1 2.93Å
420	L	73.5	Confident	79.1	Confident	4 Å²	4	58.6 Å²	58.6	2%	0.021	30%	0.3	C	S	.	.	H	α-helix	trans	-99.9	-19.1	-175	-65.2	176.7	0	0	0	115	L416 I422 S474 F498 S502 L506	L416-L420 WeakPolarHBondContact O-CB 3Å; L416-L420 PolarHBondContact O-N 3.01Å; L420-I422 HydrophobicContact CB-CB 4.35Å; L420-I422 HydrophobicContact CB-CD1 4.1Å; L420-I422 HydrophobicContact CB-CG1 4.19Å; L420-I422 PolarHBondContact O-N 3.05Å; L420-S474 WeakPolarHBondContact CD1-OG 3.14Å; L420-F498 HydrophobicContact CD1-CE2 3.88Å; L420-F498 HydrophobicContact CD2-CE2 3.75Å; L420-F498 HydrophobicContact CD2-CZ 3.98Å; L420-F498 HydrophobicContact CG-CE2 4.37Å; L420-S502 PolarHBondContact O-OG 2.99Å; L420-L506 HydrophobicContact CD2-CD2 3.98Å; L420-L506 HydrophobicContact CD2-CG 4.22Å
421	H	75.8	Confident	79.1	Confident	126 Å²	126	58.3 Å²	58.3	58%	0.583	31%	0.306	S	S	*	.			trans	58.4	24.5	-169.2	-57.2	-6.3	0	0	0	114.6	M417 A418 R505	M417-H421 WeakPolarHBondContact O-CA 3.44Å; M417-H421 PolarHBondContact O-N 3.32Å; M417-H421 PolarHBondContact O-ND1 3.43Å; M417-H421 VanDerWaalsContact O-ND1 3.17Å; A418-H421 PolarHBondContact O-CE1 3.41Å; A418-H421 PolarHBondContact O-ND1 3.4Å; A418-H421 VanDerWaalsContact O-ND1 3.12Å; H421-R505 PolarHBondContact CD2-NH1 2.9Å; H421-R505 VanDerWaalsContact CD2-NH1 3.29Å; H421-R505 PolarHBondContact CD2-NH2 2.9Å; H421-R505 PolarHBondContact CE1-NH1 2.65Å; H421-R505 VanDerWaalsContact CG-NH1 3.28Å; H421-R505 PolarHBondContact ND1-NH1 2.82Å; H421-R505 VanDerWaalsContact ND1-NH1 3.2Å; H421-R505 PolarHBondContact NE2-NH1 2.88Å; H421-R505 VanDerWaalsContact NE2-NH1 3.14Å; H421-R505 PolarHBondContact NE2-NH2 3.33Å
422	I	74	Confident	79.1	Confident	17 Å²	17	55.8 Å²	55.8	9%	0.087	29%	0.288	C	S	.	.			trans	-104	131.6	178.8	-63	168.2	0	0	0	109.8	M417 L420 I424 I496 F498	M417-I422 WeakPolarHBondContact CG-O 3.07Å; L420-I422 HydrophobicContact CB-CB 4.35Å; L420-I422 HydrophobicContact CB-CD1 4.1Å; L420-I422 HydrophobicContact CB-CG1 4.19Å; L420-I422 PolarHBondContact O-N 3.05Å; I422-I424 HydrophobicContact CG2-CG1 4.13Å; I422-I424 PolarHBondContact O-N 3.28Å; I422-I424 VanDerWaalsContact O-N 3.13Å; I422-I496 HydrophobicContact CG2-CG2 3.68Å; I422-F498 HydrophobicContact CD1-CB 4.05Å; I422-F498 HydrophobicContact CD1-CD2 3.25Å; I422-F498 HydrophobicContact CD1-CE2 3.77Å; I422-F498 HydrophobicContact CD1-CG 3.75Å
423	G	70.6	Confident	79.1	Confident	62 Å²	62	56.5 Å²	56.5	64%	0.639	29%	0.291	S	S	*	.			trans	-75.2	94.4	174.1	0	0	0	0	0	111.9
424	I	76.7	Confident	79	Confident	8 Å²	8	57 Å²	57	4%	0.041	30%	0.304	C	S	.	.			trans	-90.4	124.2	-178.8	-62	152.4	0	0	0	110.2	L416 I422 R426 R428 L429 L471 I496	L416-I424 HydrophobicContact CB-CD1 3.69Å; L416-I424 HydrophobicContact CD1-CD1 3.97Å; L416-I424 HydrophobicContact CG-CD1 4.39Å; I422-I424 HydrophobicContact CG2-CG1 4.13Å; I422-I424 PolarHBondContact O-N 3.28Å; I422-I424 VanDerWaalsContact O-N 3.13Å; I424-R426 PolarHBondContact O-N 3.11Å; I424-R428 HydrophobicContact CG2-CB 4.44Å; I424-L429 HydrophobicContact CG2-CD1 4.06Å; I424-L429 HydrophobicContact CG2-CD2 4.13Å; I424-L429 HydrophobicContact CG2-CG 3.82Å; I424-L471 HydrophobicContact CD1-CD2 3.61Å; I424-L471 HydrophobicContact CG1-CD2 4.26Å; I424-L471 HydrophobicContact CG2-CD2 4.23Å; I424-I496 HydrophobicContact CG1-CD1 4.49Å
425	P	78.8	Confident	78.8	Confident	75 Å²	75	57.1 Å²	57.1	49%	0.487	30%	0.304	S	S	.	.			trans	-62.2	132	178.2	-23.8	34.1	0	0	0	112.4	K427 R428	P425-K427 VanDerWaalsContact C-N 3.31Å; P425-K427 PolarHBondContact O-N 3.08Å; P425-R428 HydrophobicContact CB-CB 4.43Å; P425-R428 WeakPolarHBondContact O-CA 3.29Å; P425-R428 WeakPolarHBondContact O-CB 3.3Å; P425-R428 PolarHBondContact O-N 2.91Å
426	R	81	Confident	78.7	Confident	134 Å²	134	54.8 Å²	54.8	51%	0.506	29%	0.294	S	S	.	.	H	α-helix	trans	-53.8	-43.3	-177.8	178.8	178.2	157.5	155.3	4.6	113.4	I424 R428 L429 E430	I424-R426 PolarHBondContact O-N 3.11Å; R426-R428 PolarHBondContact O-N 2.76Å; R426-R428 VanDerWaalsContact O-N 3.14Å; R426-L429 PolarHBondContact O-N 3.29Å; R426-L429 VanDerWaalsContact O-N 3.13Å; R426-E430 HydrophobicContact CG-CG 4.44Å; R426-E430 IonicContact CZ-OE1 3.21Å; R426-E430 IonicContact NE-OE1 2.72Å; R426-E430 PolarHBondContact NE-OE1 2.96Å; R426-E430 IonicContact NE-OE2 3.84Å; R426-E430 IonicContact NH2-OE1 2.81Å; R426-E430 PolarHBondContact NH2-OE1 3.43Å; R426-E430 WeakPolarHBondContact O-CG 3.32Å; R426-E430 PolarHBondContact O-N 2.84Å; R426-E430 VanDerWaalsContact O-N 3.07Å
427	K	83	Confident	78.6	Confident	176 Å²	176	57.2 Å²	57.2	77%	0.765	31%	0.311	S	S	*	.	H	α-helix	trans	-55.4	-29.6	175.9	-67.5	-176	177.4	-178.7	0	113.4	P425 A431	P425-K427 VanDerWaalsContact C-N 3.31Å; P425-K427 PolarHBondContact O-N 3.08Å; K427-A431 WeakPolarHBondContact O-CB 3.24Å; K427-A431 PolarHBondContact O-N 3.41Å
428	R	78.1	Confident	78.5	Confident	43 Å²	43	58.4 Å²	58.4	16%	0.162	32%	0.323	C	S	.	.	H	α-helix	trans	-70.3	-45.1	179	-165.1	-174.9	-161.3	77.5	21.9	111.5	I424 P425 R426 E430 A431 Y432 D467 E495	I424-R428 HydrophobicContact CG2-CB 4.44Å; P425-R428 HydrophobicContact CB-CB 4.43Å; P425-R428 WeakPolarHBondContact O-CA 3.29Å; P425-R428 WeakPolarHBondContact O-CB 3.3Å; P425-R428 PolarHBondContact O-N 2.91Å; R426-R428 PolarHBondContact O-N 2.76Å; R426-R428 VanDerWaalsContact O-N 3.14Å; R428-E430 VanDerWaalsContact C-N 3.34Å; R428-A431 PolarHBondContact O-N 3.33Å; R428-Y432 WeakPolarHBondContact O-CB 3.21Å; R428-Y432 PolarHBondContact O-N 3.24Å; R428-D467 IonicContact CZ-OD1 3.83Å; R428-D467 IonicContact CZ-OD2 2.9Å; R428-D467 VanDerWaalsContact NE-CG 3.3Å; R428-D467 IonicContact NE-OD1 2.68Å; R428-D467 IonicContact NE-OD2 3.23Å; R428-D467 PolarHBondContact NE-OD2 2.83Å; R428-D467 IonicContact NH2-OD1 2.72Å; R428-D467 PolarHBondContact NH2-OD1 3.39Å; R428-D467 IonicContact NH2-OD2 3.39Å; R428-D467 PolarHBondContact NH2-OD2 3.1Å; R428-E495 IonicContact CZ-OE2 3.16Å; R428-E495 IonicContact NH1-OE2 2.96Å; R428-E495 PolarHBondContact NH1-OE2 3.19Å; R428-E495 IonicContact NH2-OE2 3.08Å; R428-E495 PolarHBondContact NH2-OE2 2.88Å
429	L	82.9	Confident	78.2	Confident	0 Å²	0	59 Å²	59	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-66.9	-38	176.2	-66.8	168.8	0	0	0	111.3	V412 R413 L416 I424 R426 A431 Y432 F433 L471	V412-L429 HydrophobicContact CG1-CD2 4.41Å; R413-L429 HydrophobicContact CB-CD1 3.54Å; R413-L429 HydrophobicContact CG-CD1 3.97Å; L416-L429 HydrophobicContact CD1-CD1 4.24Å; L416-L429 HydrophobicContact CD1-CD2 3.58Å; I424-L429 HydrophobicContact CG2-CD1 4.06Å; I424-L429 HydrophobicContact CG2-CD2 4.13Å; I424-L429 HydrophobicContact CG2-CG 3.82Å; R426-L429 PolarHBondContact O-N 3.29Å; R426-L429 VanDerWaalsContact O-N 3.13Å; L429-A431 VanDerWaalsContact C-N 3.35Å; L429-Y432 PolarHBondContact O-N 2.92Å; L429-F433 WeakPolarHBondContact O-CB 3.12Å; L429-F433 VanDerWaalsContact O-CG 3.23Å; L429-F433 WeakPolarHBondContact O-CG 3.36Å; L429-F433 PolarHBondContact O-N 2.98Å; L429-L471 HydrophobicContact CD2-CD1 4.3Å; L429-L471 HydrophobicContact CD2-CD2 4.03Å
430	E	83.8	Confident	78.2	Confident	70 Å²	70	57.9 Å²	57.9	33%	0.327	31%	0.307	S	S	.	.	H	α-helix	trans	-63.6	-39.4	173.8	-68.8	169.1	156.1	0	0	111.6	S409 R426 R428 S434	S409-E430 PolarHBondContact OG-OE1 3.15Å; R426-E430 HydrophobicContact CG-CG 4.44Å; R426-E430 IonicContact CZ-OE1 3.21Å; R426-E430 IonicContact NE-OE1 2.72Å; R426-E430 PolarHBondContact NE-OE1 2.96Å; R426-E430 IonicContact NE-OE2 3.84Å; R426-E430 IonicContact NH2-OE1 2.81Å; R426-E430 PolarHBondContact NH2-OE1 3.43Å; R426-E430 WeakPolarHBondContact O-CG 3.32Å; R426-E430 PolarHBondContact O-N 2.84Å; R426-E430 VanDerWaalsContact O-N 3.07Å; R428-E430 VanDerWaalsContact C-N 3.34Å; E430-S434 VanDerWaalsContact O-CB 3.25Å; E430-S434 WeakPolarHBondContact O-CB 3.3Å; E430-S434 PolarHBondContact O-N 2.89Å
431	A	82	Confident	78.2	Confident	41 Å²	41	60.5 Å²	60.5	34%	0.339	33%	0.329	S	S	.	.	H	α-helix	trans	-67.4	-43	172.7	0	0	0	0	0	113	K427 R428 L429 S434 R435	K427-A431 WeakPolarHBondContact O-CB 3.24Å; K427-A431 PolarHBondContact O-N 3.41Å; R428-A431 PolarHBondContact O-N 3.33Å; L429-A431 VanDerWaalsContact C-N 3.35Å; A431-S434 PolarHBondContact O-N 3.15Å; A431-R435 VanDerWaalsContact O-CG 3.31Å; A431-R435 WeakPolarHBondContact O-CG 3.49Å; A431-R435 PolarHBondContact O-N 3.26Å
432	Y	81	Confident	78	Confident	3 Å²	3	63.1 Å²	63.1	1%	0.012	34%	0.34	C	S	.	.	H	α-helix	trans	-58.8	-49.5	175.9	175.2	-127.1	0	0	0	111.5	I399 R428 L429 R435 I436 E468 L471 G472	I399-Y432 HydrophobicContact CG2-CE1 4.43Å; R428-Y432 WeakPolarHBondContact O-CB 3.21Å; R428-Y432 PolarHBondContact O-N 3.24Å; L429-Y432 PolarHBondContact O-N 2.92Å; Y432-R435 WeakPolarHBondContact O-CB 3.13Å; Y432-R435 PolarHBondContact O-N 3.3Å; Y432-I436 HydrophobicContact CD1-CD1 4Å; Y432-I436 HydrophobicContact CD2-CD1 3.85Å; Y432-I436 HydrophobicContact CD2-CG1 4.48Å; Y432-I436 HydrophobicContact CE1-CD1 3.75Å; Y432-I436 HydrophobicContact CE2-CD1 3.61Å; Y432-I436 HydrophobicContact CE2-CG1 4.31Å; Y432-I436 HydrophobicContact CG-CD1 4.06Å; Y432-I436 WeakPolarHBondContact O-CD1 3.46Å; Y432-I436 WeakPolarHBondContact O-CG1 3.43Å; Y432-I436 PolarHBondContact O-N 2.86Å; Y432-E468 HydrophobicContact CD2-CB 3.98Å; Y432-E468 HydrophobicContact CD2-CG 3.56Å; Y432-E468 HydrophobicContact CE2-CB 3.67Å; Y432-E468 HydrophobicContact CE2-CG 3.8Å; Y432-E468 PolarHBondContact OH-O 2.87Å; Y432-L471 HydrophobicContact CD1-CD1 4.37Å; Y432-L471 HydrophobicContact CE1-CB 4.15Å; Y432-L471 HydrophobicContact CG-CD1 4.4Å; Y432-G472 WeakPolarHBondContact OH-CA 3.49Å; Y432-G472 PolarHBondContact OH-N 3.17Å
433	F	82.2	Confident	78	Confident	18 Å²	18	64.7 Å²	64.7	8%	0.079	35%	0.347	C	S	.	.	H	α-helix	trans	-65.6	-40.6	177.1	-61.6	-14.8	0	0	0	112.1	I399 R407 V412 L429 R435 I436 S437	I399-F433 HydrophobicContact CD1-CD1 4.09Å; I399-F433 HydrophobicContact CD1-CE1 3.58Å; I399-F433 HydrophobicContact CD1-CZ 3.98Å; I399-F433 HydrophobicContact CG1-CD1 4.03Å; I399-F433 HydrophobicContact CG1-CE1 3.84Å; R407-F433 WeakPolarHBondContact O-CD2 3.42Å; R407-F433 WeakPolarHBondContact O-CE2 3.36Å; V412-F433 HydrophobicContact CB-CE2 4.39Å; V412-F433 HydrophobicContact CB-CZ 3.8Å; V412-F433 HydrophobicContact CG1-CE1 4.47Å; V412-F433 HydrophobicContact CG1-CZ 3.73Å; V412-F433 HydrophobicContact CG2-CE2 4.46Å; V412-F433 HydrophobicContact CG2-CZ 3.86Å; L429-F433 WeakPolarHBondContact O-CB 3.12Å; L429-F433 VanDerWaalsContact O-CG 3.23Å; L429-F433 WeakPolarHBondContact O-CG 3.36Å; L429-F433 PolarHBondContact O-N 2.98Å; F433-R435 VanDerWaalsContact C-N 3.27Å; F433-R435 PolarHBondContact O-N 2.96Å; F433-I436 HydrophobicContact CD1-CD1 4.33Å; F433-I436 PolarHBondContact O-N 2.93Å; F433-S437 WeakPolarHBondContact O-CB 3.44Å; F433-S437 PolarHBondContact O-N 3.5Å; F433-S437 PolarHBondContact O-OG 3.49Å
434	S	81	Confident	78.4	Confident	73 Å²	73	63.8 Å²	63.8	51%	0.51	33%	0.325	S	S	.	.	H	α-helix	trans	-58.9	-37.8	174.7	-175	0	0	0	0	112.3	E430 A431 T438	E430-S434 VanDerWaalsContact O-CB 3.25Å; E430-S434 WeakPolarHBondContact O-CB 3.3Å; E430-S434 PolarHBondContact O-N 2.89Å; A431-S434 PolarHBondContact O-N 3.15Å; S434-T438 VanDerWaalsContact O-CB 3.28Å; S434-T438 WeakPolarHBondContact O-CB 3.24Å; S434-T438 PolarHBondContact O-N 3.47Å; S434-T438 VanDerWaalsContact O-N 3.09Å; S434-T438 PolarHBondContact O-OG1 3.29Å
435	R	79.1	Confident	78.3	Confident	129 Å²	129	68 Å²	68	49%	0.487	36%	0.362	S	S	.	.	H	α-helix	trans	-65.2	-49.7	174.2	-70.1	165.6	-175.7	174.6	1.8	111.1	A431 Y432 F433 T438 I439 E468	A431-R435 VanDerWaalsContact O-CG 3.31Å; A431-R435 WeakPolarHBondContact O-CG 3.49Å; A431-R435 PolarHBondContact O-N 3.26Å; Y432-R435 WeakPolarHBondContact O-CB 3.13Å; Y432-R435 PolarHBondContact O-N 3.3Å; F433-R435 VanDerWaalsContact C-N 3.27Å; F433-R435 PolarHBondContact O-N 2.96Å; R435-T438 PolarHBondContact O-N 3.14Å; R435-I439 VanDerWaalsContact O-CG1 3.31Å; R435-I439 WeakPolarHBondContact O-CG1 3.38Å; R435-I439 PolarHBondContact O-N 2.88Å; R435-E468 WeakPolarHBondContact CD-OE1 3.32Å; R435-E468 IonicContact CZ-OE1 2.71Å; R435-E468 IonicContact NE-OE1 3.75Å; R435-E468 IonicContact NH1-OE1 3.86Å; R435-E468 PolarHBondContact NH1-OE1 3.34Å
436	I	79.1	Confident	78	Confident	1 Å²	1	66.5 Å²	66.5	1%	0.005	35%	0.349	C	S	.	.	H	α-helix	trans	-58.2	-53.3	179.2	-67	157.1	0	0	0	111	R396 I399 L400 Y432 F433 T438 I439 Y440	R396-I436 HydrophobicContact CG-CG1 4.19Å; I399-I436 HydrophobicContact CB-CD1 4.44Å; I399-I436 HydrophobicContact CG1-CD1 4.03Å; I399-I436 HydrophobicContact CG2-CD1 3.54Å; L400-I436 HydrophobicContact CD2-CG2 3.59Å; L400-I436 HydrophobicContact CG-CG2 4.15Å; Y432-I436 HydrophobicContact CD1-CD1 4Å; Y432-I436 HydrophobicContact CD2-CD1 3.85Å; Y432-I436 HydrophobicContact CD2-CG1 4.48Å; Y432-I436 HydrophobicContact CE1-CD1 3.75Å; Y432-I436 HydrophobicContact CE2-CD1 3.61Å; Y432-I436 HydrophobicContact CE2-CG1 4.31Å; Y432-I436 HydrophobicContact CG-CD1 4.06Å; Y432-I436 WeakPolarHBondContact O-CD1 3.46Å; Y432-I436 WeakPolarHBondContact O-CG1 3.43Å; Y432-I436 PolarHBondContact O-N 2.86Å; F433-I436 HydrophobicContact CD1-CD1 4.33Å; F433-I436 PolarHBondContact O-N 2.93Å; I436-T438 PolarHBondContact O-N 2.82Å; I436-I439 PolarHBondContact O-N 3.29Å; I436-I439 VanDerWaalsContact O-N 3.1Å; I436-Y440 HydrophobicContact CG2-CD2 4.49Å; I436-Y440 PolarHBondContact O-N 2.94Å
437	S	78.1	Confident	78	Confident	53 Å²	53	60.7 Å²	60.7	37%	0.371	33%	0.329	S	S	.	.	H	α-helix	trans	-57.7	-36.2	177.5	-63.5	0	0	0	0	112.1	F433 A441	F433-S437 WeakPolarHBondContact O-CB 3.44Å; F433-S437 PolarHBondContact O-N 3.5Å; F433-S437 PolarHBondContact O-OG 3.49Å; S437-A441 WeakPolarHBondContact O-CA 3.42Å; S437-A441 WeakPolarHBondContact O-CB 3.24Å; S437-A441 PolarHBondContact O-N 3.21Å
438	T	77.2	Confident	77.8	Confident	101 Å²	101	52.8 Å²	52.8	62%	0.62	30%	0.297	S	S	*	.	H	α-helix	trans	-70.2	-34.4	178.3	-60	0	0	0	0	112.6	S434 R435 I436	S434-T438 VanDerWaalsContact O-CB 3.28Å; S434-T438 WeakPolarHBondContact O-CB 3.24Å; S434-T438 PolarHBondContact O-N 3.47Å; S434-T438 VanDerWaalsContact O-N 3.09Å; S434-T438 PolarHBondContact O-OG1 3.29Å; R435-T438 PolarHBondContact O-N 3.14Å; I436-T438 PolarHBondContact O-N 2.82Å
439	I	70.1	Confident	78.1	Confident	77 Å²	77	52.2 Å²	52.2	40%	0.395	30%	0.296	S	S	.	.	H	α-helix	trans	-78.4	-42.7	-178.7	-65.9	165.6	0	0	0	110.8	R435 I436	R435-I439 VanDerWaalsContact O-CG1 3.31Å; R435-I439 WeakPolarHBondContact O-CG1 3.38Å; R435-I439 PolarHBondContact O-N 2.88Å; I436-I439 PolarHBondContact O-N 3.29Å; I436-I439 VanDerWaalsContact O-N 3.1Å
440	Y	73.4	Confident	78.1	Confident	4 Å²	4	53.2 Å²	53.2	2%	0.016	31%	0.307	C	S	.	.	H	α-helix	trans	-100.9	3.8	-172.9	-68.2	-93.2	0	0	0	114.5	I364 E393 L400 I436 F442 H443 E444	I364-Y440 HydrophobicContact CG2-CE1 3.96Å; E393-Y440 PolarHBondContact OE2-OH 3.35Å; L400-Y440 HydrophobicContact CD1-CD1 3.98Å; L400-Y440 HydrophobicContact CD1-CD2 4.02Å; L400-Y440 HydrophobicContact CD1-CE1 3.78Å; L400-Y440 HydrophobicContact CD1-CE2 3.84Å; L400-Y440 HydrophobicContact CD1-CG 4.1Å; L400-Y440 HydrophobicContact CD2-CD1 4.05Å; L400-Y440 HydrophobicContact CD2-CD2 3.72Å; L400-Y440 HydrophobicContact CD2-CE2 4.38Å; L400-Y440 HydrophobicContact CD2-CG 3.54Å; L400-Y440 HydrophobicContact CG-CD2 4.45Å; L400-Y440 HydrophobicContact CG-CG 4.49Å; I436-Y440 HydrophobicContact CG2-CD2 4.49Å; I436-Y440 PolarHBondContact O-N 2.94Å; Y440-F442 PolarHBondContact O-N 2.76Å; Y440-H443 CarbonylContact O-C 3.59Å; Y440-H443 PolarHBondContact O-N 3.16Å; Y440-E444 PolarHBondContact O-N 2.67Å
441	A	74.6	Confident	78.1	Confident	59 Å²	59	55.2 Å²	55.2	49%	0.488	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.9	-36.6	179.2	0	0	0	0	0	115.1	S437 H443	S437-A441 WeakPolarHBondContact O-CA 3.42Å; S437-A441 WeakPolarHBondContact O-CB 3.24Å; S437-A441 PolarHBondContact O-N 3.21Å; A441-H443 VanDerWaalsContact C-N 3.28Å; A441-H443 PolarHBondContact O-N 3.16Å
442	F	71.4	Confident	78.1	Confident	182 Å²	182	62.4 Å²	62.4	80%	0.798	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-12	-179.3	-64.1	-74.1	0	0	0	114.2	Y440	Y440-F442 PolarHBondContact O-N 2.76Å
443	H	74.7	Confident	78.5	Confident	50 Å²	50	64.6 Å²	64.6	23%	0.231	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.7	-5.5	-178.6	-62.2	-54.3	0	0	0	113.2	L365 Y440 A441 A445 D446 I447	L365-H443 HydrophobicContact CD2-CB 3.66Å; Y440-H443 CarbonylContact O-C 3.59Å; Y440-H443 PolarHBondContact O-N 3.16Å; A441-H443 VanDerWaalsContact C-N 3.28Å; A441-H443 PolarHBondContact O-N 3.16Å; H443-A445 PolarHBondContact O-N 3.44Å; H443-A445 VanDerWaalsContact O-N 3.11Å; H443-D446 IonicContact ND1-OD2 3.94Å; H443-D446 PolarHBondContact ND1-OD2 3.22Å; H443-D446 PolarHBondContact O-N 2.72Å; H443-I447 HydrophobicContact CB-CD1 4.39Å; H443-I447 WeakPolarHBondContact O-CG1 3.41Å; H443-I447 PolarHBondContact O-N 3.08Å
444	E	77.3	Confident	78.9	Confident	42 Å²	42	69 Å²	69	20%	0.196	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-18.3	178	-165.1	76.5	-138.8	0	0	113.1	R407 Y440 H449	R407-E444 IonicContact CZ-OE1 3.09Å; R407-E444 IonicContact CZ-OE2 2.73Å; R407-E444 IonicContact NH1-OE1 3.78Å; R407-E444 PolarHBondContact NH1-OE1 3.01Å; R407-E444 IonicContact NH1-OE2 3.17Å; R407-E444 PolarHBondContact NH1-OE2 2.95Å; R407-E444 IonicContact NH2-OE1 2.68Å; R407-E444 PolarHBondContact NH2-OE1 3.01Å; R407-E444 IonicContact NH2-OE2 2.71Å; Y440-E444 PolarHBondContact O-N 2.67Å; E444-H449 PolarHBondContact O-NE2 2.75Å; E444-H449 VanDerWaalsContact O-NE2 3.09Å; E444-H449 IonicContact OE1-CE1 2.73Å; E444-H449 PolarHBondContact OE1-CE1 3.27Å; E444-H449 VanDerWaalsContact OE1-CE1 3.23Å; E444-H449 IonicContact OE1-NE2 3.61Å; E444-H449 PolarHBondContact OE1-NE2 3.22Å
445	A	74.8	Confident	79.4	Confident	97 Å²	97	68.9 Å²	68.9	80%	0.802	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-18.4	171.7	0	0	0	0	0	113.7	H443	H443-A445 PolarHBondContact O-N 3.44Å; H443-A445 VanDerWaalsContact O-N 3.11Å
446	D	72.6	Confident	80.2	Confident	43 Å²	43	62.8 Å²	62.8	23%	0.23	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-17.1	-172.3	-51.1	-26.8	0	0	0	112.4	T369 H443	T369-D446 VanDerWaalsContact CG2-O 3.31Å; T369-D446 WeakPolarHBondContact CG2-O 3.21Å; H443-D446 IonicContact ND1-OD2 3.94Å; H443-D446 PolarHBondContact ND1-OD2 3.22Å; H443-D446 PolarHBondContact O-N 2.72Å
447	I	81.7	Confident	81	Confident	13 Å²	13	64.7 Å²	64.7	7%	0.067	36%	0.362	C	S	.	.	S	Bend	trans	-83.7	136.6	-171.9	-70.3	161.3	0	0	0	112.2	L365 L368 H443 H449	L365-I447 HydrophobicContact CD2-CD1 4.49Å; L365-I447 HydrophobicContact CD2-CG1 4.4Å; L368-I447 HydrophobicContact CB-CG1 4.17Å; L368-I447 HydrophobicContact CB-CG2 3.98Å; L368-I447 HydrophobicContact CD1-CD1 4.17Å; L368-I447 HydrophobicContact CD1-CG1 4.4Å; L368-I447 HydrophobicContact CD2-CG2 4.36Å; H443-I447 HydrophobicContact CB-CD1 4.39Å; H443-I447 WeakPolarHBondContact O-CG1 3.41Å; H443-I447 PolarHBondContact O-N 3.08Å; I447-H449 WeakPolarHBondContact CG2-CE1 3.42Å; I447-H449 WeakPolarHBondContact CG2-ND1 3.31Å; I447-H449 PolarHBondContact O-CD2 3.46Å; I447-H449 PolarHBondContact O-N 2.89Å
448	G	79	Confident	81.9	Confident	10 Å²	10	62.2 Å²	62.2	10%	0.103	34%	0.344	C	S	.	.			trans	-71.3	64.3	173.6	0	0	0	0	0	113.4	L368 G450 E451	L368-G448 PolarHBondContact O-N 3.45Å; G448-G450 PolarHBondContact O-N 3.38Å; G448-G450 VanDerWaalsContact O-N 3.14Å; G448-E451 WeakPolarHBondContact CA-OE2 3.47Å; G448-E451 PolarHBondContact O-N 2.83Å
449	H	83.2	Confident	82.8	Confident	30 Å²	30	59.8 Å²	59.8	14%	0.139	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	113.3	-172	-69.9	-58.8	0	0	0	113.3	L400 W401 K403 R407 E444 I447 E451	L400-H449 PolarHBondContact O-CE1 3.45Å; L400-H449 PolarHBondContact O-ND1 3.47Å; W401-H449 CarbonylContact O-C 3.5Å; W401-H449 WeakPolarHBondContact O-CA 3.34Å; K403-H449 WeakPolarHBondContact CE-O 3.29Å; K403-H449 HydrophobicContact CG-CB 4.2Å; K403-H449 WeakPolarHBondContact CG-O 3.39Å; R407-H449 PolarHBondContact NH2-CE1 3.28Å; R407-H449 PolarHBondContact NH2-ND1 2.85Å; E444-H449 PolarHBondContact O-NE2 2.75Å; E444-H449 VanDerWaalsContact O-NE2 3.09Å; E444-H449 IonicContact OE1-CE1 2.73Å; E444-H449 PolarHBondContact OE1-CE1 3.27Å; E444-H449 VanDerWaalsContact OE1-CE1 3.23Å; E444-H449 IonicContact OE1-NE2 3.61Å; E444-H449 PolarHBondContact OE1-NE2 3.22Å; I447-H449 WeakPolarHBondContact CG2-CE1 3.42Å; I447-H449 WeakPolarHBondContact CG2-ND1 3.31Å; I447-H449 PolarHBondContact O-CD2 3.46Å; I447-H449 PolarHBondContact O-N 2.89Å; H449-E451 VanDerWaalsContact C-N 3.26Å; H449-E451 PolarHBondContact O-N 2.99Å
450	G	83.8	Confident	83.9	Confident	22 Å²	22	56.2 Å²	56.2	23%	0.227	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.2	12.8	179.4	0	0	0	0	0	114.3	W401 G448	W401-G450 PolarHBondContact O-N 3.19Å; G448-G450 PolarHBondContact O-N 3.38Å; G448-G450 VanDerWaalsContact O-N 3.14Å
451	E	84.3	Confident	84.7	Confident	112 Å²	112	57.6 Å²	57.6	52%	0.523	32%	0.315	S	S	.	.			trans	-68.9	134.5	174.6	-66.7	-172.7	152	0	0	110.6	W401 G448 H449 F453	W401-E451 WeakPolarHBondContact CZ2-O 3.41Å; W401-E451 PolarHBondContact NE1-O 2.76Å; G448-E451 WeakPolarHBondContact CA-OE2 3.47Å; G448-E451 PolarHBondContact O-N 2.83Å; H449-E451 VanDerWaalsContact C-N 3.26Å; H449-E451 PolarHBondContact O-N 2.99Å; E451-F453 WeakPolarHBondContact O-CD1 3.41Å
452	Q	82.5	Confident	85.4	Confident	191 Å²	191	54.9 Å²	54.9	89%	0.893	29%	0.293	S	S	*	.			trans	-85.9	123.4	-176.5	-66.5	-174	-4.4	0	0	110.7
453	F	88.9	Confident	86.2	Confident	50 Å²	50	47.1 Å²	47.1	22%	0.219	26%	0.259	C	S	.	.			trans	-139.9	166.1	170.9	52.9	-94.1	0	0	0	110.3	W401 E451 V456 P480 F481	W401-F453 AromaticContact CD1-CE1 3.77Å; W401-F453 AromaticContact NE1-CE1 3.56Å; E451-F453 WeakPolarHBondContact O-CD1 3.41Å; F453-V456 HydrophobicContact CD2-CG2 3.97Å; F453-V456 HydrophobicContact CE2-CG2 3.72Å; F453-P480 HydrophobicContact CD1-CG 4.42Å; F453-P480 HydrophobicContact CD2-CB 3.96Å; F453-P480 HydrophobicContact CD2-CG 4.07Å; F453-P480 HydrophobicContact CE1-CG 3.92Å; F453-P480 HydrophobicContact CE2-CB 3.73Å; F453-P480 HydrophobicContact CE2-CG 3.5Å; F453-P480 HydrophobicContact CG-CG 4.49Å; F453-P480 HydrophobicContact CZ-CB 4.19Å; F453-P480 HydrophobicContact CZ-CG 3.43Å; F453-P480 VanDerWaalsContact CZ-CG 3.43Å; F453-F481 HydrophobicContact CE2-CZ 4.3Å; F453-F481 HydrophobicContact CZ-CE1 4.49Å; F453-F481 HydrophobicContact CZ-CE2 4.14Å; F453-F481 AromaticContact CZ-CZ 3.83Å; F453-F481 HydrophobicContact CZ-CZ 3.83Å
454	D	89.1	Confident	86.6	Confident	109 Å²	109	44.8 Å²	44.8	58%	0.583	25%	0.249	S	C	*	.			trans	-52.7	151.2	177.9	-88.7	-2.5	0	0	0	112.4	V456	D454-V456 WeakPolarHBondContact O-CG2 3.44Å; D454-V456 PolarHBondContact O-N 3.11Å
455	T	93	Very high	86.6	Confident	72 Å²	72	44.9 Å²	44.9	44%	0.442	25%	0.252	S	S	.	.			trans	-62.8	129.1	-179.5	-65.8	0	0	0	0	111.7	P480 R482	T455-P480 CarbonylContact C-O 3.55Å; T455-P480 VanDerWaalsContact CA-O 3.29Å; T455-P480 WeakPolarHBondContact CA-O 3.49Å; T455-R482 HydrophobicContact CG2-CB 4.36Å; T455-R482 HydrophobicContact CG2-CG 3.45Å; T455-R482 VanDerWaalsContact CG2-CG 3.45Å
456	V	95.4	Very high	86.7	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	119.1	-179.6	-171	0	0	0	0	109.7	L367 K377 V379 F453 D454 I458 P480 F481 R482	L367-V456 HydrophobicContact CD2-CG1 4.42Å; K377-V456 CarbonylContact O-C 3.6Å; K377-V456 WeakPolarHBondContact O-CA 3.39Å; V379-V456 HydrophobicContact CG2-CG1 4.17Å; F453-V456 HydrophobicContact CD2-CG2 3.97Å; F453-V456 HydrophobicContact CE2-CG2 3.72Å; D454-V456 WeakPolarHBondContact O-CG2 3.44Å; D454-V456 PolarHBondContact O-N 3.11Å; V456-I458 HydrophobicContact CG1-CD1 3.97Å; V456-P480 PolarHBondContact N-O 2.91Å; V456-F481 HydrophobicContact CB-CD1 4.34Å; V456-F481 WeakPolarHBondContact O-CA 3.43Å; V456-R482 PolarHBondContact O-N 3.07Å
457	T	96.3	Very high	86.8	Confident	42 Å²	42	41.3 Å²	41.3	26%	0.258	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	118.4	173.4	-52.4	0	0	0	0	110.2	K377 S378 V379 H459 R482	K377-T457 PolarHBondContact O-N 3.04Å; S378-T457 CarbonylContact C-O 3.3Å; S378-T457 VanDerWaalsContact CA-O 3.3Å; S378-T457 WeakPolarHBondContact CA-O 3.46Å; V379-T457 PolarHBondContact N-O 2.95Å; T457-H459 WeakPolarHBondContact CG2-NE2 3.35Å; T457-R482 CarbonylContact C-O 3.6Å; T457-R482 WeakPolarHBondContact CA-O 3.31Å
458	I	96.5	Very high	86.7	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	114.7	171.2	-53.1	-57.5	0	0	0	107.5	L367 V379 F381 L394 L397 V456 L460 F481 R482 F483 S484	L367-I458 HydrophobicContact CD1-CD1 3.88Å; V379-I458 HydrophobicContact CB-CD1 4.12Å; V379-I458 HydrophobicContact CG2-CD1 4.13Å; F381-I458 HydrophobicContact CD2-CG2 3.93Å; F381-I458 HydrophobicContact CE2-CG2 4.18Å; L394-I458 HydrophobicContact CD1-CG2 3.93Å; L394-I458 HydrophobicContact CD2-CG2 4.29Å; L397-I458 HydrophobicContact CD1-CD1 4.38Å; L397-I458 HydrophobicContact CD1-CG1 4.2Å; V456-I458 HydrophobicContact CG1-CD1 3.97Å; I458-L460 HydrophobicContact CG2-CD2 4.32Å; I458-F481 HydrophobicContact CD1-CD1 4.36Å; I458-F481 HydrophobicContact CG1-CD1 4.16Å; I458-R482 PolarHBondContact N-O 2.81Å; I458-F483 HydrophobicContact CB-CD1 3.8Å; I458-F483 HydrophobicContact CB-CE1 3.91Å; I458-F483 HydrophobicContact CG1-CD1 4.47Å; I458-F483 HydrophobicContact CG1-CE1 4.17Å; I458-F483 HydrophobicContact CG2-CD1 4.11Å; I458-F483 HydrophobicContact CG2-CE1 4.09Å; I458-F483 WeakPolarHBondContact O-CA 3.38Å; I458-S484 PolarHBondContact O-N 2.75Å
459	H	95.2	Very high	87	Confident	50 Å²	50	40.5 Å²	40.5	23%	0.231	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	131.2	173	-51.1	-100.1	0	0	0	108.8	S378 V379 D380 F381 T382 T457 S484	S378-H459 PolarHBondContact OG-CD2 3.15Å; S378-H459 PolarHBondContact OG-NE2 3.08Å; V379-H459 PolarHBondContact O-N 2.82Å; D380-H459 HydrophobicContact CB-CB 4.23Å; F381-H459 PolarHBondContact N-O 3.21Å; T382-H459 HydrophobicContact CG2-CB 4.45Å; T457-H459 WeakPolarHBondContact CG2-NE2 3.35Å; H459-S484 WeakPolarHBondContact CA-O 3.43Å; H459-S484 VanDerWaalsContact ND1-CB 3.31Å; H459-S484 WeakPolarHBondContact ND1-CB 3.42Å; H459-S484 PolarHBondContact ND1-OG 2.83Å
460	L	93.5	Very high	87	Confident	2 Å²	2	39.2 Å²	39.2	1%	0.01	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	161.3	178.4	66.8	150.2	0	0	0	112	L394 I458 C462 F483 S484 C485	L394-L460 HydrophobicContact CD1-CB 4.32Å; I458-L460 HydrophobicContact CG2-CD2 4.32Å; L460-C462 HydrophobicContact CD1-CB 4.31Å; L460-F483 HydrophobicContact CD2-CB 4.3Å; L460-F483 HydrophobicContact CD2-CD1 3.71Å; L460-F483 HydrophobicContact CD2-CG 4.47Å; L460-S484 PolarHBondContact N-O 3.27Å; L460-C485 WeakPolarHBondContact O-CA 3.5Å
461	D	90.7	Very high	87	Confident	34 Å²	34	38.3 Å²	38.3	18%	0.182	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	117.5	159.2	-58.2	-50.4	0	0	0	107.7	T382 G383 N463 R487	T382-D461 WeakPolarHBondContact CA-OD2 3.26Å; G383-D461 PolarHBondContact N-OD2 3.43Å; D461-N463 PolarHBondContact O-N 3.2Å; D461-R487 CarbonylContact C-O 3.57Å; D461-R487 WeakPolarHBondContact CA-O 3.2Å; D461-R487 HydrophobicContact CB-CB 4.24Å; D461-R487 WeakPolarHBondContact OD1-CB 3.39Å
462	C	90.3	Very high	87.2	Confident	2 Å²	2	33 Å²	33	1%	0.014	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	107.2	-172.8	-172.5	0	0	0	0	110.5	L460 C485 R487 L488 L489 F507	L460-C462 HydrophobicContact CD1-CB 4.31Å; C462-C485 HydrophobicContact CB-CB 4.42Å; C462-C485 VanDerWaalsContact CB-SG 3.52Å; C462-R487 PolarHBondContact N-O 2.89Å; C462-L488 HydrophobicContact CB-CD1 3.76Å; C462-L489 PolarHBondContact O-N 3.24Å; C462-F507 HydrophobicContact CB-CE2 4.23Å; C462-F507 HydrophobicContact CB-CZ 3.88Å
463	N	86.7	Confident	87.5	Confident	18 Å²	18	23.9 Å²	23.9	10%	0.096	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	112.2	159.6	-170.7	-22.1	0	0	0	108.8	C388 S391 D461 T465	C388-N463 WeakPolarHBondContact CB-ND2 3.13Å; C388-N463 PolarHBondContact SG-ND2 2.94Å; S391-N463 PolarHBondContact OG-O 3Å; D461-N463 PolarHBondContact O-N 3.2Å; N463-T465 WeakPolarHBondContact OD1-CB 3.22Å; N463-T465 WeakPolarHBondContact OD1-CG2 3.5Å; N463-T465 PolarHBondContact OD1-N 2.88Å; N463-T465 PolarHBondContact OD1-OG1 3.32Å
464	M	83.4	Confident	87.5	Confident	1 Å²	1	21.7 Å²	21.7	1%	0.005	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	51.4	-179	-166.4	79.6	75.8	0	0	110.5	V469 A470 L473 L488 L489 L490 L503 L506 F507	M464-V469 HydrophobicContact CE-CG1 4.35Å; M464-V469 HydrophobicContact SD-CB 3.82Å; M464-V469 HydrophobicContact SD-CG1 3.69Å; M464-A470 HydrophobicContact SD-CB 3.77Å; M464-L473 HydrophobicContact CE-CD1 3.78Å; M464-L488 HydrophobicContact CB-CD1 4.11Å; M464-L488 HydrophobicContact CE-CD1 4.37Å; M464-L489 WeakPolarHBondContact CB-O 3.31Å; M464-L489 PolarHBondContact N-O 3.3Å; M464-L490 HydrophobicContact CB-CD1 3.92Å; M464-L490 HydrophobicContact CG-CD1 3.66Å; M464-L503 HydrophobicContact CE-CD2 4.06Å; M464-L506 HydrophobicContact CE-CD1 3.85Å; M464-F507 HydrophobicContact CE-CE2 3.93Å
465	T	78.1	Confident	87.5	Confident	44 Å²	44	16.6 Å²	16.6	27%	0.27	10%	0.095	S	C	.	.			trans	-88.5	-19.3	174.2	33.7	0	0	0	0	113.6	N463 Q491 L493	N463-T465 WeakPolarHBondContact OD1-CB 3.22Å; N463-T465 WeakPolarHBondContact OD1-CG2 3.5Å; N463-T465 PolarHBondContact OD1-N 2.88Å; N463-T465 PolarHBondContact OD1-OG1 3.32Å; T465-Q491 HydrophobicContact CG2-CB 3.88Å; T465-Q491 HydrophobicContact CG2-CG 3.85Å; T465-L493 VanDerWaalsContact C-CD2 3.47Å; T465-L493 VanDerWaalsContact O-CD2 3.28Å; T465-L493 WeakPolarHBondContact O-CD2 3.49Å
466	V	75.9	Confident	87.3	Confident	47 Å²	47	14 Å²	14	29%	0.285	8%	0.078	S	C	.	.	S	Bend	trans	-122.9	132.6	-176.8	-172.9	0	0	0	0	109.2	I392 E468 V469	I392-V466 HydrophobicContact CD1-CB 4.3Å; I392-V466 HydrophobicContact CD1-CG2 3.78Å; V466-E468 HydrophobicContact CG1-CB 3.94Å; V466-E468 HydrophobicContact CG1-CG 3.93Å; V466-E468 PolarHBondContact O-N 3.28Å; V466-V469 HydrophobicContact CB-CG2 4.43Å; V466-V469 VanDerWaalsContact O-CB 3.28Å; V466-V469 WeakPolarHBondContact O-CB 2.99Å; V466-V469 WeakPolarHBondContact O-CG2 3.45Å; V466-V469 PolarHBondContact O-N 3.13Å
467	D	74.8	Confident	86.9	Confident	18 Å²	18	18.1 Å²	18.1	10%	0.096	10%	0.103	C	C	.	.	H	α-helix	trans	-64.1	-25.4	-176.8	65.1	-80.5	0	0	0	113.4	R428 V469 A470 L471 L493 I496	R428-D467 IonicContact CZ-OD1 3.83Å; R428-D467 IonicContact CZ-OD2 2.9Å; R428-D467 VanDerWaalsContact NE-CG 3.3Å; R428-D467 IonicContact NE-OD1 2.68Å; R428-D467 IonicContact NE-OD2 3.23Å; R428-D467 PolarHBondContact NE-OD2 2.83Å; R428-D467 IonicContact NH2-OD1 2.72Å; R428-D467 PolarHBondContact NH2-OD1 3.39Å; R428-D467 IonicContact NH2-OD2 3.39Å; R428-D467 PolarHBondContact NH2-OD2 3.1Å; D467-V469 PolarHBondContact O-N 3.34Å; D467-V469 VanDerWaalsContact O-N 3.1Å; D467-A470 PolarHBondContact O-N 3.45Å; D467-L471 WeakPolarHBondContact O-CB 3.43Å; D467-L471 VanDerWaalsContact O-CG 3.28Å; D467-L471 WeakPolarHBondContact O-CG 3.39Å; D467-L471 PolarHBondContact O-N 2.89Å; D467-L471 WeakPolarHBondContact OD2-CD1 3.37Å; D467-L493 HydrophobicContact CB-CD1 4.04Å; D467-L493 HydrophobicContact CB-CD2 4.46Å; D467-I496 HydrophobicContact CB-CD1 3.67Å; D467-I496 HydrophobicContact CB-CG1 4.06Å
468	E	80.1	Confident	86.5	Confident	7 Å²	7	19.6 Å²	19.6	3%	0.033	11%	0.109	C	C	.	.	H	α-helix	trans	-51.2	-29.5	169.3	-64.3	-161.4	170.7	0	0	113.2	S395 R396 Y432 R435 V466 G472	S395-E468 PolarHBondContact OG-O 3.25Å; S395-E468 VanDerWaalsContact OG-O 3.07Å; R396-E468 IonicContact CZ-OE2 2.72Å; R396-E468 IonicContact NE-OE2 3.77Å; R396-E468 IonicContact NH2-OE2 3.79Å; R396-E468 PolarHBondContact NH2-OE2 2.72Å; Y432-E468 HydrophobicContact CD2-CB 3.98Å; Y432-E468 HydrophobicContact CD2-CG 3.56Å; Y432-E468 HydrophobicContact CE2-CB 3.67Å; Y432-E468 HydrophobicContact CE2-CG 3.8Å; Y432-E468 PolarHBondContact OH-O 2.87Å; R435-E468 WeakPolarHBondContact CD-OE1 3.32Å; R435-E468 IonicContact CZ-OE1 2.71Å; R435-E468 IonicContact NE-OE1 3.75Å; R435-E468 IonicContact NH1-OE1 3.86Å; R435-E468 PolarHBondContact NH1-OE1 3.34Å; V466-E468 HydrophobicContact CG1-CB 3.94Å; V466-E468 HydrophobicContact CG1-CG 3.93Å; V466-E468 PolarHBondContact O-N 3.28Å; E468-G472 PolarHBondContact O-N 2.92Å
469	V	84.9	Confident	86.3	Confident	0 Å²	0	20 Å²	20	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-69.4	-53.4	175.5	-174.6	0	0	0	0	109.6	I392 M464 V466 D467 L471 G472 L473	I392-V469 HydrophobicContact CB-CG2 4.34Å; I392-V469 HydrophobicContact CG1-CG2 3.71Å; M464-V469 HydrophobicContact CE-CG1 4.35Å; M464-V469 HydrophobicContact SD-CB 3.82Å; M464-V469 HydrophobicContact SD-CG1 3.69Å; V466-V469 HydrophobicContact CB-CG2 4.43Å; V466-V469 VanDerWaalsContact O-CB 3.28Å; V466-V469 WeakPolarHBondContact O-CB 2.99Å; V466-V469 WeakPolarHBondContact O-CG2 3.45Å; V466-V469 PolarHBondContact O-N 3.13Å; D467-V469 PolarHBondContact O-N 3.34Å; D467-V469 VanDerWaalsContact O-N 3.1Å; V469-L471 PolarHBondContact O-N 3.27Å; V469-G472 PolarHBondContact O-N 2.69Å; V469-L473 HydrophobicContact CG1-CD1 3.66Å; V469-L473 HydrophobicContact CG1-CG 4.34Å; V469-L473 WeakPolarHBondContact O-CB 3.45Å; V469-L473 WeakPolarHBondContact O-CD1 3.35Å; V469-L473 WeakPolarHBondContact O-CG 3.44Å; V469-L473 PolarHBondContact O-N 2.82Å
470	A	83.1	Confident	86.1	Confident	3 Å²	3	18.1 Å²	18.1	3%	0.025	10%	0.104	C	C	.	.	H	α-helix	trans	-61.2	-41.5	177.5	0	0	0	0	0	112.6	M464 D467 S474 F498 L506	M464-A470 HydrophobicContact SD-CB 3.77Å; D467-A470 PolarHBondContact O-N 3.45Å; A470-S474 WeakPolarHBondContact O-CB 3.21Å; A470-S474 PolarHBondContact O-N 2.88Å; A470-S474 VanDerWaalsContact O-N 3.09Å; A470-S474 PolarHBondContact O-OG 2.95Å; A470-F498 HydrophobicContact CB-CD2 4.04Å; A470-F498 HydrophobicContact CB-CE2 3.93Å; A470-L506 HydrophobicContact CB-CD1 4.42Å
471	L	85	Confident	86.2	Confident	2 Å²	2	18 Å²	18	1%	0.01	10%	0.103	C	C	.	.	H	α-helix	trans	-61.8	-47.6	176.4	-67.5	175.5	0	0	0	111.5	L416 I424 L429 Y432 D467 V469 S474 L475	L416-L471 HydrophobicContact CD1-CD2 3.95Å; I424-L471 HydrophobicContact CD1-CD2 3.61Å; I424-L471 HydrophobicContact CG1-CD2 4.26Å; I424-L471 HydrophobicContact CG2-CD2 4.23Å; L429-L471 HydrophobicContact CD2-CD1 4.3Å; L429-L471 HydrophobicContact CD2-CD2 4.03Å; Y432-L471 HydrophobicContact CD1-CD1 4.37Å; Y432-L471 HydrophobicContact CE1-CB 4.15Å; Y432-L471 HydrophobicContact CG-CD1 4.4Å; D467-L471 WeakPolarHBondContact O-CB 3.43Å; D467-L471 VanDerWaalsContact O-CG 3.28Å; D467-L471 WeakPolarHBondContact O-CG 3.39Å; D467-L471 PolarHBondContact O-N 2.89Å; D467-L471 WeakPolarHBondContact OD2-CD1 3.37Å; V469-L471 PolarHBondContact O-N 3.27Å; L471-S474 PolarHBondContact O-OG 2.73Å; L471-S474 VanDerWaalsContact O-OG 3.04Å; L471-L475 WeakPolarHBondContact O-CG 3.46Å
472	G	87.5	Confident	86.4	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-65.4	-47.7	178.2	0	0	0	0	0	113.2	S395 Y432 E468 V469 S474 L475	S395-G472 CarbonylContact O-C 3.55Å; S395-G472 WeakPolarHBondContact O-CA 3.38Å; Y432-G472 WeakPolarHBondContact OH-CA 3.49Å; Y432-G472 PolarHBondContact OH-N 3.17Å; E468-G472 PolarHBondContact O-N 2.92Å; V469-G472 PolarHBondContact O-N 2.69Å; G472-S474 VanDerWaalsContact C-N 3.3Å; G472-S474 PolarHBondContact O-N 3.09Å; G472-L475 WeakPolarHBondContact O-CB 3.48Å; G472-L475 PolarHBondContact O-N 3.18Å; G472-L475 VanDerWaalsContact O-N 3.08Å
473	L	90	Very high	86.6	Confident	1 Å²	1	20.9 Å²	20.9	1%	0.005	11%	0.112	C	C	.	.	H	α-helix	trans	-63.6	-31.4	-179.3	-68.1	169.7	0	0	0	113.3	M464 V469 L475 Q476 F483 L506 F507	M464-L473 HydrophobicContact CE-CD1 3.78Å; V469-L473 HydrophobicContact CG1-CD1 3.66Å; V469-L473 HydrophobicContact CG1-CG 4.34Å; V469-L473 WeakPolarHBondContact O-CB 3.45Å; V469-L473 WeakPolarHBondContact O-CD1 3.35Å; V469-L473 WeakPolarHBondContact O-CG 3.44Å; V469-L473 PolarHBondContact O-N 2.82Å; L473-L475 PolarHBondContact O-N 3.16Å; L473-Q476 VanDerWaalsContact O-CB 3.32Å; L473-Q476 WeakPolarHBondContact O-CB 3.14Å; L473-Q476 WeakPolarHBondContact O-CG 3.4Å; L473-Q476 PolarHBondContact O-N 3.36Å; L473-Q476 PolarHBondContact O-NE2 3.24Å; L473-F483 HydrophobicContact CD2-CB 3.63Å; L473-F483 HydrophobicContact CD2-CD1 3.74Å; L473-F483 HydrophobicContact CD2-CD2 3.48Å; L473-F483 VanDerWaalsContact CD2-CD2 3.48Å; L473-F483 HydrophobicContact CD2-CE1 4.24Å; L473-F483 HydrophobicContact CD2-CE2 4.02Å; L473-F483 HydrophobicContact CD2-CG 3.31Å; L473-F483 HydrophobicContact CD2-CZ 4.37Å; L473-L506 HydrophobicContact CB-CD1 4.48Å; L473-L506 HydrophobicContact CB-CD2 3.95Å; L473-F507 HydrophobicContact CD1-CE1 4.18Å; L473-F507 HydrophobicContact CD1-CE2 4.12Å; L473-F507 HydrophobicContact CD1-CZ 3.47Å; L473-F507 VanDerWaalsContact CD1-CZ 3.47Å; L473-F507 HydrophobicContact CD2-CE1 4.28Å; L473-F507 HydrophobicContact CD2-CZ 4.33Å
474	S	87.4	Confident	86.9	Confident	4 Å²	4	21.2 Å²	21.2	3%	0.028	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-9.2	176.7	44.4	0	0	0	0	114	L416 L420 A470 L471 G472	L416-S474 WeakPolarHBondContact CD2-OG 2.97Å; L420-S474 WeakPolarHBondContact CD1-OG 3.14Å; A470-S474 WeakPolarHBondContact O-CB 3.21Å; A470-S474 PolarHBondContact O-N 2.88Å; A470-S474 VanDerWaalsContact O-N 3.09Å; A470-S474 PolarHBondContact O-OG 2.95Å; L471-S474 PolarHBondContact O-OG 2.73Å; L471-S474 VanDerWaalsContact O-OG 3.04Å; G472-S474 VanDerWaalsContact C-N 3.3Å; G472-S474 PolarHBondContact O-N 3.09Å
475	L	89	Confident	87.4	Confident	1 Å²	1	21.2 Å²	21.2	1%	0.005	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-8.5	170	-60.8	174.1	0	0	0	113.3	P398 I399 V412 L416 L471 G472 L473 T477 L478	P398-L475 HydrophobicContact CB-CB 3.88Å; I399-L475 HydrophobicContact CB-CD1 4.03Å; I399-L475 HydrophobicContact CD1-CD1 4.42Å; V412-L475 HydrophobicContact CG1-CD1 4.37Å; V412-L475 HydrophobicContact CG1-CD2 3.8Å; V412-L475 HydrophobicContact CG2-CD2 4.43Å; L416-L475 HydrophobicContact CD2-CD2 3.98Å; L416-L475 HydrophobicContact CD2-CG 4.32Å; L416-L475 HydrophobicContact CG-CD2 4.33Å; L471-L475 WeakPolarHBondContact O-CG 3.46Å; G472-L475 WeakPolarHBondContact O-CB 3.48Å; G472-L475 PolarHBondContact O-N 3.18Å; G472-L475 VanDerWaalsContact O-N 3.08Å; L473-L475 PolarHBondContact O-N 3.16Å; L475-T477 PolarHBondContact O-N 2.67Å; L475-T477 VanDerWaalsContact O-N 3.07Å; L475-L478 HydrophobicContact CD2-CD1 4.01Å; L475-L478 WeakPolarHBondContact O-CB 3.3Å; L475-L478 PolarHBondContact O-N 3Å
476	Q	90.5	Very high	88	Confident	19 Å²	19	22.1 Å²	22.1	9%	0.089	12%	0.119	C	C	.	.	G	3₁₀ helix	trans	-52.7	-38.1	-176.5	79	-177.2	-82.5	0	0	112.3	L473 L478 T479 F481 R482 F483 L506	L473-Q476 VanDerWaalsContact O-CB 3.32Å; L473-Q476 WeakPolarHBondContact O-CB 3.14Å; L473-Q476 WeakPolarHBondContact O-CG 3.4Å; L473-Q476 PolarHBondContact O-N 3.36Å; L473-Q476 PolarHBondContact O-NE2 3.24Å; Q476-L478 PolarHBondContact O-N 3.33Å; Q476-L478 VanDerWaalsContact O-N 3.12Å; Q476-T479 PolarHBondContact O-N 2.8Å; Q476-T479 PolarHBondContact O-OG1 3.41Å; Q476-F481 WeakPolarHBondContact CB-O 3.33Å; Q476-R482 PolarHBondContact O-NH1 3.33Å; Q476-F483 HydrophobicContact CB-CD2 3.67Å; Q476-F483 HydrophobicContact CB-CE2 3.84Å; Q476-F483 HydrophobicContact CG-CD2 4.44Å; Q476-L506 PolarHBondContact NE2-O 3.15Å
477	T	86.8	Confident	88.7	Confident	85 Å²	85	22.8 Å²	22.8	52%	0.521	12%	0.116	S	C	.	.	G	3₁₀ helix	trans	-64	-14	179.2	50.4	0	0	0	0	115.2	H415 L475	H415-T477 PolarHBondContact NE2-OG1 3.21Å; H415-T477 VanDerWaalsContact NE2-OG1 3.1Å; L475-T477 PolarHBondContact O-N 2.67Å; L475-T477 VanDerWaalsContact O-N 3.07Å
478	L	87.6	Confident	89.5	Confident	74 Å²	74	22 Å²	22	39%	0.387	11%	0.112	S	C	.	.	G	3₁₀ helix	trans	-92	-2.4	174.6	-63	178.4	0	0	0	113.7	W401 M402 H415 L475 Q476	W401-L478 WeakPolarHBondContact CZ3-O 3.42Å; M402-L478 HydrophobicContact SD-CD1 4.49Å; H415-L478 HydrophobicContact CB-CD1 4.33Å; H415-L478 VanDerWaalsContact CE1-CD2 3.49Å; H415-L478 WeakPolarHBondContact CE1-CD2 3.28Å; L475-L478 HydrophobicContact CD2-CD1 4.01Å; L475-L478 WeakPolarHBondContact O-CB 3.3Å; L475-L478 PolarHBondContact O-N 3Å; Q476-L478 PolarHBondContact O-N 3.33Å; Q476-L478 VanDerWaalsContact O-N 3.12Å
479	T	90.8	Very high	89.9	Confident	8 Å²	8	23.4 Å²	23.4	5%	0.049	12%	0.119	C	C	.	.	S	Bend	trans	-138.5	169.3	-162.4	72.1	0	0	0	0	111.6	P398 W401 M402 Q476 F481 R482	P398-T479 HydrophobicContact CB-CG2 3.65Å; W401-T479 HydrophobicContact CE3-CG2 3.57Å; W401-T479 HydrophobicContact CZ3-CG2 3.91Å; M402-T479 HydrophobicContact CG-CG2 4.42Å; Q476-T479 PolarHBondContact O-N 2.8Å; Q476-T479 PolarHBondContact O-OG1 3.41Å; T479-F481 PolarHBondContact O-N 2.79Å; T479-F481 PolarHBondContact OG1-N 3.1Å; T479-R482 PolarHBondContact O-NH1 3.26Å
480	P	92.9	Very high	89.9	Confident	11 Å²	11	24 Å²	24	7%	0.071	12%	0.122	C	C	.	.	S	Bend	trans	-72.2	-8.6	172.5	28.1	-35.2	0	0	0	113.9	W401 F453 T455 V456	W401-P480 HydrophobicContact CD2-CG 4.26Å; W401-P480 VanDerWaalsContact CE2-CD 3.44Å; W401-P480 HydrophobicContact CZ2-CG 4.16Å; F453-P480 HydrophobicContact CD1-CG 4.42Å; F453-P480 HydrophobicContact CD2-CB 3.96Å; F453-P480 HydrophobicContact CD2-CG 4.07Å; F453-P480 HydrophobicContact CE1-CG 3.92Å; F453-P480 HydrophobicContact CE2-CB 3.73Å; F453-P480 HydrophobicContact CE2-CG 3.5Å; F453-P480 HydrophobicContact CG-CG 4.49Å; F453-P480 HydrophobicContact CZ-CB 4.19Å; F453-P480 HydrophobicContact CZ-CG 3.43Å; F453-P480 VanDerWaalsContact CZ-CG 3.43Å; T455-P480 CarbonylContact C-O 3.55Å; T455-P480 VanDerWaalsContact CA-O 3.29Å; T455-P480 WeakPolarHBondContact CA-O 3.49Å; V456-P480 PolarHBondContact N-O 2.91Å
481	F	94.9	Very high	89.8	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	134.5	179.7	-61.5	-76.5	0	0	0	112.1	L367 L368 L397 W401 F453 V456 I458 Q476 T479 F483	L367-F481 HydrophobicContact CB-CE1 4.3Å; L368-F481 HydrophobicContact CD2-CE2 4.32Å; L368-F481 HydrophobicContact CD2-CZ 4.33Å; L397-F481 HydrophobicContact CB-CD1 4.36Å; L397-F481 HydrophobicContact CB-CD2 4.1Å; L397-F481 HydrophobicContact CB-CE1 4.43Å; L397-F481 HydrophobicContact CB-CE2 4.19Å; L397-F481 HydrophobicContact CB-CG 4.2Å; L397-F481 HydrophobicContact CB-CZ 4.34Å; L397-F481 HydrophobicContact CD1-CD1 4.21Å; L397-F481 HydrophobicContact CD1-CE1 4.18Å; L397-F481 HydrophobicContact CD2-CE1 4.25Å; L397-F481 HydrophobicContact CD2-CZ 4.07Å; W401-F481 HydrophobicContact CB-CE2 3.9Å; W401-F481 HydrophobicContact CG-CE2 4.19Å; F453-F481 HydrophobicContact CE2-CZ 4.3Å; F453-F481 HydrophobicContact CZ-CE1 4.49Å; F453-F481 HydrophobicContact CZ-CE2 4.14Å; F453-F481 AromaticContact CZ-CZ 3.83Å; F453-F481 HydrophobicContact CZ-CZ 3.83Å; V456-F481 HydrophobicContact CB-CD1 4.34Å; V456-F481 WeakPolarHBondContact O-CA 3.43Å; I458-F481 HydrophobicContact CD1-CD1 4.36Å; I458-F481 HydrophobicContact CG1-CD1 4.16Å; Q476-F481 WeakPolarHBondContact CB-O 3.33Å; T479-F481 PolarHBondContact O-N 2.79Å; T479-F481 PolarHBondContact OG1-N 3.1Å; F481-F483 HydrophobicContact CB-CE2 4.31Å; F481-F483 HydrophobicContact CB-CZ 4.4Å
482	R	94.2	Very high	89.2	Confident	84 Å²	84	34 Å²	34	32%	0.317	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	147.8	167.7	-63.9	-68.8	171.4	-80.5	-5.3	109	T455 V456 T457 I458 Q476 T479	T455-R482 HydrophobicContact CG2-CB 4.36Å; T455-R482 HydrophobicContact CG2-CG 3.45Å; T455-R482 VanDerWaalsContact CG2-CG 3.45Å; V456-R482 PolarHBondContact O-N 3.07Å; T457-R482 CarbonylContact C-O 3.6Å; T457-R482 WeakPolarHBondContact CA-O 3.31Å; I458-R482 PolarHBondContact N-O 2.81Å; Q476-R482 PolarHBondContact O-NH1 3.33Å; T479-R482 PolarHBondContact O-NH1 3.26Å
483	F	94.6	Very high	88.3	Confident	11 Å²	11	34.6 Å²	34.6	5%	0.048	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	127	-179.7	-63.4	-84.5	0	0	0	111.4	L394 P398 I458 L460 L473 Q476 F481 F507	L394-F483 WeakPolarHBondContact O-CZ 3.45Å; P398-F483 HydrophobicContact CG-CE2 3.73Å; P398-F483 HydrophobicContact CG-CZ 4.02Å; I458-F483 HydrophobicContact CB-CD1 3.8Å; I458-F483 HydrophobicContact CB-CE1 3.91Å; I458-F483 HydrophobicContact CG1-CD1 4.47Å; I458-F483 HydrophobicContact CG1-CE1 4.17Å; I458-F483 HydrophobicContact CG2-CD1 4.11Å; I458-F483 HydrophobicContact CG2-CE1 4.09Å; I458-F483 WeakPolarHBondContact O-CA 3.38Å; L460-F483 HydrophobicContact CD2-CB 4.3Å; L460-F483 HydrophobicContact CD2-CD1 3.71Å; L460-F483 HydrophobicContact CD2-CG 4.47Å; L473-F483 HydrophobicContact CD2-CB 3.63Å; L473-F483 HydrophobicContact CD2-CD1 3.74Å; L473-F483 HydrophobicContact CD2-CD2 3.48Å; L473-F483 VanDerWaalsContact CD2-CD2 3.48Å; L473-F483 HydrophobicContact CD2-CE1 4.24Å; L473-F483 HydrophobicContact CD2-CE2 4.02Å; L473-F483 HydrophobicContact CD2-CG 3.31Å; L473-F483 HydrophobicContact CD2-CZ 4.37Å; Q476-F483 HydrophobicContact CB-CD2 3.67Å; Q476-F483 HydrophobicContact CB-CE2 3.84Å; Q476-F483 HydrophobicContact CG-CD2 4.44Å; F481-F483 HydrophobicContact CB-CE2 4.31Å; F481-F483 HydrophobicContact CB-CZ 4.4Å; F483-F507 HydrophobicContact CB-CE1 4.09Å
484	S	93.5	Very high	87	Confident	26 Å²	26	40.2 Å²	40.2	18%	0.182	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	136.6	172.9	-179.9	0	0	0	0	108.7	I458 H459 L460	I458-S484 PolarHBondContact O-N 2.75Å; H459-S484 WeakPolarHBondContact CA-O 3.43Å; H459-S484 VanDerWaalsContact ND1-CB 3.31Å; H459-S484 WeakPolarHBondContact ND1-CB 3.42Å; H459-S484 PolarHBondContact ND1-OG 2.83Å; L460-S484 PolarHBondContact N-O 3.27Å
485	C	93.1	Very high	85.8	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.007	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	117.6	-173.5	174.1	0	0	0	0	109.4	L460 C462 R487 F507 S511 I512	L460-C485 WeakPolarHBondContact O-CA 3.5Å; C462-C485 HydrophobicContact CB-CB 4.42Å; C462-C485 VanDerWaalsContact CB-SG 3.52Å; C485-R487 VanDerWaalsContact SG-C 3.56Å; C485-R487 PolarHBondContact SG-O 3.13Å; C485-F507 HydrophobicContact CB-CD1 3.53Å; C485-F507 HydrophobicContact CB-CD2 4.22Å; C485-F507 HydrophobicContact CB-CE1 3.49Å; C485-F507 VanDerWaalsContact CB-CE1 3.49Å; C485-F507 HydrophobicContact CB-CE2 4.18Å; C485-F507 HydrophobicContact CB-CG 3.89Å; C485-F507 HydrophobicContact CB-CZ 3.81Å; C485-S511 CarbonylContact O-C 3.52Å; C485-I512 WeakPolarHBondContact O-CG1 3.15Å
486	N	91	Very high	84.6	Confident	62 Å²	62	47.3 Å²	47.3	33%	0.332	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	-41.4	175.6	-167.3	-82.5	0	0	0	112.1	S511 T513 Q514	N486-S511 PolarHBondContact ND2-O 2.87Å; N486-T513 WeakPolarHBondContact ND2-CG2 3.4Å; N486-T513 PolarHBondContact O-N 3.03Å; N486-T513 PolarHBondContact OD1-OG1 2.88Å; N486-Q514 PolarHBondContact O-N 2.78Å
487	R	91.4	Very high	83.4	Confident	62 Å²	62	52.8 Å²	52.8	23%	0.234	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	121.3	175.1	179.1	174.8	178.1	174	-8.6	110.6	E385 D461 C462 C485 Q514	E385-R487 IonicContact OE1-NH1 3.32Å; E385-R487 PolarHBondContact OE1-NH1 2.65Å; E385-R487 IonicContact OE2-CZ 3.64Å; E385-R487 IonicContact OE2-NH1 3.41Å; E385-R487 PolarHBondContact OE2-NH1 2.86Å; E385-R487 IonicContact OE2-NH2 3.15Å; D461-R487 CarbonylContact C-O 3.57Å; D461-R487 WeakPolarHBondContact CA-O 3.2Å; D461-R487 HydrophobicContact CB-CB 4.24Å; D461-R487 WeakPolarHBondContact OD1-CB 3.39Å; C462-R487 PolarHBondContact N-O 2.89Å; C485-R487 VanDerWaalsContact SG-C 3.56Å; C485-R487 PolarHBondContact SG-O 3.13Å; R487-Q514 WeakPolarHBondContact CA-O 3.49Å; R487-Q514 HydrophobicContact CB-CB 3.95Å; R487-Q514 HydrophobicContact CG-CB 3.88Å
488	L	91	Very high	82.5	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.005	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	119.5	174.5	178.2	64	0	0	0	110	C462 M464 L503 F507 I512 Q514 F515 E516 W536	C462-L488 HydrophobicContact CB-CD1 3.76Å; M464-L488 HydrophobicContact CB-CD1 4.11Å; M464-L488 HydrophobicContact CE-CD1 4.37Å; L488-L503 HydrophobicContact CD2-CD1 3.63Å; L488-L503 HydrophobicContact CD2-CD2 4.11Å; L488-L503 HydrophobicContact CD2-CG 4.39Å; L488-F507 HydrophobicContact CD1-CE2 4.08Å; L488-I512 HydrophobicContact CD2-CD1 4.43Å; L488-Q514 PolarHBondContact N-O 2.59Å; L488-F515 HydrophobicContact CB-CD2 4.27Å; L488-F515 HydrophobicContact CD2-CD2 4.14Å; L488-F515 HydrophobicContact CD2-CE2 4.11Å; L488-F515 HydrophobicContact CG-CD2 4.28Å; L488-F515 HydrophobicContact CG-CE2 4.46Å; L488-F515 WeakPolarHBondContact O-CA 3.39Å; L488-E516 PolarHBondContact O-N 3.23Å; L488-W536 HydrophobicContact CD2-CH2 3.96Å
489	L	88.3	Confident	81.7	Confident	36 Å²	36	47.4 Å²	47.4	19%	0.188	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	115.7	164.9	167	59.6	0	0	0	108.2	C462 M464 Q491 E516	C462-L489 PolarHBondContact O-N 3.24Å; M464-L489 WeakPolarHBondContact CB-O 3.31Å; M464-L489 PolarHBondContact N-O 3.3Å; L489-Q491 HydrophobicContact CD1-CG 4.32Å; L489-E516 HydrophobicContact CD1-CB 3.89Å; L489-E516 HydrophobicContact CD1-CG 3.62Å
490	L	85.6	Confident	80.7	Confident	12 Å²	12	47.4 Å²	47.4	6%	0.063	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	130.9	172.4	-178.7	66.9	0	0	0	109.5	M464 P500 L503 F515 E516 M517 E518	M464-L490 HydrophobicContact CB-CD1 3.92Å; M464-L490 HydrophobicContact CG-CD1 3.66Å; L490-P500 HydrophobicContact CD2-CB 4.37Å; L490-P500 HydrophobicContact CD2-CG 4.15Å; L490-L503 HydrophobicContact CD2-CD1 4.25Å; L490-F515 HydrophobicContact CB-CE2 4.49Å; L490-E516 PolarHBondContact N-O 2.85Å; L490-M517 HydrophobicContact CB-CB 4.43Å; L490-M517 HydrophobicContact CB-CG 4.43Å; L490-M517 HydrophobicContact CD2-CG 4Å; L490-M517 HydrophobicContact CD2-SD 3.88Å; L490-M517 HydrophobicContact CG-CG 4.46Å; L490-M517 CarbonylContact O-C 3.48Å; L490-M517 VanDerWaalsContact O-CA 3.29Å; L490-M517 WeakPolarHBondContact O-CA 3.3Å; L490-E518 PolarHBondContact O-N 3.19Å
491	Q	79.8	Confident	79.7	Confident	77 Å²	77	51.7 Å²	51.7	36%	0.36	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	153.7	162.1	-64.4	-163.4	-47	0	0	109	T465 L489 L493 E518	T465-Q491 HydrophobicContact CG2-CB 3.88Å; T465-Q491 HydrophobicContact CG2-CG 3.85Å; L489-Q491 HydrophobicContact CD1-CG 4.32Å; Q491-L493 PolarHBondContact O-N 3.48Å; Q491-E518 HydrophobicContact CG-CB 4.26Å; Q491-E518 PolarHBondContact NE2-OE2 3.31Å
492	R	72.5	Confident	78.9	Confident	138 Å²	138	51.8 Å²	51.8	52%	0.521	25%	0.25	S	S	.	.			trans	-58.4	110	-179.8	-170.6	-171.7	-169.4	-146.8	-5.8	111.8	P494 E518 D519 T521	R492-P494 WeakPolarHBondContact O-CD 3.36Å; R492-E518 PolarHBondContact N-O 2.89Å; R492-D519 HydrophobicContact CB-CB 3.93Å; R492-D519 VanDerWaalsContact CD-OD1 3.29Å; R492-D519 WeakPolarHBondContact CD-OD1 3.31Å; R492-D519 HydrophobicContact CG-CB 4.39Å; R492-D519 WeakPolarHBondContact CG-OD2 3.25Å; R492-D519 IonicContact NE-OD1 3.92Å; R492-D519 IonicContact NE-OD2 3.54Å; R492-T521 VanDerWaalsContact CZ-CG2 3.46Å; R492-T521 PolarHBondContact NE-OG1 3.44Å
493	L	69.9	Low	78.2	Confident	13 Å²	13	47.8 Å²	47.8	7%	0.068	24%	0.235	C	C	.	.			trans	-66.4	112.2	170.9	-60.8	178.2	0	0	0	109.3	T465 D467 Q491 E495 I496 F498	T465-L493 VanDerWaalsContact C-CD2 3.47Å; T465-L493 VanDerWaalsContact O-CD2 3.28Å; T465-L493 WeakPolarHBondContact O-CD2 3.49Å; D467-L493 HydrophobicContact CB-CD1 4.04Å; D467-L493 HydrophobicContact CB-CD2 4.46Å; Q491-L493 PolarHBondContact O-N 3.48Å; L493-E495 VanDerWaalsContact C-N 3.28Å; L493-E495 PolarHBondContact O-N 3.38Å; L493-I496 WeakPolarHBondContact CB-O 3.45Å; L493-F498 HydrophobicContact CD1-CB 4.13Å
494	P	62.6	Low	77.5	Confident	120 Å²	120	51.4 Å²	51.4	78%	0.779	25%	0.254	S	S	*	.	S	Bend	trans	-68.1	-27.5	-169.3	-23	35.1	0	0	0	114	R492	R492-P494 WeakPolarHBondContact O-CD 3.36Å
495	E	62.3	Low	77	Confident	140 Å²	140	55 Å²	55	65%	0.654	26%	0.264	S	S	*	.	S	Bend	trans	-108.6	-11.8	-171.5	-54.5	-178.5	167.6	0	0	114.1	R428 L493	R428-E495 IonicContact CZ-OE2 3.16Å; R428-E495 IonicContact NH1-OE2 2.96Å; R428-E495 PolarHBondContact NH1-OE2 3.19Å; R428-E495 IonicContact NH2-OE2 3.08Å; R428-E495 PolarHBondContact NH2-OE2 2.88Å; L493-E495 VanDerWaalsContact C-N 3.28Å; L493-E495 PolarHBondContact O-N 3.38Å
496	I	62.4	Low	76.7	Confident	14 Å²	14	55.3 Å²	55.3	7%	0.072	27%	0.265	C	S	.	.	S	Bend	trans	-122.9	111.2	167.3	-54.7	-164.7	0	0	0	107.2	I422 I424 D467 L493 F498	I422-I496 HydrophobicContact CG2-CG2 3.68Å; I424-I496 HydrophobicContact CG1-CD1 4.49Å; D467-I496 HydrophobicContact CB-CD1 3.67Å; D467-I496 HydrophobicContact CB-CG1 4.06Å; L493-I496 WeakPolarHBondContact CB-O 3.45Å; I496-F498 HydrophobicContact CG2-CB 4.21Å; I496-F498 PolarHBondContact O-N 2.97Å
497	N	66	Low	76.6	Confident	134 Å²	134	52.8 Å²	52.8	72%	0.717	25%	0.252	S	S	*	.			trans	-68.5	87.9	163	-172.7	0.4	0	0	0	108.3	P499	N497-P499 WeakPolarHBondContact O-CD 3.43Å
498	F	69	Low	76.5	Confident	19 Å²	19	53.3 Å²	53.3	8%	0.083	26%	0.259	C	S	.	.			trans	-91.8	106.1	174.8	-173.7	-73.6	0	0	0	107.7	L420 I422 A470 L493 I496 L503 L506	L420-F498 HydrophobicContact CD1-CE2 3.88Å; L420-F498 HydrophobicContact CD2-CE2 3.75Å; L420-F498 HydrophobicContact CD2-CZ 3.98Å; L420-F498 HydrophobicContact CG-CE2 4.37Å; I422-F498 HydrophobicContact CD1-CB 4.05Å; I422-F498 HydrophobicContact CD1-CD2 3.25Å; I422-F498 HydrophobicContact CD1-CE2 3.77Å; I422-F498 HydrophobicContact CD1-CG 3.75Å; A470-F498 HydrophobicContact CB-CD2 4.04Å; A470-F498 HydrophobicContact CB-CE2 3.93Å; L493-F498 HydrophobicContact CD1-CB 4.13Å; I496-F498 HydrophobicContact CG2-CB 4.21Å; I496-F498 PolarHBondContact O-N 2.97Å; F498-L503 HydrophobicContact CE1-CD2 3.78Å; F498-L503 HydrophobicContact CE1-CG 3.96Å; F498-L503 HydrophobicContact CZ-CD2 4.33Å; F498-L506 HydrophobicContact CE2-CD1 4.13Å; F498-L506 HydrophobicContact CZ-CD1 3.69Å; F498-L506 HydrophobicContact CZ-CG 4.34Å
499	P	69.7	Low	76.4	Confident	26 Å²	26	54.1 Å²	54.1	17%	0.169	26%	0.264	C	S	.	.			trans	-68	133.6	-177.8	-20	34.8	0	0	0	109.9	N497 Y501 S502	N497-P499 WeakPolarHBondContact O-CD 3.43Å; P499-Y501 HydrophobicContact CB-CD1 3.44Å; P499-Y501 VanDerWaalsContact CB-CD1 3.44Å; P499-Y501 HydrophobicContact CB-CE1 3.18Å; P499-Y501 HydrophobicContact CB-CE2 4.5Å; P499-Y501 HydrophobicContact CB-CG 4.25Å; P499-Y501 HydrophobicContact CG-CE1 3.82Å; P499-Y501 PolarHBondContact O-N 3.42Å; P499-S502 WeakPolarHBondContact O-CB 3.41Å; P499-S502 PolarHBondContact O-N 2.87Å
500	P	70.8	Confident	76.5	Confident	8 Å²	8	56.5 Å²	56.5	5%	0.052	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-54.6	-29	-178.5	-29.8	35.8	0	0	0	114.1	L490 S502 L503 M517 I522 A533	L490-P500 HydrophobicContact CD2-CB 4.37Å; L490-P500 HydrophobicContact CD2-CG 4.15Å; P500-S502 PolarHBondContact O-N 3.08Å; P500-L503 VanDerWaalsContact O-CB 3.23Å; P500-L503 WeakPolarHBondContact O-CB 3.37Å; P500-L503 WeakPolarHBondContact O-CD1 3.43Å; P500-L503 WeakPolarHBondContact O-CG 3.45Å; P500-L503 PolarHBondContact O-N 3.22Å; P500-L503 VanDerWaalsContact O-N 3.08Å; P500-M517 HydrophobicContact CB-SD 4.02Å; P500-M517 HydrophobicContact CG-SD 3.73Å; P500-I522 HydrophobicContact CG-CD1 4.22Å; P500-A533 HydrophobicContact CB-CB 4.48Å
501	Y	71.8	Confident	76.7	Confident	102 Å²	102	57.8 Å²	57.8	40%	0.4	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-62.2	-24.6	175.8	73.6	-104.6	0	0	0	113.8	P499 L503 I504	P499-Y501 HydrophobicContact CB-CD1 3.44Å; P499-Y501 VanDerWaalsContact CB-CD1 3.44Å; P499-Y501 HydrophobicContact CB-CE1 3.18Å; P499-Y501 HydrophobicContact CB-CE2 4.5Å; P499-Y501 HydrophobicContact CB-CG 4.25Å; P499-Y501 HydrophobicContact CG-CE1 3.82Å; P499-Y501 PolarHBondContact O-N 3.42Å; Y501-L503 PolarHBondContact O-N 3.14Å; Y501-I504 WeakPolarHBondContact O-CG2 3.33Å; Y501-I504 PolarHBondContact O-N 3.49Å
502	S	78	Confident	77.3	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.007	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-72.5	-11.2	176.7	-73.7	0	0	0	0	113.1	L420 P499 P500 I504 R505	L420-S502 PolarHBondContact O-OG 2.99Å; P499-S502 WeakPolarHBondContact O-CB 3.41Å; P499-S502 PolarHBondContact O-N 2.87Å; P500-S502 PolarHBondContact O-N 3.08Å; S502-I504 PolarHBondContact O-N 3.25Å; S502-R505 WeakPolarHBondContact O-CB 3.31Å; S502-R505 PolarHBondContact O-N 2.99Å
503	L	79	Confident	78.3	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-60.6	-28.3	173.4	-66.8	171.1	0	0	0	112.7	M464 L488 L490 F498 P500 Y501 R505 L506 F507 W536	M464-L503 HydrophobicContact CE-CD2 4.06Å; L488-L503 HydrophobicContact CD2-CD1 3.63Å; L488-L503 HydrophobicContact CD2-CD2 4.11Å; L488-L503 HydrophobicContact CD2-CG 4.39Å; L490-L503 HydrophobicContact CD2-CD1 4.25Å; F498-L503 HydrophobicContact CE1-CD2 3.78Å; F498-L503 HydrophobicContact CE1-CG 3.96Å; F498-L503 HydrophobicContact CZ-CD2 4.33Å; P500-L503 VanDerWaalsContact O-CB 3.23Å; P500-L503 WeakPolarHBondContact O-CB 3.37Å; P500-L503 WeakPolarHBondContact O-CD1 3.43Å; P500-L503 WeakPolarHBondContact O-CG 3.45Å; P500-L503 PolarHBondContact O-N 3.22Å; P500-L503 VanDerWaalsContact O-N 3.08Å; Y501-L503 PolarHBondContact O-N 3.14Å; L503-R505 PolarHBondContact O-N 3.01Å; L503-L506 HydrophobicContact CD2-CD1 4.39Å; L503-L506 PolarHBondContact O-N 3.1Å; L503-F507 PolarHBondContact O-N 3.09Å; L503-W536 HydrophobicContact CB-CD2 4.45Å; L503-W536 HydrophobicContact CB-CH2 4.09Å; L503-W536 HydrophobicContact CB-CZ2 3.44Å; L503-W536 VanDerWaalsContact CB-CZ2 3.44Å; L503-W536 HydrophobicContact CD1-CD2 4.48Å; L503-W536 HydrophobicContact CD1-CE3 4.23Å; L503-W536 HydrophobicContact CD1-CH2 3.51Å; L503-W536 HydrophobicContact CD1-CZ2 3.78Å; L503-W536 HydrophobicContact CD1-CZ3 3.75Å; L503-W536 HydrophobicContact CG-CH2 4.47Å; L503-W536 HydrophobicContact CG-CZ2 4.28Å
504	I	80.3	Confident	79.4	Confident	88 Å²	88	51.4 Å²	51.4	45%	0.451	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-60.3	-13.8	174.4	-158.1	160.2	0	0	0	113.6	Y501 S502 P509	Y501-I504 WeakPolarHBondContact O-CG2 3.33Å; Y501-I504 PolarHBondContact O-N 3.49Å; S502-I504 PolarHBondContact O-N 3.25Å; I504-P509 HydrophobicContact CD1-CG 3.94Å; I504-P509 HydrophobicContact CG1-CG 3.7Å
505	R	82.8	Confident	80.8	Confident	102 Å²	102	46 Å²	46	39%	0.385	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-99.6	-6.9	178.4	-47.5	-171.5	179.9	-168.8	-5.3	113	S419 H421 S502 L503	S419-R505 WeakPolarHBondContact O-CD 3.4Å; S419-R505 PolarHBondContact O-NH1 2.93Å; H421-R505 PolarHBondContact CD2-NH1 2.9Å; H421-R505 VanDerWaalsContact CD2-NH1 3.29Å; H421-R505 PolarHBondContact CD2-NH2 2.9Å; H421-R505 PolarHBondContact CE1-NH1 2.65Å; H421-R505 VanDerWaalsContact CG-NH1 3.28Å; H421-R505 PolarHBondContact ND1-NH1 2.82Å; H421-R505 VanDerWaalsContact ND1-NH1 3.2Å; H421-R505 PolarHBondContact NE2-NH1 2.88Å; H421-R505 VanDerWaalsContact NE2-NH1 3.14Å; H421-R505 PolarHBondContact NE2-NH2 3.33Å; S502-R505 WeakPolarHBondContact O-CB 3.31Å; S502-R505 PolarHBondContact O-N 2.99Å; L503-R505 PolarHBondContact O-N 3.01Å
506	L	86.1	Confident	82.2	Confident	6 Å²	6	40.3 Å²	40.3	3%	0.031	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.1	-36.1	175.9	-65.5	-175.7	0	0	0	112.2	L420 M464 A470 L473 Q476 F498 L503	L420-L506 HydrophobicContact CD2-CD2 3.98Å; L420-L506 HydrophobicContact CD2-CG 4.22Å; M464-L506 HydrophobicContact CE-CD1 3.85Å; A470-L506 HydrophobicContact CB-CD1 4.42Å; L473-L506 HydrophobicContact CB-CD1 4.48Å; L473-L506 HydrophobicContact CB-CD2 3.95Å; Q476-L506 PolarHBondContact NE2-O 3.15Å; F498-L506 HydrophobicContact CE2-CD1 4.13Å; F498-L506 HydrophobicContact CZ-CD1 3.69Å; F498-L506 HydrophobicContact CZ-CG 4.34Å; L503-L506 HydrophobicContact CD2-CD1 4.39Å; L503-L506 PolarHBondContact O-N 3.1Å
507	F	89.1	Confident	83.3	Confident	10 Å²	10	40.1 Å²	40.1	4%	0.044	20%	0.201	C	C	.	.	S	Bend	trans	-138.4	150.8	-174.4	-58.7	-59	0	0	0	112	C462 M464 L473 F483 C485 L488 L503 P509 I512	C462-F507 HydrophobicContact CB-CE2 4.23Å; C462-F507 HydrophobicContact CB-CZ 3.88Å; M464-F507 HydrophobicContact CE-CE2 3.93Å; L473-F507 HydrophobicContact CD1-CE1 4.18Å; L473-F507 HydrophobicContact CD1-CE2 4.12Å; L473-F507 HydrophobicContact CD1-CZ 3.47Å; L473-F507 VanDerWaalsContact CD1-CZ 3.47Å; L473-F507 HydrophobicContact CD2-CE1 4.28Å; L473-F507 HydrophobicContact CD2-CZ 4.33Å; F483-F507 HydrophobicContact CB-CE1 4.09Å; C485-F507 HydrophobicContact CB-CD1 3.53Å; C485-F507 HydrophobicContact CB-CD2 4.22Å; C485-F507 HydrophobicContact CB-CE1 3.49Å; C485-F507 VanDerWaalsContact CB-CE1 3.49Å; C485-F507 HydrophobicContact CB-CE2 4.18Å; C485-F507 HydrophobicContact CB-CG 3.89Å; C485-F507 HydrophobicContact CB-CZ 3.81Å; L488-F507 HydrophobicContact CD1-CE2 4.08Å; L503-F507 PolarHBondContact O-N 3.09Å; F507-P509 WeakPolarHBondContact O-CD 3.46Å; F507-I512 HydrophobicContact CB-CD1 4.26Å
508	D	89.6	Confident	84.2	Confident	72 Å²	72	35.6 Å²	35.6	39%	0.385	18%	0.175	S	C	.	.			trans	-69.7	122.1	167.4	160.5	43	0	0	0	111.1	L510 S511	D508-L510 PolarHBondContact O-N 2.89Å; D508-L510 WeakPolarHBondContact OD1-CB 3.34Å; D508-L510 PolarHBondContact OD1-N 3.45Å; D508-S511 PolarHBondContact O-N 2.91Å; D508-S511 WeakPolarHBondContact OD2-CB 3.44Å; D508-S511 PolarHBondContact OD2-N 3.08Å; D508-S511 PolarHBondContact OD2-OG 2.67Å
509	P	88.5	Confident	84.7	Confident	19 Å²	19	35.6 Å²	35.6	12%	0.123	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-23.6	174.7	-28.8	38.1	0	0	0	115.6	I504 F507 S539 L540	I504-P509 HydrophobicContact CD1-CG 3.94Å; I504-P509 HydrophobicContact CG1-CG 3.7Å; F507-P509 WeakPolarHBondContact O-CD 3.46Å; P509-S539 WeakPolarHBondContact CB-O 3.43Å; P509-L540 HydrophobicContact CB-CD2 3.99Å
510	L	90.8	Very high	85	Confident	85 Å²	85	37.1 Å²	37.1	45%	0.445	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-22.6	-179.2	-55.5	179.2	0	0	0	112.6	D508 R541 N542	D508-L510 PolarHBondContact O-N 2.89Å; D508-L510 WeakPolarHBondContact OD1-CB 3.34Å; D508-L510 PolarHBondContact OD1-N 3.45Å; L510-R541 HydrophobicContact CD2-CB 4.09Å; L510-N542 PolarHBondContact O-ND2 3.15Å
511	S	90.9	Very high	85.2	Confident	39 Å²	39	38.9 Å²	38.9	27%	0.273	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-28	176.4	-67.2	0	0	0	0	112.9	C485 N486 D508 T513	C485-S511 CarbonylContact O-C 3.52Å; N486-S511 PolarHBondContact ND2-O 2.87Å; D508-S511 PolarHBondContact O-N 2.91Å; D508-S511 WeakPolarHBondContact OD2-CB 3.44Å; D508-S511 PolarHBondContact OD2-N 3.08Å; D508-S511 PolarHBondContact OD2-OG 2.67Å; S511-T513 PolarHBondContact O-N 3.09Å
512	I	92.1	Very high	85.3	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.179	C	C	.	.			trans	-77.3	120.1	-178	-59.4	172	0	0	0	109.9	C485 L488 F507 Q514 F515 W536 L540 L543	C485-I512 WeakPolarHBondContact O-CG1 3.15Å; L488-I512 HydrophobicContact CD2-CD1 4.43Å; F507-I512 HydrophobicContact CB-CD1 4.26Å; I512-Q514 WeakPolarHBondContact CG2-O 3.37Å; I512-F515 HydrophobicContact CG2-CB 4.42Å; I512-W536 HydrophobicContact CD1-CH2 4.02Å; I512-W536 HydrophobicContact CD1-CZ2 3.98Å; I512-L540 HydrophobicContact CB-CD2 4.3Å; I512-L540 HydrophobicContact CD1-CD2 4.06Å; I512-L540 HydrophobicContact CG2-CD1 4.32Å; I512-L543 HydrophobicContact CG2-CD1 4.03Å
513	T	93.4	Very high	84.8	Confident	26 Å²	26	34.4 Å²	34.4	16%	0.16	18%	0.18	C	C	.	.			trans	-114.7	-14.5	173.3	82.7	0	0	0	0	113.5	N486 S511 R544 A545	N486-T513 WeakPolarHBondContact ND2-CG2 3.4Å; N486-T513 PolarHBondContact O-N 3.03Å; N486-T513 PolarHBondContact OD1-OG1 2.88Å; S511-T513 PolarHBondContact O-N 3.09Å; T513-R544 PolarHBondContact O-N 2.73Å; T513-A545 PolarHBondContact O-N 3.45Å; T513-A545 VanDerWaalsContact O-N 3.13Å
514	Q	93.2	Very high	84.3	Confident	69 Å²	69	38 Å²	38	32%	0.322	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	130.6	174.2	-53.3	-178.1	40.9	0	0	110	N486 R487 L488 I512 A545	N486-Q514 PolarHBondContact O-N 2.78Å; R487-Q514 WeakPolarHBondContact CA-O 3.49Å; R487-Q514 HydrophobicContact CB-CB 3.95Å; R487-Q514 HydrophobicContact CG-CB 3.88Å; L488-Q514 PolarHBondContact N-O 2.59Å; I512-Q514 WeakPolarHBondContact CG2-O 3.37Å; Q514-A545 HydrophobicContact CB-CB 4.24Å; Q514-A545 HydrophobicContact CG-CB 4.12Å
515	F	91.7	Very high	83.9	Confident	6 Å²	6	35.8 Å²	35.8	3%	0.026	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	130.4	-179.3	176.4	-122.6	0	0	0	110.3	L488 L490 I512 M517 W536 L537 L540 L543 A545 C546 S547 L548	L488-F515 HydrophobicContact CB-CD2 4.27Å; L488-F515 HydrophobicContact CD2-CD2 4.14Å; L488-F515 HydrophobicContact CD2-CE2 4.11Å; L488-F515 HydrophobicContact CG-CD2 4.28Å; L488-F515 HydrophobicContact CG-CE2 4.46Å; L488-F515 WeakPolarHBondContact O-CA 3.39Å; L490-F515 HydrophobicContact CB-CE2 4.49Å; I512-F515 HydrophobicContact CG2-CB 4.42Å; F515-M517 HydrophobicContact CE1-CB 3.92Å; F515-M517 HydrophobicContact CE1-CE 3.98Å; F515-M517 HydrophobicContact CE1-SD 4.35Å; F515-M517 HydrophobicContact CE2-CB 4.06Å; F515-M517 HydrophobicContact CZ-CB 3.48Å; F515-M517 VanDerWaalsContact CZ-CB 3.48Å; F515-M517 HydrophobicContact CZ-CE 3.95Å; F515-M517 HydrophobicContact CZ-CG 4.15Å; F515-M517 HydrophobicContact CZ-SD 3.71Å; F515-W536 HydrophobicContact CD1-CZ3 4.36Å; F515-W536 HydrophobicContact CD2-CH2 4.24Å; F515-W536 AromaticContact CD2-CZ3 3.98Å; F515-W536 HydrophobicContact CD2-CZ3 3.98Å; F515-W536 AromaticContact CE1-CZ3 3.96Å; F515-W536 HydrophobicContact CE1-CZ3 3.96Å; F515-W536 HydrophobicContact CE2-CH2 4.06Å; F515-W536 AromaticContact CE2-CZ3 3.56Å; F515-W536 HydrophobicContact CE2-CZ3 3.56Å; F515-W536 HydrophobicContact CG-CZ3 4.36Å; F515-W536 HydrophobicContact CZ-CE3 4.26Å; F515-W536 HydrophobicContact CZ-CH2 4.46Å; F515-W536 AromaticContact CZ-CZ3 3.52Å; F515-W536 HydrophobicContact CZ-CZ3 3.52Å; F515-L537 HydrophobicContact CD1-CD1 4.01Å; F515-L537 HydrophobicContact CE1-CD1 4.35Å; F515-L540 HydrophobicContact CB-CD1 4Å; F515-L540 HydrophobicContact CD1-CD1 4.1Å; F515-L540 HydrophobicContact CG-CD1 4Å; F515-L543 HydrophobicContact CB-CD1 3.58Å; F515-L543 HydrophobicContact CB-CD2 4.16Å; F515-A545 PolarHBondContact N-O 3.38Å; F515-C546 CarbonylContact O-C 3.57Å; F515-C546 WeakPolarHBondContact O-CA 3.46Å; F515-S547 PolarHBondContact O-N 2.92Å; F515-L548 HydrophobicContact CE1-CD2 4.09Å
516	E	90.4	Very high	83.2	Confident	21 Å²	21	32.9 Å²	32.9	10%	0.098	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	137.2	171.6	-177.9	153	-128.2	0	0	110	Y10 L488 L489 L490 S547	Y10-E516 PolarHBondContact OH-OE1 2.78Å; Y10-E516 VanDerWaalsContact OH-OE1 3.09Å; Y10-E516 PolarHBondContact OH-OE2 3.05Å; L488-E516 PolarHBondContact O-N 3.23Å; L489-E516 HydrophobicContact CD1-CB 3.89Å; L489-E516 HydrophobicContact CD1-CG 3.62Å; L490-E516 PolarHBondContact N-O 2.85Å; E516-S547 CarbonylContact C-O 3.56Å; E516-S547 VanDerWaalsContact CA-O 3.24Å; E516-S547 WeakPolarHBondContact CA-O 3.47Å; E516-S547 WeakPolarHBondContact OE1-CB 3.45Å; E516-S547 PolarHBondContact OE1-OG 3.36Å
517	M	86.6	Confident	82.1	Confident	9 Å²	9	37 Å²	37	4%	0.044	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	116.4	-179.7	177.9	168.7	63.3	0	0	111.2	L490 P500 F515 I522 S547 L548 P549 C551	L490-M517 HydrophobicContact CB-CB 4.43Å; L490-M517 HydrophobicContact CB-CG 4.43Å; L490-M517 HydrophobicContact CD2-CG 4Å; L490-M517 HydrophobicContact CD2-SD 3.88Å; L490-M517 HydrophobicContact CG-CG 4.46Å; L490-M517 CarbonylContact O-C 3.48Å; L490-M517 VanDerWaalsContact O-CA 3.29Å; L490-M517 WeakPolarHBondContact O-CA 3.3Å; P500-M517 HydrophobicContact CB-SD 4.02Å; P500-M517 HydrophobicContact CG-SD 3.73Å; F515-M517 HydrophobicContact CE1-CB 3.92Å; F515-M517 HydrophobicContact CE1-CE 3.98Å; F515-M517 HydrophobicContact CE1-SD 4.35Å; F515-M517 HydrophobicContact CE2-CB 4.06Å; F515-M517 HydrophobicContact CZ-CB 3.48Å; F515-M517 VanDerWaalsContact CZ-CB 3.48Å; F515-M517 HydrophobicContact CZ-CE 3.95Å; F515-M517 HydrophobicContact CZ-CG 4.15Å; F515-M517 HydrophobicContact CZ-SD 3.71Å; M517-I522 HydrophobicContact CE-CD1 3.44Å; M517-I522 VanDerWaalsContact CE-CD1 3.44Å; M517-I522 HydrophobicContact CG-CD1 3.88Å; M517-I522 HydrophobicContact SD-CD1 3.28Å; M517-I522 WeakPolarHBondContact SD-CD1 3.27Å; M517-S547 PolarHBondContact N-O 3.49Å; M517-L548 HydrophobicContact CB-CD2 4.01Å; M517-L548 HydrophobicContact CE-CD2 3.64Å; M517-P549 WeakPolarHBondContact O-CD 3.43Å; M517-C551 PolarHBondContact O-SG 2.98Å
518	E	84.2	Confident	81.2	Confident	39 Å²	39	41 Å²	41	18%	0.182	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	97.7	172.7	-172	149.8	-134.5	0	0	110.9	L490 Q491 R492 P549 S550 R678	L490-E518 PolarHBondContact O-N 3.19Å; Q491-E518 HydrophobicContact CG-CB 4.26Å; Q491-E518 PolarHBondContact NE2-OE2 3.31Å; R492-E518 PolarHBondContact N-O 2.89Å; E518-P549 HydrophobicContact CB-CG 4Å; E518-P549 HydrophobicContact CG-CG 4.3Å; E518-S550 PolarHBondContact OE1-OG 3.4Å; E518-R678 IonicContact OE1-CZ 3.72Å; E518-R678 IonicContact OE1-NE 3.15Å; E518-R678 IonicContact OE1-NH2 3.62Å; E518-R678 PolarHBondContact OE1-NH2 3.34Å; E518-R678 IonicContact OE2-NH2 2.95Å
519	D	79.4	Confident	80.5	Confident	19 Å²	19	39.6 Å²	39.6	10%	0.102	24%	0.243	C	C	.	.			trans	-148	102	169.6	-176.9	-8.3	0	0	0	110.7	R492 T521 I522	R492-D519 HydrophobicContact CB-CB 3.93Å; R492-D519 VanDerWaalsContact CD-OD1 3.29Å; R492-D519 WeakPolarHBondContact CD-OD1 3.31Å; R492-D519 HydrophobicContact CG-CB 4.39Å; R492-D519 WeakPolarHBondContact CG-OD2 3.25Å; R492-D519 IonicContact NE-OD1 3.92Å; R492-D519 IonicContact NE-OD2 3.54Å; D519-T521 VanDerWaalsContact CG-OG1 3.32Å; D519-T521 PolarHBondContact O-N 3.23Å; D519-T521 VanDerWaalsContact O-N 3.09Å; D519-T521 WeakPolarHBondContact OD1-CA 3.33Å; D519-T521 WeakPolarHBondContact OD1-CB 3.28Å; D519-T521 PolarHBondContact OD1-N 3.04Å; D519-T521 PolarHBondContact OD1-OG1 3.26Å; D519-T521 PolarHBondContact OD2-OG1 3.25Å; D519-I522 HydrophobicContact CB-CD1 3.79Å; D519-I522 HydrophobicContact CB-CG1 3.88Å; D519-I522 PolarHBondContact O-N 2.85Å
520	P	77	Confident	80	Confident	58 Å²	58	39.3 Å²	39.3	38%	0.377	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-18.7	176.9	-25.6	34.9	0	0	0	115.2	I522 S524 S550	P520-I522 VanDerWaalsContact C-N 3.29Å; P520-I522 PolarHBondContact O-N 2.92Å; P520-S524 PolarHBondContact O-OG 2.83Å; P520-S550 VanDerWaalsContact CA-O 3.31Å; P520-S550 WeakPolarHBondContact CA-O 3.48Å
521	T	73.6	Confident	79.5	Confident	46 Å²	46	37.7 Å²	37.7	28%	0.282	24%	0.235	S	C	.	.	H	α-helix	trans	-79.5	-11.1	-179.1	69	0	0	0	0	113.9	R492 D519 S524 S525	R492-T521 VanDerWaalsContact CZ-CG2 3.46Å; R492-T521 PolarHBondContact NE-OG1 3.44Å; D519-T521 VanDerWaalsContact CG-OG1 3.32Å; D519-T521 PolarHBondContact O-N 3.23Å; D519-T521 VanDerWaalsContact O-N 3.09Å; D519-T521 WeakPolarHBondContact OD1-CA 3.33Å; D519-T521 WeakPolarHBondContact OD1-CB 3.28Å; D519-T521 PolarHBondContact OD1-N 3.04Å; D519-T521 PolarHBondContact OD1-OG1 3.26Å; D519-T521 PolarHBondContact OD2-OG1 3.25Å; T521-S524 WeakPolarHBondContact O-CB 3.26Å; T521-S524 PolarHBondContact O-N 3.18Å; T521-S525 PolarHBondContact O-N 2.89Å
522	I	74.7	Confident	78.9	Confident	5 Å²	5	37.9 Å²	37.9	3%	0.026	24%	0.237	C	C	.	.	H	α-helix	trans	-64	-53.7	176.3	-66.7	179.4	0	0	0	110.1	P500 M517 D519 P520 S524 S525 V529 L530 A533	P500-I522 HydrophobicContact CG-CD1 4.22Å; M517-I522 HydrophobicContact CE-CD1 3.44Å; M517-I522 VanDerWaalsContact CE-CD1 3.44Å; M517-I522 HydrophobicContact CG-CD1 3.88Å; M517-I522 HydrophobicContact SD-CD1 3.28Å; M517-I522 WeakPolarHBondContact SD-CD1 3.27Å; D519-I522 HydrophobicContact CB-CD1 3.79Å; D519-I522 HydrophobicContact CB-CG1 3.88Å; D519-I522 PolarHBondContact O-N 2.85Å; P520-I522 VanDerWaalsContact C-N 3.29Å; P520-I522 PolarHBondContact O-N 2.92Å; I522-S524 PolarHBondContact O-N 2.95Å; I522-S525 PolarHBondContact O-N 3.04Å; I522-V529 HydrophobicContact CB-CG1 4.42Å; I522-V529 HydrophobicContact CG1-CG1 3.98Å; I522-L530 HydrophobicContact CG2-CB 4.34Å; I522-L530 HydrophobicContact CG2-CD1 3.8Å; I522-A533 HydrophobicContact CG2-CB 4.17Å
523	G	67.8	Low	78.4	Confident	3 Å²	3	38.2 Å²	38.2	3%	0.031	24%	0.239	C	C	.	.	H	α-helix	trans	-65.2	-23.5	175	0	0	0	0	0	113.9	S525 C551	G523-S525 VanDerWaalsContact C-N 3.32Å; G523-S525 PolarHBondContact O-N 2.72Å; G523-C551 WeakPolarHBondContact CA-O 3.22Å; G523-C551 PolarHBondContact N-O 2.66Å
524	S	69.2	Low	78	Confident	77 Å²	77	37.4 Å²	37.4	54%	0.538	24%	0.235	S	C	.	.	H	α-helix	trans	-68	-26.5	174.4	-48	0	0	0	0	113.7	P520 T521 I522	P520-S524 PolarHBondContact O-OG 2.83Å; T521-S524 WeakPolarHBondContact O-CB 3.26Å; T521-S524 PolarHBondContact O-N 3.18Å; I522-S524 PolarHBondContact O-N 2.95Å
525	S	70.6	Confident	77.7	Confident	41 Å²	41	36.1 Å²	36.1	29%	0.287	24%	0.24	S	C	.	.			trans	-118.1	73.6	-173.5	-173.4	0	0	0	0	112.4	T521 I522 G523 A527 V528 V529 L530	T521-S525 PolarHBondContact O-N 2.89Å; I522-S525 PolarHBondContact O-N 3.04Å; G523-S525 VanDerWaalsContact C-N 3.32Å; G523-S525 PolarHBondContact O-N 2.72Å; S525-A527 VanDerWaalsContact C-N 3.26Å; S525-A527 PolarHBondContact O-N 2.93Å; S525-V528 PolarHBondContact O-N 2.91Å; S525-V529 PolarHBondContact O-N 3.07Å; S525-V529 VanDerWaalsContact O-N 3.09Å; S525-L530 PolarHBondContact O-N 2.92Å
526	I	67.6	Low	77.3	Confident	40 Å²	40	36.3 Å²	36.3	21%	0.205	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-26.2	179.8	-65.1	177.9	0	0	0	113.1	L530 P531 S653 A656 A657 L660	I526-L530 HydrophobicContact CG1-CD2 4.3Å; I526-P531 WeakPolarHBondContact O-CD 3.15Å; I526-P531 WeakPolarHBondContact O-CG 3.19Å; I526-S653 WeakPolarHBondContact CD1-O 3.48Å; I526-S653 WeakPolarHBondContact CD1-OG 3.4Å; I526-A656 HydrophobicContact CD1-CB 4.31Å; I526-A656 HydrophobicContact CG2-CB 4.32Å; I526-A657 HydrophobicContact CD1-CB 4.11Å; I526-A657 HydrophobicContact CG1-CB 4.41Å; I526-L660 HydrophobicContact CG2-CD1 4.11Å
527	A	64	Low	77.2	Confident	92 Å²	92	35.5 Å²	35.5	76%	0.76	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-26.9	-178.2	0	0	0	0	0	113.9	S525	S525-A527 VanDerWaalsContact C-N 3.26Å; S525-A527 PolarHBondContact O-N 2.93Å
528	V	70.8	Confident	77.4	Confident	94 Å²	94	37.8 Å²	37.8	57%	0.57	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-137.2	-60.9	-170.5	-175.2	0	0	0	0	112.3	S525 P531 S532	S525-V528 PolarHBondContact O-N 2.91Å; V528-P531 WeakPolarHBondContact O-CD 3.48Å; V528-S532 PolarHBondContact O-N 3.18Å; V528-S532 PolarHBondContact O-OG 2.82Å
529	V	74.5	Confident	77.7	Confident	43 Å²	43	37.2 Å²	37.2	26%	0.261	25%	0.249	S	C	.	.	H	α-helix	trans	-69.1	-49.9	-170.2	-175.9	0	0	0	0	111.5	I522 S525 S532 A533	I522-V529 HydrophobicContact CB-CG1 4.42Å; I522-V529 HydrophobicContact CG1-CG1 3.98Å; S525-V529 PolarHBondContact O-N 3.07Å; S525-V529 VanDerWaalsContact O-N 3.09Å; V529-S532 PolarHBondContact O-N 3.26Å; V529-A533 WeakPolarHBondContact O-CB 3.31Å; V529-A533 PolarHBondContact O-N 3.42Å
530	L	78.3	Confident	78.2	Confident	13 Å²	13	36.3 Å²	36.3	7%	0.068	24%	0.244	C	C	.	.	H	α-helix	trans	-63.1	-46.1	-177.5	179.2	63.9	0	0	0	113	I522 S525 I526 S532 A533 V534 A657 L660	I522-L530 HydrophobicContact CG2-CB 4.34Å; I522-L530 HydrophobicContact CG2-CD1 3.8Å; S525-L530 PolarHBondContact O-N 2.92Å; I526-L530 HydrophobicContact CG1-CD2 4.3Å; L530-S532 VanDerWaalsContact C-N 3.31Å; L530-S532 PolarHBondContact O-N 3.22Å; L530-A533 PolarHBondContact O-N 3.08Å; L530-V534 HydrophobicContact CD1-CG2 3.86Å; L530-V534 HydrophobicContact CG-CG2 4.29Å; L530-V534 VanDerWaalsContact O-CB 3.27Å; L530-V534 WeakPolarHBondContact O-CB 3.5Å; L530-V534 WeakPolarHBondContact O-CG2 3.45Å; L530-V534 PolarHBondContact O-N 3.21Å; L530-A657 HydrophobicContact CD2-CB 3.6Å; L530-L660 HydrophobicContact CD2-CB 4.19Å; L530-L660 HydrophobicContact CD2-CD1 3.95Å; L530-L660 HydrophobicContact CG-CB 4.4Å; L530-L660 HydrophobicContact CG-CD1 4.25Å
531	P	80.5	Confident	78.9	Confident	51 Å²	51	42.1 Å²	42.1	33%	0.331	26%	0.259	S	S	.	.	H	α-helix	trans	-58.1	-39	174.7	-26.8	35.3	0	0	0	113.5	I526 V528 G535 L660	I526-P531 WeakPolarHBondContact O-CD 3.15Å; I526-P531 WeakPolarHBondContact O-CG 3.19Å; V528-P531 WeakPolarHBondContact O-CD 3.48Å; P531-G535 PolarHBondContact O-N 2.76Å; P531-L660 HydrophobicContact CG-CD1 4.33Å
532	S	78	Confident	79.9	Confident	44 Å²	44	42.9 Å²	42.9	31%	0.308	26%	0.261	S	S	.	.	H	α-helix	trans	-71.3	-40.3	176.8	-59.9	0	0	0	0	112.8	V528 V529 L530 G535 W536	V528-S532 PolarHBondContact O-N 3.18Å; V528-S532 PolarHBondContact O-OG 2.82Å; V529-S532 PolarHBondContact O-N 3.26Å; L530-S532 VanDerWaalsContact C-N 3.31Å; L530-S532 PolarHBondContact O-N 3.22Å; S532-G535 PolarHBondContact O-N 2.82Å; S532-W536 PolarHBondContact O-N 3.29Å
533	A	81.3	Confident	80.8	Confident	6 Å²	6	42.7 Å²	42.7	5%	0.05	26%	0.26	C	S	.	.	H	α-helix	trans	-64.9	-41.7	174.7	0	0	0	0	0	111.6	P500 I522 V529 L530 W536 L537	P500-A533 HydrophobicContact CB-CB 4.48Å; I522-A533 HydrophobicContact CG2-CB 4.17Å; V529-A533 WeakPolarHBondContact O-CB 3.31Å; V529-A533 PolarHBondContact O-N 3.42Å; L530-A533 PolarHBondContact O-N 3.08Å; A533-W536 PolarHBondContact O-N 3.46Å; A533-L537 WeakPolarHBondContact O-CB 3.21Å; A533-L537 PolarHBondContact O-N 3.11Å
534	V	85.5	Confident	82.1	Confident	10 Å²	10	49.1 Å²	49.1	6%	0.061	28%	0.283	C	S	.	.	H	α-helix	trans	-62	-44.5	172.2	156.3	0	0	0	0	111.5	L530 W536 L537 I538 L660 A664	L530-V534 HydrophobicContact CD1-CG2 3.86Å; L530-V534 HydrophobicContact CG-CG2 4.29Å; L530-V534 VanDerWaalsContact O-CB 3.27Å; L530-V534 WeakPolarHBondContact O-CB 3.5Å; L530-V534 WeakPolarHBondContact O-CG2 3.45Å; L530-V534 PolarHBondContact O-N 3.21Å; V534-W536 VanDerWaalsContact C-N 3.3Å; V534-W536 PolarHBondContact O-N 2.86Å; V534-L537 PolarHBondContact O-N 3.26Å; V534-I538 HydrophobicContact CG1-CD1 3.79Å; V534-I538 WeakPolarHBondContact O-CD1 3.49Å; V534-I538 VanDerWaalsContact O-CG1 3.23Å; V534-I538 WeakPolarHBondContact O-CG1 3.49Å; V534-I538 PolarHBondContact O-N 3.08Å; V534-L660 HydrophobicContact CG2-CB 4.31Å; V534-A664 HydrophobicContact CG1-CB 4.15Å; V534-A664 HydrophobicContact CG2-CB 4.38Å
535	G	85.4	Confident	83.3	Confident	42 Å²	42	46.4 Å²	46.4	43%	0.433	27%	0.265	S	S	.	.	H	α-helix	trans	-60.6	-38.5	176.1	0	0	0	0	0	112.9	P531 S532	P531-G535 PolarHBondContact O-N 2.76Å; S532-G535 PolarHBondContact O-N 2.82Å
536	W	84.1	Confident	84.4	Confident	9 Å²	9	44.6 Å²	44.6	3%	0.034	25%	0.253	C	S	.	.	H	α-helix	trans	-72.6	-41.1	174	-172.1	76	0	0	0	112.5	L488 L503 I512 F515 S532 A533 V534 I538 S539 L540	L488-W536 HydrophobicContact CD2-CH2 3.96Å; L503-W536 HydrophobicContact CB-CD2 4.45Å; L503-W536 HydrophobicContact CB-CH2 4.09Å; L503-W536 HydrophobicContact CB-CZ2 3.44Å; L503-W536 VanDerWaalsContact CB-CZ2 3.44Å; L503-W536 HydrophobicContact CD1-CD2 4.48Å; L503-W536 HydrophobicContact CD1-CE3 4.23Å; L503-W536 HydrophobicContact CD1-CH2 3.51Å; L503-W536 HydrophobicContact CD1-CZ2 3.78Å; L503-W536 HydrophobicContact CD1-CZ3 3.75Å; L503-W536 HydrophobicContact CG-CH2 4.47Å; L503-W536 HydrophobicContact CG-CZ2 4.28Å; I512-W536 HydrophobicContact CD1-CH2 4.02Å; I512-W536 HydrophobicContact CD1-CZ2 3.98Å; F515-W536 HydrophobicContact CD1-CZ3 4.36Å; F515-W536 HydrophobicContact CD2-CH2 4.24Å; F515-W536 AromaticContact CD2-CZ3 3.98Å; F515-W536 HydrophobicContact CD2-CZ3 3.98Å; F515-W536 AromaticContact CE1-CZ3 3.96Å; F515-W536 HydrophobicContact CE1-CZ3 3.96Å; F515-W536 HydrophobicContact CE2-CH2 4.06Å; F515-W536 AromaticContact CE2-CZ3 3.56Å; F515-W536 HydrophobicContact CE2-CZ3 3.56Å; F515-W536 HydrophobicContact CG-CZ3 4.36Å; F515-W536 HydrophobicContact CZ-CE3 4.26Å; F515-W536 HydrophobicContact CZ-CH2 4.46Å; F515-W536 AromaticContact CZ-CZ3 3.52Å; F515-W536 HydrophobicContact CZ-CZ3 3.52Å; S532-W536 PolarHBondContact O-N 3.29Å; A533-W536 PolarHBondContact O-N 3.46Å; V534-W536 VanDerWaalsContact C-N 3.3Å; V534-W536 PolarHBondContact O-N 2.86Å; W536-I538 VanDerWaalsContact C-N 3.3Å; W536-I538 PolarHBondContact O-N 3.23Å; W536-S539 WeakPolarHBondContact O-CA 3.24Å; W536-S539 VanDerWaalsContact O-CB 3.27Å; W536-S539 WeakPolarHBondContact O-CB 3.17Å; W536-S539 PolarHBondContact O-N 3.26Å; W536-S539 PolarHBondContact O-OG 2.91Å; W536-L540 HydrophobicContact CE3-CD1 4.29Å; W536-L540 HydrophobicContact CH2-CD1 3.84Å; W536-L540 HydrophobicContact CH2-CD2 3.79Å; W536-L540 HydrophobicContact CH2-CG 4.28Å; W536-L540 HydrophobicContact CZ2-CD2 3.73Å; W536-L540 HydrophobicContact CZ3-CD1 3.67Å; W536-L540 HydrophobicContact CZ3-CD2 4.23Å; W536-L540 HydrophobicContact CZ3-CG 4.24Å
537	L	89	Confident	85.6	Confident	4 Å²	4	43.7 Å²	43.7	2%	0.021	25%	0.25	C	S	.	.	H	α-helix	trans	-59.3	-39.6	175.5	-177.8	56.6	0	0	0	111.9	F515 A533 V534 S539 L540 L543 L548 L661 A664 L668	F515-L537 HydrophobicContact CD1-CD1 4.01Å; F515-L537 HydrophobicContact CE1-CD1 4.35Å; A533-L537 WeakPolarHBondContact O-CB 3.21Å; A533-L537 PolarHBondContact O-N 3.11Å; V534-L537 PolarHBondContact O-N 3.26Å; L537-S539 PolarHBondContact O-N 2.65Å; L537-L540 HydrophobicContact CD1-CD1 4.1Å; L537-L540 WeakPolarHBondContact O-CB 3.46Å; L537-L540 PolarHBondContact O-N 3.05Å; L537-L540 VanDerWaalsContact O-N 3.12Å; L537-L543 HydrophobicContact CD1-CD2 3.81Å; L537-L548 HydrophobicContact CD2-CD1 4.24Å; L537-L661 HydrophobicContact CD2-CD1 3.98Å; L537-A664 HydrophobicContact CB-CB 4.39Å; L537-A664 HydrophobicContact CD2-CB 3.78Å; L537-A664 HydrophobicContact CG-CB 4.08Å; L537-L668 HydrophobicContact CD1-CD1 4.12Å; L537-L668 HydrophobicContact CG-CD1 4.3Å
538	I	90.4	Very high	87	Confident	57 Å²	57	39.7 Å²	39.7	29%	0.292	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-23.8	172.8	-68.9	162.7	0	0	0	112.4	V534 W536 A664	V534-I538 HydrophobicContact CG1-CD1 3.79Å; V534-I538 WeakPolarHBondContact O-CD1 3.49Å; V534-I538 VanDerWaalsContact O-CG1 3.23Å; V534-I538 WeakPolarHBondContact O-CG1 3.49Å; V534-I538 PolarHBondContact O-N 3.08Å; W536-I538 VanDerWaalsContact C-N 3.3Å; W536-I538 PolarHBondContact O-N 3.23Å; I538-A664 HydrophobicContact CD1-CB 4.49Å; I538-A664 HydrophobicContact CG1-CB 4Å
539	S	89.5	Confident	87.9	Confident	28 Å²	28	35.5 Å²	35.5	20%	0.196	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-20.2	176.4	82.3	0	0	0	0	113.5	P509 W536 L537 R541	P509-S539 WeakPolarHBondContact CB-O 3.43Å; W536-S539 WeakPolarHBondContact O-CA 3.24Å; W536-S539 VanDerWaalsContact O-CB 3.27Å; W536-S539 WeakPolarHBondContact O-CB 3.17Å; W536-S539 PolarHBondContact O-N 3.26Å; W536-S539 PolarHBondContact O-OG 2.91Å; L537-S539 PolarHBondContact O-N 2.65Å; S539-R541 PolarHBondContact O-N 3.14Å
540	L	91.4	Very high	88.5	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.184	C	C	.	.			trans	-76.3	60.5	178.6	-52.8	-171.7	0	0	0	111.5	P509 I512 F515 W536 L537 N542 L543 L668	P509-L540 HydrophobicContact CB-CD2 3.99Å; I512-L540 HydrophobicContact CB-CD2 4.3Å; I512-L540 HydrophobicContact CD1-CD2 4.06Å; I512-L540 HydrophobicContact CG2-CD1 4.32Å; F515-L540 HydrophobicContact CB-CD1 4Å; F515-L540 HydrophobicContact CD1-CD1 4.1Å; F515-L540 HydrophobicContact CG-CD1 4Å; W536-L540 HydrophobicContact CE3-CD1 4.29Å; W536-L540 HydrophobicContact CH2-CD1 3.84Å; W536-L540 HydrophobicContact CH2-CD2 3.79Å; W536-L540 HydrophobicContact CH2-CG 4.28Å; W536-L540 HydrophobicContact CZ2-CD2 3.73Å; W536-L540 HydrophobicContact CZ3-CD1 3.67Å; W536-L540 HydrophobicContact CZ3-CD2 4.23Å; W536-L540 HydrophobicContact CZ3-CG 4.24Å; L537-L540 HydrophobicContact CD1-CD1 4.1Å; L537-L540 WeakPolarHBondContact O-CB 3.46Å; L537-L540 PolarHBondContact O-N 3.05Å; L537-L540 VanDerWaalsContact O-N 3.12Å; L540-N542 PolarHBondContact O-N 3.37Å; L540-L543 HydrophobicContact CB-CB 3.99Å; L540-L543 HydrophobicContact CB-CD1 4.35Å; L540-L543 HydrophobicContact CB-CD2 4.48Å; L540-L543 HydrophobicContact CD1-CD1 3.98Å; L540-L543 HydrophobicContact CD1-CD2 4.21Å; L540-L543 WeakPolarHBondContact O-CB 3.48Å; L540-L543 PolarHBondContact O-N 3.34Å; L540-L668 WeakPolarHBondContact O-CD2 3.43Å
541	R	91	Very high	88.8	Confident	180 Å²	180	34 Å²	34	68%	0.679	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-24.6	-170.5	-67.7	-179.1	179.8	175.5	1.4	114.3	L510 S539 Y670	L510-R541 HydrophobicContact CD2-CB 4.09Å; S539-R541 PolarHBondContact O-N 3.14Å; R541-Y670 WeakPolarHBondContact O-CD2 3.4Å
542	N	93.3	Very high	89.1	Confident	62 Å²	62	32 Å²	32	33%	0.332	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	8.4	-179.3	-68.6	-17	0	0	0	113.5	L510 L540 R544	L510-N542 PolarHBondContact O-ND2 3.15Å; L540-N542 PolarHBondContact O-N 3.37Å; N542-R544 PolarHBondContact O-N 3.3Å
543	L	94	Very high	89.2	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.005	17%	0.165	C	C	.	.			trans	-66.4	125.9	-176.1	-158.7	74.2	0	0	0	112.5	I512 F515 L537 L540 A545 C546 L668 Y670 L671	I512-L543 HydrophobicContact CG2-CD1 4.03Å; F515-L543 HydrophobicContact CB-CD1 3.58Å; F515-L543 HydrophobicContact CB-CD2 4.16Å; L537-L543 HydrophobicContact CD1-CD2 3.81Å; L540-L543 HydrophobicContact CB-CB 3.99Å; L540-L543 HydrophobicContact CB-CD1 4.35Å; L540-L543 HydrophobicContact CB-CD2 4.48Å; L540-L543 HydrophobicContact CD1-CD1 3.98Å; L540-L543 HydrophobicContact CD1-CD2 4.21Å; L540-L543 WeakPolarHBondContact O-CB 3.48Å; L540-L543 PolarHBondContact O-N 3.34Å; L543-A545 WeakPolarHBondContact CD1-O 3.38Å; L543-A545 WeakPolarHBondContact CG-O 3.32Å; L543-C546 HydrophobicContact CD2-CB 3.7Å; L543-L668 HydrophobicContact CB-CD2 4.17Å; L543-L668 HydrophobicContact CD2-CD1 3.91Å; L543-Y670 CarbonylContact O-C 3.53Å; L543-Y670 VanDerWaalsContact O-C 3.3Å; L543-L671 PolarHBondContact O-N 2.62Å
544	R	95	Very high	89	Confident	138 Å²	138	34.3 Å²	34.3	52%	0.521	18%	0.183	S	C	.	.			trans	-107.9	-31.4	176.6	-59.9	-177.1	-174	-169.1	2.8	112.7	T513 N542 Y670 Q672 R673	T513-R544 PolarHBondContact O-N 2.73Å; N542-R544 PolarHBondContact O-N 3.3Å; R544-Y670 WeakPolarHBondContact CA-O 3.28Å; R544-Q672 PolarHBondContact O-N 2.77Å; R544-R673 PolarHBondContact O-N 2.93Å
545	A	94.8	Very high	88.3	Confident	19 Å²	19	34.1 Å²	34.1	16%	0.157	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	127.9	175	0	0	0	0	0	111	T513 Q514 F515 L543 R673	T513-A545 PolarHBondContact O-N 3.45Å; T513-A545 VanDerWaalsContact O-N 3.13Å; Q514-A545 HydrophobicContact CB-CB 4.24Å; Q514-A545 HydrophobicContact CG-CB 4.12Å; F515-A545 PolarHBondContact N-O 3.38Å; L543-A545 WeakPolarHBondContact CD1-O 3.38Å; L543-A545 WeakPolarHBondContact CG-O 3.32Å; A545-R673 WeakPolarHBondContact CA-O 3.18Å; A545-R673 HydrophobicContact CB-CB 3.99Å
546	C	94.5	Very high	87.1	Confident	3 Å²	3	36.8 Å²	36.8	2%	0.02	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	123.3	174.8	-168.7	0	0	0	0	109.1	F515 L543 L671 R673 L674 G675	F515-C546 CarbonylContact O-C 3.57Å; F515-C546 WeakPolarHBondContact O-CA 3.46Å; L543-C546 HydrophobicContact CD2-CB 3.7Å; C546-L671 HydrophobicContact CB-CD1 3.66Å; C546-R673 PolarHBondContact N-O 3.48Å; C546-L674 CarbonylContact O-C 3.48Å; C546-L674 WeakPolarHBondContact O-CA 3.33Å; C546-G675 PolarHBondContact O-N 2.65Å
547	S	93.4	Very high	85.6	Confident	22 Å²	22	42.5 Å²	42.5	15%	0.154	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	119.6	175.8	-170.2	0	0	0	0	108.8	F515 E516 M517 P549 G675	F515-S547 PolarHBondContact O-N 2.92Å; E516-S547 CarbonylContact C-O 3.56Å; E516-S547 VanDerWaalsContact CA-O 3.24Å; E516-S547 WeakPolarHBondContact CA-O 3.47Å; E516-S547 WeakPolarHBondContact OE1-CB 3.45Å; E516-S547 PolarHBondContact OE1-OG 3.36Å; M517-S547 PolarHBondContact N-O 3.49Å; S547-P549 WeakPolarHBondContact O-CD 3.37Å; S547-G675 WeakPolarHBondContact CA-O 3.31Å
548	L	91.8	Very high	83.7	Confident	7 Å²	7	46.2 Å²	46.2	4%	0.037	25%	0.246	C	C	.	.			trans	-123.8	56.8	-178.5	-60.1	175.1	0	0	0	110.2	F515 M517 L537 C551 L661 G675 L676 C679	F515-L548 HydrophobicContact CE1-CD2 4.09Å; M517-L548 HydrophobicContact CB-CD2 4.01Å; M517-L548 HydrophobicContact CE-CD2 3.64Å; L537-L548 HydrophobicContact CD2-CD1 4.24Å; L548-C551 HydrophobicContact CB-CB 4.22Å; L548-C551 WeakPolarHBondContact O-CB 3.42Å; L548-L661 HydrophobicContact CD1-CD1 3.43Å; L548-L661 VanDerWaalsContact CD1-CD1 3.43Å; L548-L661 HydrophobicContact CD1-CD2 3.91Å; L548-L661 HydrophobicContact CD1-CG 4.33Å; L548-G675 PolarHBondContact N-O 3.5Å; L548-L676 HydrophobicContact CB-CD2 4.42Å; L548-C679 PolarHBondContact O-SG 2.87Å
549	P	89.5	Confident	81.2	Confident	6 Å²	6	48.2 Å²	48.2	4%	0.039	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	145	-176.8	29.1	-36.6	0	0	0	111	M517 E518 S547 C551 A677	M517-P549 WeakPolarHBondContact O-CD 3.43Å; E518-P549 HydrophobicContact CB-CG 4Å; E518-P549 HydrophobicContact CG-CG 4.3Å; S547-P549 WeakPolarHBondContact O-CD 3.37Å; P549-C551 PolarHBondContact O-N 3.01Å; P549-C551 PolarHBondContact O-SG 3.09Å; P549-C551 VanDerWaalsContact O-SG 3.36Å; P549-A677 CarbonylContact C-O 3.53Å; P549-A677 WeakPolarHBondContact CA-O 3.22Å
550	S	87.1	Confident	78.5	Confident	18 Å²	18	51.8 Å²	51.8	13%	0.126	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.4	2.1	174.4	-42.2	0	0	0	0	115.5	E518 P520 I552 A677 R678	E518-S550 PolarHBondContact OE1-OG 3.4Å; P520-S550 VanDerWaalsContact CA-O 3.31Å; P520-S550 WeakPolarHBondContact CA-O 3.48Å; S550-I552 PolarHBondContact O-N 2.87Å; S550-A677 PolarHBondContact N-O 2.99Å; S550-R678 PolarHBondContact OG-NE 3.26Å; S550-R678 VanDerWaalsContact OG-NE 3.09Å
551	C	85.4	Confident	75.5	Confident	8 Å²	8	59.6 Å²	59.6	5%	0.054	32%	0.324	C	S	.	.			trans	-73.8	-18.9	-167.9	-79.5	0	0	0	0	115.4	M517 G523 L548 P549	M517-C551 PolarHBondContact O-SG 2.98Å; G523-C551 WeakPolarHBondContact CA-O 3.22Å; G523-C551 PolarHBondContact N-O 2.66Å; L548-C551 HydrophobicContact CB-CB 4.22Å; L548-C551 WeakPolarHBondContact O-CB 3.42Å; P549-C551 PolarHBondContact O-N 3.01Å; P549-C551 PolarHBondContact O-SG 3.09Å; P549-C551 VanDerWaalsContact O-SG 3.36Å
552	I	87	Confident	72.7	Confident	8 Å²	8	56 Å²	56	4%	0.041	32%	0.323	C	S	.	.	S	Bend	trans	-111.5	100.4	175.3	-60.3	175.5	0	0	0	107.5	S550 T654 L661 C679 H680 L681	S550-I552 PolarHBondContact O-N 2.87Å; I552-T654 HydrophobicContact CG2-CG2 3.84Å; I552-L661 HydrophobicContact CD1-CD2 4.16Å; I552-C679 HydrophobicContact CB-CB 3.94Å; I552-C679 HydrophobicContact CG1-CB 4.49Å; I552-C679 WeakPolarHBondContact O-CA 3.37Å; I552-H680 PolarHBondContact O-N 3.4Å; I552-L681 HydrophobicContact CD1-CD2 3.97Å
553	P	79.9	Confident	69.6	Low	33 Å²	33	59 Å²	59	21%	0.214	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-72.4	163.3	-177.8	31.1	-36	0	0	0	111.9
554	P	77	Confident	66.8	Low	65 Å²	65	64.8 Å²	64.8	42%	0.422	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-60.5	157.5	169.2	27.6	-35.6	0	0	0	111.8	V558 H680	P554-V558 HydrophobicContact CB-CB 4.38Å; P554-H680 HydrophobicContact CB-CB 4.4Å
555	P	70.5	Confident	63.6	Low	6 Å²	6	63.2 Å²	63.2	4%	0.039	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-56.2	141.6	169.4	-20.8	32.3	0	0	0	110.6	D557 V558 A650	P555-D557 PolarHBondContact O-N 3.45Å; P555-V558 HydrophobicContact CB-CG2 4.3Å; P555-V558 HydrophobicContact CG-CG2 4.38Å; P555-V558 PolarHBondContact O-N 3.23Å; P555-A650 HydrophobicContact CB-CB 3.85Å
556	P	61.1	Low	60.6	Low	98 Å²	98	67.9 Å²	67.9	64%	0.636	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-21	-178.9	16	-32.3	0	0	0	115.9	V558 A650	P556-V558 PolarHBondContact O-N 3.36Å; P556-A650 HydrophobicContact CG-CB 3.95Å
557	D	52.4	Low	57.7	Low	130 Å²	130	74.6 Å²	74.6	70%	0.695	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-4.8	174.9	-49.8	-62.2	0	0	0	113.6	P555 A650	P555-D557 PolarHBondContact O-N 3.45Å; D557-A650 WeakPolarHBondContact OD2-CB 3.24Å
558	V	49.1	Very low	54.8	Low	82 Å²	82	80.9 Å²	80.9	50%	0.497	49%	0.492	S	S	.	.			trans	-115.6	49.8	-177.5	-162.6	0	0	0	0	110.8	P554 P555 P556	P554-V558 HydrophobicContact CB-CB 4.38Å; P555-V558 HydrophobicContact CB-CG2 4.3Å; P555-V558 HydrophobicContact CG-CG2 4.38Å; P555-V558 PolarHBondContact O-N 3.23Å; P556-V558 PolarHBondContact O-N 3.36Å
559	V	38.4	Very low	52	Low	98 Å²	98	86.3 Å²	86.3	59%	0.594	53%	0.527	S	S	*	.			trans	-95.9	122	164.3	-180	0	0	0	0	108.1	N561	V559-N561 PolarHBondContact O-N 2.86Å
560	P	32.4	Very low	49.1	Very low	103 Å²	103	92.7 Å²	92.7	67%	0.669	57%	0.567	S	S	*	*			trans	-61.5	126.2	170.3	-19.6	31.9	0	0	0	109.5	T562	P560-T562 PolarHBondContact O-N 3.33Å
561	N	28.3	Very low	46.5	Very low	165 Å²	165	98.7 Å²	98.7	88%	0.882	60%	0.603	S	S	*	*			trans	-69.8	74.7	179.1	-77.6	-33.6	0	0	0	111.7	V559 P563	V559-N561 PolarHBondContact O-N 2.86Å; N561-P563 WeakPolarHBondContact O-CD 3.43Å
562	T	32	Very low	43.7	Very low	105 Å²	105	105.5 Å²	105.5	64%	0.644	64%	0.637	S	S	*	*			trans	-77.6	118.5	163.3	42.4	0	0	0	0	108.7	P560 T564	P560-T562 PolarHBondContact O-N 3.33Å; T562-T564 VanDerWaalsContact C-N 3.26Å; T562-T564 PolarHBondContact O-N 3.29Å
563	P	28.7	Very low	41.1	Very low	123 Å²	123	111.9 Å²	111.9	80%	0.799	68%	0.676	S	S	*	*			trans	-78.6	73.6	-175.7	32.1	-35.7	0	0	0	111.3	N561 S565	N561-P563 WeakPolarHBondContact O-CD 3.43Å; P563-S565 PolarHBondContact O-N 3.1Å; P563-S565 VanDerWaalsContact O-N 3.14Å
564	T	33.7	Very low	38.5	Very low	124 Å²	124	115.8 Å²	115.8	76%	0.761	70%	0.699	S	S	*	*			trans	-62.6	113.3	166.3	51.7	0	0	0	0	108.8	T562	T562-T564 VanDerWaalsContact C-N 3.26Å; T562-T564 PolarHBondContact O-N 3.29Å
565	S	28	Very low	36.4	Very low	105 Å²	105	118.5 Å²	118.5	73%	0.734	72%	0.72	S	S	*	*			trans	-59.3	134.5	-170.8	-44.9	0	0	0	0	112	P563 T567	P563-S565 PolarHBondContact O-N 3.1Å; P563-S565 VanDerWaalsContact O-N 3.14Å; S565-T567 PolarHBondContact O-N 2.86Å; S565-T567 VanDerWaalsContact O-N 3.1Å
566	P	33.1	Very low	34.3	Very low	117 Å²	117	124.9 Å²	124.9	76%	0.76	75%	0.753	S	S	*	*			trans	-71.5	108.5	-178	28.1	-33.9	0	0	0	110.9	L568	P566-L568 PolarHBondContact O-N 3.18Å
567	T	33.8	Very low	33	Very low	144 Å²	144	127.2 Å²	127.2	88%	0.883	77%	0.766	S	S	*	*			trans	-68.7	92	168.2	42.4	0	0	0	0	110.2	S565	S565-T567 PolarHBondContact O-N 2.86Å; S565-T567 VanDerWaalsContact O-N 3.1Å
568	L	32.5	Very low	32	Very low	153 Å²	153	125 Å²	125	80%	0.801	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-58.3	141.2	172.8	-78.6	157	0	0	0	111.4	P566	P566-L568 PolarHBondContact O-N 3.18Å
569	P	31.6	Very low	31.1	Very low	121 Å²	121	124.8 Å²	124.8	79%	0.786	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-70.6	142.7	175	30.1	-34.3	0	0	0	111.2	T571	P569-T571 PolarHBondContact O-N 3.13Å
570	T	29.3	Very low	30.9	Very low	141 Å²	141	127.5 Å²	127.5	87%	0.865	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-64.3	124.2	-178.4	43.9	0	0	0	0	113.6
571	T	31.6	Very low	30.8	Very low	143 Å²	143	130.5 Å²	130.5	88%	0.877	80%	0.804	S	S	*	*			trans	-142.8	147.5	142.8	-65.2	0	0	0	0	108.5	P569	P569-T571 PolarHBondContact O-N 3.13Å
572	I	27.7	Very low	31.1	Very low	152 Å²	152	128.5 Å²	128.5	78%	0.779	80%	0.803	S	S	*	*			trans	-90.3	140.8	-170.6	-64.9	156.9	0	0	0	111.5
573	V	31	Very low	31	Very low	141 Å²	141	130.9 Å²	130.9	86%	0.855	81%	0.812	S	S	*	*			trans	-165.8	147.8	132.4	138.5	0	0	0	0	109.5
574	V	26.5	Very low	31.4	Very low	116 Å²	116	130 Å²	130	70%	0.703	81%	0.809	S	S	*	*			trans	-103.9	142.2	-171.5	173.3	0	0	0	0	111.7
575	S	31.7	Very low	31.4	Very low	122 Å²	122	129.3 Å²	129.3	85%	0.853	81%	0.809	S	S	*	*			trans	-159.7	141.9	152.9	-80.4	0	0	0	0	111
576	N	27	Very low	31.8	Very low	140 Å²	140	133 Å²	133	75%	0.749	81%	0.814	S	S	*	*			trans	-93.6	157.7	-175.4	-62.8	-32.8	0	0	0	112.5
577	T	35	Very low	31.7	Very low	146 Å²	146	135.6 Å²	135.6	90%	0.896	82%	0.816	S	S	*	*				168	145.2	114.6	35	0	0	0	0	113.8
578	G	31.6	Very low	31.8	Very low	84 Å²	84	134.4 Å²	134.4	87%	0.866	81%	0.814	S	S	*	*			trans	76.3	141.8	175.1	0	0	0	0	0	115.3
579	G	30	Very low	31.6	Very low	78 Å²	78	133.8 Å²	133.8	80%	0.804	81%	0.811	S	S	*	*			cis	111.1	126.5	11.3	0	0	0	0	0	110
580	L	34.4	Very low	31.8	Very low	155 Å²	155	134.1 Å²	134.1	81%	0.812	81%	0.811	S	S	*	*			cis	-147.3	135.6	17.7	-75.5	147.1	0	0	0	108.8
581	Q	30	Very low	32	Very low	166 Å²	166	136.1 Å²	136.1	78%	0.776	81%	0.813	S	S	*	*				66.3	105.6	86.7	-69.8	-166.4	-0.2	0	0	119.5
582	S	34.5	Very low	32	Very low	123 Å²	123	133.8 Å²	133.8	86%	0.86	80%	0.803	S	S	*	*			trans	-179.3	110.1	141	52.6	0	0	0	0	108.9
583	N	30	Very low	32.3	Very low	155 Å²	155	134 Å²	134	83%	0.829	80%	0.804	S	S	*	*			cis	99.2	95.1	25.8	-94.4	7.4	0	0	0	117.9
584	S	36.3	Very low	32.2	Very low	105 Å²	105	132.3 Å²	132.3	73%	0.734	80%	0.799	S	S	*	*			trans	-165.8	112.2	140.5	46	0	0	0	0	107.6
585	S	34.5	Very low	32.6	Very low	109 Å²	109	131.9 Å²	131.9	76%	0.762	80%	0.801	S	S	*	*				62.1	133.5	70.4	73.9	0	0	0	0	112.8
586	Q	35.6	Very low	32.8	Very low	182 Å²	182	131.2 Å²	131.2	85%	0.85	80%	0.797	S	S	*	*			cis	-132.7	150.6	12.6	-57.9	156.1	-2.4	0	0	108.5
587	Q	30.6	Very low	33.1	Very low	172 Å²	172	130.1 Å²	130.1	80%	0.804	80%	0.8	S	S	*	*			cis	86.2	105.1	31.8	-166.6	179.2	71	0	0	116.3
588	S	35.6	Very low	33.1	Very low	118 Å²	118	126.7 Å²	126.7	83%	0.825	79%	0.794	S	S	*	*			trans	-150.2	134	152.4	50.9	0	0	0	0	110.1
589	N	29.1	Very low	33.3	Very low	140 Å²	140	128.7 Å²	128.7	75%	0.749	79%	0.794	S	S	*	*			trans	-134.8	137.5	-169	-81	-31.1	0	0	0	112.1
590	T	35.4	Very low	33.4	Very low	129 Å²	129	130.5 Å²	130.5	79%	0.791	79%	0.794	S	S	*	*			trans	-154.8	115.8	152	43.9	0	0	0	0	107.6
591	M	33.6	Very low	33.5	Very low	183 Å²	183	129.5 Å²	129.5	90%	0.901	80%	0.797	S	S	*	*				62.3	135.5	85.4	-72.4	-169.9	173.2	0	0	114.4
592	S	31.5	Very low	33.6	Very low	94 Å²	94	127.1 Å²	127.1	66%	0.657	80%	0.799	S	S	*	*			cis	-171.4	-178.4	-4.7	51.3	0	0	0	0	111.4
593	L	33.7	Very low	33.7	Very low	156 Å²	156	126.7 Å²	126.7	82%	0.817	80%	0.796	S	S	*	*			trans	73.2	125	168	-52	166.5	0	0	0	116.9
594	S	29.9	Very low	33.9	Very low	106 Å²	106	124.5 Å²	124.5	74%	0.741	79%	0.793	S	S	*	*			cis	100.1	95.6	3.5	91.6	0	0	0	0	119.5
595	S	35.1	Very low	33.9	Very low	106 Å²	106	125.1 Å²	125.1	74%	0.741	80%	0.797	S	S	*	*			trans	-172.9	108	160.2	55.1	0	0	0	0	109.5
596	S	35.6	Very low	33.9	Very low	109 Å²	109	125.1 Å²	125.1	76%	0.762	80%	0.797	S	S	*	*				65.6	139	93.9	68.6	0	0	0	0	115.9
597	S	34	Very low	33.9	Very low	117 Å²	117	121 Å²	121	82%	0.818	79%	0.788	S	S	*	*			cis	-177.9	153.8	-5.9	45	0	0	0	0	112
598	G	34.1	Very low	34.1	Very low	74 Å²	74	119 Å²	119	76%	0.763	79%	0.788	S	S	*	*			trans	91.9	155.8	158.8	0	0	0	0	0	117.4
599	S	35.8	Very low	34.1	Very low	125 Å²	125	118.4 Å²	118.4	87%	0.874	78%	0.784	S	S	*	*			cis	-157.3	144.3	-10	-73.1	0	0	0	0	111.1
600	S	31.7	Very low	34.5	Very low	116 Å²	116	118.3 Å²	118.3	81%	0.811	78%	0.783	S	S	*	*			trans	-87	172.2	163.5	-52.3	0	0	0	0	110.6
601	P	37.3	Very low	34.6	Very low	135 Å²	135	117.4 Å²	117.4	88%	0.877	78%	0.778	S	S	*	*				-146.8	-176.9	93.7	39.4	-22.9	0	0	0	115.1
602	S	31.4	Very low	34.8	Very low	116 Å²	116	114.5 Å²	114.5	81%	0.811	77%	0.766	S	S	*	*			trans	-129.6	152	-172.3	55.7	0	0	0	0	113.2
603	S	35.9	Very low	35.1	Very low	114 Å²	114	116.1 Å²	116.1	80%	0.797	77%	0.767	S	S	*	*			trans	-157.1	130.3	162.2	55.3	0	0	0	0	110.1
604	S	34.6	Very low	35.3	Very low	109 Å²	109	114 Å²	114	76%	0.762	76%	0.761	S	S	*	*			cis	106.3	99.6	16	75.2	0	0	0	0	115.1
605	S	36	Very low	35.7	Very low	117 Å²	117	115.8 Å²	115.8	82%	0.818	77%	0.767	S	S	*	*			trans	-175.7	134.5	146.8	47.3	0	0	0	0	114.2
606	S	35.8	Very low	35.7	Very low	109 Å²	109	113.8 Å²	113.8	76%	0.762	76%	0.763	S	S	*	*			trans	-3.3	168.8	152	63.6	0	0	0	0	122.6
607	S	35.5	Very low	35.7	Very low	96 Å²	96	113 Å²	113	67%	0.671	76%	0.763	S	S	*	*			cis	-159.2	132.9	24.3	-32.3	0	0	0	0	116.1
608	T	34	Very low	35.8	Very low	131 Å²	131	114.8 Å²	114.8	80%	0.804	76%	0.763	S	S	*	*			trans	35.5	151.5	134.8	54	0	0	0	0	126.7
609	S	36.4	Very low	35.9	Very low	105 Å²	105	116.2 Å²	116.2	73%	0.734	76%	0.761	S	S	*	*			trans	104.1	142.9	147.9	81.5	0	0	0	0	118.2
610	N	36.5	Very low	35.9	Very low	137 Å²	137	115.1 Å²	115.1	73%	0.733	75%	0.754	S	S	*	*			cis	-165.6	148.7	-14.8	-115.5	4	0	0	0	113.4
611	T	38.5	Very low	36.1	Very low	111 Å²	111	116.2 Å²	116.2	68%	0.681	75%	0.751	S	S	*	*			trans	61.9	156	147.6	57.3	0	0	0	0	120.4
612	N	36.7	Very low	36	Very low	121 Å²	121	116 Å²	116	65%	0.647	74%	0.742	S	S	*	*			cis	-162.9	149.2	-2.4	-117.2	-2	0	0	0	112.8
613	N	38.3	Very low	36.3	Very low	129 Å²	129	116.6 Å²	116.6	69%	0.69	74%	0.735	S	S	*	*			trans	55.7	153.3	135.3	-64.9	-4	0	0	0	122.8
614	T	37.5	Very low	36.2	Very low	112 Å²	112	117.4 Å²	117.4	69%	0.687	73%	0.731	S	S	*	*			cis	-168	149.4	-4.7	20.7	0	0	0	0	112.4
615	V	39.3	Very low	36.2	Very low	143 Å²	143	118.4 Å²	118.4	87%	0.867	73%	0.732	S	S	*	*			trans	55.8	138.7	143.4	177.6	0	0	0	0	120.4
616	G	35.1	Very low	36.2	Very low	63 Å²	63	117.2 Å²	117.2	65%	0.649	72%	0.724	S	S	*	*			cis	150.8	160.6	-8.2	0	0	0	0	0	114.6
617	A	36	Very low	36.1	Very low	92 Å²	92	117.3 Å²	117.3	76%	0.76	72%	0.72	S	S	*	*			trans	65.1	151.5	166.2	0	0	0	0	0	118.8
618	N	35.6	Very low	35.9	Very low	156 Å²	156	118.6 Å²	118.6	83%	0.834	72%	0.724	S	S	*	*			cis	-158.8	177.2	-13.4	-111.3	-2.2	0	0	0	112.1
619	S	35.2	Very low	36.1	Very low	103 Å²	103	117.2 Å²	117.2	72%	0.72	72%	0.719	S	S	*	*			trans	-44	171.9	175.9	-40.9	0	0	0	0	118
620	S	37.2	Very low	36.2	Very low	103 Å²	103	117 Å²	117	72%	0.72	72%	0.718	S	S	*	*			cis	-163.7	151.1	20.7	-18.5	0	0	0	0	115.4
621	N	35.1	Very low	36.2	Very low	139 Å²	139	115.7 Å²	115.7	74%	0.743	72%	0.719	S	S	*	*			trans	47.9	126.2	134.2	-65.5	9.5	0	0	0	124.8
622	N	35.4	Very low	36.1	Very low	130 Å²	130	115.5 Å²	115.5	70%	0.695	72%	0.723	S	S	*	*				106.2	120.6	120.3	-81.3	6.7	0	0	0	124
623	I	37.6	Very low	36.1	Very low	128 Å²	128	118.3 Å²	118.3	66%	0.656	73%	0.734	S	S	*	*				91.7	98.6	128.2	-69.2	171.8	0	0	0	120.4
624	N	34.6	Very low	36	Very low	132 Å²	132	118.5 Å²	118.5	71%	0.706	75%	0.746	S	S	*	*				73.5	138.5	127.4	-63.6	4.9	0	0	0	124.4
625	T	34.5	Very low	35.7	Very low	129 Å²	129	118.5 Å²	118.5	79%	0.791	75%	0.75	S	S	*	*			trans	65.6	138.9	145	47.2	0	0	0	0	119.6
626	S	34.7	Very low	35.5	Very low	92 Å²	92	118.6 Å²	118.6	64%	0.643	75%	0.752	S	S	*	*			cis	-168.2	-179.4	-11	52.5	0	0	0	0	111.9
627	T	33.6	Very low	35.3	Very low	112 Å²	112	122.3 Å²	122.3	69%	0.687	76%	0.762	S	S	*	*			trans	70.4	103.2	147	38.6	0	0	0	0	121.1
628	T	33	Very low	35.2	Very low	122 Å²	122	124.2 Å²	124.2	75%	0.748	76%	0.764	S	S	*	*				85.5	136.8	123.1	51.7	0	0	0	0	124.6
629	S	37.2	Very low	34.9	Very low	102 Å²	102	122.7 Å²	122.7	71%	0.713	76%	0.76	S	S	*	*			trans	85.8	105.2	138.1	48.1	0	0	0	0	122.9
630	S	38.2	Very low	34.8	Very low	100 Å²	100	125.2 Å²	125.2	70%	0.699	77%	0.766	S	S	*	*				78.1	129.1	121.3	65.8	0	0	0	0	123.1
631	S	37.4	Very low	34.5	Very low	110 Å²	110	128.3 Å²	128.3	77%	0.769	77%	0.774	S	S	*	*			trans	64	147.4	148.4	40.7	0	0	0	0	119.2
632	S	36.7	Very low	34.4	Very low	107 Å²	107	127.1 Å²	127.1	75%	0.748	77%	0.772	S	S	*	*			cis	-163.9	156.5	-9.3	42.5	0	0	0	0	111.4
633	M	36.6	Very low	34.1	Very low	180 Å²	180	129.6 Å²	129.6	89%	0.887	79%	0.785	S	S	*	*			trans	9.9	121.5	159.6	-57.4	-178.6	73.5	0	0	119.8
634	S	36.1	Very low	33.8	Very low	134 Å²	134	131 Å²	131	94%	0.937	79%	0.788	S	S	*	*			trans	-162.4	154.1	133.5	-85.5	0	0	0	0	111.1
635	S	30.3	Very low	33.5	Very low	112 Å²	112	132.1 Å²	132.1	78%	0.783	79%	0.794	S	S	*	*			trans	-106.9	133	-170.7	55.4	0	0	0	0	113.5
636	T	36.2	Very low	33.4	Very low	145 Å²	145	135.2 Å²	135.2	89%	0.89	80%	0.797	S	S	*	*			trans	-154.3	150.6	154.7	14.1	0	0	0	0	111.6
637	T	29.6	Very low	33.3	Very low	140 Å²	140	137.2 Å²	137.2	86%	0.859	81%	0.805	S	S	*	*			trans	-98.6	119.1	-167.4	-30.2	0	0	0	0	111.8
638	T	34.5	Very low	33.5	Very low	132 Å²	132	136.7 Å²	136.7	81%	0.81	80%	0.802	S	S	*	*			trans	-144.6	133.2	160.5	-30.2	0	0	0	0	110.9
639	T	30.1	Very low	33.7	Very low	124 Å²	124	135.2 Å²	135.2	76%	0.761	80%	0.795	S	S	*	*			trans	-75.8	132.7	179.1	48.7	0	0	0	0	112
640	N	33.5	Very low	34	Very low	156 Å²	156	131 Å²	131	83%	0.834	77%	0.765	S	S	*	*			trans	-148.6	124.5	157.1	-99.6	-38.7	0	0	0	110.4	T642	N640-T642 PolarHBondContact O-N 2.89Å
641	N	29.1	Very low	34.2	Very low	168 Å²	168	133.6 Å²	133.6	90%	0.898	77%	0.765	S	S	*	*			trans	-80.8	112.2	-177.8	-72.8	-27.3	0	0	0	110.7
642	T	33	Very low	35.2	Very low	114 Å²	114	131.5 Å²	131.5	70%	0.699	75%	0.747	S	S	*	*			trans	-130.6	133.4	161.2	44.8	0	0	0	0	109.5	N640 Q644	N640-T642 PolarHBondContact O-N 2.89Å; T642-Q644 PolarHBondContact O-N 3.3Å; T642-Q644 VanDerWaalsContact O-N 3.15Å
643	L	29.9	Very low	37	Very low	183 Å²	183	128.4 Å²	128.4	96%	0.958	73%	0.725	S	S	*	*			trans	-74.8	104.1	179.1	-69.8	103.9	0	0	0	109.7
644	Q	30.6	Very low	39.2	Very low	157 Å²	157	120.3 Å²	120.3	73%	0.734	69%	0.686	S	S	*	*			trans	-98.5	127.3	168.7	-69.2	-169.5	-14.8	0	0	110.3	T642 F646	T642-Q644 PolarHBondContact O-N 3.3Å; T642-Q644 VanDerWaalsContact O-N 3.15Å; Q644-F646 PolarHBondContact O-N 3.41Å
645	N	29	Very low	41.5	Very low	155 Å²	155	115.4 Å²	115.4	83%	0.829	65%	0.65	S	S	*	*			trans	-70.5	110.4	176.2	-71.3	-32.1	0	0	0	110	V647	N645-V647 PolarHBondContact O-N 3.27Å
646	F	31.3	Very low	44.2	Very low	195 Å²	195	111.6 Å²	111.6	86%	0.855	63%	0.626	S	S	*	*			trans	-71.1	99.5	171.8	-90.1	-91.8	0	0	0	110.8	Q644 T648	Q644-F646 PolarHBondContact O-N 3.41Å; F646-T648 PolarHBondContact O-N 2.96Å
647	V	34.2	Very low	46.6	Very low	134 Å²	134	104.8 Å²	104.8	81%	0.812	58%	0.584	S	S	*	*			trans	-79.5	96.9	165	-178.8	0	0	0	0	108.1	N645	N645-V647 PolarHBondContact O-N 3.27Å
648	T	37	Very low	49.5	Very low	101 Å²	101	98.1 Å²	98.1	62%	0.62	54%	0.543	S	S	*	.			trans	-69.7	125.2	177.6	-34.1	0	0	0	0	109.8	F646 A650 T652	F646-T648 PolarHBondContact O-N 2.96Å; T648-A650 PolarHBondContact O-N 3.03Å; T648-T652 WeakPolarHBondContact CG2-OG1 3.34Å
649	P	36.3	Very low	52.2	Low	91 Å²	91	99.4 Å²	99.4	59%	0.591	53%	0.533	S	S	*	.			trans	-64.2	134.2	-172.2	22.3	-32.4	0	0	0	112.2	F651 T652	P649-F651 VanDerWaalsContact C-N 3.31Å; P649-F651 PolarHBondContact O-N 3.12Å; P649-F651 VanDerWaalsContact O-N 3.09Å; P649-T652 HydrophobicContact CG-CG2 4.09Å; P649-T652 WeakPolarHBondContact O-CB 3.5Å; P649-T652 PolarHBondContact O-N 3.43Å; P649-T652 PolarHBondContact O-OG1 2.64Å
650	A	43.6	Very low	55	Low	12 Å²	12	95.8 Å²	95.8	10%	0.099	51%	0.509	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-36.7	-161.2	0	0	0	0	0	115.3	P555 P556 D557 T648 T652 S653	P555-A650 HydrophobicContact CB-CB 3.85Å; P556-A650 HydrophobicContact CG-CB 3.95Å; D557-A650 WeakPolarHBondContact OD2-CB 3.24Å; T648-A650 PolarHBondContact O-N 3.03Å; A650-T652 PolarHBondContact O-N 3Å; A650-T652 VanDerWaalsContact O-N 3.17Å; A650-S653 WeakPolarHBondContact O-CB 3.45Å; A650-S653 PolarHBondContact O-N 2.86Å
651	F	44.3	Very low	57.7	Low	156 Å²	156	88.9 Å²	88.9	68%	0.684	47%	0.472	S	S	*	.	H	α-helix	trans	-57	-28.9	176.3	-82.1	-89.9	0	0	0	114	P649 S653 V655	P649-F651 VanDerWaalsContact C-N 3.31Å; P649-F651 PolarHBondContact O-N 3.12Å; P649-F651 VanDerWaalsContact O-N 3.09Å; F651-S653 PolarHBondContact O-N 3.41Å; F651-V655 WeakPolarHBondContact O-CG2 3.39Å
652	T	56.9	Low	60.8	Low	66 Å²	66	82.4 Å²	82.4	41%	0.405	44%	0.437	S	S	.	.	H	α-helix	trans	-65.3	-26.4	176.7	62.2	0	0	0	0	112.6	T648 P649 A650 A656	T648-T652 WeakPolarHBondContact CG2-OG1 3.34Å; P649-T652 HydrophobicContact CG-CG2 4.09Å; P649-T652 WeakPolarHBondContact O-CB 3.5Å; P649-T652 PolarHBondContact O-N 3.43Å; P649-T652 PolarHBondContact O-OG1 2.64Å; A650-T652 PolarHBondContact O-N 3Å; A650-T652 VanDerWaalsContact O-N 3.17Å; T652-A656 VanDerWaalsContact O-CB 3.31Å; T652-A656 WeakPolarHBondContact O-CB 3.35Å; T652-A656 PolarHBondContact O-N 3.13Å; T652-A656 VanDerWaalsContact O-N 3.11Å
653	S	74.7	Confident	63.6	Low	41 Å²	41	85.5 Å²	85.5	29%	0.287	44%	0.436	S	S	.	.	H	α-helix	trans	-64.8	-62.9	-179.9	-168.3	0	0	0	0	111	I526 A650 F651 V655 A656 A657	I526-S653 WeakPolarHBondContact CD1-O 3.48Å; I526-S653 WeakPolarHBondContact CD1-OG 3.4Å; A650-S653 WeakPolarHBondContact O-CB 3.45Å; A650-S653 PolarHBondContact O-N 2.86Å; F651-S653 PolarHBondContact O-N 3.41Å; S653-V655 VanDerWaalsContact C-N 3.28Å; S653-V655 PolarHBondContact O-N 2.92Å; S653-A656 PolarHBondContact O-N 3Å; S653-A657 PolarHBondContact O-N 3.47Å
654	T	82.4	Confident	66.6	Low	11 Å²	11	76.8 Å²	76.8	7%	0.067	39%	0.39	C	S	.	.	H	α-helix	trans	-58.1	-39.6	-177.4	-45.5	0	0	0	0	112.2	I552 A657 C658 H680 Q684	I552-T654 HydrophobicContact CG2-CG2 3.84Å; T654-A657 PolarHBondContact O-N 2.86Å; T654-C658 WeakPolarHBondContact O-CB 3.45Å; T654-C658 PolarHBondContact O-N 2.92Å; T654-C658 PolarHBondContact O-SG 2.92Å; T654-H680 VanDerWaalsContact CG2-O 3.31Å; T654-H680 WeakPolarHBondContact CG2-O 3.11Å; T654-Q684 HydrophobicContact CG2-CG 4.15Å
655	V	86	Confident	69.6	Low	30 Å²	30	69.3 Å²	69.3	18%	0.182	36%	0.356	C	S	.	.	H	α-helix	trans	-60.9	-48.9	175.2	177.6	0	0	0	0	111.3	F651 S653 C658 R659	F651-V655 WeakPolarHBondContact O-CG2 3.39Å; S653-V655 VanDerWaalsContact C-N 3.28Å; S653-V655 PolarHBondContact O-N 2.92Å; V655-C658 PolarHBondContact O-N 2.85Å; V655-R659 WeakPolarHBondContact O-CG 3.39Å; V655-R659 PolarHBondContact O-N 2.84Å
656	A	85.1	Confident	72.7	Confident	33 Å²	33	65 Å²	65	27%	0.273	34%	0.335	S	S	.	.	H	α-helix	trans	-66	-39	179.6	0	0	0	0	0	111.9	I526 T652 S653 R659 L660	I526-A656 HydrophobicContact CD1-CB 4.31Å; I526-A656 HydrophobicContact CG2-CB 4.32Å; T652-A656 VanDerWaalsContact O-CB 3.31Å; T652-A656 WeakPolarHBondContact O-CB 3.35Å; T652-A656 PolarHBondContact O-N 3.13Å; T652-A656 VanDerWaalsContact O-N 3.11Å; S653-A656 PolarHBondContact O-N 3Å; A656-R659 PolarHBondContact O-N 3.48Å; A656-L660 WeakPolarHBondContact O-CG 3.45Å; A656-L660 PolarHBondContact O-N 3.32Å
657	A	86.7	Confident	75.5	Confident	1 Å²	1	58 Å²	58	1%	0.008	31%	0.31	C	S	.	.	H	α-helix	trans	-62	-45.3	175.2	0	0	0	0	0	112	I526 L530 S653 T654 R659 L660 L661	I526-A657 HydrophobicContact CD1-CB 4.11Å; I526-A657 HydrophobicContact CG1-CB 4.41Å; L530-A657 HydrophobicContact CD2-CB 3.6Å; S653-A657 PolarHBondContact O-N 3.47Å; T654-A657 PolarHBondContact O-N 2.86Å; A657-R659 VanDerWaalsContact C-N 3.35Å; A657-R659 PolarHBondContact O-N 2.96Å; A657-L660 PolarHBondContact O-N 3.39Å; A657-L661 WeakPolarHBondContact O-CB 3.43Å; A657-L661 PolarHBondContact O-N 2.86Å
658	C	90.7	Very high	78.4	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-61.8	-39.5	176.1	-69.4	0	0	0	0	112.4	T654 V655 N662 Q684 T687 L688	T654-C658 WeakPolarHBondContact O-CB 3.45Å; T654-C658 PolarHBondContact O-N 2.92Å; T654-C658 PolarHBondContact O-SG 2.92Å; V655-C658 PolarHBondContact O-N 2.85Å; C658-N662 WeakPolarHBondContact O-CB 3.4Å; C658-N662 PolarHBondContact O-N 3.49Å; C658-Q684 HydrophobicContact CB-CB 4.49Å; C658-T687 HydrophobicContact CB-CG2 3.96Å; C658-L688 HydrophobicContact CB-CB 4.13Å
659	R	90.9	Very high	81	Confident	160 Å²	160	56.7 Å²	56.7	60%	0.604	28%	0.279	S	S	*	.	H	α-helix	trans	-65.4	-41.1	175.3	-69.9	173.1	-173.8	174.2	3.2	112.7	V655 A656 A657 R663 T687	V655-R659 WeakPolarHBondContact O-CG 3.39Å; V655-R659 PolarHBondContact O-N 2.84Å; A656-R659 PolarHBondContact O-N 3.48Å; A657-R659 VanDerWaalsContact C-N 3.35Å; A657-R659 PolarHBondContact O-N 2.96Å; R659-R663 PolarHBondContact O-N 2.87Å; R659-R663 VanDerWaalsContact O-N 3.14Å; R659-T687 HydrophobicContact CG-CG2 3.53Å
660	L	89.2	Confident	83.7	Confident	48 Å²	48	59.1 Å²	59.1	25%	0.251	28%	0.278	S	S	.	.	H	α-helix	trans	-66.9	-43.2	177.3	-73.4	170.9	0	0	0	111.6	I526 L530 P531 V534 A656 A657 R663 A664	I526-L660 HydrophobicContact CG2-CD1 4.11Å; L530-L660 HydrophobicContact CD2-CB 4.19Å; L530-L660 HydrophobicContact CD2-CD1 3.95Å; L530-L660 HydrophobicContact CG-CB 4.4Å; L530-L660 HydrophobicContact CG-CD1 4.25Å; P531-L660 HydrophobicContact CG-CD1 4.33Å; V534-L660 HydrophobicContact CG2-CB 4.31Å; A656-L660 WeakPolarHBondContact O-CG 3.45Å; A656-L660 PolarHBondContact O-N 3.32Å; A657-L660 PolarHBondContact O-N 3.39Å; L660-R663 PolarHBondContact O-N 2.92Å; L660-A664 PolarHBondContact O-N 2.87Å
661	L	91.4	Very high	86.1	Confident	10 Å²	10	58.6 Å²	58.6	5%	0.052	27%	0.273	C	S	.	.	H	α-helix	trans	-68.6	-40.3	176.4	-179.7	55.4	0	0	0	112.1	L537 L548 I552 A657 R663 A664 L665 L676 L688	L537-L661 HydrophobicContact CD2-CD1 3.98Å; L548-L661 HydrophobicContact CD1-CD1 3.43Å; L548-L661 VanDerWaalsContact CD1-CD1 3.43Å; L548-L661 HydrophobicContact CD1-CD2 3.91Å; L548-L661 HydrophobicContact CD1-CG 4.33Å; I552-L661 HydrophobicContact CD1-CD2 4.16Å; A657-L661 WeakPolarHBondContact O-CB 3.43Å; A657-L661 PolarHBondContact O-N 2.86Å; L661-R663 VanDerWaalsContact C-N 3.32Å; L661-R663 PolarHBondContact O-N 2.84Å; L661-A664 HydrophobicContact CD1-CB 4.47Å; L661-A664 WeakPolarHBondContact O-CA 3.4Å; L661-A664 WeakPolarHBondContact O-CB 3.49Å; L661-A664 PolarHBondContact O-N 3.34Å; L661-L665 HydrophobicContact CD1-CD1 4.3Å; L661-L665 HydrophobicContact CD1-CD2 4.36Å; L661-L665 HydrophobicContact CD1-CG 4.02Å; L661-L665 HydrophobicContact CG-CD1 3.99Å; L661-L665 HydrophobicContact CG-CG 4.2Å; L661-L665 WeakPolarHBondContact O-CG 3.45Å; L661-L665 PolarHBondContact O-N 2.94Å; L661-L676 HydrophobicContact CD2-CD2 4.02Å; L661-L688 HydrophobicContact CB-CD1 3.9Å; L661-L688 HydrophobicContact CD2-CD1 3.77Å; L661-L688 HydrophobicContact CG-CD1 3.73Å
662	N	93.9	Very high	88.5	Confident	32 Å²	32	53.9 Å²	53.9	17%	0.171	25%	0.253	C	S	.	.	H	α-helix	trans	-54.2	-46.7	172.8	175.5	-99.6	0	0	0	111.9	C658 A664 L665 V666 L688 G690	C658-N662 WeakPolarHBondContact O-CB 3.4Å; C658-N662 PolarHBondContact O-N 3.49Å; N662-A664 PolarHBondContact O-N 2.92Å; N662-L665 PolarHBondContact O-N 3.35Å; N662-L665 VanDerWaalsContact O-N 3.16Å; N662-V666 WeakPolarHBondContact O-CB 3.41Å; N662-V666 WeakPolarHBondContact O-CG2 3.34Å; N662-V666 PolarHBondContact O-N 2.74Å; N662-L688 PolarHBondContact ND2-O 3.33Å; N662-G690 PolarHBondContact ND2-O 2.78Å
663	R	92	Very high	90.4	Very high	179 Å²	179	53.3 Å²	53.3	68%	0.675	24%	0.244	S	C	*	.	H	α-helix	trans	-57.1	-34.9	175	179.7	178.9	175.4	174.9	-0.7	112.7	R659 L660 L661	R659-R663 PolarHBondContact O-N 2.87Å; R659-R663 VanDerWaalsContact O-N 3.14Å; L660-R663 PolarHBondContact O-N 2.92Å; L661-R663 VanDerWaalsContact C-N 3.32Å; L661-R663 PolarHBondContact O-N 2.84Å
664	A	91.7	Very high	91.4	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-69.3	-55.2	172.6	0	0	0	0	0	111.2	V534 L537 I538 L660 L661 N662 V666 S667 L668	V534-A664 HydrophobicContact CG1-CB 4.15Å; V534-A664 HydrophobicContact CG2-CB 4.38Å; L537-A664 HydrophobicContact CB-CB 4.39Å; L537-A664 HydrophobicContact CD2-CB 3.78Å; L537-A664 HydrophobicContact CG-CB 4.08Å; I538-A664 HydrophobicContact CD1-CB 4.49Å; I538-A664 HydrophobicContact CG1-CB 4Å; L660-A664 PolarHBondContact O-N 2.87Å; L661-A664 HydrophobicContact CD1-CB 4.47Å; L661-A664 WeakPolarHBondContact O-CA 3.4Å; L661-A664 WeakPolarHBondContact O-CB 3.49Å; L661-A664 PolarHBondContact O-N 3.34Å; N662-A664 PolarHBondContact O-N 2.92Å; A664-V666 VanDerWaalsContact C-N 3.32Å; A664-V666 PolarHBondContact O-N 3.13Å; A664-S667 WeakPolarHBondContact O-CB 3.38Å; A664-S667 PolarHBondContact O-N 3.21Å; A664-S667 PolarHBondContact O-OG 3.22Å; A664-L668 PolarHBondContact O-N 2.86Å
665	L	93.8	Very high	92	Very high	0 Å²	0	51 Å²	51	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-60.1	-37.6	-175.1	-64	176.3	0	0	0	112.7	L661 N662 S667 L668 L671 L674 L688 L692 Q694	L661-L665 HydrophobicContact CD1-CD1 4.3Å; L661-L665 HydrophobicContact CD1-CD2 4.36Å; L661-L665 HydrophobicContact CD1-CG 4.02Å; L661-L665 HydrophobicContact CG-CD1 3.99Å; L661-L665 HydrophobicContact CG-CG 4.2Å; L661-L665 WeakPolarHBondContact O-CG 3.45Å; L661-L665 PolarHBondContact O-N 2.94Å; N662-L665 PolarHBondContact O-N 3.35Å; N662-L665 VanDerWaalsContact O-N 3.16Å; L665-S667 VanDerWaalsContact C-N 3.26Å; L665-S667 PolarHBondContact O-N 2.64Å; L665-L668 HydrophobicContact CD2-CD1 4.34Å; L665-L668 PolarHBondContact O-N 3.33Å; L665-L671 HydrophobicContact CD2-CD2 3.96Å; L665-L674 HydrophobicContact CD1-CD1 4.13Å; L665-L674 HydrophobicContact CD1-CD2 4.05Å; L665-L674 HydrophobicContact CD2-CD1 3.83Å; L665-L688 HydrophobicContact CD1-CD1 4.08Å; L665-L692 HydrophobicContact CB-CD1 4.34Å; L665-L692 HydrophobicContact CB-CD2 3.64Å; L665-L692 HydrophobicContact CD1-CD1 4.39Å; L665-Q694 PolarHBondContact O-NE2 3.04Å
666	V	93.7	Very high	92.4	Very high	65 Å²	65	49.5 Å²	49.5	39%	0.394	22%	0.219	S	C	.	.	H	α-helix	trans	-65.8	-26.4	175.2	172.7	0	0	0	0	112.4	N662 A664 L692	N662-V666 WeakPolarHBondContact O-CB 3.41Å; N662-V666 WeakPolarHBondContact O-CG2 3.34Å; N662-V666 PolarHBondContact O-N 2.74Å; A664-V666 VanDerWaalsContact C-N 3.32Å; A664-V666 PolarHBondContact O-N 3.13Å; V666-L692 HydrophobicContact CB-CD2 4.38Å; V666-L692 HydrophobicContact CG2-CD2 3.65Å; V666-L692 HydrophobicContact CG2-CG 4.44Å
667	S	92	Very high	92.8	Very high	49 Å²	49	48.5 Å²	48.5	34%	0.343	21%	0.211	S	C	.	.	H	α-helix	trans	-76.5	-22.5	177.2	78.9	0	0	0	0	113.7	A664 L665 R669	A664-S667 WeakPolarHBondContact O-CB 3.38Å; A664-S667 PolarHBondContact O-N 3.21Å; A664-S667 PolarHBondContact O-OG 3.22Å; L665-S667 VanDerWaalsContact C-N 3.26Å; L665-S667 PolarHBondContact O-N 2.64Å; S667-R669 PolarHBondContact O-N 3.38Å
668	L	93.1	Very high	93	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.005	23%	0.225	C	C	.	.			trans	-81.8	82.5	-175	-61.7	176.6	0	0	0	111	L537 L540 L543 A664 L665 Y670 L671 Q694	L537-L668 HydrophobicContact CD1-CD1 4.12Å; L537-L668 HydrophobicContact CG-CD1 4.3Å; L540-L668 WeakPolarHBondContact O-CD2 3.43Å; L543-L668 HydrophobicContact CB-CD2 4.17Å; L543-L668 HydrophobicContact CD2-CD1 3.91Å; A664-L668 PolarHBondContact O-N 2.86Å; L665-L668 HydrophobicContact CD2-CD1 4.34Å; L665-L668 PolarHBondContact O-N 3.33Å; L668-Y670 PolarHBondContact O-N 3.18Å; L668-L671 HydrophobicContact CB-CB 3.94Å; L668-L671 HydrophobicContact CD1-CD1 4.45Å; L668-L671 HydrophobicContact CD1-CD2 4.46Å; L668-L671 WeakPolarHBondContact O-CB 3.39Å; L668-L671 PolarHBondContact O-N 3.41Å; L668-Q694 PolarHBondContact O-NE2 2.8Å
669	R	91.9	Very high	93	Very high	205 Å²	205	52.2 Å²	52.2	77%	0.774	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-26.3	-173.6	-65.1	-177.7	-179.4	177.8	-1	115	S667	S667-R669 PolarHBondContact O-N 3.38Å
670	Y	93.5	Very high	93.1	Very high	142 Å²	142	46.2 Å²	46.2	56%	0.557	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.4	8.1	-178.8	-56.9	-64.8	0	0	0	113.8	R541 L543 R544 L668 Q672	R541-Y670 WeakPolarHBondContact O-CD2 3.4Å; L543-Y670 CarbonylContact O-C 3.53Å; L543-Y670 VanDerWaalsContact O-C 3.3Å; R544-Y670 WeakPolarHBondContact CA-O 3.28Å; L668-Y670 PolarHBondContact O-N 3.18Å; Y670-Q672 PolarHBondContact O-N 3.33Å
671	L	94.4	Very high	93.2	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.005	19%	0.192	C	C	.	.			trans	-65.2	116.2	-178.1	-171.8	69.1	0	0	0	111.1	L543 C546 L665 L668 R673 L696	L543-L671 PolarHBondContact O-N 2.62Å; C546-L671 HydrophobicContact CB-CD1 3.66Å; L665-L671 HydrophobicContact CD2-CD2 3.96Å; L668-L671 HydrophobicContact CB-CB 3.94Å; L668-L671 HydrophobicContact CD1-CD1 4.45Å; L668-L671 HydrophobicContact CD1-CD2 4.46Å; L668-L671 WeakPolarHBondContact O-CB 3.39Å; L668-L671 PolarHBondContact O-N 3.41Å; L671-R673 WeakPolarHBondContact CD1-O 3.28Å; L671-L696 HydrophobicContact CD2-CD2 4.28Å; L671-L696 HydrophobicContact CG-CD2 3.99Å; L671-L696 WeakPolarHBondContact O-CD2 3.45Å
672	Q	94.6	Very high	93.3	Very high	57 Å²	57	46.1 Å²	46.1	27%	0.266	21%	0.205	S	C	.	.			trans	-109.5	-29	177.5	-69.3	170	-78.8	0	0	112	R544 Y670 E697 Y698	R544-Q672 PolarHBondContact O-N 2.77Å; Y670-Q672 PolarHBondContact O-N 3.33Å; Q672-E697 HydrophobicContact CB-CG 4.37Å; Q672-E697 PolarHBondContact NE2-OE1 2.95Å; Q672-E697 PolarHBondContact O-N 3.37Å; Q672-Y698 PolarHBondContact O-N 3.31Å
673	R	95.8	Very high	93.2	Very high	55 Å²	55	46.3 Å²	46.3	21%	0.208	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	124	-176.2	-48.9	-174.3	73.4	91.3	-8	110.8	T6 R544 A545 C546 L671 Y698 E726	T6-R673 PolarHBondContact OG1-NH2 2.91Å; R544-R673 PolarHBondContact O-N 2.93Å; A545-R673 WeakPolarHBondContact CA-O 3.18Å; A545-R673 HydrophobicContact CB-CB 3.99Å; C546-R673 PolarHBondContact N-O 3.48Å; L671-R673 WeakPolarHBondContact CD1-O 3.28Å; R673-Y698 HydrophobicContact CB-CD1 3.91Å; R673-Y698 HydrophobicContact CB-CG 4.23Å; R673-Y698 VanDerWaalsContact NH2-CD2 3.26Å; R673-E726 IonicContact CZ-OE1 3.62Å; R673-E726 IonicContact NH1-OE1 3.34Å; R673-E726 PolarHBondContact NH1-OE1 3.16Å; R673-E726 VanDerWaalsContact NH1-OE1 3.08Å; R673-E726 IonicContact NH2-OE1 4Å; R673-E726 PolarHBondContact NH2-OE1 2.65Å; R673-E726 IonicContact NH2-OE2 3.72Å; R673-E726 PolarHBondContact NH2-OE2 2.96Å; R673-E726 VanDerWaalsContact NH2-OE2 3.16Å
674	L	95.8	Very high	93.3	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	118.8	179	179.9	57.5	0	0	0	111.4	C546 L665 L676 L689 L692 L696 Y698 L699 N700	C546-L674 CarbonylContact O-C 3.48Å; C546-L674 WeakPolarHBondContact O-CA 3.33Å; L665-L674 HydrophobicContact CD1-CD1 4.13Å; L665-L674 HydrophobicContact CD1-CD2 4.05Å; L665-L674 HydrophobicContact CD2-CD1 3.83Å; L674-L676 HydrophobicContact CD1-CD1 4.33Å; L674-L676 HydrophobicContact CD1-CD2 4.22Å; L674-L676 HydrophobicContact CD1-CG 4.04Å; L674-L676 HydrophobicContact CD2-CD1 4Å; L674-L676 HydrophobicContact CG-CD1 4.05Å; L674-L676 HydrophobicContact CG-CG 4.1Å; L674-L689 HydrophobicContact CD2-CD2 3.9Å; L674-L692 HydrophobicContact CD2-CD1 4.25Å; L674-L696 HydrophobicContact CB-CD2 4.29Å; L674-Y698 PolarHBondContact N-O 2.79Å; L674-L699 HydrophobicContact CB-CD1 4.28Å; L674-L699 HydrophobicContact CD2-CD1 4.19Å; L674-L699 HydrophobicContact CG-CD1 4.25Å; L674-L699 WeakPolarHBondContact O-CA 3.27Å; L674-N700 PolarHBondContact O-N 2.78Å
675	G	95.3	Very high	93.5	Very high	2 Å²	2	39 Å²	39	2%	0.021	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	130	171.2	0	0	0	0	0	111.7	C546 S547 L548	C546-G675 PolarHBondContact O-N 2.65Å; S547-G675 WeakPolarHBondContact CA-O 3.31Å; L548-G675 PolarHBondContact N-O 3.5Å
676	L	94.8	Very high	93.5	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	21%	0.213	C	C	.	.			trans	-136.2	17.7	-179.7	-65.4	166.5	0	0	0	111.7	L548 L661 L674 C679 L681 L688 L689 N700 L701 C704	L548-L676 HydrophobicContact CB-CD2 4.42Å; L661-L676 HydrophobicContact CD2-CD2 4.02Å; L674-L676 HydrophobicContact CD1-CD1 4.33Å; L674-L676 HydrophobicContact CD1-CD2 4.22Å; L674-L676 HydrophobicContact CD1-CG 4.04Å; L674-L676 HydrophobicContact CD2-CD1 4Å; L674-L676 HydrophobicContact CG-CD1 4.05Å; L674-L676 HydrophobicContact CG-CG 4.1Å; L676-C679 WeakPolarHBondContact O-CB 3.49Å; L676-C679 PolarHBondContact O-N 3.18Å; L676-C679 PolarHBondContact O-SG 3.2Å; L676-C679 VanDerWaalsContact O-SG 3.33Å; L676-L681 HydrophobicContact CB-CD1 4.42Å; L676-L681 HydrophobicContact CD1-CD1 4.47Å; L676-L688 HydrophobicContact CD1-CD2 3.66Å; L676-L688 HydrophobicContact CD1-CG 4.39Å; L676-L688 HydrophobicContact CD2-CD2 4.32Å; L676-L689 HydrophobicContact CD1-CD2 4.36Å; L676-N700 PolarHBondContact N-O 3Å; L676-L701 HydrophobicContact CB-CD2 4.14Å; L676-L701 HydrophobicContact CD1-CD2 3.9Å; L676-C704 PolarHBondContact O-SG 2.79Å
677	A	92.6	Very high	93.6	Very high	12 Å²	12	43.4 Å²	43.4	10%	0.099	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	147	-172.9	0	0	0	0	0	112.7	P549 S550 C679 Q702	P549-A677 CarbonylContact C-O 3.53Å; P549-A677 WeakPolarHBondContact CA-O 3.22Å; S550-A677 PolarHBondContact N-O 2.99Å; A677-C679 PolarHBondContact O-N 3.19Å; A677-C679 VanDerWaalsContact O-N 3.1Å; A677-Q702 CarbonylContact C-O 3.57Å; A677-Q702 WeakPolarHBondContact CA-O 3.32Å; A677-Q702 HydrophobicContact CB-CB 4Å; A677-Q702 WeakPolarHBondContact CB-O 3.44Å
678	R	91.6	Very high	93.7	Very high	78 Å²	78	41.1 Å²	41.1	29%	0.294	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.4	8.3	-176.8	-54.5	-173.2	-74.7	-132.1	9.1	115.5	D14 E518 S550 Q702 D703	D14-R678 VanDerWaalsContact CG-NH1 3.3Å; D14-R678 IonicContact OD1-CZ 2.89Å; D14-R678 IonicContact OD1-NH1 3.58Å; D14-R678 PolarHBondContact OD1-NH1 3.34Å; D14-R678 IonicContact OD2-NH1 2.67Å; D14-R678 PolarHBondContact OD2-NH1 3.34Å; E518-R678 IonicContact OE1-CZ 3.72Å; E518-R678 IonicContact OE1-NE 3.15Å; E518-R678 IonicContact OE1-NH2 3.62Å; E518-R678 PolarHBondContact OE1-NH2 3.34Å; E518-R678 IonicContact OE2-NH2 2.95Å; S550-R678 PolarHBondContact OG-NE 3.26Å; S550-R678 VanDerWaalsContact OG-NE 3.09Å; R678-Q702 PolarHBondContact N-O 2.86Å; R678-D703 WeakPolarHBondContact CA-O 3.24Å; R678-D703 HydrophobicContact CG-CB 4.01Å
679	C	91.6	Very high	93.8	Very high	1 Å²	1	41 Å²	41	1%	0.007	19%	0.19	C	C	.	.			trans	-80.1	131.8	168.6	-71.3	0	0	0	0	111	L548 I552 L676 A677 L681 C704	L548-C679 PolarHBondContact O-SG 2.87Å; I552-C679 HydrophobicContact CB-CB 3.94Å; I552-C679 HydrophobicContact CG1-CB 4.49Å; I552-C679 WeakPolarHBondContact O-CA 3.37Å; L676-C679 WeakPolarHBondContact O-CB 3.49Å; L676-C679 PolarHBondContact O-N 3.18Å; L676-C679 PolarHBondContact O-SG 3.2Å; L676-C679 VanDerWaalsContact O-SG 3.33Å; A677-C679 PolarHBondContact O-N 3.19Å; A677-C679 VanDerWaalsContact O-N 3.1Å; C679-L681 HydrophobicContact CB-CD1 4.33Å; C679-L681 HydrophobicContact CB-CD2 4.17Å; C679-L681 HydrophobicContact CB-CG 3.97Å; C679-L681 PolarHBondContact O-N 3.41Å; C679-L681 VanDerWaalsContact O-N 3.13Å; C679-C704 CarbonylContact O-C 3.57Å; C679-C704 WeakPolarHBondContact O-CA 3.42Å; C679-C704 WeakPolarHBondContact O-CB 3.44Å; C679-C704 PolarHBondContact O-SG 3.41Å
680	H	91.4	Very high	93.8	Very high	33 Å²	33	32.4 Å²	32.4	15%	0.153	16%	0.164	C	C	.	.			trans	-75.4	101.1	176.2	-170.2	96.9	0	0	0	110.7	I552 P554 T654 T682	I552-H680 PolarHBondContact O-N 3.4Å; P554-H680 HydrophobicContact CB-CB 4.4Å; T654-H680 VanDerWaalsContact CG2-O 3.31Å; T654-H680 WeakPolarHBondContact CG2-O 3.11Å; H680-T682 PolarHBondContact CE1-OG1 3.14Å; H680-T682 PolarHBondContact NE2-OG1 2.84Å
681	L	93.2	Very high	93.6	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	17%	0.166	C	C	.	.			trans	-114.4	11.2	-170.3	-64.6	-178.8	0	0	0	114.7	I552 L676 C679 G683 Q684 L685 L688 L701 C704 L706	I552-L681 HydrophobicContact CD1-CD2 3.97Å; L676-L681 HydrophobicContact CB-CD1 4.42Å; L676-L681 HydrophobicContact CD1-CD1 4.47Å; C679-L681 HydrophobicContact CB-CD1 4.33Å; C679-L681 HydrophobicContact CB-CD2 4.17Å; C679-L681 HydrophobicContact CB-CG 3.97Å; C679-L681 PolarHBondContact O-N 3.41Å; C679-L681 VanDerWaalsContact O-N 3.13Å; L681-G683 PolarHBondContact O-N 2.87Å; L681-G683 VanDerWaalsContact O-N 3.13Å; L681-Q684 WeakPolarHBondContact O-CA 3.29Å; L681-Q684 PolarHBondContact O-N 2.72Å; L681-L685 HydrophobicContact CD1-CD1 4.19Å; L681-L688 HydrophobicContact CD1-CD2 3.92Å; L681-L688 HydrophobicContact CD2-CD2 3.58Å; L681-L688 HydrophobicContact CG-CD2 4.42Å; L681-L701 HydrophobicContact CD1-CD2 4.14Å; L681-C704 HydrophobicContact CB-CB 4.42Å; L681-C704 HydrophobicContact CD1-CB 4.24Å; L681-C704 HydrophobicContact CG-CB 4.46Å; L681-C704 PolarHBondContact N-O 2.88Å; L681-L706 HydrophobicContact CB-CD2 4.04Å
682	T	92.9	Very high	93.5	Very high	56 Å²	56	28.8 Å²	28.8	34%	0.344	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.2	113.1	-176.8	-35.1	0	0	0	0	113.2	H680 Q684 C705	H680-T682 PolarHBondContact CE1-OG1 3.14Å; H680-T682 PolarHBondContact NE2-OG1 2.84Å; T682-Q684 PolarHBondContact O-N 2.99Å; T682-C705 WeakPolarHBondContact OG1-CB 3.15Å; T682-C705 PolarHBondContact OG1-O 3.17Å; T682-C705 VanDerWaalsContact OG1-O 3.08Å
683	G	92.4	Very high	93.1	Very high	36 Å²	36	31 Å²	31	37%	0.371	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	71	7.2	-178.2	0	0	0	0	0	115	L681 D710	L681-G683 PolarHBondContact O-N 2.87Å; L681-G683 VanDerWaalsContact O-N 3.13Å; G683-D710 WeakPolarHBondContact CA-OD1 3.38Å; G683-D710 WeakPolarHBondContact CA-OD2 3.46Å; G683-D710 PolarHBondContact N-OD1 3.41Å; G683-D710 PolarHBondContact N-OD2 3.21Å
684	Q	93.3	Very high	92.7	Very high	26 Å²	26	29.2 Å²	29.2	12%	0.121	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.4	-3.6	-174.5	-58.4	-47.6	-48.9	0	0	114.2	T654 C658 L681 T682 K686 T687 L688 D710	T654-Q684 HydrophobicContact CG2-CG 4.15Å; C658-Q684 HydrophobicContact CB-CB 4.49Å; L681-Q684 WeakPolarHBondContact O-CA 3.29Å; L681-Q684 PolarHBondContact O-N 2.72Å; T682-Q684 PolarHBondContact O-N 2.99Å; Q684-K686 PolarHBondContact O-N 2.88Å; Q684-T687 WeakPolarHBondContact O-CA 3.47Å; Q684-T687 WeakPolarHBondContact O-CB 3.22Å; Q684-T687 PolarHBondContact O-N 3.46Å; Q684-T687 PolarHBondContact OE1-OG1 3.27Å; Q684-L688 PolarHBondContact O-N 3.04Å; Q684-D710 PolarHBondContact N-OD1 3.05Å
685	L	95	Very high	92.3	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-61.2	-35.6	-176.3	-166.2	68.5	0	0	0	111.8	L681 T687 L688 L689 L701 L706 D710 L714	L681-L685 HydrophobicContact CD1-CD1 4.19Å; L685-T687 VanDerWaalsContact C-N 3.35Å; L685-T687 PolarHBondContact O-N 2.98Å; L685-L688 PolarHBondContact O-N 3.47Å; L685-L689 HydrophobicContact CD1-CD1 3.63Å; L685-L689 HydrophobicContact CD1-CG 3.88Å; L685-L689 HydrophobicContact CD2-CD1 4.31Å; L685-L689 HydrophobicContact CG-CD1 3.81Å; L685-L689 HydrophobicContact CG-CG 4.17Å; L685-L689 WeakPolarHBondContact O-CB 3.49Å; L685-L689 PolarHBondContact O-N 2.65Å; L685-L701 HydrophobicContact CD1-CD1 3.78Å; L685-L701 HydrophobicContact CD1-CD2 3.85Å; L685-L701 HydrophobicContact CD1-CG 4.5Å; L685-L701 HydrophobicContact CD2-CD1 3.91Å; L685-L706 HydrophobicContact CB-CD2 4.42Å; L685-L706 HydrophobicContact CD1-CD2 4.23Å; L685-L706 HydrophobicContact CD2-CD2 4.21Å; L685-D710 HydrophobicContact CB-CB 3.74Å; L685-D710 WeakPolarHBondContact CB-OD1 3.41Å; L685-D710 HydrophobicContact CD2-CB 4.04Å; L685-D710 PolarHBondContact N-OD1 2.89Å; L685-L714 HydrophobicContact CD2-CB 4.13Å; L685-L714 HydrophobicContact CD2-CD1 4.42Å
686	K	95	Very high	92.3	Very high	116 Å²	116	34.1 Å²	34.1	50%	0.504	22%	0.216	S	C	.	.	H	α-helix	trans	-63.7	-34.6	172.5	-178.8	163.7	-176.5	161.4	0	113.7	Q684 G690 Y713	Q684-K686 PolarHBondContact O-N 2.88Å; K686-G690 WeakPolarHBondContact O-CA 3.2Å; K686-G690 PolarHBondContact O-N 3.4Å; K686-Y713 HydrophobicContact CB-CD1 4.05Å; K686-Y713 HydrophobicContact CB-CD2 3.79Å; K686-Y713 HydrophobicContact CB-CE1 4.2Å; K686-Y713 HydrophobicContact CB-CE2 3.95Å; K686-Y713 HydrophobicContact CB-CG 3.85Å; K686-Y713 HydrophobicContact CD-CD2 3.64Å; K686-Y713 HydrophobicContact CD-CE2 3.92Å; K686-Y713 HydrophobicContact CD-CG 4.39Å; K686-Y713 HydrophobicContact CG-CD2 3.69Å; K686-Y713 HydrophobicContact CG-CE2 3.58Å; K686-Y713 HydrophobicContact CG-CG 4.29Å
687	T	94.4	Very high	92.2	Very high	42 Å²	42	37.1 Å²	37.1	26%	0.258	23%	0.23	S	C	.	.	H	α-helix	trans	-75.4	-34.7	176.4	-60.6	0	0	0	0	111.5	C658 R659 Q684 L685	C658-T687 HydrophobicContact CB-CG2 3.96Å; R659-T687 HydrophobicContact CG-CG2 3.53Å; Q684-T687 WeakPolarHBondContact O-CA 3.47Å; Q684-T687 WeakPolarHBondContact O-CB 3.22Å; Q684-T687 PolarHBondContact O-N 3.46Å; Q684-T687 PolarHBondContact OE1-OG1 3.27Å; L685-T687 VanDerWaalsContact C-N 3.35Å; L685-T687 PolarHBondContact O-N 2.98Å
688	L	94.5	Very high	92.4	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-82.2	-43.4	-178.1	-178.9	54.7	0	0	0	113.4	C658 L661 N662 L665 L676 L681 Q684 L685	C658-L688 HydrophobicContact CB-CB 4.13Å; L661-L688 HydrophobicContact CB-CD1 3.9Å; L661-L688 HydrophobicContact CD2-CD1 3.77Å; L661-L688 HydrophobicContact CG-CD1 3.73Å; N662-L688 PolarHBondContact ND2-O 3.33Å; L665-L688 HydrophobicContact CD1-CD1 4.08Å; L676-L688 HydrophobicContact CD1-CD2 3.66Å; L676-L688 HydrophobicContact CD1-CG 4.39Å; L676-L688 HydrophobicContact CD2-CD2 4.32Å; L681-L688 HydrophobicContact CD1-CD2 3.92Å; L681-L688 HydrophobicContact CD2-CD2 3.58Å; L681-L688 HydrophobicContact CG-CD2 4.42Å; Q684-L688 PolarHBondContact O-N 3.04Å; L685-L688 PolarHBondContact O-N 3.47Å
689	L	95	Very high	92.6	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-95	-7	-176.8	-56	-173.7	0	0	0	114.2	L674 L676 L685 G691 L692 L699 Y713 L714 W718	L674-L689 HydrophobicContact CD2-CD2 3.9Å; L676-L689 HydrophobicContact CD1-CD2 4.36Å; L685-L689 HydrophobicContact CD1-CD1 3.63Å; L685-L689 HydrophobicContact CD1-CG 3.88Å; L685-L689 HydrophobicContact CD2-CD1 4.31Å; L685-L689 HydrophobicContact CG-CD1 3.81Å; L685-L689 HydrophobicContact CG-CG 4.17Å; L685-L689 WeakPolarHBondContact O-CB 3.49Å; L685-L689 PolarHBondContact O-N 2.65Å; L689-G691 PolarHBondContact O-N 2.86Å; L689-L692 HydrophobicContact CB-CD1 4.32Å; L689-L692 HydrophobicContact CD2-CD1 3.74Å; L689-L692 WeakPolarHBondContact O-CB 3.44Å; L689-L692 PolarHBondContact O-N 3.23Å; L689-L699 HydrophobicContact CD1-CD2 4.42Å; L689-Y713 HydrophobicContact CB-CE1 4.38Å; L689-L714 HydrophobicContact CD1-CD1 4.41Å; L689-W718 HydrophobicContact CD1-CD2 4.32Å; L689-W718 HydrophobicContact CD1-CZ2 4.18Å; L689-W718 PolarHBondContact O-NE1 2.86Å
690	G	92.7	Very high	92.8	Very high	23 Å²	23	33.7 Å²	33.7	24%	0.237	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	129.2	179.5	0	0	0	0	0	112.7	N662 K686 L692	N662-G690 PolarHBondContact ND2-O 2.78Å; K686-G690 WeakPolarHBondContact O-CA 3.2Å; K686-G690 PolarHBondContact O-N 3.4Å; G690-L692 PolarHBondContact O-N 3.06Å
691	G	88.6	Confident	93.1	Very high	59 Å²	59	32.1 Å²	32.1	61%	0.608	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.7	-9	-178.6	0	0	0	0	0	115.4	L689 S693	L689-G691 PolarHBondContact O-N 2.86Å; G691-S693 PolarHBondContact O-N 3.15Å; G691-S693 PolarHBondContact O-OG 2.94Å
692	L	92.3	Very high	93.2	Very high	8 Å²	8	32.3 Å²	32.3	4%	0.042	21%	0.208	C	C	.	.			trans	-64	120.1	166.5	-61.5	-179.1	0	0	0	109.1	L665 V666 L674 L689 G690 P720	L665-L692 HydrophobicContact CB-CD1 4.34Å; L665-L692 HydrophobicContact CB-CD2 3.64Å; L665-L692 HydrophobicContact CD1-CD1 4.39Å; V666-L692 HydrophobicContact CB-CD2 4.38Å; V666-L692 HydrophobicContact CG2-CD2 3.65Å; V666-L692 HydrophobicContact CG2-CG 4.44Å; L674-L692 HydrophobicContact CD2-CD1 4.25Å; L689-L692 HydrophobicContact CB-CD1 4.32Å; L689-L692 HydrophobicContact CD2-CD1 3.74Å; L689-L692 WeakPolarHBondContact O-CB 3.44Å; L689-L692 PolarHBondContact O-N 3.23Å; G690-L692 PolarHBondContact O-N 3.06Å; L692-P720 WeakPolarHBondContact O-CG 3.22Å
693	S	86	Confident	93.3	Very high	105 Å²	105	32 Å²	32	73%	0.734	20%	0.204	S	C	*	.			trans	-133.3	0.6	-173.3	47	0	0	0	0	112.5	G691	G691-S693 PolarHBondContact O-N 3.15Å; G691-S693 PolarHBondContact O-OG 2.94Å
694	Q	88.1	Confident	93.4	Very high	17 Å²	17	30.3 Å²	30.3	8%	0.079	19%	0.187	C	C	.	.	S	Bend	trans	-61.8	149.3	170.6	-58.9	96.5	-51.4	0	0	111.1	L665 L668 L696	L665-Q694 PolarHBondContact O-NE2 3.04Å; L668-Q694 PolarHBondContact O-NE2 2.8Å; Q694-L696 PolarHBondContact O-N 3.2Å
695	P	88.5	Confident	93.3	Very high	103 Å²	103	32.1 Å²	32.1	67%	0.669	20%	0.202	S	C	*	.			trans	-74.4	77.8	174.5	32.6	-35.1	0	0	0	110.3
696	L	93.4	Very high	93.3	Very high	2 Å²	2	32.5 Å²	32.5	1%	0.01	20%	0.204	C	C	.	.			trans	-65.5	138.3	172.9	-71.1	168.5	0	0	0	110.4	L671 L674 Q694 W718 G723 L724	L671-L696 HydrophobicContact CD2-CD2 4.28Å; L671-L696 HydrophobicContact CG-CD2 3.99Å; L671-L696 WeakPolarHBondContact O-CD2 3.45Å; L674-L696 HydrophobicContact CB-CD2 4.29Å; Q694-L696 PolarHBondContact O-N 3.2Å; L696-W718 HydrophobicContact CD1-CH2 3.62Å; L696-W718 HydrophobicContact CD1-CZ2 3.63Å; L696-G723 CarbonylContact O-C 3.56Å; L696-L724 HydrophobicContact CB-CD2 4.04Å
697	E	94.2	Very high	93.3	Very high	62 Å²	62	28.5 Å²	28.5	29%	0.29	19%	0.19	S	C	.	.			trans	-109.2	-30.2	-179.9	-65.8	177.1	-172.3	0	0	111.5	Q672 Y725 E726	Q672-E697 HydrophobicContact CB-CG 4.37Å; Q672-E697 PolarHBondContact NE2-OE1 2.95Å; Q672-E697 PolarHBondContact O-N 3.37Å; E697-Y725 HydrophobicContact CB-CD2 3.92Å; E697-Y725 HydrophobicContact CG-CD2 3.93Å; E697-Y725 HydrophobicContact CG-CE2 4.1Å; E697-Y725 PolarHBondContact O-N 3.27Å; E697-E726 PolarHBondContact O-N 3.36Å
698	Y	95.5	Very high	93.3	Very high	15 Å²	15	28.1 Å²	28.1	6%	0.059	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	130.4	-179.5	169.1	-83.8	0	0	0	110.5	L7 Q672 R673 L674 N700 E726	L7-Y698 HydrophobicContact CD1-CE2 4.16Å; Q672-Y698 PolarHBondContact O-N 3.31Å; R673-Y698 HydrophobicContact CB-CD1 3.91Å; R673-Y698 HydrophobicContact CB-CG 4.23Å; R673-Y698 VanDerWaalsContact NH2-CD2 3.26Å; L674-Y698 PolarHBondContact N-O 2.79Å; Y698-N700 HydrophobicContact CE1-CB 3.69Å; Y698-N700 WeakPolarHBondContact OH-CB 3.35Å; Y698-N700 PolarHBondContact OH-ND2 3.4Å; Y698-E726 WeakPolarHBondContact CA-O 3.45Å; Y698-E726 HydrophobicContact CD2-CB 3.59Å; Y698-E726 HydrophobicContact CD2-CG 4.33Å; Y698-E726 WeakPolarHBondContact CD2-OE2 3.31Å; Y698-E726 HydrophobicContact CE2-CB 4.48Å; Y698-E726 HydrophobicContact CG-CB 4.3Å
699	L	96.6	Very high	93.4	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	123.3	170.7	179.5	63.1	0	0	0	110.3	L674 L689 L701 L714 W718 L724 E726 L727 N728	L674-L699 HydrophobicContact CB-CD1 4.28Å; L674-L699 HydrophobicContact CD2-CD1 4.19Å; L674-L699 HydrophobicContact CG-CD1 4.25Å; L674-L699 WeakPolarHBondContact O-CA 3.27Å; L689-L699 HydrophobicContact CD1-CD2 4.42Å; L699-L701 HydrophobicContact CD1-CD2 4.12Å; L699-L701 HydrophobicContact CD1-CG 4.11Å; L699-L701 HydrophobicContact CD2-CD1 3.98Å; L699-L701 HydrophobicContact CD2-CG 4.26Å; L699-L701 HydrophobicContact CG-CD1 4.3Å; L699-L701 HydrophobicContact CG-CG 4.02Å; L699-L714 HydrophobicContact CD2-CD1 4.06Å; L699-W718 HydrophobicContact CD2-CH2 3.84Å; L699-W718 HydrophobicContact CD2-CZ3 3.68Å; L699-L724 HydrophobicContact CB-CD1 3.83Å; L699-L724 HydrophobicContact CB-CD2 3.98Å; L699-L724 HydrophobicContact CD2-CD1 4.38Å; L699-E726 PolarHBondContact N-O 2.83Å; L699-L727 HydrophobicContact CB-CD1 4.21Å; L699-L727 HydrophobicContact CD2-CD1 4.16Å; L699-L727 HydrophobicContact CG-CD1 4.31Å; L699-L727 WeakPolarHBondContact O-CA 3.42Å; L699-N728 PolarHBondContact O-N 3.25Å
700	N	96.6	Very high	93.5	Very high	4 Å²	4	35.7 Å²	35.7	2%	0.021	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	113	173.2	-178.1	-6.4	0	0	0	111.1	L674 L676 Y698 Q702 N728	L674-N700 PolarHBondContact O-N 2.78Å; L676-N700 PolarHBondContact N-O 3Å; Y698-N700 HydrophobicContact CE1-CB 3.69Å; Y698-N700 WeakPolarHBondContact OH-CB 3.35Å; Y698-N700 PolarHBondContact OH-ND2 3.4Å; N700-Q702 WeakPolarHBondContact OD1-CB 3.29Å; N700-Q702 PolarHBondContact OD1-N 3.11Å; N700-N728 HydrophobicContact CB-CB 4.05Å; N700-N728 PolarHBondContact ND2-ND2 3.25Å; N700-N728 PolarHBondContact OD1-ND2 3.09Å
701	L	96.9	Very high	93.6	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	21%	0.214	C	C	.	.			trans	-118.3	31.3	174.6	-57.3	172.8	0	0	0	110.9	L676 L681 L685 L699 C704 L706 L714 N728 L729 N732	L676-L701 HydrophobicContact CB-CD2 4.14Å; L676-L701 HydrophobicContact CD1-CD2 3.9Å; L681-L701 HydrophobicContact CD1-CD2 4.14Å; L685-L701 HydrophobicContact CD1-CD1 3.78Å; L685-L701 HydrophobicContact CD1-CD2 3.85Å; L685-L701 HydrophobicContact CD1-CG 4.5Å; L685-L701 HydrophobicContact CD2-CD1 3.91Å; L699-L701 HydrophobicContact CD1-CD2 4.12Å; L699-L701 HydrophobicContact CD1-CG 4.11Å; L699-L701 HydrophobicContact CD2-CD1 3.98Å; L699-L701 HydrophobicContact CD2-CG 4.26Å; L699-L701 HydrophobicContact CG-CD1 4.3Å; L699-L701 HydrophobicContact CG-CG 4.02Å; L701-C704 HydrophobicContact CB-CB 4.46Å; L701-C704 WeakPolarHBondContact O-CB 3.36Å; L701-C704 PolarHBondContact O-SG 2.94Å; L701-C704 VanDerWaalsContact O-SG 3.38Å; L701-L706 HydrophobicContact CB-CD1 4.01Å; L701-L706 HydrophobicContact CD1-CD1 4Å; L701-L714 HydrophobicContact CD1-CD2 4.34Å; L701-N728 CarbonylContact C-O 3.22Å; L701-N728 PolarHBondContact N-O 3.31Å; L701-L729 HydrophobicContact CB-CD2 4.28Å; L701-L729 HydrophobicContact CD1-CD2 4.25Å; L701-N732 PolarHBondContact O-ND2 3.1Å
702	Q	95	Very high	94	Very high	4 Å²	4	35.7 Å²	35.7	2%	0.019	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	135.7	178.3	167.7	177.7	-22.4	0	0	111.3	A677 R678 N700 C704 N728 S730	A677-Q702 CarbonylContact C-O 3.57Å; A677-Q702 WeakPolarHBondContact CA-O 3.32Å; A677-Q702 HydrophobicContact CB-CB 4Å; A677-Q702 WeakPolarHBondContact CB-O 3.44Å; R678-Q702 PolarHBondContact N-O 2.86Å; N700-Q702 WeakPolarHBondContact OD1-CB 3.29Å; N700-Q702 PolarHBondContact OD1-N 3.11Å; Q702-C704 VanDerWaalsContact C-N 3.27Å; Q702-C704 PolarHBondContact O-N 2.97Å; Q702-N728 PolarHBondContact OE1-ND2 3.01Å; Q702-S730 CarbonylContact C-O 3.4Å; Q702-S730 VanDerWaalsContact CA-O 3.24Å; Q702-S730 WeakPolarHBondContact CA-O 3.36Å; Q702-S730 VanDerWaalsContact CG-OG 3.32Å; Q702-S730 WeakPolarHBondContact CG-OG 3.45Å; Q702-S730 PolarHBondContact OE1-OG 3.06Å
703	D	94.3	Very high	94.2	Very high	50 Å²	50	36.3 Å²	36.3	27%	0.267	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.9	34	171.7	-137.2	-11.8	0	0	0	112.9	R678 S730 R731	R678-D703 WeakPolarHBondContact CA-O 3.24Å; R678-D703 HydrophobicContact CG-CB 4.01Å; D703-S730 PolarHBondContact N-O 3.43Å; D703-R731 HydrophobicContact CB-CB 3.91Å; D703-R731 VanDerWaalsContact CG-CD 3.47Å; D703-R731 WeakPolarHBondContact OD2-CD 3.39Å; D703-R731 IonicContact OD2-CZ 3.5Å; D703-R731 IonicContact OD2-NE 3.79Å; D703-R731 IonicContact OD2-NH1 3.69Å; D703-R731 PolarHBondContact OD2-NH1 3.04Å
704	C	94.5	Very high	94.7	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.17	C	C	.	.			trans	-95.6	6.4	-171.4	-79.2	0	0	0	0	115.3	L676 C679 L681 L701 Q702 L706 N732	L676-C704 PolarHBondContact O-SG 2.79Å; C679-C704 CarbonylContact O-C 3.57Å; C679-C704 WeakPolarHBondContact O-CA 3.42Å; C679-C704 WeakPolarHBondContact O-CB 3.44Å; C679-C704 PolarHBondContact O-SG 3.41Å; L681-C704 HydrophobicContact CB-CB 4.42Å; L681-C704 HydrophobicContact CD1-CB 4.24Å; L681-C704 HydrophobicContact CG-CB 4.46Å; L681-C704 PolarHBondContact N-O 2.88Å; L701-C704 HydrophobicContact CB-CB 4.46Å; L701-C704 WeakPolarHBondContact O-CB 3.36Å; L701-C704 PolarHBondContact O-SG 2.94Å; L701-C704 VanDerWaalsContact O-SG 3.38Å; Q702-C704 VanDerWaalsContact C-N 3.27Å; Q702-C704 PolarHBondContact O-N 2.97Å; C704-L706 HydrophobicContact CB-CD2 3.98Å; C704-L706 HydrophobicContact CB-CG 3.9Å; C704-L706 PolarHBondContact O-N 2.85Å; C704-N732 PolarHBondContact N-OD1 3.18Å; C704-N732 VanDerWaalsContact N-OD1 3.08Å
705	C	93.1	Very high	95	Very high	65 Å²	65	30.7 Å²	30.7	44%	0.439	17%	0.167	S	C	.	.			trans	52.1	33.5	-172.6	-56.7	0	0	0	0	113.8	T682 S707 N732	T682-C705 WeakPolarHBondContact OG1-CB 3.15Å; T682-C705 PolarHBondContact OG1-O 3.17Å; T682-C705 VanDerWaalsContact OG1-O 3.08Å; C705-S707 PolarHBondContact O-N 3.07Å; C705-N732 PolarHBondContact N-OD1 2.69Å
706	L	94.9	Very high	95.2	Very high	8 Å²	8	30.3 Å²	30.3	4%	0.042	16%	0.156	C	C	.	.			trans	-59.2	134.8	-176.5	-62.3	178.3	0	0	0	112.1	L681 L685 L701 C704 D710 I711 L729 N732	L681-L706 HydrophobicContact CB-CD2 4.04Å; L685-L706 HydrophobicContact CB-CD2 4.42Å; L685-L706 HydrophobicContact CD1-CD2 4.23Å; L685-L706 HydrophobicContact CD2-CD2 4.21Å; L701-L706 HydrophobicContact CB-CD1 4.01Å; L701-L706 HydrophobicContact CD1-CD1 4Å; C704-L706 HydrophobicContact CB-CD2 3.98Å; C704-L706 HydrophobicContact CB-CG 3.9Å; C704-L706 PolarHBondContact O-N 2.85Å; L706-D710 HydrophobicContact CB-CB 4.21Å; L706-D710 HydrophobicContact CD2-CB 4.04Å; L706-I711 HydrophobicContact CB-CD1 4.17Å; L706-I711 HydrophobicContact CB-CG1 4.43Å; L706-I711 HydrophobicContact CD1-CD1 3.71Å; L706-L729 HydrophobicContact CD1-CD2 4.2Å; L706-N732 HydrophobicContact CB-CB 4.41Å; L706-N732 WeakPolarHBondContact CG-OD1 3.33Å; L706-N732 PolarHBondContact N-OD1 3.46Å; L706-N732 VanDerWaalsContact N-OD1 3.11Å
707	S	94.2	Very high	95.2	Very high	31 Å²	31	34.6 Å²	34.6	22%	0.217	18%	0.176	C	C	.	.			trans	-82.4	167.7	173.1	73.1	0	0	0	0	111.7	C705 E709 D710 I711	C705-S707 PolarHBondContact O-N 3.07Å; S707-E709 PolarHBondContact O-N 2.74Å; S707-E709 PolarHBondContact OG-N 2.9Å; S707-D710 VanDerWaalsContact CB-OD2 3.3Å; S707-D710 WeakPolarHBondContact CB-OD2 3.4Å; S707-D710 PolarHBondContact N-OD2 3.23Å; S707-D710 PolarHBondContact O-N 3.43Å; S707-D710 VanDerWaalsContact O-N 3.14Å; S707-D710 PolarHBondContact OG-N 2.89Å; S707-D710 PolarHBondContact OG-OD2 2.97Å; S707-I711 PolarHBondContact O-N 2.99Å; S707-I711 VanDerWaalsContact O-N 3.15Å
708	S	95	Very high	95.1	Very high	34 Å²	34	32 Å²	32	24%	0.238	16%	0.164	C	C	.	.	H	α-helix	trans	-61.1	-28	171.4	-173.4	0	0	0	0	112.9	H712 P738	S708-H712 VanDerWaalsContact O-CB 3.24Å; S708-H712 WeakPolarHBondContact O-CB 3.3Å; S708-H712 PolarHBondContact O-N 3.47Å; S708-P738 WeakPolarHBondContact OG-CD 3.39Å
709	E	95.6	Very high	94.8	Very high	156 Å²	156	41.8 Å²	41.8	73%	0.729	20%	0.2	S	C	*	.	H	α-helix	trans	-71.6	-36.2	175.3	-66.5	-172.3	-165	0	0	112	S707 H712 Y713	S707-E709 PolarHBondContact O-N 2.74Å; S707-E709 PolarHBondContact OG-N 2.9Å; E709-H712 PolarHBondContact O-N 3.37Å; E709-Y713 WeakPolarHBondContact O-CB 3.42Å; E709-Y713 PolarHBondContact O-N 3.11Å
710	D	96.6	Very high	94.5	Very high	4 Å²	4	42.7 Å²	42.7	2%	0.021	21%	0.207	C	C	.	.	H	α-helix	trans	-65.5	-43.5	175.5	-62.2	-66.6	0	0	0	111	G683 Q684 L685 L706 S707 Y713 L714	G683-D710 WeakPolarHBondContact CA-OD1 3.38Å; G683-D710 WeakPolarHBondContact CA-OD2 3.46Å; G683-D710 PolarHBondContact N-OD1 3.41Å; G683-D710 PolarHBondContact N-OD2 3.21Å; Q684-D710 PolarHBondContact N-OD1 3.05Å; L685-D710 HydrophobicContact CB-CB 3.74Å; L685-D710 WeakPolarHBondContact CB-OD1 3.41Å; L685-D710 HydrophobicContact CD2-CB 4.04Å; L685-D710 PolarHBondContact N-OD1 2.89Å; L706-D710 HydrophobicContact CB-CB 4.21Å; L706-D710 HydrophobicContact CD2-CB 4.04Å; S707-D710 VanDerWaalsContact CB-OD2 3.3Å; S707-D710 WeakPolarHBondContact CB-OD2 3.4Å; S707-D710 PolarHBondContact N-OD2 3.23Å; S707-D710 PolarHBondContact O-N 3.43Å; S707-D710 VanDerWaalsContact O-N 3.14Å; S707-D710 PolarHBondContact OG-N 2.89Å; S707-D710 PolarHBondContact OG-OD2 2.97Å; D710-Y713 PolarHBondContact O-N 3.49Å; D710-L714 WeakPolarHBondContact O-CB 3.18Å; D710-L714 PolarHBondContact O-N 3.13Å
711	I	96.6	Very high	94.3	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-66.9	-42.7	176.3	-58.6	-63.3	0	0	0	110.8	L706 S707 Y713 L714 V715 L729 L734 V737 T741	L706-I711 HydrophobicContact CB-CD1 4.17Å; L706-I711 HydrophobicContact CB-CG1 4.43Å; L706-I711 HydrophobicContact CD1-CD1 3.71Å; S707-I711 PolarHBondContact O-N 2.99Å; S707-I711 VanDerWaalsContact O-N 3.15Å; I711-Y713 VanDerWaalsContact C-N 3.34Å; I711-Y713 PolarHBondContact O-N 2.91Å; I711-L714 WeakPolarHBondContact O-CB 3.31Å; I711-L714 PolarHBondContact O-N 3.42Å; I711-V715 HydrophobicContact CG2-CG2 4.35Å; I711-V715 WeakPolarHBondContact O-CG2 3.25Å; I711-V715 PolarHBondContact O-N 3.4Å; I711-L729 HydrophobicContact CD1-CD2 4.39Å; I711-L734 HydrophobicContact CD1-CD2 3.83Å; I711-L734 HydrophobicContact CG1-CD2 3.93Å; I711-V737 HydrophobicContact CB-CG1 4.35Å; I711-V737 HydrophobicContact CB-CG2 4.13Å; I711-V737 HydrophobicContact CG1-CG2 4.04Å; I711-V737 HydrophobicContact CG2-CG1 3.85Å; I711-V737 HydrophobicContact CG2-CG2 4.21Å; I711-T741 HydrophobicContact CG2-CG2 4.13Å
712	H	96.5	Very high	93.8	Very high	81 Å²	81	45.4 Å²	45.4	38%	0.375	22%	0.219	S	C	.	.	H	α-helix	trans	-62.5	-39.1	174.7	-178.5	-85.5	0	0	0	112.2	S708 E709 H716 T741	S708-H712 VanDerWaalsContact O-CB 3.24Å; S708-H712 WeakPolarHBondContact O-CB 3.3Å; S708-H712 PolarHBondContact O-N 3.47Å; E709-H712 PolarHBondContact O-N 3.37Å; H712-H716 AromaticContact CD2-CD2 3.29Å; H712-H716 PolarHBondContact CD2-CD2 3.34Å; H712-H716 AromaticContact CD2-NE2 3.48Å; H712-H716 PolarHBondContact CD2-NE2 2.89Å; H712-H716 AromaticContact CE1-CD2 3.98Å; H712-H716 AromaticContact CG-CD2 3.72Å; H712-H716 AromaticContact NE2-CD2 3.48Å; H712-H716 PolarHBondContact NE2-CD2 3.07Å; H712-H716 WeakPolarHBondContact O-CB 3.44Å; H712-H716 PolarHBondContact O-CD2 3.05Å; H712-H716 VanDerWaalsContact O-CD2 3.3Å; H712-H716 PolarHBondContact O-N 2.85Å; H712-T741 HydrophobicContact CB-CG2 4.46Å
713	Y	96.2	Very high	93.5	Very high	21 Å²	21	46.5 Å²	46.5	8%	0.082	23%	0.232	C	C	.	.	H	α-helix	trans	-61.5	-47.8	171.2	168.8	-98.6	0	0	0	111.9	K686 L689 E709 D710 I711 V715 Q717 W718	K686-Y713 HydrophobicContact CB-CD1 4.05Å; K686-Y713 HydrophobicContact CB-CD2 3.79Å; K686-Y713 HydrophobicContact CB-CE1 4.2Å; K686-Y713 HydrophobicContact CB-CE2 3.95Å; K686-Y713 HydrophobicContact CB-CG 3.85Å; K686-Y713 HydrophobicContact CD-CD2 3.64Å; K686-Y713 HydrophobicContact CD-CE2 3.92Å; K686-Y713 HydrophobicContact CD-CG 4.39Å; K686-Y713 HydrophobicContact CG-CD2 3.69Å; K686-Y713 HydrophobicContact CG-CE2 3.58Å; K686-Y713 HydrophobicContact CG-CG 4.29Å; L689-Y713 HydrophobicContact CB-CE1 4.38Å; E709-Y713 WeakPolarHBondContact O-CB 3.42Å; E709-Y713 PolarHBondContact O-N 3.11Å; D710-Y713 PolarHBondContact O-N 3.49Å; I711-Y713 VanDerWaalsContact C-N 3.34Å; I711-Y713 PolarHBondContact O-N 2.91Å; Y713-V715 PolarHBondContact O-N 3.32Å; Y713-Q717 HydrophobicContact CD2-CB 3.58Å; Y713-Q717 HydrophobicContact CD2-CG 4.29Å; Y713-Q717 HydrophobicContact CE2-CB 3.76Å; Y713-Q717 HydrophobicContact CG-CB 4.46Å; Y713-Q717 WeakPolarHBondContact O-CA 3.33Å; Y713-Q717 WeakPolarHBondContact O-CB 3.44Å; Y713-Q717 PolarHBondContact O-N 3.36Å; Y713-W718 HydrophobicContact CE1-CB 3.99Å; Y713-W718 HydrophobicContact CE1-CG 4.25Å; Y713-W718 PolarHBondContact O-N 2.84Å
714	L	95.4	Very high	93.4	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-57.9	-48	-179.6	-176.3	67	0	0	0	111.1	L685 L689 L699 L701 D710 I711 W718 L721 L729	L685-L714 HydrophobicContact CD2-CB 4.13Å; L685-L714 HydrophobicContact CD2-CD1 4.42Å; L689-L714 HydrophobicContact CD1-CD1 4.41Å; L699-L714 HydrophobicContact CD2-CD1 4.06Å; L701-L714 HydrophobicContact CD1-CD2 4.34Å; D710-L714 WeakPolarHBondContact O-CB 3.18Å; D710-L714 PolarHBondContact O-N 3.13Å; I711-L714 WeakPolarHBondContact O-CB 3.31Å; I711-L714 PolarHBondContact O-N 3.42Å; L714-W718 HydrophobicContact CD1-CB 4.46Å; L714-W718 HydrophobicContact CD1-CD2 4.17Å; L714-W718 HydrophobicContact CD1-CE3 3.55Å; L714-W718 HydrophobicContact CD1-CZ3 4.12Å; L714-L721 HydrophobicContact CD1-CD1 4.36Å; L714-L721 HydrophobicContact CG-CD1 4.23Å; L714-L721 WeakPolarHBondContact O-CD2 3.3Å; L714-L729 HydrophobicContact CD2-CD2 4.01Å
715	V	94.9	Very high	93.5	Very high	4 Å²	4	48.9 Å²	48.9	2%	0.024	24%	0.238	C	C	.	.	H	α-helix	trans	-70.6	-51.5	-177.4	175.7	0	0	0	0	112.6	I711 Y713 T741 E744 L745	I711-V715 HydrophobicContact CG2-CG2 4.35Å; I711-V715 WeakPolarHBondContact O-CG2 3.25Å; I711-V715 PolarHBondContact O-N 3.4Å; Y713-V715 PolarHBondContact O-N 3.32Å; V715-T741 HydrophobicContact CB-CG2 4.13Å; V715-T741 HydrophobicContact CG1-CG2 4.42Å; V715-T741 HydrophobicContact CG2-CG2 3.99Å; V715-E744 HydrophobicContact CG1-CB 3.94Å; V715-E744 HydrophobicContact CG1-CG 3.86Å; V715-L745 HydrophobicContact CG1-CB 4.48Å; V715-L745 HydrophobicContact CG2-CB 3.7Å; V715-L745 HydrophobicContact CG2-CD1 4.03Å; V715-L745 HydrophobicContact CG2-CG 4.33Å
716	H	93.6	Very high	93.6	Very high	94 Å²	94	46.1 Å²	46.1	44%	0.435	22%	0.218	S	C	.	.	H	α-helix	trans	-98.9	-16.9	-166.2	-58.8	-79.7	0	0	0	114.5	H712 T741 E744	H712-H716 AromaticContact CD2-CD2 3.29Å; H712-H716 PolarHBondContact CD2-CD2 3.34Å; H712-H716 AromaticContact CD2-NE2 3.48Å; H712-H716 PolarHBondContact CD2-NE2 2.89Å; H712-H716 AromaticContact CE1-CD2 3.98Å; H712-H716 AromaticContact CG-CD2 3.72Å; H712-H716 AromaticContact NE2-CD2 3.48Å; H712-H716 PolarHBondContact NE2-CD2 3.07Å; H712-H716 WeakPolarHBondContact O-CB 3.44Å; H712-H716 PolarHBondContact O-CD2 3.05Å; H712-H716 VanDerWaalsContact O-CD2 3.3Å; H712-H716 PolarHBondContact O-N 2.85Å; H716-T741 WeakPolarHBondContact NE2-CA 3.34Å; H716-T741 WeakPolarHBondContact NE2-CB 3.21Å; H716-T741 WeakPolarHBondContact NE2-CG2 3.31Å; H716-T741 PolarHBondContact NE2-OG1 3.21Å; H716-E744 WeakPolarHBondContact CE1-CB 3.04Å; H716-E744 WeakPolarHBondContact CE1-CG 3.19Å
717	Q	92.8	Very high	93.7	Very high	93 Å²	93	45.7 Å²	45.7	44%	0.435	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.3	-29	-173.9	-62	175.5	37	0	0	113.7	Y713 R719	Y713-Q717 HydrophobicContact CD2-CB 3.58Å; Y713-Q717 HydrophobicContact CD2-CG 4.29Å; Y713-Q717 HydrophobicContact CE2-CB 3.76Å; Y713-Q717 HydrophobicContact CG-CB 4.46Å; Y713-Q717 WeakPolarHBondContact O-CA 3.33Å; Y713-Q717 WeakPolarHBondContact O-CB 3.44Å; Y713-Q717 PolarHBondContact O-N 3.36Å; Q717-R719 PolarHBondContact O-N 3.3Å; Q717-R719 VanDerWaalsContact O-N 3.15Å
718	W	93	Very high	93.8	Very high	7 Å²	7	44.2 Å²	44.2	3%	0.027	21%	0.206	C	C	.	.			trans	-87	86.6	-174.7	-164.9	65.8	0	0	0	113.2	L689 L696 L699 Y713 L714 P720 L721 L724	L689-W718 HydrophobicContact CD1-CD2 4.32Å; L689-W718 HydrophobicContact CD1-CZ2 4.18Å; L689-W718 PolarHBondContact O-NE1 2.86Å; L696-W718 HydrophobicContact CD1-CH2 3.62Å; L696-W718 HydrophobicContact CD1-CZ2 3.63Å; L699-W718 HydrophobicContact CD2-CH2 3.84Å; L699-W718 HydrophobicContact CD2-CZ3 3.68Å; Y713-W718 HydrophobicContact CE1-CB 3.99Å; Y713-W718 HydrophobicContact CE1-CG 4.25Å; Y713-W718 PolarHBondContact O-N 2.84Å; L714-W718 HydrophobicContact CD1-CB 4.46Å; L714-W718 HydrophobicContact CD1-CD2 4.17Å; L714-W718 HydrophobicContact CD1-CE3 3.55Å; L714-W718 HydrophobicContact CD1-CZ3 4.12Å; W718-P720 VanDerWaalsContact C-N 3.34Å; W718-P720 HydrophobicContact CD2-CB 4.28Å; W718-P720 HydrophobicContact CD2-CG 4.21Å; W718-P720 HydrophobicContact CE3-CB 4.25Å; W718-P720 HydrophobicContact CH2-CB 3.87Å; W718-P720 HydrophobicContact CH2-CG 4.48Å; W718-P720 HydrophobicContact CZ2-CB 3.87Å; W718-P720 HydrophobicContact CZ2-CG 3.98Å; W718-P720 HydrophobicContact CZ3-CB 4.05Å; W718-P720 WeakPolarHBondContact O-CD 3.25Å; W718-P720 VanDerWaalsContact O-N 3.08Å; W718-L721 HydrophobicContact CE3-CB 4.01Å; W718-L721 VanDerWaalsContact O-CB 3.31Å; W718-L721 WeakPolarHBondContact O-CB 3.38Å; W718-L721 PolarHBondContact O-N 3.18Å; W718-L724 HydrophobicContact CZ3-CD1 4.43Å
719	R	88.7	Confident	93.9	Very high	220 Å²	220	42.6 Å²	42.6	83%	0.83	19%	0.194	S	C	*	.	G	3₁₀ helix	trans	-43.2	-42.6	-176.3	-62.3	-177.9	-179.3	177.5	-0.3	116	Q717 L721 H722	Q717-R719 PolarHBondContact O-N 3.3Å; Q717-R719 VanDerWaalsContact O-N 3.15Å; R719-L721 PolarHBondContact O-N 3.47Å; R719-L721 VanDerWaalsContact O-N 3.11Å; R719-H722 PolarHBondContact O-ND1 3.3Å
720	P	89.7	Confident	93.9	Very high	20 Å²	20	35.3 Å²	35.3	13%	0.13	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-61.1	-16.5	-178.2	-24.4	35.2	0	0	0	115.5	L692 W718 H722 G723	L692-P720 WeakPolarHBondContact O-CG 3.22Å; W718-P720 VanDerWaalsContact C-N 3.34Å; W718-P720 HydrophobicContact CD2-CB 4.28Å; W718-P720 HydrophobicContact CD2-CG 4.21Å; W718-P720 HydrophobicContact CE3-CB 4.25Å; W718-P720 HydrophobicContact CH2-CB 3.87Å; W718-P720 HydrophobicContact CH2-CG 4.48Å; W718-P720 HydrophobicContact CZ2-CB 3.87Å; W718-P720 HydrophobicContact CZ2-CG 3.98Å; W718-P720 HydrophobicContact CZ3-CB 4.05Å; W718-P720 WeakPolarHBondContact O-CD 3.25Å; W718-P720 VanDerWaalsContact O-N 3.08Å; P720-H722 PolarHBondContact O-N 3.04Å; P720-H722 VanDerWaalsContact O-N 3.11Å; P720-G723 PolarHBondContact O-N 2.89Å
721	L	91.9	Very high	93.7	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.005	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-48.4	-41.4	-179.3	-176.7	65.3	0	0	0	113.4	L714 W718 R719 G723 L724 L727 L745 V749	L714-L721 HydrophobicContact CD1-CD1 4.36Å; L714-L721 HydrophobicContact CG-CD1 4.23Å; L714-L721 WeakPolarHBondContact O-CD2 3.3Å; W718-L721 HydrophobicContact CE3-CB 4.01Å; W718-L721 VanDerWaalsContact O-CB 3.31Å; W718-L721 WeakPolarHBondContact O-CB 3.38Å; W718-L721 PolarHBondContact O-N 3.18Å; R719-L721 PolarHBondContact O-N 3.47Å; R719-L721 VanDerWaalsContact O-N 3.11Å; L721-G723 PolarHBondContact O-N 2.86Å; L721-L724 HydrophobicContact CD1-CD1 4.03Å; L721-L724 PolarHBondContact O-N 2.99Å; L721-L727 HydrophobicContact CD1-CD2 4.11Å; L721-L745 HydrophobicContact CD1-CD1 4.49Å; L721-L745 HydrophobicContact CD2-CD1 4.2Å; L721-V749 HydrophobicContact CD1-CG1 3.81Å; L721-V749 HydrophobicContact CD2-CG1 3.91Å; L721-V749 HydrophobicContact CG-CG1 3.53Å
722	H	86.8	Confident	93.6	Very high	59 Å²	59	38.8 Å²	38.8	27%	0.273	17%	0.173	S	C	.	.	G	3₁₀ helix	trans	-67.2	-17.2	180	-51.5	87.4	0	0	0	114.2	R719 P720 N748	R719-H722 PolarHBondContact O-ND1 3.3Å; P720-H722 PolarHBondContact O-N 3.04Å; P720-H722 VanDerWaalsContact O-N 3.11Å; H722-N748 PolarHBondContact NE2-OD1 2.98Å
723	G	88.5	Confident	93.4	Very high	28 Å²	28	38.1 Å²	38.1	29%	0.289	17%	0.173	S	C	.	.	G	3₁₀ helix	trans	-87.1	-17.3	178.9	0	0	0	0	0	114.2	L696 P720 L721	L696-G723 CarbonylContact O-C 3.56Å; P720-G723 PolarHBondContact O-N 2.89Å; L721-G723 PolarHBondContact O-N 2.86Å
724	L	94	Very high	93.3	Very high	2 Å²	2	37.2 Å²	37.2	1%	0.01	17%	0.169	C	C	.	.			trans	-64.6	139.5	-174.6	-64.3	-178.4	0	0	0	112.5	L696 L699 W718 L721 L727 R756 L757	L696-L724 HydrophobicContact CB-CD2 4.04Å; L699-L724 HydrophobicContact CB-CD1 3.83Å; L699-L724 HydrophobicContact CB-CD2 3.98Å; L699-L724 HydrophobicContact CD2-CD1 4.38Å; W718-L724 HydrophobicContact CZ3-CD1 4.43Å; L721-L724 HydrophobicContact CD1-CD1 4.03Å; L721-L724 PolarHBondContact O-N 2.99Å; L724-L727 HydrophobicContact CD1-CB 4.14Å; L724-L727 HydrophobicContact CD1-CD1 3.95Å; L724-L727 HydrophobicContact CD1-CG 4.43Å; L724-R756 CarbonylContact O-C 3.6Å; L724-L757 HydrophobicContact CB-CD1 3.84Å; L724-L757 WeakPolarHBondContact O-CA 3.28Å; L724-L757 PolarHBondContact O-N 3.17Å
725	Y	94.9	Very high	93.2	Very high	98 Å²	98	39.8 Å²	39.8	38%	0.384	19%	0.187	S	C	.	.	S	Bend	trans	-97.3	-25.7	163.7	-64.1	-79.2	0	0	0	111.7	E697 R756 V758 C759	E697-Y725 HydrophobicContact CB-CD2 3.92Å; E697-Y725 HydrophobicContact CG-CD2 3.93Å; E697-Y725 HydrophobicContact CG-CE2 4.1Å; E697-Y725 PolarHBondContact O-N 3.27Å; Y725-R756 HydrophobicContact CE1-CB 4.42Å; Y725-V758 HydrophobicContact CD1-CG2 4.06Å; Y725-V758 WeakPolarHBondContact O-CA 3.14Å; Y725-V758 WeakPolarHBondContact O-CB 3.1Å; Y725-V758 PolarHBondContact O-N 2.94Å; Y725-C759 PolarHBondContact O-N 3.06Å
726	E	95.9	Very high	93.1	Very high	6 Å²	6	43.7 Å²	43.7	3%	0.028	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	127.5	-177.9	-68.3	178.2	-113.6	0	0	111.4	T6 L7 R673 E697 Y698 L699 C759	T6-E726 PolarHBondContact OG1-OE2 3.49Å; L7-E726 HydrophobicContact CD1-CB 3.95Å; R673-E726 IonicContact CZ-OE1 3.62Å; R673-E726 IonicContact NH1-OE1 3.34Å; R673-E726 PolarHBondContact NH1-OE1 3.16Å; R673-E726 VanDerWaalsContact NH1-OE1 3.08Å; R673-E726 IonicContact NH2-OE1 4Å; R673-E726 PolarHBondContact NH2-OE1 2.65Å; R673-E726 IonicContact NH2-OE2 3.72Å; R673-E726 PolarHBondContact NH2-OE2 2.96Å; R673-E726 VanDerWaalsContact NH2-OE2 3.16Å; E697-E726 PolarHBondContact O-N 3.36Å; Y698-E726 WeakPolarHBondContact CA-O 3.45Å; Y698-E726 HydrophobicContact CD2-CB 3.59Å; Y698-E726 HydrophobicContact CD2-CG 4.33Å; Y698-E726 WeakPolarHBondContact CD2-OE2 3.31Å; Y698-E726 HydrophobicContact CE2-CB 4.48Å; Y698-E726 HydrophobicContact CG-CB 4.3Å; L699-E726 PolarHBondContact N-O 2.83Å; E726-C759 HydrophobicContact CB-CB 4.49Å; E726-C759 HydrophobicContact CG-CB 4Å
727	L	96.9	Very high	93.1	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	123.6	179.2	177.6	61.1	0	0	0	110.5	L699 L721 L724 L729 L745 L757 C759 L760 S761	L699-L727 HydrophobicContact CB-CD1 4.21Å; L699-L727 HydrophobicContact CD2-CD1 4.16Å; L699-L727 HydrophobicContact CG-CD1 4.31Å; L699-L727 WeakPolarHBondContact O-CA 3.42Å; L721-L727 HydrophobicContact CD1-CD2 4.11Å; L724-L727 HydrophobicContact CD1-CB 4.14Å; L724-L727 HydrophobicContact CD1-CD1 3.95Å; L724-L727 HydrophobicContact CD1-CG 4.43Å; L727-L729 HydrophobicContact CD1-CD2 4.18Å; L727-L729 HydrophobicContact CD1-CG 4.19Å; L727-L729 HydrophobicContact CD2-CD1 4.22Å; L727-L729 HydrophobicContact CD2-CG 4.42Å; L727-L729 HydrophobicContact CG-CD1 4.47Å; L727-L729 HydrophobicContact CG-CG 4.14Å; L727-L745 HydrophobicContact CD2-CD1 4.16Å; L727-L757 HydrophobicContact CB-CD1 3.74Å; L727-L757 HydrophobicContact CB-CD2 4.02Å; L727-C759 PolarHBondContact N-O 2.86Å; L727-L760 HydrophobicContact CB-CD1 4.41Å; L727-L760 HydrophobicContact CD2-CD1 4.25Å; L727-L760 HydrophobicContact CG-CD1 4.37Å; L727-S761 PolarHBondContact O-N 2.92Å
728	N	96.9	Very high	93.2	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	116.4	174.8	-168.2	-2.8	0	0	0	110.7	L7 L699 N700 L701 Q702 S730 S761	L7-N728 HydrophobicContact CD1-CB 4.12Å; L7-N728 HydrophobicContact CD2-CB 3.81Å; L7-N728 HydrophobicContact CG-CB 4.06Å; L699-N728 PolarHBondContact O-N 3.25Å; N700-N728 HydrophobicContact CB-CB 4.05Å; N700-N728 PolarHBondContact ND2-ND2 3.25Å; N700-N728 PolarHBondContact OD1-ND2 3.09Å; L701-N728 CarbonylContact C-O 3.22Å; L701-N728 PolarHBondContact N-O 3.31Å; Q702-N728 PolarHBondContact OE1-ND2 3.01Å; N728-S730 WeakPolarHBondContact OD1-CB 3.22Å; N728-S730 PolarHBondContact OD1-N 3.33Å; N728-S730 PolarHBondContact OD1-OG 2.79Å; N728-S761 WeakPolarHBondContact OD1-CB 3.42Å; N728-S761 PolarHBondContact OD1-OG 3.22Å
729	L	97	Very high	93.1	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.201	C	C	.	.			trans	-118.7	10.2	174.1	-62.8	177.1	0	0	0	111.9	L701 L706 I711 L714 L727 N732 L745 S761	L701-L729 HydrophobicContact CB-CD2 4.28Å; L701-L729 HydrophobicContact CD1-CD2 4.25Å; L706-L729 HydrophobicContact CD1-CD2 4.2Å; I711-L729 HydrophobicContact CD1-CD2 4.39Å; L714-L729 HydrophobicContact CD2-CD2 4.01Å; L727-L729 HydrophobicContact CD1-CD2 4.18Å; L727-L729 HydrophobicContact CD1-CG 4.19Å; L727-L729 HydrophobicContact CD2-CD1 4.22Å; L727-L729 HydrophobicContact CD2-CG 4.42Å; L727-L729 HydrophobicContact CG-CD1 4.47Å; L727-L729 HydrophobicContact CG-CG 4.14Å; L729-N732 PolarHBondContact O-N 2.94Å; L729-N732 PolarHBondContact O-ND2 3.02Å; L729-L745 HydrophobicContact CD1-CD2 4.02Å; L729-S761 PolarHBondContact N-O 3.08Å
730	S	94.3	Very high	93.3	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.014	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	154.7	-176.4	59	0	0	0	0	113.5	Q702 D703 N728 N732 S761 A763	Q702-S730 CarbonylContact C-O 3.4Å; Q702-S730 VanDerWaalsContact CA-O 3.24Å; Q702-S730 WeakPolarHBondContact CA-O 3.36Å; Q702-S730 VanDerWaalsContact CG-OG 3.32Å; Q702-S730 WeakPolarHBondContact CG-OG 3.45Å; Q702-S730 PolarHBondContact OE1-OG 3.06Å; D703-S730 PolarHBondContact N-O 3.43Å; N728-S730 WeakPolarHBondContact OD1-CB 3.22Å; N728-S730 PolarHBondContact OD1-N 3.33Å; N728-S730 PolarHBondContact OD1-OG 2.79Å; S730-N732 PolarHBondContact O-N 2.92Å; S730-N732 PolarHBondContact O-ND2 2.95Å; S730-S761 WeakPolarHBondContact CB-OG 3.31Å; S730-S761 PolarHBondContact N-O 3.48Å; S730-A763 CarbonylContact C-O 3.59Å; S730-A763 WeakPolarHBondContact CA-O 3.45Å; S730-A763 WeakPolarHBondContact CB-O 3.26Å
731	R	92.8	Very high	93.6	Very high	77 Å²	77	35.5 Å²	35.5	29%	0.291	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.5	5.3	-175	-57.5	-177.4	-177	172.5	2.2	116.3	D14 D703 A763 Y764	D14-R731 IonicContact OD2-CZ 2.7Å; D14-R731 IonicContact OD2-NH1 2.81Å; D14-R731 PolarHBondContact OD2-NH1 2.79Å; D14-R731 IonicContact OD2-NH2 2.71Å; D703-R731 HydrophobicContact CB-CB 3.91Å; D703-R731 VanDerWaalsContact CG-CD 3.47Å; D703-R731 WeakPolarHBondContact OD2-CD 3.39Å; D703-R731 IonicContact OD2-CZ 3.5Å; D703-R731 IonicContact OD2-NE 3.79Å; D703-R731 IonicContact OD2-NH1 3.69Å; D703-R731 PolarHBondContact OD2-NH1 3.04Å; R731-A763 PolarHBondContact N-O 3.2Å; R731-Y764 WeakPolarHBondContact CA-O 3.46Å
732	N	93.9	Very high	93.8	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.011	19%	0.187	C	C	.	.	S	Bend	trans	-88.4	141.5	166.5	-63.2	-80	0	0	0	110.6	L701 C704 C705 L706 L729 S730 L734 T765	L701-N732 PolarHBondContact O-ND2 3.1Å; C704-N732 PolarHBondContact N-OD1 3.18Å; C704-N732 VanDerWaalsContact N-OD1 3.08Å; C705-N732 PolarHBondContact N-OD1 2.69Å; L706-N732 HydrophobicContact CB-CB 4.41Å; L706-N732 WeakPolarHBondContact CG-OD1 3.33Å; L706-N732 PolarHBondContact N-OD1 3.46Å; L706-N732 VanDerWaalsContact N-OD1 3.11Å; L729-N732 PolarHBondContact O-N 2.94Å; L729-N732 PolarHBondContact O-ND2 3.02Å; S730-N732 PolarHBondContact O-N 2.92Å; S730-N732 PolarHBondContact O-ND2 2.95Å; N732-L734 PolarHBondContact O-N 3.1Å; N732-T765 CarbonylContact O-C 3.3Å; N732-T765 WeakPolarHBondContact O-CA 3.5Å; N732-T765 VanDerWaalsContact O-CB 3.24Å; N732-T765 WeakPolarHBondContact O-CB 3.48Å; N732-T765 WeakPolarHBondContact O-CG2 3.17Å
733	N	92.9	Very high	94.1	Very high	67 Å²	67	34.8 Å²	34.8	36%	0.358	18%	0.182	S	C	.	.			trans	-73	94.8	177.4	-174.6	9.1	0	0	0	111.1	S735 V736 C766	N733-S735 VanDerWaalsContact C-N 3.35Å; N733-S735 WeakPolarHBondContact OD1-CB 3.26Å; N733-S735 PolarHBondContact OD1-N 2.85Å; N733-S735 VanDerWaalsContact OD1-N 3.13Å; N733-S735 PolarHBondContact OD1-OG 3.01Å; N733-V736 WeakPolarHBondContact O-CG2 3.48Å; N733-C766 WeakPolarHBondContact OD1-CB 3.36Å
734	L	95	Very high	94.3	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.01	18%	0.179	C	C	.	.			trans	-86.1	-5.4	175.3	-59.2	-177.9	0	0	0	112.6	I711 N732 V736 V737 I762 T765 L767	I711-L734 HydrophobicContact CD1-CD2 3.83Å; I711-L734 HydrophobicContact CG1-CD2 3.93Å; N732-L734 PolarHBondContact O-N 3.1Å; L734-V736 VanDerWaalsContact C-N 3.25Å; L734-V736 PolarHBondContact O-N 3.01Å; L734-V737 HydrophobicContact CB-CG2 4.45Å; L734-V737 HydrophobicContact CD2-CG2 4.08Å; L734-V737 WeakPolarHBondContact O-CB 3.48Å; L734-V737 PolarHBondContact O-N 2.98Å; L734-V737 VanDerWaalsContact O-N 3.12Å; L734-I762 HydrophobicContact CD1-CB 4.33Å; L734-I762 HydrophobicContact CD1-CG2 4.02Å; L734-T765 HydrophobicContact CD1-CG2 3.67Å; L734-T765 HydrophobicContact CG-CG2 3.87Å; L734-T765 PolarHBondContact N-O 2.93Å; L734-L767 HydrophobicContact CB-CD1 4.27Å; L734-L767 HydrophobicContact CB-CD2 3.9Å; L734-L767 HydrophobicContact CB-CG 3.96Å; L734-L767 HydrophobicContact CD1-CD1 4.39Å
735	S	92.4	Very high	94.3	Very high	53 Å²	53	36.1 Å²	36.1	37%	0.371	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-31.9	179.3	87.6	0	0	0	0	112.5	N733 V737 C766 R771	N733-S735 VanDerWaalsContact C-N 3.35Å; N733-S735 WeakPolarHBondContact OD1-CB 3.26Å; N733-S735 PolarHBondContact OD1-N 2.85Å; N733-S735 VanDerWaalsContact OD1-N 3.13Å; N733-S735 PolarHBondContact OD1-OG 3.01Å; S735-V737 VanDerWaalsContact C-N 3.27Å; S735-V737 PolarHBondContact O-N 2.73Å; S735-C766 VanDerWaalsContact CB-O 3.27Å; S735-C766 WeakPolarHBondContact CB-O 3.21Å; S735-R771 PolarHBondContact O-NH1 3.27Å
736	V	92.2	Very high	94.2	Very high	87 Å²	87	31.7 Å²	31.7	53%	0.527	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-2.1	176.5	-60.6	0	0	0	0	114.1	N733 L734	N733-V736 WeakPolarHBondContact O-CG2 3.48Å; L734-V736 VanDerWaalsContact C-N 3.25Å; L734-V736 PolarHBondContact O-N 3.01Å
737	V	94.8	Very high	93.8	Very high	3 Å²	3	34 Å²	34	2%	0.018	18%	0.175	C	C	.	.	S	Bend	trans	-86.6	131.9	-180	-176.1	0	0	0	0	110	I711 L734 S735 T741 L742 R771	I711-V737 HydrophobicContact CB-CG1 4.35Å; I711-V737 HydrophobicContact CB-CG2 4.13Å; I711-V737 HydrophobicContact CG1-CG2 4.04Å; I711-V737 HydrophobicContact CG2-CG1 3.85Å; I711-V737 HydrophobicContact CG2-CG2 4.21Å; L734-V737 HydrophobicContact CB-CG2 4.45Å; L734-V737 HydrophobicContact CD2-CG2 4.08Å; L734-V737 WeakPolarHBondContact O-CB 3.48Å; L734-V737 PolarHBondContact O-N 2.98Å; L734-V737 VanDerWaalsContact O-N 3.12Å; S735-V737 VanDerWaalsContact C-N 3.27Å; S735-V737 PolarHBondContact O-N 2.73Å; V737-T741 HydrophobicContact CG1-CG2 3.92Å; V737-L742 HydrophobicContact CB-CD1 4.44Å; V737-L742 HydrophobicContact CB-CD2 4.03Å; V737-L742 HydrophobicContact CB-CG 4.19Å; V737-L742 HydrophobicContact CG1-CD2 3.76Å; V737-L742 HydrophobicContact CG1-CG 3.92Å; V737-R771 PolarHBondContact O-NH1 2.85Å; V737-R771 PolarHBondContact O-NH2 3.41Å
738	P	94.2	Very high	93.5	Very high	57 Å²	57	34.4 Å²	34.4	37%	0.37	18%	0.177	S	C	.	.			trans	-52.8	142.9	172.2	-27.9	34.9	0	0	0	112.6	S708 E740 T741 L742	S708-P738 WeakPolarHBondContact OG-CD 3.39Å; P738-E740 VanDerWaalsContact C-N 3.33Å; P738-E740 VanDerWaalsContact CB-OE2 3.29Å; P738-E740 WeakPolarHBondContact CB-OE2 3.41Å; P738-E740 PolarHBondContact O-N 2.82Å; P738-T741 PolarHBondContact O-N 2.65Å; P738-T741 VanDerWaalsContact O-N 3.14Å; P738-L742 PolarHBondContact O-N 3.21Å
739	E	91.8	Very high	93.3	Very high	65 Å²	65	34.5 Å²	34.5	30%	0.304	18%	0.177	S	C	.	.	H	α-helix	trans	-69	-35.4	-171.1	-159.3	163	106.6	0	0	112.5	T741 L742 Y743 R771	E739-T741 PolarHBondContact O-N 3.02Å; E739-L742 PolarHBondContact O-N 2.63Å; E739-L742 VanDerWaalsContact O-N 3.08Å; E739-Y743 HydrophobicContact CB-CE2 4.49Å; E739-Y743 HydrophobicContact CG-CD2 4.16Å; E739-Y743 HydrophobicContact CG-CE1 4.05Å; E739-Y743 HydrophobicContact CG-CE2 3.58Å; E739-Y743 PolarHBondContact O-N 3.49Å; E739-Y743 WeakPolarHBondContact OE1-CE2 3.47Å; E739-Y743 PolarHBondContact OE1-OH 3.47Å; E739-R771 VanDerWaalsContact CA-NH2 3.28Å; E739-R771 IonicContact OE2-CZ 3.81Å; E739-R771 IonicContact OE2-NE 3.27Å; E739-R771 PolarHBondContact OE2-NE 3.29Å; E739-R771 IonicContact OE2-NH2 3.18Å
740	E	93	Very high	93	Very high	131 Å²	131	34.5 Å²	34.5	61%	0.612	18%	0.177	S	C	*	.	H	α-helix	trans	-57.4	-37.1	173.5	-51.5	81.6	176.6	0	0	111.3	P738 E744	P738-E740 VanDerWaalsContact C-N 3.33Å; P738-E740 VanDerWaalsContact CB-OE2 3.29Å; P738-E740 WeakPolarHBondContact CB-OE2 3.41Å; P738-E740 PolarHBondContact O-N 2.82Å; E740-E744 VanDerWaalsContact O-CB 3.29Å; E740-E744 WeakPolarHBondContact O-CB 3.49Å; E740-E744 PolarHBondContact O-N 3.43Å
741	T	95.9	Very high	92.8	Very high	5 Å²	5	34.6 Å²	34.6	3%	0.031	18%	0.178	C	C	.	.	H	α-helix	trans	-75.1	-34.2	177.6	-65	0	0	0	0	111.9	I711 H712 V715 H716 V737 P738 E739 L745	I711-T741 HydrophobicContact CG2-CG2 4.13Å; H712-T741 HydrophobicContact CB-CG2 4.46Å; V715-T741 HydrophobicContact CB-CG2 4.13Å; V715-T741 HydrophobicContact CG1-CG2 4.42Å; V715-T741 HydrophobicContact CG2-CG2 3.99Å; H716-T741 WeakPolarHBondContact NE2-CA 3.34Å; H716-T741 WeakPolarHBondContact NE2-CB 3.21Å; H716-T741 WeakPolarHBondContact NE2-CG2 3.31Å; H716-T741 PolarHBondContact NE2-OG1 3.21Å; V737-T741 HydrophobicContact CG1-CG2 3.92Å; P738-T741 PolarHBondContact O-N 2.65Å; P738-T741 VanDerWaalsContact O-N 3.14Å; E739-T741 PolarHBondContact O-N 3.02Å; T741-L745 WeakPolarHBondContact O-CB 3.48Å; T741-L745 PolarHBondContact O-N 2.87Å
742	L	95.3	Very high	92.3	Very high	5 Å²	5	36.3 Å²	36.3	3%	0.026	19%	0.187	C	C	.	.	H	α-helix	trans	-72.3	-36.5	173.6	-61.3	179.4	0	0	0	111.8	V737 P738 E739 L745 V746 L767 L775	V737-L742 HydrophobicContact CB-CD1 4.44Å; V737-L742 HydrophobicContact CB-CD2 4.03Å; V737-L742 HydrophobicContact CB-CG 4.19Å; V737-L742 HydrophobicContact CG1-CD2 3.76Å; V737-L742 HydrophobicContact CG1-CG 3.92Å; P738-L742 PolarHBondContact O-N 3.21Å; E739-L742 PolarHBondContact O-N 2.63Å; E739-L742 VanDerWaalsContact O-N 3.08Å; L742-L745 WeakPolarHBondContact O-CB 3.28Å; L742-V746 WeakPolarHBondContact O-CG2 3.29Å; L742-V746 PolarHBondContact O-N 3.07Å; L742-L767 HydrophobicContact CD1-CD2 3.8Å; L742-L775 HydrophobicContact CB-CD1 4.48Å; L742-L775 HydrophobicContact CB-CD2 3.89Å; L742-L775 HydrophobicContact CD1-CD1 4.45Å
743	Y	92.9	Very high	91.6	Very high	41 Å²	41	42.2 Å²	42.2	16%	0.161	23%	0.226	C	C	.	.	H	α-helix	trans	-66.9	-43.7	172.5	-66.3	-23.1	0	0	0	111.8	E739 L745 V746 Q747 L775 L778	E739-Y743 HydrophobicContact CB-CE2 4.49Å; E739-Y743 HydrophobicContact CG-CD2 4.16Å; E739-Y743 HydrophobicContact CG-CE1 4.05Å; E739-Y743 HydrophobicContact CG-CE2 3.58Å; E739-Y743 PolarHBondContact O-N 3.49Å; E739-Y743 WeakPolarHBondContact OE1-CE2 3.47Å; E739-Y743 PolarHBondContact OE1-OH 3.47Å; Y743-L745 VanDerWaalsContact C-N 3.35Å; Y743-L745 PolarHBondContact O-N 3.08Å; Y743-V746 PolarHBondContact O-N 3Å; Y743-Q747 WeakPolarHBondContact O-CG 3.31Å; Y743-Q747 PolarHBondContact O-N 3.09Å; Y743-L775 HydrophobicContact CD1-CD2 3.75Å; Y743-L775 HydrophobicContact CE1-CD2 4.07Å; Y743-L775 HydrophobicContact CE1-CG 4.44Å; Y743-L778 HydrophobicContact CD1-CD2 3.67Å; Y743-L778 HydrophobicContact CG-CD2 4.02Å
744	E	92.6	Very high	91	Very high	50 Å²	50	46.1 Å²	46.1	23%	0.234	24%	0.235	C	C	.	.	H	α-helix	trans	-67.7	-32.6	177.1	-172.1	62.7	-172.6	0	0	112.4	V715 H716 E740 Q747 N748	V715-E744 HydrophobicContact CG1-CB 3.94Å; V715-E744 HydrophobicContact CG1-CG 3.86Å; H716-E744 WeakPolarHBondContact CE1-CB 3.04Å; H716-E744 WeakPolarHBondContact CE1-CG 3.19Å; E740-E744 VanDerWaalsContact O-CB 3.29Å; E740-E744 WeakPolarHBondContact O-CB 3.49Å; E740-E744 PolarHBondContact O-N 3.43Å; E744-Q747 PolarHBondContact O-N 3.18Å; E744-N748 VanDerWaalsContact CD-ND2 3.26Å; E744-N748 WeakPolarHBondContact CG-ND2 3.38Å; E744-N748 WeakPolarHBondContact O-CB 3.16Å; E744-N748 PolarHBondContact O-N 3.05Å; E744-N748 PolarHBondContact O-ND2 3.34Å; E744-N748 PolarHBondContact OE1-ND2 3.29Å
745	L	94.4	Very high	90.4	Very high	8 Å²	8	46.2 Å²	46.2	4%	0.042	24%	0.236	C	C	.	.	H	α-helix	trans	-55	-56.5	167.8	174	60.5	0	0	0	110.5	V715 L721 L727 L729 T741 L742 Y743 Q747 N748 V749	V715-L745 HydrophobicContact CG1-CB 4.48Å; V715-L745 HydrophobicContact CG2-CB 3.7Å; V715-L745 HydrophobicContact CG2-CD1 4.03Å; V715-L745 HydrophobicContact CG2-CG 4.33Å; L721-L745 HydrophobicContact CD1-CD1 4.49Å; L721-L745 HydrophobicContact CD2-CD1 4.2Å; L727-L745 HydrophobicContact CD2-CD1 4.16Å; L729-L745 HydrophobicContact CD1-CD2 4.02Å; T741-L745 WeakPolarHBondContact O-CB 3.48Å; T741-L745 PolarHBondContact O-N 2.87Å; L742-L745 WeakPolarHBondContact O-CB 3.28Å; Y743-L745 VanDerWaalsContact C-N 3.35Å; Y743-L745 PolarHBondContact O-N 3.08Å; L745-Q747 VanDerWaalsContact C-N 3.34Å; L745-Q747 PolarHBondContact O-N 3.14Å; L745-N748 PolarHBondContact O-N 3.37Å; L745-V749 HydrophobicContact CD1-CG1 4.07Å; L745-V749 HydrophobicContact CD1-CG2 4.22Å; L745-V749 VanDerWaalsContact O-CG2 3.31Å; L745-V749 WeakPolarHBondContact O-CG2 3.43Å; L745-V749 PolarHBondContact O-N 3.1Å
746	V	92.7	Very high	90.4	Very high	5 Å²	5	50.3 Å²	50.3	3%	0.03	24%	0.244	C	C	.	.	H	α-helix	trans	-60.6	-42.3	-178.9	172.5	0	0	0	0	111.4	L742 Y743 N748 C750 L751 L775 L778 M779	L742-V746 WeakPolarHBondContact O-CG2 3.29Å; L742-V746 PolarHBondContact O-N 3.07Å; Y743-V746 PolarHBondContact O-N 3Å; V746-N748 PolarHBondContact O-N 3.46Å; V746-C750 HydrophobicContact CG1-CB 4.11Å; V746-C750 WeakPolarHBondContact O-CA 3.38Å; V746-C750 WeakPolarHBondContact O-CB 3.36Å; V746-C750 PolarHBondContact O-N 3.3Å; V746-L751 PolarHBondContact O-N 3.35Å; V746-L775 HydrophobicContact CG2-CD2 3.79Å; V746-L778 HydrophobicContact CB-CD2 3.87Å; V746-L778 HydrophobicContact CG1-CD2 3.83Å; V746-L778 HydrophobicContact CG1-CG 4.44Å; V746-M779 HydrophobicContact CG1-CE 4.1Å; V746-M779 HydrophobicContact CG1-CG 3.54Å; V746-M779 HydrophobicContact CG2-CE 3.65Å
747	Q	88.9	Confident	90.5	Very high	55 Å²	55	46.2 Å²	46.2	26%	0.257	22%	0.219	S	C	.	.	H	α-helix	trans	-64.2	-38.2	178.4	-72.6	-164.8	79.7	0	0	113.3	Y743 E744 L745 L751 L778	Y743-Q747 WeakPolarHBondContact O-CG 3.31Å; Y743-Q747 PolarHBondContact O-N 3.09Å; E744-Q747 PolarHBondContact O-N 3.18Å; L745-Q747 VanDerWaalsContact C-N 3.34Å; L745-Q747 PolarHBondContact O-N 3.14Å; Q747-L751 HydrophobicContact CG-CD1 4.28Å; Q747-L778 HydrophobicContact CG-CD2 4.41Å
748	N	89.5	Confident	90.5	Very high	8 Å²	8	47.2 Å²	47.2	4%	0.043	23%	0.225	C	C	.	.	H	α-helix	trans	-82.8	-27.5	-178.8	-77.4	-42	0	0	0	114.3	H722 E744 L745 V746 R754 G755	H722-N748 PolarHBondContact NE2-OD1 2.98Å; E744-N748 VanDerWaalsContact CD-ND2 3.26Å; E744-N748 WeakPolarHBondContact CG-ND2 3.38Å; E744-N748 WeakPolarHBondContact O-CB 3.16Å; E744-N748 PolarHBondContact O-N 3.05Å; E744-N748 PolarHBondContact O-ND2 3.34Å; E744-N748 PolarHBondContact OE1-ND2 3.29Å; L745-N748 PolarHBondContact O-N 3.37Å; V746-N748 PolarHBondContact O-N 3.46Å; N748-R754 WeakPolarHBondContact OD1-CD 3.38Å; N748-R754 PolarHBondContact OD1-NH1 3.46Å; N748-G755 WeakPolarHBondContact O-CA 3.35Å
749	V	92.1	Very high	90.5	Very high	2 Å²	2	44.6 Å²	44.6	1%	0.012	21%	0.208	C	C	.	.	H	α-helix	trans	-106.7	-38.5	-176.9	-48.2	0	0	0	0	114.8	L721 L745 G755 R756 L757	L721-V749 HydrophobicContact CD1-CG1 3.81Å; L721-V749 HydrophobicContact CD2-CG1 3.91Å; L721-V749 HydrophobicContact CG-CG1 3.53Å; L745-V749 HydrophobicContact CD1-CG1 4.07Å; L745-V749 HydrophobicContact CD1-CG2 4.22Å; L745-V749 VanDerWaalsContact O-CG2 3.31Å; L745-V749 WeakPolarHBondContact O-CG2 3.43Å; L745-V749 PolarHBondContact O-N 3.1Å; V749-G755 CarbonylContact O-C 3.5Å; V749-G755 WeakPolarHBondContact O-CA 3.47Å; V749-R756 PolarHBondContact O-N 3.32Å; V749-R756 VanDerWaalsContact O-N 3.13Å; V749-L757 HydrophobicContact CB-CB 4.11Å; V749-L757 HydrophobicContact CB-CD2 4.17Å; V749-L757 HydrophobicContact CG2-CB 4.28Å; V749-L757 HydrophobicContact CG2-CD2 3.63Å; V749-L757 WeakPolarHBondContact O-CB 3.05Å; V749-L757 PolarHBondContact O-N 2.69Å
750	C	91.7	Very high	90.8	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-19.8	-171.7	-62.2	0	0	0	0	114.2	V746 C810 T811 L812	V746-C750 HydrophobicContact CG1-CB 4.11Å; V746-C750 WeakPolarHBondContact O-CA 3.38Å; V746-C750 WeakPolarHBondContact O-CB 3.36Å; V746-C750 PolarHBondContact O-N 3.3Å; C750-C810 CarbonylContact O-C 3.54Å; C750-C810 VanDerWaalsContact O-CA 3.3Å; C750-C810 WeakPolarHBondContact O-CA 3.43Å; C750-T811 PolarHBondContact O-N 2.96Å; C750-T811 PolarHBondContact O-OG1 3.22Å; C750-L812 HydrophobicContact CB-CD1 4.44Å; C750-L812 HydrophobicContact CB-CG 4.39Å
751	L	89.5	Confident	90.9	Very high	4 Å²	4	35.4 Å²	35.4	2%	0.021	17%	0.165	C	C	.	.	B	Isolated β-bridge	trans	-113.3	132.2	-171.2	-60.8	-173.4	0	0	0	112.5	V746 Q747 G755 K808 C810	V746-L751 PolarHBondContact O-N 3.35Å; Q747-L751 HydrophobicContact CG-CD1 4.28Å; L751-G755 WeakPolarHBondContact O-CA 3.28Å; L751-G755 PolarHBondContact O-N 2.99Å; L751-K808 HydrophobicContact CB-CB 4.33Å; L751-K808 HydrophobicContact CB-CD 4.49Å; L751-K808 HydrophobicContact CD1-CB 4.34Å; L751-K808 HydrophobicContact CD1-CD 4.02Å; L751-C810 HydrophobicContact CD2-CB 4.09Å
752	K	83.1	Confident	90.9	Very high	112 Å²	112	35.7 Å²	35.7	49%	0.487	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	153.3	172.3	-81.7	-166	169.4	-163.7	0	112	T811	K752-T811 HydrophobicContact CG-CG2 3.92Å
753	P	78.8	Confident	90.8	Very high	127 Å²	127	35.6 Å²	35.6	83%	0.825	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	cis	-86.4	-12.8	5.2	34	-36.7	0	0	0	115.2
754	R	80.5	Confident	90.8	Very high	149 Å²	149	35.6 Å²	35.6	56%	0.562	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-50	-178.2	-69.9	-176.3	-179	169	0.9	112.3	N748	N748-R754 WeakPolarHBondContact OD1-CD 3.38Å; N748-R754 PolarHBondContact OD1-NH1 3.46Å
755	G	83	Confident	90.8	Very high	3 Å²	3	33.5 Å²	33.5	3%	0.031	16%	0.157	C	C	.	.			trans	-62.2	139.2	-173.8	0	0	0	0	0	113.5	N748 V749 L751 T811	N748-G755 WeakPolarHBondContact O-CA 3.35Å; V749-G755 CarbonylContact O-C 3.5Å; V749-G755 WeakPolarHBondContact O-CA 3.47Å; L751-G755 WeakPolarHBondContact O-CA 3.28Å; L751-G755 PolarHBondContact O-N 2.99Å; G755-T811 WeakPolarHBondContact O-CG2 3.39Å
756	R	91	Very high	90.6	Very high	140 Å²	140	36.4 Å²	36.4	53%	0.528	18%	0.177	S	C	.	.			trans	-129.3	-2.7	177.3	-62.5	-175.5	179.5	-160.6	-0.9	112.7	L724 Y725 V749 V758	L724-R756 CarbonylContact O-C 3.6Å; Y725-R756 HydrophobicContact CE1-CB 4.42Å; V749-R756 PolarHBondContact O-N 3.32Å; V749-R756 VanDerWaalsContact O-N 3.13Å; R756-V758 PolarHBondContact O-N 3.09Å
757	L	94.4	Very high	90.6	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.182	C	C	.	.			trans	-65.3	129.1	-168.8	-158.8	75.3	0	0	0	111	L724 L727 V749 C759 L760 T811 L812	L724-L757 HydrophobicContact CB-CD1 3.84Å; L724-L757 WeakPolarHBondContact O-CA 3.28Å; L724-L757 PolarHBondContact O-N 3.17Å; L727-L757 HydrophobicContact CB-CD1 3.74Å; L727-L757 HydrophobicContact CB-CD2 4.02Å; V749-L757 HydrophobicContact CB-CB 4.11Å; V749-L757 HydrophobicContact CB-CD2 4.17Å; V749-L757 HydrophobicContact CG2-CB 4.28Å; V749-L757 HydrophobicContact CG2-CD2 3.63Å; V749-L757 WeakPolarHBondContact O-CB 3.05Å; V749-L757 PolarHBondContact O-N 2.69Å; L757-C759 WeakPolarHBondContact CG-O 3.48Å; L757-L760 HydrophobicContact CD2-CB 3.76Å; L757-L760 HydrophobicContact CD2-CD1 3.89Å; L757-L760 HydrophobicContact CD2-CG 4.32Å; L757-T811 PolarHBondContact N-OG1 3.21Å; L757-T811 CarbonylContact O-C 3.54Å; L757-T811 VanDerWaalsContact O-CB 3.26Å; L757-T811 WeakPolarHBondContact O-CB 3.43Å; L757-T811 PolarHBondContact O-OG1 2.86Å; L757-L812 HydrophobicContact CB-CD2 4.3Å; L757-L812 HydrophobicContact CD2-CD2 4.12Å; L757-L812 HydrophobicContact CG-CD2 4.23Å; L757-L812 PolarHBondContact O-N 2.73Å
758	V	94.6	Very high	90.7	Very high	25 Å²	25	37.7 Å²	37.7	15%	0.152	19%	0.19	C	C	.	.	S	Bend	trans	-104.5	-34.3	-178.6	173.8	0	0	0	0	110.7	Y725 R756 R813 V814	Y725-V758 HydrophobicContact CD1-CG2 4.06Å; Y725-V758 WeakPolarHBondContact O-CA 3.14Å; Y725-V758 WeakPolarHBondContact O-CB 3.1Å; Y725-V758 PolarHBondContact O-N 2.94Å; R756-V758 PolarHBondContact O-N 3.09Å; V758-R813 HydrophobicContact CG1-CB 3.89Å; V758-R813 HydrophobicContact CG1-CG 3.89Å; V758-R813 PolarHBondContact O-N 3.2Å; V758-V814 PolarHBondContact O-N 3.07Å
759	C	95.6	Very high	90.7	Very high	2 Å²	2	38.7 Å²	38.7	1%	0.014	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	127.6	173.2	-170.3	0	0	0	0	111.4	L7 Y725 E726 L727 L757 V814	L7-C759 HydrophobicContact CD1-CB 4.26Å; Y725-C759 PolarHBondContact O-N 3.06Å; E726-C759 HydrophobicContact CB-CB 4.49Å; E726-C759 HydrophobicContact CG-CB 4Å; L727-C759 PolarHBondContact N-O 2.86Å; L757-C759 WeakPolarHBondContact CG-O 3.48Å; C759-V814 WeakPolarHBondContact CA-O 3.42Å; C759-V814 HydrophobicContact CB-CB 4.08Å
760	L	96.7	Very high	90.7	Very high	3 Å²	3	41.9 Å²	41.9	2%	0.016	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	130.5	169.5	179.9	62.4	0	0	0	109.7	L727 L757 I762 M779 L812 V814 L815 C816	L727-L760 HydrophobicContact CB-CD1 4.41Å; L727-L760 HydrophobicContact CD2-CD1 4.25Å; L727-L760 HydrophobicContact CG-CD1 4.37Å; L757-L760 HydrophobicContact CD2-CB 3.76Å; L757-L760 HydrophobicContact CD2-CD1 3.89Å; L757-L760 HydrophobicContact CD2-CG 4.32Å; L760-I762 HydrophobicContact CD1-CG2 4.09Å; L760-I762 HydrophobicContact CD2-CG2 4.44Å; L760-I762 HydrophobicContact CG-CG2 4.19Å; L760-M779 HydrophobicContact CD2-CE 3.8Å; L760-L812 HydrophobicContact CB-CD1 4.37Å; L760-L812 HydrophobicContact CB-CD2 3.76Å; L760-V814 PolarHBondContact N-O 2.92Å; L760-L815 HydrophobicContact CB-CD1 4.14Å; L760-L815 HydrophobicContact CD2-CD1 4.28Å; L760-L815 HydrophobicContact CG-CD1 4.36Å; L760-L815 WeakPolarHBondContact O-CA 3.27Å; L760-C816 PolarHBondContact O-N 2.71Å
761	S	96.6	Very high	90.7	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	118.5	167	-177.2	0	0	0	0	111.2	L727 N728 L729 S730 C816	L727-S761 PolarHBondContact O-N 2.92Å; N728-S761 WeakPolarHBondContact OD1-CB 3.42Å; N728-S761 PolarHBondContact OD1-OG 3.22Å; L729-S761 PolarHBondContact N-O 3.08Å; S730-S761 WeakPolarHBondContact CB-OG 3.31Å; S730-S761 PolarHBondContact N-O 3.48Å; S761-C816 WeakPolarHBondContact OG-CB 3.42Å
762	I	95.9	Very high	90.9	Very high	11 Å²	11	44.5 Å²	44.5	6%	0.056	22%	0.222	C	C	.	.			trans	-125.4	26.5	170.8	58.1	173.7	0	0	0	110.2	L734 L760 T765 L767 L772 C816 I817	L734-I762 HydrophobicContact CD1-CB 4.33Å; L734-I762 HydrophobicContact CD1-CG2 4.02Å; L760-I762 HydrophobicContact CD1-CG2 4.09Å; L760-I762 HydrophobicContact CD2-CG2 4.44Å; L760-I762 HydrophobicContact CG-CG2 4.19Å; I762-T765 VanDerWaalsContact C-CG2 3.46Å; I762-T765 HydrophobicContact CB-CG2 4.14Å; I762-T765 WeakPolarHBondContact O-CB 3.42Å; I762-T765 WeakPolarHBondContact O-CG2 3.41Å; I762-T765 PolarHBondContact O-OG1 3.28Å; I762-L767 HydrophobicContact CD1-CD1 4.31Å; I762-L772 HydrophobicContact CD1-CD1 4.13Å; I762-C816 CarbonylContact C-O 3.59Å; I762-C816 PolarHBondContact N-O 2.82Å; I762-I817 HydrophobicContact CD1-CG2 4.19Å; I762-I817 HydrophobicContact CG1-CG2 3.87Å
763	A	92.7	Very high	91.3	Very high	2 Å²	2	39.1 Å²	39.1	2%	0.017	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	144.4	176.4	0	0	0	0	0	111.7	S730 R731 T765 C816 Q818	S730-A763 CarbonylContact C-O 3.59Å; S730-A763 WeakPolarHBondContact CA-O 3.45Å; S730-A763 WeakPolarHBondContact CB-O 3.26Å; R731-A763 PolarHBondContact N-O 3.2Å; A763-T765 VanDerWaalsContact C-N 3.25Å; A763-T765 PolarHBondContact O-N 2.93Å; A763-C816 HydrophobicContact CB-CB 4.39Å; A763-C816 PolarHBondContact N-O 3.27Å; A763-C816 VanDerWaalsContact N-O 3.17Å; A763-Q818 CarbonylContact C-O 3.59Å; A763-Q818 WeakPolarHBondContact CA-O 3.4Å; A763-Q818 HydrophobicContact CB-CB 4.27Å; A763-Q818 VanDerWaalsContact CB-OE1 3.27Å
764	Y	92.7	Very high	92	Very high	41 Å²	41	34.7 Å²	34.7	16%	0.161	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	33.6	175.7	-51.5	-68.1	0	0	0	113.8	R731 Q818 F820 P848	R731-Y764 WeakPolarHBondContact CA-O 3.46Å; Y764-Q818 HydrophobicContact CE1-CB 4.11Å; Y764-Q818 HydrophobicContact CE2-CB 4.16Å; Y764-Q818 PolarHBondContact N-O 3.09Å; Y764-F820 AromaticContact CD1-CD1 3.81Å; Y764-F820 HydrophobicContact CD1-CD1 3.81Å; Y764-F820 AromaticContact CD1-CE1 3.96Å; Y764-F820 HydrophobicContact CD1-CE1 3.96Å; Y764-F820 HydrophobicContact CD1-CG 4.13Å; Y764-F820 HydrophobicContact CD1-CZ 4.41Å; Y764-F820 HydrophobicContact CG-CE1 4.31Å; Y764-F820 HydrophobicContact CG-CZ 4.44Å; Y764-F820 WeakPolarHBondContact O-CE2 3.48Å; Y764-P848 HydrophobicContact CE1-CB 4.18Å
765	T	91.9	Very high	92.6	Very high	7 Å²	7	28 Å²	28	4%	0.043	14%	0.143	C	C	.	.	S	Bend	trans	-95.8	11.6	-173.7	52.5	0	0	0	0	115.3	N732 L734 I762 A763 L767	N732-T765 CarbonylContact O-C 3.3Å; N732-T765 WeakPolarHBondContact O-CA 3.5Å; N732-T765 VanDerWaalsContact O-CB 3.24Å; N732-T765 WeakPolarHBondContact O-CB 3.48Å; N732-T765 WeakPolarHBondContact O-CG2 3.17Å; L734-T765 HydrophobicContact CD1-CG2 3.67Å; L734-T765 HydrophobicContact CG-CG2 3.87Å; L734-T765 PolarHBondContact N-O 2.93Å; I762-T765 VanDerWaalsContact C-CG2 3.46Å; I762-T765 HydrophobicContact CB-CG2 4.14Å; I762-T765 WeakPolarHBondContact O-CB 3.42Å; I762-T765 WeakPolarHBondContact O-CG2 3.41Å; I762-T765 PolarHBondContact O-OG1 3.28Å; A763-T765 VanDerWaalsContact C-N 3.25Å; A763-T765 PolarHBondContact O-N 2.93Å; T765-L767 PolarHBondContact O-N 3.27Å
766	C	91.6	Very high	93.1	Very high	69 Å²	69	27.9 Å²	27.9	47%	0.466	14%	0.142	S	C	.	.			trans	58.3	7.8	-175.8	-57.7	0	0	0	0	116.1	N733 S735	N733-C766 WeakPolarHBondContact OD1-CB 3.36Å; S735-C766 VanDerWaalsContact CB-O 3.27Å; S735-C766 WeakPolarHBondContact CB-O 3.21Å
767	L	92.2	Very high	93.1	Very high	25 Å²	25	21.3 Å²	21.3	13%	0.131	12%	0.117	C	C	.	.			trans	-58.6	137.9	169.1	-67.7	172.8	0	0	0	110.2	L734 L742 I762 T765 L775	L734-L767 HydrophobicContact CB-CD1 4.27Å; L734-L767 HydrophobicContact CB-CD2 3.9Å; L734-L767 HydrophobicContact CB-CG 3.96Å; L734-L767 HydrophobicContact CD1-CD1 4.39Å; L742-L767 HydrophobicContact CD1-CD2 3.8Å; I762-L767 HydrophobicContact CD1-CD1 4.31Å; T765-L767 PolarHBondContact O-N 3.27Å; L767-L775 HydrophobicContact CD1-CD1 4.06Å
768	S	91.3	Very high	93	Very high	62 Å²	62	21.5 Å²	21.5	43%	0.434	12%	0.119	S	C	.	.			trans	-68.4	151.8	170	60.1	0	0	0	0	110.3	E770 R771 L772	S768-E770 PolarHBondContact O-N 3.01Å; S768-R771 PolarHBondContact O-N 3.43Å; S768-L772 PolarHBondContact O-N 2.89Å
769	T	90	Very high	92.8	Very high	28 Å²	28	20.7 Å²	20.7	17%	0.172	11%	0.113	C	C	.	.	H	α-helix	trans	-59.2	-30.9	-179.4	-35.7	0	0	0	0	112.5	L772 I773 P823 Q827 I831	T769-L772 PolarHBondContact O-N 3.33Å; T769-I773 HydrophobicContact CG2-CD1 4.23Å; T769-I773 WeakPolarHBondContact O-CB 3.19Å; T769-I773 WeakPolarHBondContact O-CD1 3.49Å; T769-I773 WeakPolarHBondContact O-CG1 3.47Å; T769-I773 PolarHBondContact O-N 3.34Å; T769-P823 HydrophobicContact CG2-CB 4.09Å; T769-P823 HydrophobicContact CG2-CG 4.45Å; T769-Q827 HydrophobicContact CG2-CB 3.8Å; T769-Q827 HydrophobicContact CG2-CG 3.93Å; T769-Q827 PolarHBondContact OG1-OE1 3.32Å; T769-I831 HydrophobicContact CG2-CD1 3.98Å
770	E	91	Very high	92.5	Very high	70 Å²	70	21.1 Å²	21.1	33%	0.327	12%	0.117	S	C	.	.	H	α-helix	trans	-66.1	-55.2	175.6	-52.2	-51.4	126.6	0	0	111	S768 L772 I773 D774 Q827 R830	S768-E770 PolarHBondContact O-N 3.01Å; E770-L772 PolarHBondContact O-N 3.06Å; E770-L772 VanDerWaalsContact O-N 3.08Å; E770-I773 CarbonylContact O-C 3.53Å; E770-I773 WeakPolarHBondContact O-CA 3.31Å; E770-I773 VanDerWaalsContact O-CB 3.31Å; E770-I773 WeakPolarHBondContact O-CB 3.46Å; E770-I773 PolarHBondContact O-N 3.11Å; E770-D774 VanDerWaalsContact C-OD2 3.3Å; E770-D774 PolarHBondContact O-N 2.98Å; E770-Q827 PolarHBondContact OE1-NE2 3.48Å; E770-R830 VanDerWaalsContact CD-NH1 3.31Å; E770-R830 IonicContact OE1-NH1 2.72Å; E770-R830 PolarHBondContact OE1-NH1 2.83Å; E770-R830 VanDerWaalsContact OE1-NH1 3.1Å; E770-R830 IonicContact OE2-CZ 2.78Å; E770-R830 IonicContact OE2-NH1 3.17Å; E770-R830 PolarHBondContact OE2-NH1 3.14Å; E770-R830 IonicContact OE2-NH2 3.29Å; E770-R830 PolarHBondContact OE2-NH2 3.45Å
771	R	92.4	Very high	91.9	Very high	43 Å²	43	22.1 Å²	22.1	16%	0.162	13%	0.128	C	C	.	.	H	α-helix	trans	-58.5	-29.7	176.5	-66.3	-176.8	84.9	-153.5	0.5	112.8	S735 V737 E739 S768 D774 L775	S735-R771 PolarHBondContact O-NH1 3.27Å; V737-R771 PolarHBondContact O-NH1 2.85Å; V737-R771 PolarHBondContact O-NH2 3.41Å; E739-R771 VanDerWaalsContact CA-NH2 3.28Å; E739-R771 IonicContact OE2-CZ 3.81Å; E739-R771 IonicContact OE2-NE 3.27Å; E739-R771 PolarHBondContact OE2-NE 3.29Å; E739-R771 IonicContact OE2-NH2 3.18Å; S768-R771 PolarHBondContact O-N 3.43Å; R771-D774 WeakPolarHBondContact CA-OD2 3.39Å; R771-L775 WeakPolarHBondContact O-CD1 3.4Å; R771-L775 VanDerWaalsContact O-CG 3.27Å; R771-L775 WeakPolarHBondContact O-CG 3.42Å; R771-L775 PolarHBondContact O-N 2.82Å
772	L	92.8	Very high	91.3	Very high	15 Å²	15	23.2 Å²	23.2	8%	0.079	13%	0.133	C	C	.	.	H	α-helix	trans	-69.1	-42.8	171.1	176.3	62	0	0	0	112.3	I762 S768 T769 E770 D774 L775 L776 I817 I831	I762-L772 HydrophobicContact CD1-CD1 4.13Å; S768-L772 PolarHBondContact O-N 2.89Å; T769-L772 PolarHBondContact O-N 3.33Å; E770-L772 PolarHBondContact O-N 3.06Å; E770-L772 VanDerWaalsContact O-N 3.08Å; L772-D774 VanDerWaalsContact C-N 3.27Å; L772-D774 PolarHBondContact O-N 2.95Å; L772-L775 PolarHBondContact O-N 3.34Å; L772-L776 HydrophobicContact CD1-CD1 4.43Å; L772-L776 HydrophobicContact CG-CD1 4.28Å; L772-L776 WeakPolarHBondContact O-CB 3.49Å; L772-L776 VanDerWaalsContact O-CG 3.22Å; L772-L776 WeakPolarHBondContact O-CG 3.43Å; L772-L776 PolarHBondContact O-N 3.44Å; L772-I817 HydrophobicContact CD1-CB 4.03Å; L772-I817 HydrophobicContact CD1-CG2 3.82Å; L772-I817 HydrophobicContact CD2-CB 4.18Å; L772-I817 HydrophobicContact CD2-CD1 4.32Å; L772-I831 HydrophobicContact CD2-CD1 4.35Å
773	I	92.9	Very high	90.2	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-62.2	-35.2	172.7	-74.7	164.5	0	0	0	110.9	T769 E770 L776 S777 R830 I831 R834	T769-I773 HydrophobicContact CG2-CD1 4.23Å; T769-I773 WeakPolarHBondContact O-CB 3.19Å; T769-I773 WeakPolarHBondContact O-CD1 3.49Å; T769-I773 WeakPolarHBondContact O-CG1 3.47Å; T769-I773 PolarHBondContact O-N 3.34Å; E770-I773 CarbonylContact O-C 3.53Å; E770-I773 WeakPolarHBondContact O-CA 3.31Å; E770-I773 VanDerWaalsContact O-CB 3.31Å; E770-I773 WeakPolarHBondContact O-CB 3.46Å; E770-I773 PolarHBondContact O-N 3.11Å; I773-L776 PolarHBondContact O-N 3.14Å; I773-S777 PolarHBondContact O-N 2.89Å; I773-S777 PolarHBondContact O-OG 2.96Å; I773-R830 HydrophobicContact CD1-CB 3.84Å; I773-R830 HydrophobicContact CG1-CB 4.47Å; I773-I831 HydrophobicContact CD1-CG1 4.25Å; I773-I831 HydrophobicContact CG1-CG1 3.67Å; I773-R834 WeakPolarHBondContact O-CD 3.29Å
774	D	92.1	Very high	89	Confident	33 Å²	33	27.1 Å²	27.1	18%	0.176	16%	0.156	C	C	.	.	H	α-helix	trans	-70.9	-45.8	178.7	-55.5	-32.1	0	0	0	111.3	E770 R771 L772 L776 S777 L778 P784	E770-D774 VanDerWaalsContact C-OD2 3.3Å; E770-D774 PolarHBondContact O-N 2.98Å; R771-D774 WeakPolarHBondContact CA-OD2 3.39Å; L772-D774 VanDerWaalsContact C-N 3.27Å; L772-D774 PolarHBondContact O-N 2.95Å; D774-L776 VanDerWaalsContact C-N 3.3Å; D774-L776 PolarHBondContact O-N 3.08Å; D774-S777 VanDerWaalsContact O-CB 3.3Å; D774-S777 WeakPolarHBondContact O-CB 3.26Å; D774-S777 PolarHBondContact O-N 3.19Å; D774-S777 VanDerWaalsContact O-N 3.1Å; D774-L778 PolarHBondContact O-N 2.86Å; D774-P784 HydrophobicContact CB-CB 4.26Å
775	L	93.1	Very high	87.5	Confident	8 Å²	8	29.6 Å²	29.6	4%	0.042	18%	0.179	C	C	.	.	H	α-helix	trans	-59.4	-38.4	170.9	-72.6	165	0	0	0	112.4	L742 Y743 V746 L767 R771 L772 L778 M779	L742-L775 HydrophobicContact CB-CD1 4.48Å; L742-L775 HydrophobicContact CB-CD2 3.89Å; L742-L775 HydrophobicContact CD1-CD1 4.45Å; Y743-L775 HydrophobicContact CD1-CD2 3.75Å; Y743-L775 HydrophobicContact CE1-CD2 4.07Å; Y743-L775 HydrophobicContact CE1-CG 4.44Å; V746-L775 HydrophobicContact CG2-CD2 3.79Å; L767-L775 HydrophobicContact CD1-CD1 4.06Å; R771-L775 WeakPolarHBondContact O-CD1 3.4Å; R771-L775 VanDerWaalsContact O-CG 3.27Å; R771-L775 WeakPolarHBondContact O-CG 3.42Å; R771-L775 PolarHBondContact O-N 2.82Å; L772-L775 PolarHBondContact O-N 3.34Å; L775-L778 WeakPolarHBondContact O-CB 3.36Å; L775-L778 PolarHBondContact O-N 2.84Å; L775-M779 WeakPolarHBondContact O-CG 3.43Å; L775-M779 PolarHBondContact O-N 2.76Å
776	L	93.8	Very high	85.7	Confident	2 Å²	2	33.4 Å²	33.4	1%	0.01	20%	0.196	C	C	.	.	H	α-helix	trans	-69.5	-34.1	174.1	-74	170.2	0	0	0	112.6	L772 I773 D774 M779 A780 L815 I817 I831 R834 I835	L772-L776 HydrophobicContact CD1-CD1 4.43Å; L772-L776 HydrophobicContact CG-CD1 4.28Å; L772-L776 WeakPolarHBondContact O-CB 3.49Å; L772-L776 VanDerWaalsContact O-CG 3.22Å; L772-L776 WeakPolarHBondContact O-CG 3.43Å; L772-L776 PolarHBondContact O-N 3.44Å; I773-L776 PolarHBondContact O-N 3.14Å; D774-L776 VanDerWaalsContact C-N 3.3Å; D774-L776 PolarHBondContact O-N 3.08Å; L776-M779 HydrophobicContact CD2-SD 4.39Å; L776-M779 PolarHBondContact O-N 2.79Å; L776-A780 VanDerWaalsContact O-CB 3.22Å; L776-A780 WeakPolarHBondContact O-CB 3.23Å; L776-A780 PolarHBondContact O-N 2.83Å; L776-L815 HydrophobicContact CD2-CD2 3.82Å; L776-I817 HydrophobicContact CD1-CD1 4.32Å; L776-I831 HydrophobicContact CD1-CB 4.24Å; L776-I831 HydrophobicContact CD1-CG1 4.02Å; L776-I831 HydrophobicContact CD1-CG2 3.77Å; L776-R834 HydrophobicContact CB-CB 4.1Å; L776-I835 HydrophobicContact CD2-CD1 3.73Å
777	S	91.8	Very high	83.7	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.007	21%	0.205	C	C	.	.	H	α-helix	trans	-61.2	-49	172.6	-55.2	0	0	0	0	109.9	I773 D774 M779 A780 G781 M782 R834	I773-S777 PolarHBondContact O-N 2.89Å; I773-S777 PolarHBondContact O-OG 2.96Å; D774-S777 VanDerWaalsContact O-CB 3.3Å; D774-S777 WeakPolarHBondContact O-CB 3.26Å; D774-S777 PolarHBondContact O-N 3.19Å; D774-S777 VanDerWaalsContact O-N 3.1Å; S777-M779 PolarHBondContact O-N 3.17Å; S777-A780 CarbonylContact O-C 3.47Å; S777-A780 PolarHBondContact O-N 3.12Å; S777-G781 PolarHBondContact O-N 2.9Å; S777-M782 CarbonylContact C-O 3.56Å; S777-M782 PolarHBondContact O-N 3.31Å; S777-R834 WeakPolarHBondContact OG-CD 3.37Å; S777-R834 PolarHBondContact OG-NE 3.08Å
778	L	90.6	Very high	81.7	Confident	5 Å²	5	37 Å²	37	3%	0.026	22%	0.218	C	C	.	.	H	α-helix	trans	-57.4	-43.9	175.7	-164.5	82	0	0	0	112.3	Y743 V746 Q747 D774 L775 A780 G781 P784 W805	Y743-L778 HydrophobicContact CD1-CD2 3.67Å; Y743-L778 HydrophobicContact CG-CD2 4.02Å; V746-L778 HydrophobicContact CB-CD2 3.87Å; V746-L778 HydrophobicContact CG1-CD2 3.83Å; V746-L778 HydrophobicContact CG1-CG 4.44Å; Q747-L778 HydrophobicContact CG-CD2 4.41Å; D774-L778 PolarHBondContact O-N 2.86Å; L775-L778 WeakPolarHBondContact O-CB 3.36Å; L775-L778 PolarHBondContact O-N 2.84Å; L778-A780 VanDerWaalsContact C-N 3.33Å; L778-A780 PolarHBondContact O-N 3.25Å; L778-G781 PolarHBondContact O-N 3.35Å; L778-P784 HydrophobicContact CD1-CG 4.23Å; L778-W805 HydrophobicContact CD1-CH2 3.45Å; L778-W805 VanDerWaalsContact CD1-CH2 3.45Å; L778-W805 HydrophobicContact CD1-CZ3 3.47Å; L778-W805 VanDerWaalsContact CD1-CZ3 3.47Å; L778-W805 HydrophobicContact CG-CZ3 4.25Å
779	M	91.7	Very high	79.6	Confident	7 Å²	7	39.9 Å²	39.9	3%	0.034	23%	0.229	C	C	.	.	H	α-helix	trans	-65.5	-33.8	175.1	-71	-179.9	-164.8	0	0	113.2	V746 L760 L775 L776 S777 G781 L812 L838	V746-M779 HydrophobicContact CG1-CE 4.1Å; V746-M779 HydrophobicContact CG1-CG 3.54Å; V746-M779 HydrophobicContact CG2-CE 3.65Å; L760-M779 HydrophobicContact CD2-CE 3.8Å; L775-M779 WeakPolarHBondContact O-CG 3.43Å; L775-M779 PolarHBondContact O-N 2.76Å; L776-M779 HydrophobicContact CD2-SD 4.39Å; L776-M779 PolarHBondContact O-N 2.79Å; S777-M779 PolarHBondContact O-N 3.17Å; M779-G781 VanDerWaalsContact C-N 3.29Å; M779-G781 PolarHBondContact O-N 2.62Å; M779-L812 HydrophobicContact CE-CD1 4.35Å; M779-L812 HydrophobicContact SD-CD1 3.76Å; M779-L838 HydrophobicContact CB-CD2 4.01Å; M779-L838 WeakPolarHBondContact O-CD2 3.42Å
780	A	89.1	Confident	77.4	Confident	11 Å²	11	46 Å²	46	9%	0.091	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-1.7	-179.1	0	0	0	0	0	113.9	L776 S777 L778 M782 R834 R837 L838	L776-A780 VanDerWaalsContact O-CB 3.22Å; L776-A780 WeakPolarHBondContact O-CB 3.23Å; L776-A780 PolarHBondContact O-N 2.83Å; S777-A780 CarbonylContact O-C 3.47Å; S777-A780 PolarHBondContact O-N 3.12Å; L778-A780 VanDerWaalsContact C-N 3.33Å; L778-A780 PolarHBondContact O-N 3.25Å; A780-M782 HydrophobicContact CB-CG 4.21Å; A780-M782 HydrophobicContact CB-SD 4.26Å; A780-R834 HydrophobicContact CB-CB 4.41Å; A780-R837 HydrophobicContact CB-CB 3.99Å; A780-R837 VanDerWaalsContact O-CZ 3.31Å; A780-R837 PolarHBondContact O-NE 2.83Å; A780-R837 PolarHBondContact O-NH2 3.28Å; A780-L838 HydrophobicContact CB-CD2 4.37Å
781	G	84.2	Confident	75	Confident	25 Å²	25	49.6 Å²	49.6	26%	0.258	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.7	37	-172.5	0	0	0	0	0	112.5	S777 L778 M779 R837	S777-G781 PolarHBondContact O-N 2.9Å; L778-G781 PolarHBondContact O-N 3.35Å; M779-G781 VanDerWaalsContact C-N 3.29Å; M779-G781 PolarHBondContact O-N 2.62Å; G781-R837 PolarHBondContact O-NH2 3.31Å
782	M	83.3	Confident	72.6	Confident	22 Å²	22	51.9 Å²	51.9	11%	0.108	29%	0.292	C	S	.	.			trans	-109.4	149.8	172.2	-64.3	176.1	61	0	0	109.3	S777 A780 P784 Y833 R834	S777-M782 CarbonylContact C-O 3.56Å; S777-M782 PolarHBondContact O-N 3.31Å; A780-M782 HydrophobicContact CB-CG 4.21Å; A780-M782 HydrophobicContact CB-SD 4.26Å; M782-P784 WeakPolarHBondContact O-CD 3.31Å; M782-Y833 HydrophobicContact CE-CE1 4.02Å; M782-Y833 HydrophobicContact SD-CE1 4.45Å; M782-R834 HydrophobicContact SD-CG 3.9Å
783	D	73.6	Confident	70.4	Confident	65 Å²	65	58.4 Å²	58.4	35%	0.348	32%	0.322	S	S	.	.			trans	-71.5	125.2	172.5	-159.7	-56.1	0	0	0	109.9	S785 H786	D783-S785 PolarHBondContact O-N 3.49Å; D783-S785 WeakPolarHBondContact OD1-CB 3.47Å; D783-S785 PolarHBondContact OD1-N 2.65Å; D783-S785 PolarHBondContact OD1-OG 2.87Å; D783-H786 PolarHBondContact O-N 3.25Å
784	P	67.7	Low	67.8	Low	31 Å²	31	66.8 Å²	66.8	20%	0.201	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-27.1	176.3	-23.6	35	0	0	0	113.5	D774 L778 M782 H786	D774-P784 HydrophobicContact CB-CB 4.26Å; L778-P784 HydrophobicContact CD1-CG 4.23Å; M782-P784 WeakPolarHBondContact O-CD 3.31Å; P784-H786 PolarHBondContact O-N 2.92Å
785	S	60.3	Low	65.3	Low	93 Å²	93	72.9 Å²	72.9	65%	0.65	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-13.7	-178.5	66.6	0	0	0	0	114.1	D783 S787	D783-S785 PolarHBondContact O-N 3.49Å; D783-S785 WeakPolarHBondContact OD1-CB 3.47Å; D783-S785 PolarHBondContact OD1-N 2.65Å; D783-S785 PolarHBondContact OD1-OG 2.87Å; S785-S787 PolarHBondContact O-N 2.69Å
786	H	54.8	Low	62.4	Low	86 Å²	86	78.5 Å²	78.5	40%	0.398	42%	0.419	S	S	.	.			trans	-78.5	88.6	174.6	-97.1	-77.9	0	0	0	111.8	D783 P784 L788 Y801	D783-H786 PolarHBondContact O-N 3.25Å; P784-H786 PolarHBondContact O-N 2.92Å; H786-L788 PolarHBondContact O-N 2.64Å; H786-Y801 AromaticContact CD2-CE1 3.84Å; H786-Y801 PolarHBondContact CE1-OH 2.84Å; H786-Y801 AromaticContact NE2-CE1 3.51Å; H786-Y801 AromaticContact NE2-CZ 3.76Å; H786-Y801 PolarHBondContact NE2-OH 2.89Å; H786-Y801 VanDerWaalsContact NE2-OH 3.08Å
787	S	48.7	Very low	59.8	Low	94 Å²	94	85.6 Å²	85.6	66%	0.657	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-54.7	118.6	151	51.8	0	0	0	0	108.8	S785 N789	S785-S787 PolarHBondContact O-N 2.69Å; S787-N789 PolarHBondContact O-N 3.09Å
788	L	51.6	Low	57.1	Low	76 Å²	76	91.4 Å²	91.4	40%	0.398	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-73.8	118.8	171.5	-71.7	166.8	0	0	0	107.4	H786 Y833	H786-L788 PolarHBondContact O-N 2.64Å; L788-Y833 HydrophobicContact CD1-CD1 4.03Å; L788-Y833 HydrophobicContact CD1-CE1 4.01Å
789	N	45.6	Very low	54.6	Low	123 Å²	123	97.3 Å²	97.3	66%	0.658	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-61.5	137.6	166.8	-74.4	-26.6	0	0	0	109	S787 N791	S787-N789 PolarHBondContact O-N 3.09Å; N789-N791 PolarHBondContact O-N 3.25Å
790	E	44.4	Very low	52	Low	155 Å²	155	106 Å²	106	72%	0.724	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	6.3	-159.9	-58.2	-173.3	121.1	0	0	115.2	L826	E790-L826 WeakPolarHBondContact OE1-CD2 3.32Å
791	N	40.4	Very low	49.6	Very low	147 Å²	147	113 Å²	113	79%	0.786	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.4	-17	-172.5	-63.3	-64.9	0	0	0	114.8	N789 E793	N789-N791 PolarHBondContact O-N 3.25Å; N791-E793 VanDerWaalsContact C-N 3.34Å; N791-E793 PolarHBondContact O-N 3.01Å
792	D	42.7	Very low	47.4	Very low	90 Å²	90	116 Å²	116	48%	0.481	60%	0.602	S	S	.	*			trans	-89.9	58.7	-169.3	-62.5	-63.4	0	0	0	113.2	Q794 E795	D792-Q794 PolarHBondContact O-N 3.33Å; D792-Q794 VanDerWaalsContact O-N 3.17Å; D792-E795 HydrophobicContact CB-CB 4.45Å; D792-E795 HydrophobicContact CB-CG 4.2Å
793	E	45.3	Very low	45.4	Very low	153 Å²	153	121.9 Å²	121.9	72%	0.715	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	-0.2	166.2	-75.6	-141.6	107.5	0	0	113.2	N791 R879	N791-E793 VanDerWaalsContact C-N 3.34Å; N791-E793 PolarHBondContact O-N 3.01Å; E793-R879 IonicContact OE1-NH2 3.53Å; E793-R879 PolarHBondContact OE1-NH2 2.99Å
794	Q	39.6	Very low	44.3	Very low	176 Å²	176	127.3 Å²	127.3	82%	0.822	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.4	7.9	-170.2	-160.5	53.9	80.9	0	0	114.3	D792	D792-Q794 PolarHBondContact O-N 3.33Å; D792-Q794 VanDerWaalsContact O-N 3.17Å
795	E	38.6	Very low	43.4	Very low	161 Å²	161	128.7 Å²	128.7	75%	0.752	66%	0.656	S	S	*	*			trans	-66.6	145.4	179.9	-103.8	-162.4	155.1	0	0	113.8	D792	D792-E795 HydrophobicContact CB-CB 4.45Å; D792-E795 HydrophobicContact CB-CG 4.2Å
796	N	33.8	Very low	42.7	Very low	126 Å²	126	131.9 Å²	131.9	67%	0.674	66%	0.662	S	S	*	*			trans	-80.8	165.3	-160.1	-165.3	28.7	0	0	0	113.7	D798	N796-D798 PolarHBondContact ND2-OD2 3.36Å; N796-D798 PolarHBondContact O-N 3.25Å
797	I	37.3	Very low	42.5	Very low	151 Å²	151	134.7 Å²	134.7	77%	0.774	68%	0.68	S	S	*	*			trans	-79.2	68.5	172.7	-50.2	176.8	0	0	0	109.7	T799	I797-T799 HydrophobicContact CG2-CG2 4.37Å
798	D	35.8	Very low	43.3	Very low	122 Å²	122	133.2 Å²	133.2	65%	0.652	66%	0.662	S	S	*	*			trans	-104.2	96.4	173.5	-88	-65.2	0	0	0	110.9	N796 Q800	N796-D798 PolarHBondContact ND2-OD2 3.36Å; N796-D798 PolarHBondContact O-N 3.25Å; D798-Q800 PolarHBondContact O-N 2.95Å
799	T	38.3	Very low	44.7	Very low	129 Å²	129	131.7 Å²	131.7	79%	0.791	66%	0.66	S	S	*	*			trans	-78.9	88.4	-171.9	51.3	0	0	0	0	112.5	I797	I797-T799 HydrophobicContact CG2-CG2 4.37Å
800	Q	37.1	Very low	46.8	Very low	189 Å²	189	126.6 Å²	126.6	88%	0.883	63%	0.634	S	S	*	*			trans	-132.8	11.5	167	-136.6	174.2	82.4	0	0	115.4	D798	D798-Q800 PolarHBondContact O-N 2.95Å
801	Y	38.9	Very low	49.1	Very low	159 Å²	159	119.9 Å²	119.9	62%	0.624	60%	0.604	S	S	*	*	S	Bend	trans	-69.6	140.9	171.9	-82	-82.3	0	0	0	112.5	H786	H786-Y801 AromaticContact CD2-CE1 3.84Å; H786-Y801 PolarHBondContact CE1-OH 2.84Å; H786-Y801 AromaticContact NE2-CE1 3.51Å; H786-Y801 AromaticContact NE2-CZ 3.76Å; H786-Y801 PolarHBondContact NE2-OH 2.89Å; H786-Y801 VanDerWaalsContact NE2-OH 3.08Å
802	T	38.1	Very low	51.7	Low	89 Å²	89	113 Å²	113	55%	0.546	57%	0.567	S	S	.	*			trans	-64.8	132.9	-158	67.3	0	0	0	0	115.5	K804	T802-K804 PolarHBondContact O-N 3.35Å
803	N	41.2	Very low	54.1	Low	144 Å²	144	114.5 Å²	114.5	77%	0.77	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.5	0.2	-178.6	-69.1	-18.7	0	0	0	116.2
804	K	49.5	Very low	56.5	Low	180 Å²	180	107.8 Å²	107.8	78%	0.783	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-17	179.6	-81.3	-177.3	174.6	176.8	0	114.6	T802	T802-K804 PolarHBondContact O-N 3.35Å
805	W	49.9	Very low	59.2	Low	60 Å²	60	99.5 Å²	99.5	23%	0.227	50%	0.496	C	S	.	.	S	Bend	trans	-108.5	-27.3	-170.2	-64.9	92.6	0	0	0	114.5	L778 D807 K808	L778-W805 HydrophobicContact CD1-CH2 3.45Å; L778-W805 VanDerWaalsContact CD1-CH2 3.45Å; L778-W805 HydrophobicContact CD1-CZ3 3.47Å; L778-W805 VanDerWaalsContact CD1-CZ3 3.47Å; L778-W805 HydrophobicContact CG-CZ3 4.25Å; W805-D807 VanDerWaalsContact C-N 3.32Å; W805-D807 PolarHBondContact O-N 2.76Å; W805-K808 PolarHBondContact O-N 2.73Å; W805-K808 VanDerWaalsContact O-N 3.14Å
806	M	44.8	Very low	61.9	Low	160 Å²	160	92 Å²	92	79%	0.788	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-29.7	-171.6	-66.7	-158.2	71.3	0	0	114.4	K808	M806-K808 VanDerWaalsContact C-N 3.28Å; M806-K808 PolarHBondContact O-N 3.32Å
807	D	52	Low	64.8	Low	144 Å²	144	86.2 Å²	86.2	77%	0.77	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-19.8	177.6	-68.8	-23.1	0	0	0	113.6	W805 A809	W805-D807 VanDerWaalsContact C-N 3.32Å; W805-D807 PolarHBondContact O-N 2.76Å; D807-A809 VanDerWaalsContact C-N 3.26Å; D807-A809 PolarHBondContact O-N 2.68Å
808	K	65.3	Low	67.4	Low	63 Å²	63	79.6 Å²	79.6	27%	0.274	40%	0.396	S	S	.	.			trans	-82.2	62.7	-174.6	-69.5	-168.5	179.5	174.6	0	112.4	L751 W805 M806 C810	L751-K808 HydrophobicContact CB-CB 4.33Å; L751-K808 HydrophobicContact CB-CD 4.49Å; L751-K808 HydrophobicContact CD1-CB 4.34Å; L751-K808 HydrophobicContact CD1-CD 4.02Å; W805-K808 PolarHBondContact O-N 2.73Å; W805-K808 VanDerWaalsContact O-N 3.14Å; M806-K808 VanDerWaalsContact C-N 3.28Å; M806-K808 PolarHBondContact O-N 3.32Å; K808-C810 PolarHBondContact O-N 3.25Å; K808-C810 VanDerWaalsContact O-N 3.15Å
809	A	80.6	Confident	69.9	Low	44 Å²	44	74.9 Å²	74.9	36%	0.364	37%	0.373	S	S	.	.			trans	-61.3	117.4	178.1	0	0	0	0	0	112.4	D807	D807-A809 VanDerWaalsContact C-N 3.26Å; D807-A809 PolarHBondContact O-N 2.68Å
810	C	89.9	Confident	72	Confident	16 Å²	16	74.3 Å²	74.3	11%	0.108	36%	0.36	C	S	.	.	B	Isolated β-bridge	trans	-57.2	146.7	177.7	-172.8	0	0	0	0	112.8	C750 L751 K808 L838 K840	C750-C810 CarbonylContact O-C 3.54Å; C750-C810 VanDerWaalsContact O-CA 3.3Å; C750-C810 WeakPolarHBondContact O-CA 3.43Å; L751-C810 HydrophobicContact CD2-CB 4.09Å; K808-C810 PolarHBondContact O-N 3.25Å; K808-C810 VanDerWaalsContact O-N 3.15Å; C810-L838 HydrophobicContact CB-CD2 4.16Å; C810-K840 PolarHBondContact O-NZ 3.11Å
811	T	92.1	Very high	74.3	Confident	15 Å²	15	71.8 Å²	71.8	9%	0.092	35%	0.351	C	S	.	.			trans	-101	-16.1	-177.8	53.3	0	0	0	0	115.5	C750 K752 G755 L757	C750-T811 PolarHBondContact O-N 2.96Å; C750-T811 PolarHBondContact O-OG1 3.22Å; K752-T811 HydrophobicContact CG-CG2 3.92Å; G755-T811 WeakPolarHBondContact O-CG2 3.39Å; L757-T811 PolarHBondContact N-OG1 3.21Å; L757-T811 CarbonylContact O-C 3.54Å; L757-T811 VanDerWaalsContact O-CB 3.26Å; L757-T811 WeakPolarHBondContact O-CB 3.43Å; L757-T811 PolarHBondContact O-OG1 2.86Å
812	L	94.1	Very high	76.5	Confident	1 Å²	1	65.2 Å²	65.2	1%	0.005	33%	0.328	C	S	.	.			trans	-60.5	141.8	-173.1	-66.7	175.7	0	0	0	113.2	C750 L757 L760 M779 L815 K840 L841	C750-L812 HydrophobicContact CB-CD1 4.44Å; C750-L812 HydrophobicContact CB-CG 4.39Å; L757-L812 HydrophobicContact CB-CD2 4.3Å; L757-L812 HydrophobicContact CD2-CD2 4.12Å; L757-L812 HydrophobicContact CG-CD2 4.23Å; L757-L812 PolarHBondContact O-N 2.73Å; L760-L812 HydrophobicContact CB-CD1 4.37Å; L760-L812 HydrophobicContact CB-CD2 3.76Å; M779-L812 HydrophobicContact CE-CD1 4.35Å; M779-L812 HydrophobicContact SD-CD1 3.76Å; L812-L815 HydrophobicContact CD1-CD1 4.32Å; L812-K840 CarbonylContact O-C 3.51Å; L812-K840 WeakPolarHBondContact O-CB 3.38Å; L812-L841 HydrophobicContact CB-CD1 4.16Å; L812-L841 PolarHBondContact O-N 3.38Å
813	R	94.6	Very high	78.8	Confident	122 Å²	122	61.2 Å²	61.2	46%	0.46	30%	0.303	S	S	.	.	S	Bend	trans	-118.5	-30	170.7	-60.6	-170.7	-169.8	-158.2	2.8	113	V758 K840 Y842 K843	V758-R813 HydrophobicContact CG1-CB 3.89Å; V758-R813 HydrophobicContact CG1-CG 3.89Å; V758-R813 PolarHBondContact O-N 3.2Å; R813-K840 WeakPolarHBondContact CA-O 3.43Å; R813-Y842 HydrophobicContact CB-CD2 4.17Å; R813-Y842 HydrophobicContact CG-CD2 4.23Å; R813-Y842 HydrophobicContact CG-CE2 4.37Å; R813-Y842 PolarHBondContact O-N 2.96Å; R813-K843 PolarHBondContact O-N 2.96Å
814	V	94.9	Very high	81.1	Confident	13 Å²	13	57.1 Å²	57.1	8%	0.079	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	133.4	177.6	-174.1	0	0	0	0	108.2	V758 C759 L760 K843	V758-V814 PolarHBondContact O-N 3.07Å; C759-V814 WeakPolarHBondContact CA-O 3.42Å; C759-V814 HydrophobicContact CB-CB 4.08Å; L760-V814 PolarHBondContact N-O 2.92Å; V814-K843 WeakPolarHBondContact CA-O 3.5Å; V814-K843 HydrophobicContact CB-CB 4.45Å; V814-K843 HydrophobicContact CG1-CB 4.1Å; V814-K843 HydrophobicContact CG2-CB 4.2Å; V814-K843 HydrophobicContact CG2-CD 4.3Å
815	L	96	Very high	83	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.005	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	129.3	178	178.5	58.4	0	0	0	109.7	L760 L776 L812 I817 I835 L841 K843 L844 H845	L760-L815 HydrophobicContact CB-CD1 4.14Å; L760-L815 HydrophobicContact CD2-CD1 4.28Å; L760-L815 HydrophobicContact CG-CD1 4.36Å; L760-L815 WeakPolarHBondContact O-CA 3.27Å; L776-L815 HydrophobicContact CD2-CD2 3.82Å; L812-L815 HydrophobicContact CD1-CD1 4.32Å; L815-I817 HydrophobicContact CD1-CG2 3.66Å; L815-I817 HydrophobicContact CD2-CG2 4.17Å; L815-I817 HydrophobicContact CG-CG2 3.71Å; L815-I835 HydrophobicContact CD2-CD1 3.98Å; L815-L841 HydrophobicContact CB-CD1 3.67Å; L815-L841 HydrophobicContact CB-CD2 4.4Å; L815-K843 PolarHBondContact N-O 3.02Å; L815-K843 VanDerWaalsContact N-O 3.13Å; L815-L844 HydrophobicContact CB-CD1 4.12Å; L815-L844 HydrophobicContact CD2-CD1 4.23Å; L815-L844 HydrophobicContact CG-CD1 4.11Å; L815-L844 WeakPolarHBondContact O-CA 3.1Å; L815-H845 PolarHBondContact O-N 2.94Å
816	C	95.9	Very high	84.9	Confident	3 Å²	3	53 Å²	53	2%	0.02	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	114.4	177.8	-52.4	0	0	0	0	109.6	L760 S761 I762 A763 H845	L760-C816 PolarHBondContact O-N 2.71Å; S761-C816 WeakPolarHBondContact OG-CB 3.42Å; I762-C816 CarbonylContact C-O 3.59Å; I762-C816 PolarHBondContact N-O 2.82Å; A763-C816 HydrophobicContact CB-CB 4.39Å; A763-C816 PolarHBondContact N-O 3.27Å; A763-C816 VanDerWaalsContact N-O 3.17Å; C816-H845 HydrophobicContact CB-CB 4.19Å; C816-H845 PolarHBondContact SG-CD2 3.27Å
817	I	95.2	Very high	87.1	Confident	6 Å²	6	47.2 Å²	47.2	3%	0.031	25%	0.246	C	C	.	.			trans	-135.1	19	-170.2	58	169.3	0	0	0	112.7	I762 L772 L776 L815 S819 I831 L844 H845 I846	I762-I817 HydrophobicContact CD1-CG2 4.19Å; I762-I817 HydrophobicContact CG1-CG2 3.87Å; L772-I817 HydrophobicContact CD1-CB 4.03Å; L772-I817 HydrophobicContact CD1-CG2 3.82Å; L772-I817 HydrophobicContact CD2-CB 4.18Å; L772-I817 HydrophobicContact CD2-CD1 4.32Å; L776-I817 HydrophobicContact CD1-CD1 4.32Å; L815-I817 HydrophobicContact CD1-CG2 3.66Å; L815-I817 HydrophobicContact CD2-CG2 4.17Å; L815-I817 HydrophobicContact CG-CG2 3.71Å; I817-S819 PolarHBondContact O-N 3.17Å; I817-I831 HydrophobicContact CD1-CG2 4.08Å; I817-L844 HydrophobicContact CD1-CD1 3.83Å; I817-L844 HydrophobicContact CG1-CD1 3.87Å; I817-H845 WeakPolarHBondContact CG1-O 3.44Å; I817-H845 PolarHBondContact N-O 3.02Å; I817-I846 HydrophobicContact CD1-CD1 4.49Å; I817-I846 HydrophobicContact CD1-CG1 4.28Å; I817-I846 HydrophobicContact CG1-CB 4.41Å; I817-I846 HydrophobicContact CG1-CG1 4.36Å
818	Q	91.2	Very high	89.1	Confident	11 Å²	11	40.3 Å²	40.3	5%	0.051	21%	0.209	C	C	.	.			trans	-55.9	127.4	-178.3	-53.7	95	-66.5	0	0	111.2	A763 Y764 H845	A763-Q818 CarbonylContact C-O 3.59Å; A763-Q818 WeakPolarHBondContact CA-O 3.4Å; A763-Q818 HydrophobicContact CB-CB 4.27Å; A763-Q818 VanDerWaalsContact CB-OE1 3.27Å; Y764-Q818 HydrophobicContact CE1-CB 4.11Å; Y764-Q818 HydrophobicContact CE2-CB 4.16Å; Y764-Q818 PolarHBondContact N-O 3.09Å; Q818-H845 VanDerWaalsContact CD-CB 3.45Å; Q818-H845 HydrophobicContact CG-CB 4.21Å; Q818-H845 PolarHBondContact OE1-O 3.06Å
819	S	87.9	Confident	90.4	Very high	24 Å²	24	39.9 Å²	39.9	17%	0.168	21%	0.208	C	C	.	.			trans	-90.3	157.2	174.4	47.6	0	0	0	0	111.3	I817 I821 P823 P848	I817-S819 PolarHBondContact O-N 3.17Å; S819-I821 VanDerWaalsContact C-N 3.26Å; S819-I821 VanDerWaalsContact CB-O 3.3Å; S819-I821 WeakPolarHBondContact CB-O 3.25Å; S819-I821 PolarHBondContact O-N 3.23Å; S819-I821 PolarHBondContact OG-O 3Å; S819-P823 WeakPolarHBondContact OG-CD 3.44Å; S819-P848 WeakPolarHBondContact O-CB 3.4Å; S819-P848 WeakPolarHBondContact O-CG 3.27Å
820	F	82.8	Confident	91	Very high	116 Å²	116	40.4 Å²	40.4	51%	0.509	20%	0.2	S	C	.	.	S	Bend	trans	-63.9	-31.7	175.1	-73.9	-75.2	0	0	0	113	Y764	Y764-F820 AromaticContact CD1-CD1 3.81Å; Y764-F820 HydrophobicContact CD1-CD1 3.81Å; Y764-F820 AromaticContact CD1-CE1 3.96Å; Y764-F820 HydrophobicContact CD1-CE1 3.96Å; Y764-F820 HydrophobicContact CD1-CG 4.13Å; Y764-F820 HydrophobicContact CD1-CZ 4.41Å; Y764-F820 HydrophobicContact CG-CE1 4.31Å; Y764-F820 HydrophobicContact CG-CZ 4.44Å; Y764-F820 WeakPolarHBondContact O-CE2 3.48Å
821	I	84.8	Confident	91.2	Very high	137 Å²	137	39.7 Å²	39.7	70%	0.703	20%	0.195	S	C	*	.	S	Bend	trans	-111.7	130.6	175	-58.2	171.9	0	0	0	106.8	S819	S819-I821 VanDerWaalsContact C-N 3.26Å; S819-I821 VanDerWaalsContact CB-O 3.3Å; S819-I821 WeakPolarHBondContact CB-O 3.25Å; S819-I821 PolarHBondContact O-N 3.23Å; S819-I821 PolarHBondContact OG-O 3Å
822	P	85.6	Confident	91.3	Very high	20 Å²	20	39 Å²	39	13%	0.13	19%	0.191	C	C	.	.	P	Polyproline II helix	trans	-56.5	133.5	176.1	-24.1	33.2	0	0	0	111.5	P848 A852 F853	P822-P848 HydrophobicContact CG-CG 3.9Å; P822-A852 WeakPolarHBondContact CD-O 3.45Å; P822-A852 HydrophobicContact CG-CB 4.35Å; P822-A852 WeakPolarHBondContact CG-O 3.39Å; P822-F853 HydrophobicContact CB-CD1 4.32Å; P822-F853 HydrophobicContact CB-CE1 4.01Å; P822-F853 HydrophobicContact CB-CE2 4.46Å; P822-F853 HydrophobicContact CB-CZ 4.08Å; P822-F853 HydrophobicContact CG-CD1 4.02Å; P822-F853 HydrophobicContact CG-CD2 3.83Å; P822-F853 HydrophobicContact CG-CE1 4.06Å; P822-F853 HydrophobicContact CG-CE2 3.86Å; P822-F853 HydrophobicContact CG-CG 3.9Å; P822-F853 HydrophobicContact CG-CZ 3.98Å
823	P	87.3	Confident	91.2	Very high	5 Å²	5	42.3 Å²	42.3	3%	0.032	20%	0.204	C	C	.	.	P	Polyproline II helix	trans	-64.1	155.4	176.9	-20.3	33.5	0	0	0	112.1	T769 S819 Q827 I828	T769-P823 HydrophobicContact CG2-CB 4.09Å; T769-P823 HydrophobicContact CG2-CG 4.45Å; S819-P823 WeakPolarHBondContact OG-CD 3.44Å; P823-Q827 HydrophobicContact CB-CB 3.95Å; P823-I828 HydrophobicContact CB-CG1 4.05Å
824	S	89.7	Confident	91.2	Very high	59 Å²	59	36.8 Å²	36.8	41%	0.413	18%	0.183	S	C	.	.	P	Polyproline II helix	trans	-66	158.3	174.5	78.4	0	0	0	0	111.4	L826 Q827 I828	S824-L826 PolarHBondContact O-N 3.45Å; S824-Q827 CarbonylContact O-C 3.54Å; S824-Q827 WeakPolarHBondContact O-CA 3.48Å; S824-Q827 WeakPolarHBondContact O-CB 3.41Å; S824-Q827 PolarHBondContact O-N 3.21Å; S824-Q827 WeakPolarHBondContact OG-CG 3.3Å; S824-Q827 PolarHBondContact OG-N 2.83Å; S824-I828 WeakPolarHBondContact O-CG1 3.38Å; S824-I828 PolarHBondContact O-N 3.21Å
825	Q	88.1	Confident	91.1	Very high	62 Å²	62	36.1 Å²	36.1	29%	0.29	18%	0.179	S	C	.	.	H	α-helix	trans	-58.7	-34.5	-178.4	-172.6	52.7	78.7	0	0	112.9	I828 H829 H871	Q825-I828 PolarHBondContact O-N 2.68Å; Q825-H829 PolarHBondContact O-N 3.42Å; Q825-H829 PolarHBondContact O-ND1 2.95Å; Q825-H871 PolarHBondContact NE2-CD2 3.48Å; Q825-H871 VanDerWaalsContact NE2-CD2 3.32Å; Q825-H871 PolarHBondContact OE1-CD2 3.11Å
826	L	90.4	Very high	90.9	Very high	90 Å²	90	37.3 Å²	37.3	47%	0.471	19%	0.187	S	C	.	.	H	α-helix	trans	-66.2	-42.9	172.8	178.5	62.8	0	0	0	112.2	E790 S824 H829 R830	E790-L826 WeakPolarHBondContact OE1-CD2 3.32Å; S824-L826 PolarHBondContact O-N 3.45Å; L826-H829 PolarHBondContact O-N 3.45Å; L826-R830 WeakPolarHBondContact O-CG 3.35Å; L826-R830 PolarHBondContact O-N 2.92Å
827	Q	91.6	Very high	90.6	Very high	39 Å²	39	42.6 Å²	42.6	18%	0.182	21%	0.206	C	C	.	.	H	α-helix	trans	-65.7	-39	175.2	-75.8	173.9	-25.3	0	0	112	T769 E770 P823 S824 H829 R830 I831	T769-Q827 HydrophobicContact CG2-CB 3.8Å; T769-Q827 HydrophobicContact CG2-CG 3.93Å; T769-Q827 PolarHBondContact OG1-OE1 3.32Å; E770-Q827 PolarHBondContact OE1-NE2 3.48Å; P823-Q827 HydrophobicContact CB-CB 3.95Å; S824-Q827 CarbonylContact O-C 3.54Å; S824-Q827 WeakPolarHBondContact O-CA 3.48Å; S824-Q827 WeakPolarHBondContact O-CB 3.41Å; S824-Q827 PolarHBondContact O-N 3.21Å; S824-Q827 WeakPolarHBondContact OG-CG 3.3Å; S824-Q827 PolarHBondContact OG-N 2.83Å; Q827-H829 VanDerWaalsContact C-N 3.33Å; Q827-H829 PolarHBondContact O-N 3.02Å; Q827-R830 PolarHBondContact O-N 2.85Å; Q827-I831 WeakPolarHBondContact O-CB 3.42Å; Q827-I831 VanDerWaalsContact O-CG1 3.31Å; Q827-I831 WeakPolarHBondContact O-CG1 3.18Å; Q827-I831 PolarHBondContact O-N 3.23Å
828	I	92.6	Very high	90.4	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-58.4	-45.8	172.6	-66.4	169	0	0	0	109.9	P823 S824 Q825 I831 L832 F847 Q868 S872	P823-I828 HydrophobicContact CB-CG1 4.05Å; S824-I828 WeakPolarHBondContact O-CG1 3.38Å; S824-I828 PolarHBondContact O-N 3.21Å; Q825-I828 PolarHBondContact O-N 2.68Å; I828-I831 PolarHBondContact O-N 3.04Å; I828-L832 HydrophobicContact CG2-CD1 3.7Å; I828-L832 HydrophobicContact CG2-CG 4.14Å; I828-L832 WeakPolarHBondContact O-CB 3.28Å; I828-L832 VanDerWaalsContact O-CG 3.26Å; I828-L832 WeakPolarHBondContact O-CG 3.34Å; I828-L832 PolarHBondContact O-N 2.86Å; I828-F847 HydrophobicContact CD1-CE1 3.96Å; I828-Q868 HydrophobicContact CD1-CG 4.45Å; I828-S872 WeakPolarHBondContact CG2-OG 3.45Å
829	H	92.3	Very high	90.3	Very high	53 Å²	53	47.1 Å²	47.1	25%	0.245	23%	0.234	C	C	.	.	H	α-helix	trans	-62.1	-45.4	174.9	-69.9	153.4	0	0	0	112.6	Q825 L826 Q827 I831 L832 Y833 H871 Y875	Q825-H829 PolarHBondContact O-N 3.42Å; Q825-H829 PolarHBondContact O-ND1 2.95Å; L826-H829 PolarHBondContact O-N 3.45Å; Q827-H829 VanDerWaalsContact C-N 3.33Å; Q827-H829 PolarHBondContact O-N 3.02Å; H829-I831 VanDerWaalsContact C-N 3.3Å; H829-I831 PolarHBondContact O-N 3.09Å; H829-L832 PolarHBondContact O-N 3.34Å; H829-Y833 WeakPolarHBondContact O-CB 3.37Å; H829-Y833 PolarHBondContact O-N 3.04Å; H829-H871 AromaticContact CE1-NE2 3.45Å; H829-H871 PolarHBondContact CE1-NE2 3.02Å; H829-H871 AromaticContact NE2-CD2 3.66Å; H829-H871 AromaticContact NE2-NE2 3.11Å; H829-H871 PolarHBondContact NE2-NE2 3.03Å; H829-H871 VanDerWaalsContact NE2-NE2 3.11Å; H829-Y875 AromaticContact CD2-CD2 3.47Å; H829-Y875 VanDerWaalsContact CD2-CD2 3.47Å; H829-Y875 WeakPolarHBondContact CD2-CD2 3.15Å; H829-Y875 AromaticContact CD2-CE2 3.77Å; H829-Y875 AromaticContact CD2-CG 3.97Å; H829-Y875 AromaticContact NE2-CD2 3.73Å
830	R	93.4	Very high	90.4	Very high	56 Å²	56	49 Å²	49	21%	0.211	24%	0.24	C	C	.	.	H	α-helix	trans	-60.6	-36.5	176.9	-73.5	172.5	66.2	-138.5	-3	112.5	E770 I773 L826 Q827 R834	E770-R830 VanDerWaalsContact CD-NH1 3.31Å; E770-R830 IonicContact OE1-NH1 2.72Å; E770-R830 PolarHBondContact OE1-NH1 2.83Å; E770-R830 VanDerWaalsContact OE1-NH1 3.1Å; E770-R830 IonicContact OE2-CZ 2.78Å; E770-R830 IonicContact OE2-NH1 3.17Å; E770-R830 PolarHBondContact OE2-NH1 3.14Å; E770-R830 IonicContact OE2-NH2 3.29Å; E770-R830 PolarHBondContact OE2-NH2 3.45Å; I773-R830 HydrophobicContact CD1-CB 3.84Å; I773-R830 HydrophobicContact CG1-CB 4.47Å; L826-R830 WeakPolarHBondContact O-CG 3.35Å; L826-R830 PolarHBondContact O-N 2.92Å; Q827-R830 PolarHBondContact O-N 2.85Å; R830-R834 WeakPolarHBondContact O-CD 3.46Å; R830-R834 PolarHBondContact O-NH1 3.32Å
831	I	93.9	Very high	90.9	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-67.5	-57.2	172.1	-71.8	166.4	0	0	0	110.4	T769 L772 I773 L776 I817 Q827 I828 H829 Y833 R834 I835 I846	T769-I831 HydrophobicContact CG2-CD1 3.98Å; L772-I831 HydrophobicContact CD2-CD1 4.35Å; I773-I831 HydrophobicContact CD1-CG1 4.25Å; I773-I831 HydrophobicContact CG1-CG1 3.67Å; L776-I831 HydrophobicContact CD1-CB 4.24Å; L776-I831 HydrophobicContact CD1-CG1 4.02Å; L776-I831 HydrophobicContact CD1-CG2 3.77Å; I817-I831 HydrophobicContact CD1-CG2 4.08Å; Q827-I831 WeakPolarHBondContact O-CB 3.42Å; Q827-I831 VanDerWaalsContact O-CG1 3.31Å; Q827-I831 WeakPolarHBondContact O-CG1 3.18Å; Q827-I831 PolarHBondContact O-N 3.23Å; I828-I831 PolarHBondContact O-N 3.04Å; H829-I831 VanDerWaalsContact C-N 3.3Å; H829-I831 PolarHBondContact O-N 3.09Å; I831-Y833 VanDerWaalsContact C-N 3.29Å; I831-Y833 PolarHBondContact O-N 3.39Å; I831-R834 PolarHBondContact O-N 3.18Å; I831-I835 HydrophobicContact CG2-CG1 4.06Å; I831-I835 WeakPolarHBondContact O-CG1 3.49Å; I831-I835 PolarHBondContact O-N 2.97Å; I831-I846 HydrophobicContact CB-CD1 4.4Å; I831-I846 HydrophobicContact CD1-CD1 4.34Å; I831-I846 HydrophobicContact CG2-CD1 3.65Å
832	L	94.7	Very high	91.3	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-59.9	-37.8	-174.7	-69.6	175.7	0	0	0	112.3	I828 H829 R834 I835 T836 L844 Y875 L876 L886	I828-L832 HydrophobicContact CG2-CD1 3.7Å; I828-L832 HydrophobicContact CG2-CG 4.14Å; I828-L832 WeakPolarHBondContact O-CB 3.28Å; I828-L832 VanDerWaalsContact O-CG 3.26Å; I828-L832 WeakPolarHBondContact O-CG 3.34Å; I828-L832 PolarHBondContact O-N 2.86Å; H829-L832 PolarHBondContact O-N 3.34Å; L832-R834 VanDerWaalsContact C-N 3.34Å; L832-R834 PolarHBondContact O-N 2.93Å; L832-I835 WeakPolarHBondContact O-CB 3.35Å; L832-I835 PolarHBondContact O-N 3.42Å; L832-T836 WeakPolarHBondContact O-CG2 3.32Å; L832-T836 PolarHBondContact O-N 3.21Å; L832-L844 HydrophobicContact CD2-CD2 4.31Å; L832-Y875 HydrophobicContact CB-CD1 3.7Å; L832-Y875 HydrophobicContact CB-CE1 3.74Å; L832-Y875 HydrophobicContact CD1-CD1 3.96Å; L832-Y875 HydrophobicContact CD1-CG 4.37Å; L832-Y875 HydrophobicContact CG-CD1 4.5Å; L832-L876 HydrophobicContact CD2-CD1 4.17Å; L832-L876 HydrophobicContact CD2-CD2 4.15Å; L832-L876 HydrophobicContact CD2-CG 4.16Å; L832-L886 HydrophobicContact CD2-CD2 4.3Å
833	Y	92.8	Very high	91.7	Very high	72 Å²	72	43.7 Å²	43.7	28%	0.282	21%	0.207	S	C	.	.	H	α-helix	trans	-52.6	-50.3	173.1	179.8	-117.3	0	0	0	112	M782 L788 H829 I831 T836	M782-Y833 HydrophobicContact CE-CE1 4.02Å; M782-Y833 HydrophobicContact SD-CE1 4.45Å; L788-Y833 HydrophobicContact CD1-CD1 4.03Å; L788-Y833 HydrophobicContact CD1-CE1 4.01Å; H829-Y833 WeakPolarHBondContact O-CB 3.37Å; H829-Y833 PolarHBondContact O-N 3.04Å; I831-Y833 VanDerWaalsContact C-N 3.29Å; I831-Y833 PolarHBondContact O-N 3.39Å; Y833-T836 PolarHBondContact O-N 2.88Å; Y833-T836 PolarHBondContact O-OG1 2.88Å
834	R	93.1	Very high	92	Very high	5 Å²	5	43.5 Å²	43.5	2%	0.019	21%	0.206	C	C	.	.	H	α-helix	trans	-67.1	-39.3	177.8	-69.8	158.8	175.6	74.4	3.7	111.9	I773 L776 S777 A780 M782 R830 I831 L832 T836 R837	I773-R834 WeakPolarHBondContact O-CD 3.29Å; L776-R834 HydrophobicContact CB-CB 4.1Å; S777-R834 WeakPolarHBondContact OG-CD 3.37Å; S777-R834 PolarHBondContact OG-NE 3.08Å; A780-R834 HydrophobicContact CB-CB 4.41Å; M782-R834 HydrophobicContact SD-CG 3.9Å; R830-R834 WeakPolarHBondContact O-CD 3.46Å; R830-R834 PolarHBondContact O-NH1 3.32Å; I831-R834 PolarHBondContact O-N 3.18Å; L832-R834 VanDerWaalsContact C-N 3.34Å; L832-R834 PolarHBondContact O-N 2.93Å; R834-T836 VanDerWaalsContact C-N 3.27Å; R834-T836 PolarHBondContact O-N 3.02Å; R834-R837 PolarHBondContact O-N 3.26Å
835	I	93.3	Very high	92.2	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-58	-36.8	173.8	-66.3	-68.7	0	0	0	111.8	L776 L815 I831 L832 R837 L838 L841 L844 I884	L776-I835 HydrophobicContact CD2-CD1 3.73Å; L815-I835 HydrophobicContact CD2-CD1 3.98Å; I831-I835 HydrophobicContact CG2-CG1 4.06Å; I831-I835 WeakPolarHBondContact O-CG1 3.49Å; I831-I835 PolarHBondContact O-N 2.97Å; L832-I835 WeakPolarHBondContact O-CB 3.35Å; L832-I835 PolarHBondContact O-N 3.42Å; I835-R837 PolarHBondContact O-N 3.09Å; I835-L838 HydrophobicContact CD1-CD1 3.96Å; I835-L838 WeakPolarHBondContact O-CB 3.21Å; I835-L838 PolarHBondContact O-N 2.67Å; I835-L841 HydrophobicContact CD1-CD2 3.94Å; I835-L841 HydrophobicContact CG2-CD2 3.84Å; I835-L844 HydrophobicContact CB-CD2 4.43Å; I835-L844 HydrophobicContact CD1-CD1 4.14Å; I835-L844 HydrophobicContact CD1-CD2 3.87Å; I835-L844 HydrophobicContact CG1-CD2 3.76Å; I835-L844 HydrophobicContact CG2-CD2 3.97Å; I835-I884 HydrophobicContact CG2-CD1 3.58Å
836	T	91.8	Very high	92.4	Very high	26 Å²	26	38.6 Å²	38.6	16%	0.16	18%	0.176	C	C	.	.	H	α-helix	trans	-59.8	-31.9	-179	68.7	0	0	0	0	113.5	L832 Y833 R834 L838 L876 R879 R881	L832-T836 WeakPolarHBondContact O-CG2 3.32Å; L832-T836 PolarHBondContact O-N 3.21Å; Y833-T836 PolarHBondContact O-N 2.88Å; Y833-T836 PolarHBondContact O-OG1 2.88Å; R834-T836 VanDerWaalsContact C-N 3.27Å; R834-T836 PolarHBondContact O-N 3.02Å; T836-L838 VanDerWaalsContact C-N 3.28Å; T836-L838 PolarHBondContact O-N 3.08Å; T836-L876 HydrophobicContact CG2-CD2 4Å; T836-R879 HydrophobicContact CG2-CB 3.85Å; T836-R879 HydrophobicContact CG2-CG 4.34Å; T836-R881 HydrophobicContact CG2-CG 4.22Å; T836-R881 PolarHBondContact O-NH1 3.29Å
837	R	90.6	Very high	92.4	Very high	113 Å²	113	34.4 Å²	34.4	43%	0.426	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-15.2	175.7	-67.7	173.4	58.2	133	-4.5	113.4	A780 G781 R834 I835 T839	A780-R837 HydrophobicContact CB-CB 3.99Å; A780-R837 VanDerWaalsContact O-CZ 3.31Å; A780-R837 PolarHBondContact O-NE 2.83Å; A780-R837 PolarHBondContact O-NH2 3.28Å; G781-R837 PolarHBondContact O-NH2 3.31Å; R834-R837 PolarHBondContact O-N 3.26Å; I835-R837 PolarHBondContact O-N 3.09Å; R837-T839 VanDerWaalsContact C-N 3.34Å; R837-T839 PolarHBondContact O-N 3.36Å
838	L	91.2	Very high	92	Very high	6 Å²	6	32.7 Å²	32.7	3%	0.031	15%	0.147	C	C	.	.			trans	-79.7	81.9	176	-55.3	-175.2	0	0	0	110.1	M779 A780 C810 I835 T836 K840 L841 R881	M779-L838 HydrophobicContact CB-CD2 4.01Å; M779-L838 WeakPolarHBondContact O-CD2 3.42Å; A780-L838 HydrophobicContact CB-CD2 4.37Å; C810-L838 HydrophobicContact CB-CD2 4.16Å; I835-L838 HydrophobicContact CD1-CD1 3.96Å; I835-L838 WeakPolarHBondContact O-CB 3.21Å; I835-L838 PolarHBondContact O-N 2.67Å; T836-L838 VanDerWaalsContact C-N 3.28Å; T836-L838 PolarHBondContact O-N 3.08Å; L838-K840 PolarHBondContact O-N 3.14Å; L838-L841 HydrophobicContact CB-CB 3.94Å; L838-L841 HydrophobicContact CD1-CD2 4.42Å; L838-L841 PolarHBondContact O-N 3.37Å; L838-R881 PolarHBondContact O-NH1 3.17Å
839	T	88.1	Confident	91.4	Very high	106 Å²	106	33.2 Å²	33.2	65%	0.65	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-5.9	-173.1	56.3	0	0	0	0	116.2	R837	R837-T839 VanDerWaalsContact C-N 3.34Å; R837-T839 PolarHBondContact O-N 3.36Å
840	K	91.1	Very high	90.9	Very high	65 Å²	65	32.9 Å²	32.9	28%	0.283	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.3	-4.5	176.5	-58.2	-170.7	-166.3	72.8	0	113.9	C810 L812 R813 L838 Y842	C810-K840 PolarHBondContact O-NZ 3.11Å; L812-K840 CarbonylContact O-C 3.51Å; L812-K840 WeakPolarHBondContact O-CB 3.38Å; R813-K840 WeakPolarHBondContact CA-O 3.43Å; L838-K840 PolarHBondContact O-N 3.14Å; K840-Y842 WeakPolarHBondContact O-CD2 3.45Å; K840-Y842 WeakPolarHBondContact O-CE2 3.23Å
841	L	93.2	Very high	90.4	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	17%	0.168	C	C	.	.			trans	-75.8	127.2	-179.7	-161.5	80.2	0	0	0	109.8	L812 L815 I835 L838 L844 R881	L812-L841 HydrophobicContact CB-CD1 4.16Å; L812-L841 PolarHBondContact O-N 3.38Å; L815-L841 HydrophobicContact CB-CD1 3.67Å; L815-L841 HydrophobicContact CB-CD2 4.4Å; I835-L841 HydrophobicContact CD1-CD2 3.94Å; I835-L841 HydrophobicContact CG2-CD2 3.84Å; L838-L841 HydrophobicContact CB-CB 3.94Å; L838-L841 HydrophobicContact CD1-CD2 4.42Å; L838-L841 PolarHBondContact O-N 3.37Å; L841-L844 HydrophobicContact CD2-CB 4.09Å; L841-L844 HydrophobicContact CD2-CD1 4.47Å; L841-R881 PolarHBondContact O-NH2 3.2Å
842	Y	92.6	Very high	89.8	Confident	113 Å²	113	39.1 Å²	39.1	44%	0.443	18%	0.179	S	C	.	.			trans	-122.1	-20.7	179.6	-59.4	-73.7	0	0	0	113.2	R813 K840 E885	R813-Y842 HydrophobicContact CB-CD2 4.17Å; R813-Y842 HydrophobicContact CG-CD2 4.23Å; R813-Y842 HydrophobicContact CG-CE2 4.37Å; R813-Y842 PolarHBondContact O-N 2.96Å; K840-Y842 WeakPolarHBondContact O-CD2 3.45Å; K840-Y842 WeakPolarHBondContact O-CE2 3.23Å; Y842-E885 WeakPolarHBondContact O-CB 3.36Å; Y842-E885 PolarHBondContact O-N 2.93Å
843	K	93.4	Very high	89.4	Confident	48 Å²	48	39.4 Å²	39.4	21%	0.209	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	133.1	173.1	-71.6	179.6	174.9	-73.7	0	110.1	R813 V814 L815 E885	R813-K843 PolarHBondContact O-N 2.96Å; V814-K843 WeakPolarHBondContact CA-O 3.5Å; V814-K843 HydrophobicContact CB-CB 4.45Å; V814-K843 HydrophobicContact CG1-CB 4.1Å; V814-K843 HydrophobicContact CG2-CB 4.2Å; V814-K843 HydrophobicContact CG2-CD 4.3Å; L815-K843 PolarHBondContact N-O 3.02Å; L815-K843 VanDerWaalsContact N-O 3.13Å; K843-E885 WeakPolarHBondContact CA-O 3.5Å; K843-E885 HydrophobicContact CG-CB 4.21Å; K843-E885 IonicContact NZ-OE1 3.61Å; K843-E885 PolarHBondContact NZ-OE1 2.97Å; K843-E885 IonicContact NZ-OE2 3.64Å; K843-E885 PolarHBondContact NZ-OE2 2.79Å
844	L	94.8	Very high	88.8	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	113.2	174.4	175.6	62.2	0	0	0	109.8	L815 I817 L832 I835 L841 I846 I884 E885 L886 L887	L815-L844 HydrophobicContact CB-CD1 4.12Å; L815-L844 HydrophobicContact CD2-CD1 4.23Å; L815-L844 HydrophobicContact CG-CD1 4.11Å; L815-L844 WeakPolarHBondContact O-CA 3.1Å; I817-L844 HydrophobicContact CD1-CD1 3.83Å; I817-L844 HydrophobicContact CG1-CD1 3.87Å; L832-L844 HydrophobicContact CD2-CD2 4.31Å; I835-L844 HydrophobicContact CB-CD2 4.43Å; I835-L844 HydrophobicContact CD1-CD1 4.14Å; I835-L844 HydrophobicContact CD1-CD2 3.87Å; I835-L844 HydrophobicContact CG1-CD2 3.76Å; I835-L844 HydrophobicContact CG2-CD2 3.97Å; L841-L844 HydrophobicContact CD2-CB 4.09Å; L841-L844 HydrophobicContact CD2-CD1 4.47Å; L844-I846 HydrophobicContact CG-CB 4.23Å; L844-I884 HydrophobicContact CB-CG2 4.01Å; L844-E885 PolarHBondContact N-O 2.76Å; L844-L886 HydrophobicContact CB-CD2 4.08Å; L844-L886 HydrophobicContact CD2-CD2 3.84Å; L844-L886 HydrophobicContact CG-CD2 4.09Å; L844-L886 WeakPolarHBondContact O-CA 3.47Å; L844-L887 PolarHBondContact O-N 3.4Å; L844-L887 VanDerWaalsContact O-N 3.1Å
845	H	92.3	Very high	88.3	Confident	16 Å²	16	42.1 Å²	42.1	7%	0.074	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	114.6	166.7	-59.9	-107.9	0	0	0	108.5	L815 C816 I817 Q818 L887	L815-H845 PolarHBondContact O-N 2.94Å; C816-H845 HydrophobicContact CB-CB 4.19Å; C816-H845 PolarHBondContact SG-CD2 3.27Å; I817-H845 WeakPolarHBondContact CG1-O 3.44Å; I817-H845 PolarHBondContact N-O 3.02Å; Q818-H845 VanDerWaalsContact CD-CB 3.45Å; Q818-H845 HydrophobicContact CG-CB 4.21Å; Q818-H845 PolarHBondContact OE1-O 3.06Å; H845-L887 WeakPolarHBondContact CA-O 3.49Å; H845-L887 WeakPolarHBondContact CE1-CD1 3.47Å; H845-L887 WeakPolarHBondContact ND1-CB 3.17Å
846	I	93.2	Very high	87.8	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.01	25%	0.251	C	S	.	.			trans	-126.3	-29.4	-176.3	-171.8	174.4	0	0	0	112.3	I817 I831 L844 L886 L887	I817-I846 HydrophobicContact CD1-CD1 4.49Å; I817-I846 HydrophobicContact CD1-CG1 4.28Å; I817-I846 HydrophobicContact CG1-CB 4.41Å; I817-I846 HydrophobicContact CG1-CG1 4.36Å; I831-I846 HydrophobicContact CB-CD1 4.4Å; I831-I846 HydrophobicContact CD1-CD1 4.34Å; I831-I846 HydrophobicContact CG2-CD1 3.65Å; L844-I846 HydrophobicContact CG-CB 4.23Å; I846-L886 HydrophobicContact CG2-CD2 3.98Å; I846-L887 PolarHBondContact N-O 3.47Å
847	F	89.7	Confident	87.5	Confident	3 Å²	3	51.2 Å²	51.2	1%	0.013	26%	0.261	C	S	.	.			trans	-93.8	127.2	-175.7	-63.5	-64.4	0	0	0	111.8	I828 F853 R865 Q868 L869 S872	I828-F847 HydrophobicContact CD1-CE1 3.96Å; F847-F853 HydrophobicContact CB-CZ 4.36Å; F847-F853 AromaticContact CD1-CZ 3.99Å; F847-F853 HydrophobicContact CD1-CZ 3.99Å; F847-R865 PolarHBondContact O-NH2 2.74Å; F847-Q868 HydrophobicContact CE1-CB 3.74Å; F847-Q868 HydrophobicContact CZ-CB 4.01Å; F847-L869 HydrophobicContact CD2-CB 4.18Å; F847-L869 HydrophobicContact CD2-CD1 4.35Å; F847-L869 HydrophobicContact CE2-CB 3.9Å; F847-L869 HydrophobicContact CE2-CG 4.47Å; F847-S872 WeakPolarHBondContact CZ-OG 3.48Å
848	P	84.7	Confident	87.3	Confident	3 Å²	3	50.3 Å²	50.3	2%	0.019	26%	0.262	C	S	.	.			trans	-62	175.3	168.9	27.9	-34.3	0	0	0	111.6	Y764 S819 P822 A852 F853 R865	Y764-P848 HydrophobicContact CE1-CB 4.18Å; S819-P848 WeakPolarHBondContact O-CB 3.4Å; S819-P848 WeakPolarHBondContact O-CG 3.27Å; P822-P848 HydrophobicContact CG-CG 3.9Å; P848-A852 HydrophobicContact CB-CB 3.88Å; P848-A852 HydrophobicContact CG-CB 3.78Å; P848-F853 HydrophobicContact CG-CE2 4.03Å; P848-R865 PolarHBondContact O-NE 2.87Å; P848-R865 PolarHBondContact O-NH2 3.49Å
849	A	79	Confident	87.1	Confident	10 Å²	10	57.6 Å²	57.6	8%	0.083	30%	0.296	C	S	.	.			trans	-59.2	157.1	170.9	0	0	0	0	0	111.8	Y851 A852	A849-Y851 VanDerWaalsContact C-N 3.26Å; A849-Y851 HydrophobicContact CB-CD1 3.76Å; A849-Y851 HydrophobicContact CB-CE1 3.28Å; A849-Y851 HydrophobicContact CB-CE2 4.47Å; A849-Y851 PolarHBondContact O-N 3.34Å; A849-A852 WeakPolarHBondContact O-CB 3.08Å; A849-A852 PolarHBondContact O-N 2.99Å; A849-A852 VanDerWaalsContact O-N 3.12Å
850	F	81.3	Confident	87	Confident	46 Å²	46	56.1 Å²	56.1	20%	0.202	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-58.2	-34.2	-171.2	62.5	-94.5	0	0	0	113.5	A852 F853 E858 Q861 R862	F850-A852 PolarHBondContact O-N 3.36Å; F850-F853 WeakPolarHBondContact O-CB 3.49Å; F850-F853 WeakPolarHBondContact O-CD2 3.38Å; F850-F853 PolarHBondContact O-N 2.87Å; F850-E858 HydrophobicContact CD2-CG 4.23Å; F850-E858 HydrophobicContact CE2-CB 4.46Å; F850-E858 HydrophobicContact CE2-CG 3.66Å; F850-E858 WeakPolarHBondContact CE2-OE1 3.13Å; F850-E858 HydrophobicContact CZ-CG 4.25Å; F850-E858 WeakPolarHBondContact CZ-OE1 3.49Å; F850-Q861 HydrophobicContact CD2-CB 4.2Å; F850-R862 HydrophobicContact CB-CG 3.87Å; F850-R862 HydrophobicContact CD1-CG 4.06Å; F850-R862 HydrophobicContact CD2-CG 3.87Å; F850-R862 HydrophobicContact CE2-CG 4.47Å; F850-R862 HydrophobicContact CG-CG 3.65Å
851	Y	84.5	Confident	86.8	Confident	160 Å²	160	54.8 Å²	54.8	63%	0.627	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-63.8	-10	-179.7	62.1	-107	0	0	0	114.7	A849	A849-Y851 VanDerWaalsContact C-N 3.26Å; A849-Y851 HydrophobicContact CB-CD1 3.76Å; A849-Y851 HydrophobicContact CB-CE1 3.28Å; A849-Y851 HydrophobicContact CB-CE2 4.47Å; A849-Y851 PolarHBondContact O-N 3.34Å
852	A	81.4	Confident	86.6	Confident	27 Å²	27	61.2 Å²	61.2	22%	0.223	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-84.8	-8.3	173	0	0	0	0	0	113.2	P822 P848 A849 F850	P822-A852 WeakPolarHBondContact CD-O 3.45Å; P822-A852 HydrophobicContact CG-CB 4.35Å; P822-A852 WeakPolarHBondContact CG-O 3.39Å; P848-A852 HydrophobicContact CB-CB 3.88Å; P848-A852 HydrophobicContact CG-CB 3.78Å; A849-A852 WeakPolarHBondContact O-CB 3.08Å; A849-A852 PolarHBondContact O-N 2.99Å; A849-A852 VanDerWaalsContact O-N 3.12Å; F850-A852 PolarHBondContact O-N 3.36Å
853	F	85.3	Confident	86.5	Confident	6 Å²	6	61.2 Å²	61.2	3%	0.026	31%	0.305	C	S	.	.	S	Bend	trans	-87.1	145.3	179.8	-70.8	-108.5	0	0	0	110.8	P822 F847 P848 F850 G855 L864 R865 Q868	P822-F853 HydrophobicContact CB-CD1 4.32Å; P822-F853 HydrophobicContact CB-CE1 4.01Å; P822-F853 HydrophobicContact CB-CE2 4.46Å; P822-F853 HydrophobicContact CB-CZ 4.08Å; P822-F853 HydrophobicContact CG-CD1 4.02Å; P822-F853 HydrophobicContact CG-CD2 3.83Å; P822-F853 HydrophobicContact CG-CE1 4.06Å; P822-F853 HydrophobicContact CG-CE2 3.86Å; P822-F853 HydrophobicContact CG-CG 3.9Å; P822-F853 HydrophobicContact CG-CZ 3.98Å; F847-F853 HydrophobicContact CB-CZ 4.36Å; F847-F853 AromaticContact CD1-CZ 3.99Å; F847-F853 HydrophobicContact CD1-CZ 3.99Å; P848-F853 HydrophobicContact CG-CE2 4.03Å; F850-F853 WeakPolarHBondContact O-CB 3.49Å; F850-F853 WeakPolarHBondContact O-CD2 3.38Å; F850-F853 PolarHBondContact O-N 2.87Å; F853-G855 PolarHBondContact O-N 3.34Å; F853-G855 VanDerWaalsContact O-N 3.16Å; F853-L864 HydrophobicContact CB-CB 4.37Å; F853-L864 HydrophobicContact CD1-CB 4.13Å; F853-R865 HydrophobicContact CD1-CB 4.23Å; F853-R865 HydrophobicContact CD2-CB 3.98Å; F853-R865 HydrophobicContact CD2-CG 4.35Å; F853-R865 HydrophobicContact CE1-CB 4.01Å; F853-R865 HydrophobicContact CE1-CG 4.37Å; F853-R865 HydrophobicContact CE2-CB 3.76Å; F853-R865 HydrophobicContact CE2-CG 3.67Å; F853-R865 HydrophobicContact CG-CB 4.22Å; F853-R865 HydrophobicContact CZ-CB 3.77Å; F853-R865 HydrophobicContact CZ-CG 3.69Å; F853-Q868 HydrophobicContact CE1-CG 4.34Å
854	P	80.8	Confident	86.3	Confident	111 Å²	111	62.4 Å²	62.4	72%	0.721	31%	0.313	S	S	*	.			trans	-76	104.3	-177.6	30	-34.1	0	0	0	111.2	L864	P854-L864 WeakPolarHBondContact O-CD1 3.49Å
855	G	81.7	Confident	86	Confident	23 Å²	23	65 Å²	65	24%	0.237	32%	0.323	C	S	.	.			trans	-162.8	149.8	173.3	0	0	0	0	0	111.6	F853 T857 Q861	F853-G855 PolarHBondContact O-N 3.34Å; F853-G855 VanDerWaalsContact O-N 3.16Å; G855-T857 VanDerWaalsContact C-N 3.34Å; G855-Q861 PolarHBondContact O-NE2 2.87Å
856	D	83.1	Confident	86	Confident	157 Å²	157	71.1 Å²	71.1	84%	0.84	35%	0.346	S	S	*	.	S	Bend	trans	-77.9	-21.7	-175.7	-57.8	-47.1	0	0	0	112.4
857	T	85.9	Confident	85.9	Confident	60 Å²	60	74.4 Å²	74.4	37%	0.368	36%	0.364	S	S	.	.	S	Bend	trans	-124.4	151.9	176.6	73.9	0	0	0	0	112.2	G855 E859 Q860 Q861	G855-T857 VanDerWaalsContact C-N 3.34Å; T857-E859 PolarHBondContact O-N 3.13Å; T857-Q860 PolarHBondContact O-N 3.22Å; T857-Q860 WeakPolarHBondContact OG1-CG 3.49Å; T857-Q860 PolarHBondContact OG1-N 3.41Å; T857-Q861 VanDerWaalsContact O-CG 3.27Å; T857-Q861 WeakPolarHBondContact O-CG 3.18Å; T857-Q861 PolarHBondContact O-N 2.98Å
858	E	86.5	Confident	85.9	Confident	94 Å²	94	76.3 Å²	76.3	44%	0.439	37%	0.373	S	S	.	.	H	α-helix	trans	-55.2	-33.3	172.8	168.1	167.2	-157.4	0	0	112.3	F850 Q861 R862	F850-E858 HydrophobicContact CD2-CG 4.23Å; F850-E858 HydrophobicContact CE2-CB 4.46Å; F850-E858 HydrophobicContact CE2-CG 3.66Å; F850-E858 WeakPolarHBondContact CE2-OE1 3.13Å; F850-E858 HydrophobicContact CZ-CG 4.25Å; F850-E858 WeakPolarHBondContact CZ-OE1 3.49Å; E858-Q861 PolarHBondContact O-N 2.97Å; E858-R862 HydrophobicContact CG-CG 4.31Å; E858-R862 WeakPolarHBondContact O-CB 3.29Å; E858-R862 WeakPolarHBondContact O-CD 3.48Å; E858-R862 WeakPolarHBondContact O-CG 3.42Å; E858-R862 PolarHBondContact O-N 3.3Å; E858-R862 IonicContact OE1-CZ 2.72Å; E858-R862 IonicContact OE1-NE 2.69Å; E858-R862 PolarHBondContact OE1-NE 3Å; E858-R862 IonicContact OE1-NH2 3.61Å; E858-R862 PolarHBondContact OE1-NH2 3.07Å
859	E	86.8	Confident	86.2	Confident	159 Å²	159	76.8 Å²	76.8	74%	0.743	38%	0.375	S	S	*	.	H	α-helix	trans	-65.5	-49.4	177.9	-62.6	-179	155	0	0	111.2	T857 Q861 R862 E863	T857-E859 PolarHBondContact O-N 3.13Å; E859-Q861 VanDerWaalsContact C-N 3.35Å; E859-Q861 PolarHBondContact O-N 2.78Å; E859-R862 PolarHBondContact O-N 2.9Å; E859-E863 WeakPolarHBondContact O-CB 3.17Å; E859-E863 PolarHBondContact O-N 3.14Å
860	Q	86.6	Confident	86.9	Confident	76 Å²	76	80.1 Å²	80.1	36%	0.355	39%	0.39	S	S	.	.	H	α-helix	trans	-60.3	-43.1	174.6	-69.6	168.6	-12.3	0	0	111.9	T857 R862 E863 L864	T857-Q860 PolarHBondContact O-N 3.22Å; T857-Q860 WeakPolarHBondContact OG1-CG 3.49Å; T857-Q860 PolarHBondContact OG1-N 3.41Å; Q860-R862 PolarHBondContact O-N 3.06Å; Q860-E863 PolarHBondContact O-N 3.22Å; Q860-L864 WeakPolarHBondContact O-CB 3.2Å; Q860-L864 VanDerWaalsContact O-CG 3.31Å; Q860-L864 WeakPolarHBondContact O-CG 3.23Å; Q860-L864 PolarHBondContact O-N 3.39Å
861	Q	86.1	Confident	87.4	Confident	37 Å²	37	81.7 Å²	81.7	17%	0.173	40%	0.399	C	S	.	.	H	α-helix	trans	-61.5	-43.4	178.4	-70.9	173.3	4.4	0	0	112	F850 G855 T857 E858 E859 R865	F850-Q861 HydrophobicContact CD2-CB 4.2Å; G855-Q861 PolarHBondContact O-NE2 2.87Å; T857-Q861 VanDerWaalsContact O-CG 3.27Å; T857-Q861 WeakPolarHBondContact O-CG 3.18Å; T857-Q861 PolarHBondContact O-N 2.98Å; E858-Q861 PolarHBondContact O-N 2.97Å; E859-Q861 VanDerWaalsContact C-N 3.35Å; E859-Q861 PolarHBondContact O-N 2.78Å; Q861-R865 PolarHBondContact O-N 2.87Å
862	R	88.8	Confident	87.8	Confident	134 Å²	134	74.1 Å²	74.1	51%	0.506	37%	0.369	S	S	.	.	H	α-helix	trans	-65.7	-41.3	174.4	-73.6	168	174.5	-117.8	6.3	111.6	F850 E858 E859 Q860 R865 Y866	F850-R862 HydrophobicContact CB-CG 3.87Å; F850-R862 HydrophobicContact CD1-CG 4.06Å; F850-R862 HydrophobicContact CD2-CG 3.87Å; F850-R862 HydrophobicContact CE2-CG 4.47Å; F850-R862 HydrophobicContact CG-CG 3.65Å; E858-R862 HydrophobicContact CG-CG 4.31Å; E858-R862 WeakPolarHBondContact O-CB 3.29Å; E858-R862 WeakPolarHBondContact O-CD 3.48Å; E858-R862 WeakPolarHBondContact O-CG 3.42Å; E858-R862 PolarHBondContact O-N 3.3Å; E858-R862 IonicContact OE1-CZ 2.72Å; E858-R862 IonicContact OE1-NE 2.69Å; E858-R862 PolarHBondContact OE1-NE 3Å; E858-R862 IonicContact OE1-NH2 3.61Å; E858-R862 PolarHBondContact OE1-NH2 3.07Å; E859-R862 PolarHBondContact O-N 2.9Å; Q860-R862 PolarHBondContact O-N 3.06Å; R862-R865 PolarHBondContact O-N 2.81Å; R862-Y866 WeakPolarHBondContact O-CB 2.99Å; R862-Y866 PolarHBondContact O-N 3.47Å
863	E	90.5	Very high	88.4	Confident	114 Å²	114	78.7 Å²	78.7	53%	0.533	38%	0.38	S	S	.	.	H	α-helix	trans	-63.6	-46.9	177.8	-163.2	-166.4	150.3	0	0	111.8	E859 Q860 R865 Y866 N867	E859-E863 WeakPolarHBondContact O-CB 3.17Å; E859-E863 PolarHBondContact O-N 3.14Å; Q860-E863 PolarHBondContact O-N 3.22Å; E863-R865 PolarHBondContact O-N 3.34Å; E863-Y866 CarbonylContact O-C 3.44Å; E863-Y866 WeakPolarHBondContact O-CB 3.24Å; E863-Y866 PolarHBondContact O-N 3.07Å; E863-Y866 VanDerWaalsContact O-N 3.1Å; E863-N867 WeakPolarHBondContact O-CB 3.21Å; E863-N867 VanDerWaalsContact O-CG 3.27Å; E863-N867 PolarHBondContact O-N 2.93Å; E863-N867 PolarHBondContact O-ND2 3.25Å; E863-N867 PolarHBondContact OE1-ND2 3.48Å
864	L	88.5	Confident	88.7	Confident	72 Å²	72	83.2 Å²	83.2	38%	0.377	40%	0.401	S	S	.	.	H	α-helix	trans	-61.8	-41.3	177.9	-72	167.3	0	0	0	112.4	F853 P854 Q860 Y866 N867 Q868	F853-L864 HydrophobicContact CB-CB 4.37Å; F853-L864 HydrophobicContact CD1-CB 4.13Å; P854-L864 WeakPolarHBondContact O-CD1 3.49Å; Q860-L864 WeakPolarHBondContact O-CB 3.2Å; Q860-L864 VanDerWaalsContact O-CG 3.31Å; Q860-L864 WeakPolarHBondContact O-CG 3.23Å; Q860-L864 PolarHBondContact O-N 3.39Å; L864-Y866 VanDerWaalsContact C-N 3.34Å; L864-N867 PolarHBondContact O-N 3.17Å; L864-Q868 PolarHBondContact O-N 3.39Å
865	R	89.7	Confident	89.3	Confident	56 Å²	56	78.9 Å²	78.9	21%	0.211	37%	0.371	C	S	.	.	H	α-helix	trans	-60.3	-43.8	171.8	-174.5	-177.8	-164.2	-84.3	-7.5	111.6	F847 P848 F853 Q861 R862 E863 L869 L887	F847-R865 PolarHBondContact O-NH2 2.74Å; P848-R865 PolarHBondContact O-NE 2.87Å; P848-R865 PolarHBondContact O-NH2 3.49Å; F853-R865 HydrophobicContact CD1-CB 4.23Å; F853-R865 HydrophobicContact CD2-CB 3.98Å; F853-R865 HydrophobicContact CD2-CG 4.35Å; F853-R865 HydrophobicContact CE1-CB 4.01Å; F853-R865 HydrophobicContact CE1-CG 4.37Å; F853-R865 HydrophobicContact CE2-CB 3.76Å; F853-R865 HydrophobicContact CE2-CG 3.67Å; F853-R865 HydrophobicContact CG-CB 4.22Å; F853-R865 HydrophobicContact CZ-CB 3.77Å; F853-R865 HydrophobicContact CZ-CG 3.69Å; Q861-R865 PolarHBondContact O-N 2.87Å; R862-R865 PolarHBondContact O-N 2.81Å; E863-R865 PolarHBondContact O-N 3.34Å; R865-L869 VanDerWaalsContact O-CB 3.28Å; R865-L869 WeakPolarHBondContact O-CB 3.35Å; R865-L869 PolarHBondContact O-N 3.45Å; R865-L869 VanDerWaalsContact O-N 3.13Å; R865-L887 PolarHBondContact NH2-OXT 3.15Å
866	Y	91.4	Very high	89.8	Confident	144 Å²	144	78 Å²	78	57%	0.565	36%	0.36	S	S	*	.	H	α-helix	trans	-66.2	-41.6	179.8	-174.3	-111.5	0	0	0	112.1	R862 E863 L864 L869 I870	R862-Y866 WeakPolarHBondContact O-CB 2.99Å; R862-Y866 PolarHBondContact O-N 3.47Å; E863-Y866 CarbonylContact O-C 3.44Å; E863-Y866 WeakPolarHBondContact O-CB 3.24Å; E863-Y866 PolarHBondContact O-N 3.07Å; E863-Y866 VanDerWaalsContact O-N 3.1Å; L864-Y866 VanDerWaalsContact C-N 3.34Å; Y866-L869 PolarHBondContact O-N 3.15Å; Y866-I870 HydrophobicContact CD1-CD1 3.78Å; Y866-I870 HydrophobicContact CE1-CD1 3.34Å; Y866-I870 HydrophobicContact CE1-CG1 4.31Å; Y866-I870 HydrophobicContact CE2-CD1 4.46Å; Y866-I870 PolarHBondContact O-N 3.03Å
867	N	91.6	Very high	90.3	Very high	71 Å²	71	77.6 Å²	77.6	38%	0.38	35%	0.351	S	S	.	.	H	α-helix	trans	-65.8	-45.1	178.6	-71.3	-19	0	0	0	112.1	E863 L864 L869 I870 H871	E863-N867 WeakPolarHBondContact O-CB 3.21Å; E863-N867 VanDerWaalsContact O-CG 3.27Å; E863-N867 PolarHBondContact O-N 2.93Å; E863-N867 PolarHBondContact O-ND2 3.25Å; E863-N867 PolarHBondContact OE1-ND2 3.48Å; L864-N867 PolarHBondContact O-N 3.17Å; N867-L869 VanDerWaalsContact C-N 3.29Å; N867-L869 PolarHBondContact O-N 3.12Å; N867-I870 PolarHBondContact O-N 2.89Å; N867-H871 WeakPolarHBondContact O-CB 3.45Å; N867-H871 PolarHBondContact O-N 2.72Å
868	Q	90	Very high	90.5	Very high	42 Å²	42	80.9 Å²	80.9	20%	0.196	36%	0.362	C	S	.	.	H	α-helix	trans	-61.7	-36.9	172.9	-74.2	-165.3	-2.9	0	0	112.5	I828 F847 F853 L864 H871 S872	I828-Q868 HydrophobicContact CD1-CG 4.45Å; F847-Q868 HydrophobicContact CE1-CB 3.74Å; F847-Q868 HydrophobicContact CZ-CB 4.01Å; F853-Q868 HydrophobicContact CE1-CG 4.34Å; L864-Q868 PolarHBondContact O-N 3.39Å; Q868-H871 PolarHBondContact O-N 3.1Å; Q868-S872 VanDerWaalsContact O-CB 3.27Å; Q868-S872 WeakPolarHBondContact O-CB 3.38Å; Q868-S872 PolarHBondContact O-N 3.15Å; Q868-S872 PolarHBondContact O-OG 2.81Å
869	L	91.8	Very high	90.7	Very high	14 Å²	14	81 Å²	81	7%	0.073	36%	0.359	C	S	.	.	H	α-helix	trans	-69.8	-37.7	177.6	174.4	147.1	0	0	0	112.4	F847 R865 Y866 N867 R873	F847-L869 HydrophobicContact CD2-CB 4.18Å; F847-L869 HydrophobicContact CD2-CD1 4.35Å; F847-L869 HydrophobicContact CE2-CB 3.9Å; F847-L869 HydrophobicContact CE2-CG 4.47Å; R865-L869 VanDerWaalsContact O-CB 3.28Å; R865-L869 WeakPolarHBondContact O-CB 3.35Å; R865-L869 PolarHBondContact O-N 3.45Å; R865-L869 VanDerWaalsContact O-N 3.13Å; Y866-L869 PolarHBondContact O-N 3.15Å; N867-L869 VanDerWaalsContact C-N 3.29Å; N867-L869 PolarHBondContact O-N 3.12Å; L869-R873 WeakPolarHBondContact O-CB 3.38Å; L869-R873 VanDerWaalsContact O-CG 3.24Å; L869-R873 WeakPolarHBondContact O-CG 3.47Å; L869-R873 PolarHBondContact O-N 2.96Å
870	I	92	Very high	90.8	Very high	79 Å²	79	78.8 Å²	78.8	41%	0.405	36%	0.359	S	S	.	.	H	α-helix	trans	-61.9	-52	170	-76.2	174.4	0	0	0	110.5	Y866 N867 S872 R873 H874	Y866-I870 HydrophobicContact CD1-CD1 3.78Å; Y866-I870 HydrophobicContact CE1-CD1 3.34Å; Y866-I870 HydrophobicContact CE1-CG1 4.31Å; Y866-I870 HydrophobicContact CE2-CD1 4.46Å; Y866-I870 PolarHBondContact O-N 3.03Å; N867-I870 PolarHBondContact O-N 2.89Å; I870-S872 VanDerWaalsContact C-N 3.28Å; I870-S872 PolarHBondContact O-N 2.91Å; I870-R873 PolarHBondContact O-N 2.9Å; I870-R873 VanDerWaalsContact O-N 3.15Å; I870-H874 PolarHBondContact O-N 3.14Å
871	H	92.5	Very high	91	Very high	80 Å²	80	76.5 Å²	76.5	37%	0.37	35%	0.348	S	S	.	.	H	α-helix	trans	-60	-40	-177.3	-171.7	82.9	0	0	0	112	Q825 H829 N867 Q868 H874 Y875	Q825-H871 PolarHBondContact NE2-CD2 3.48Å; Q825-H871 VanDerWaalsContact NE2-CD2 3.32Å; Q825-H871 PolarHBondContact OE1-CD2 3.11Å; H829-H871 AromaticContact CE1-NE2 3.45Å; H829-H871 PolarHBondContact CE1-NE2 3.02Å; H829-H871 AromaticContact NE2-CD2 3.66Å; H829-H871 AromaticContact NE2-NE2 3.11Å; H829-H871 PolarHBondContact NE2-NE2 3.03Å; H829-H871 VanDerWaalsContact NE2-NE2 3.11Å; N867-H871 WeakPolarHBondContact O-CB 3.45Å; N867-H871 PolarHBondContact O-N 2.72Å; Q868-H871 PolarHBondContact O-N 3.1Å; H871-H874 WeakPolarHBondContact O-CB 2.93Å; H871-H874 PolarHBondContact O-N 3.47Å; H871-Y875 PolarHBondContact O-N 3.19Å
872	S	94	Very high	91.1	Very high	0 Å²	0	79.3 Å²	79.3	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-67.9	-39.5	176.3	-60.5	0	0	0	0	112.9	I828 F847 Q868 I870 H874 Y875 L876 L886	I828-S872 WeakPolarHBondContact CG2-OG 3.45Å; F847-S872 WeakPolarHBondContact CZ-OG 3.48Å; Q868-S872 VanDerWaalsContact O-CB 3.27Å; Q868-S872 WeakPolarHBondContact O-CB 3.38Å; Q868-S872 PolarHBondContact O-N 3.15Å; Q868-S872 PolarHBondContact O-OG 2.81Å; I870-S872 VanDerWaalsContact C-N 3.28Å; I870-S872 PolarHBondContact O-N 2.91Å; S872-H874 VanDerWaalsContact C-N 3.3Å; S872-H874 PolarHBondContact O-N 2.84Å; S872-Y875 PolarHBondContact O-N 3.24Å; S872-L876 WeakPolarHBondContact O-CG 3.48Å; S872-L876 PolarHBondContact O-N 2.89Å; S872-L886 VanDerWaalsContact CB-CD1 3.48Å
873	R	93.1	Very high	91.2	Very high	124 Å²	124	76.3 Å²	76.3	47%	0.468	37%	0.366	S	S	.	.	H	α-helix	trans	-65.2	-34.4	171.9	-73.4	174.5	179.4	-170.1	-1.1	111.6	L869 I870 K877 L886	L869-R873 WeakPolarHBondContact O-CB 3.38Å; L869-R873 VanDerWaalsContact O-CG 3.24Å; L869-R873 WeakPolarHBondContact O-CG 3.47Å; L869-R873 PolarHBondContact O-N 2.96Å; I870-R873 PolarHBondContact O-N 2.9Å; I870-R873 VanDerWaalsContact O-N 3.15Å; R873-K877 WeakPolarHBondContact O-CB 3.49Å; R873-K877 PolarHBondContact O-N 2.93Å; R873-L886 HydrophobicContact CG-CB 4.3Å; R873-L886 HydrophobicContact CG-CD1 3.85Å; R873-L886 PolarHBondContact NH2-O 3.13Å
874	H	92.5	Very high	91.2	Very high	100 Å²	100	71.4 Å²	71.4	46%	0.463	34%	0.343	S	S	.	.	H	α-helix	trans	-66.8	-48	174.3	-167.8	-90.5	0	0	0	111.9	I870 H871 S872 L876 K877 Q878	I870-H874 PolarHBondContact O-N 3.14Å; H871-H874 WeakPolarHBondContact O-CB 2.93Å; H871-H874 PolarHBondContact O-N 3.47Å; S872-H874 VanDerWaalsContact C-N 3.3Å; S872-H874 PolarHBondContact O-N 2.84Å; H874-L876 PolarHBondContact O-N 3.11Å; H874-K877 WeakPolarHBondContact O-CB 3.09Å; H874-K877 PolarHBondContact O-N 3.22Å; H874-K877 VanDerWaalsContact O-N 3.13Å; H874-Q878 PolarHBondContact CE1-OE1 3.33Å; H874-Q878 VanDerWaalsContact ND1-CD 3.31Å; H874-Q878 PolarHBondContact ND1-OE1 3.44Å; H874-Q878 WeakPolarHBondContact O-CG 3.46Å; H874-Q878 PolarHBondContact O-N 3.49Å
875	Y	93	Very high	91.3	Very high	21 Å²	21	72 Å²	72	8%	0.082	34%	0.344	C	S	.	.	H	α-helix	trans	-57.3	-46.1	176	-176.5	-87.7	0	0	0	112.1	H829 L832 H871 S872 K877 Q878 R879	H829-Y875 AromaticContact CD2-CD2 3.47Å; H829-Y875 VanDerWaalsContact CD2-CD2 3.47Å; H829-Y875 WeakPolarHBondContact CD2-CD2 3.15Å; H829-Y875 AromaticContact CD2-CE2 3.77Å; H829-Y875 AromaticContact CD2-CG 3.97Å; H829-Y875 AromaticContact NE2-CD2 3.73Å; L832-Y875 HydrophobicContact CB-CD1 3.7Å; L832-Y875 HydrophobicContact CB-CE1 3.74Å; L832-Y875 HydrophobicContact CD1-CD1 3.96Å; L832-Y875 HydrophobicContact CD1-CG 4.37Å; L832-Y875 HydrophobicContact CG-CD1 4.5Å; H871-Y875 PolarHBondContact O-N 3.19Å; S872-Y875 PolarHBondContact O-N 3.24Å; Y875-K877 PolarHBondContact O-N 3.25Å; Y875-Q878 PolarHBondContact O-N 3.5Å; Y875-R879 HydrophobicContact CD1-CG 4.32Å; Y875-R879 HydrophobicContact CE1-CG 3.92Å; Y875-R879 WeakPolarHBondContact O-CG 3.36Å; Y875-R879 PolarHBondContact O-N 3.36Å
876	L	92.7	Very high	91.3	Very high	3 Å²	3	69.4 Å²	69.4	2%	0.016	33%	0.334	C	S	.	.	H	α-helix	trans	-63.4	-38.8	175.5	-72.5	177.9	0	0	0	112.6	L832 T836 S872 H874 R879 C880 R881 I884 L886	L832-L876 HydrophobicContact CD2-CD1 4.17Å; L832-L876 HydrophobicContact CD2-CD2 4.15Å; L832-L876 HydrophobicContact CD2-CG 4.16Å; T836-L876 HydrophobicContact CG2-CD2 4Å; S872-L876 WeakPolarHBondContact O-CG 3.48Å; S872-L876 PolarHBondContact O-N 2.89Å; H874-L876 PolarHBondContact O-N 3.11Å; L876-R879 CarbonylContact O-C 3.55Å; L876-R879 PolarHBondContact O-N 3.1Å; L876-C880 PolarHBondContact O-N 3.05Å; L876-R881 HydrophobicContact CD2-CB 4.23Å; L876-R881 CarbonylContact O-C 3.55Å; L876-R881 WeakPolarHBondContact O-CA 3.48Å; L876-R881 PolarHBondContact O-N 3.13Å; L876-I884 HydrophobicContact CD1-CB 4.15Å; L876-I884 HydrophobicContact CD1-CG2 4.46Å; L876-I884 HydrophobicContact CD2-CD1 4.27Å; L876-L886 HydrophobicContact CD1-CD1 3.55Å; L876-L886 HydrophobicContact CD1-CD2 4.17Å; L876-L886 HydrophobicContact CD1-CG 3.75Å
877	K	91.6	Very high	90.6	Very high	150 Å²	150	65.2 Å²	65.2	65%	0.652	32%	0.321	S	S	*	.	H	α-helix	trans	-63.2	-41.6	173.8	-176.9	-177.2	175.5	-171.8	0	112	R873 H874 Y875 R879 C880	R873-K877 WeakPolarHBondContact O-CB 3.49Å; R873-K877 PolarHBondContact O-N 2.93Å; H874-K877 WeakPolarHBondContact O-CB 3.09Å; H874-K877 PolarHBondContact O-N 3.22Å; H874-K877 VanDerWaalsContact O-N 3.13Å; Y875-K877 PolarHBondContact O-N 3.25Å; K877-R879 VanDerWaalsContact C-N 3.33Å; K877-R879 PolarHBondContact O-N 2.82Å; K877-C880 PolarHBondContact O-N 3.14Å
878	Q	92	Very high	90.5	Very high	129 Å²	129	64.9 Å²	64.9	60%	0.603	32%	0.318	S	S	*	.	H	α-helix	trans	-63.4	-37.5	175.3	-71.3	172.1	-70.2	0	0	112.2	H874 Y875 C880	H874-Q878 PolarHBondContact CE1-OE1 3.33Å; H874-Q878 VanDerWaalsContact ND1-CD 3.31Å; H874-Q878 PolarHBondContact ND1-OE1 3.44Å; H874-Q878 WeakPolarHBondContact O-CG 3.46Å; H874-Q878 PolarHBondContact O-N 3.49Å; Y875-Q878 PolarHBondContact O-N 3.5Å; Q878-C880 PolarHBondContact O-N 3.04Å
879	R	90.6	Very high	90.6	Very high	96 Å²	96	66.1 Å²	66.1	36%	0.362	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	21.2	175.8	-60.1	-73.4	-176	158.3	-3.7	113.2	E793 T836 Y875 L876 K877 R881	E793-R879 IonicContact OE1-NH2 3.53Å; E793-R879 PolarHBondContact OE1-NH2 2.99Å; T836-R879 HydrophobicContact CG2-CB 3.85Å; T836-R879 HydrophobicContact CG2-CG 4.34Å; Y875-R879 HydrophobicContact CD1-CG 4.32Å; Y875-R879 HydrophobicContact CE1-CG 3.92Å; Y875-R879 WeakPolarHBondContact O-CG 3.36Å; Y875-R879 PolarHBondContact O-N 3.36Å; L876-R879 CarbonylContact O-C 3.55Å; L876-R879 PolarHBondContact O-N 3.1Å; K877-R879 VanDerWaalsContact C-N 3.33Å; K877-R879 PolarHBondContact O-N 2.82Å; R879-R881 PolarHBondContact O-N 3.19Å; R879-R881 VanDerWaalsContact O-N 3.14Å
880	C	88.6	Confident	90.5	Very high	112 Å²	112	69 Å²	69	76%	0.757	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.8	24.7	178	-63.3	0	0	0	0	116.2	L876 K877 Q878	L876-C880 PolarHBondContact O-N 3.05Å; K877-C880 PolarHBondContact O-N 3.14Å; Q878-C880 PolarHBondContact O-N 3.04Å
881	R	91	Very high	90.4	Very high	28 Å²	28	68.4 Å²	68.4	11%	0.106	33%	0.334	C	S	.	.			trans	-114.2	42.4	178.9	-68	-56.1	-48.6	-83.6	2.6	113.1	T836 L838 L841 L876 R879 D883 I884	T836-R881 HydrophobicContact CG2-CG 4.22Å; T836-R881 PolarHBondContact O-NH1 3.29Å; L838-R881 PolarHBondContact O-NH1 3.17Å; L841-R881 PolarHBondContact O-NH2 3.2Å; L876-R881 HydrophobicContact CD2-CB 4.23Å; L876-R881 CarbonylContact O-C 3.55Å; L876-R881 WeakPolarHBondContact O-CA 3.48Å; L876-R881 PolarHBondContact O-N 3.13Å; R879-R881 PolarHBondContact O-N 3.19Å; R879-R881 VanDerWaalsContact O-N 3.14Å; R881-D883 WeakPolarHBondContact CA-OD1 3.39Å; R881-D883 IonicContact CZ-OD1 2.69Å; R881-D883 IonicContact CZ-OD2 2.67Å; R881-D883 IonicContact NE-OD1 3.17Å; R881-D883 PolarHBondContact NE-OD1 3.14Å; R881-D883 IonicContact NE-OD2 3.1Å; R881-D883 PolarHBondContact NE-OD2 3.12Å; R881-D883 IonicContact NH2-OD1 3.7Å; R881-D883 IonicContact NH2-OD2 3.55Å; R881-D883 PolarHBondContact NH2-OD2 3.29Å; R881-D883 PolarHBondContact O-N 2.99Å; R881-I884 HydrophobicContact CB-CD1 4.12Å; R881-I884 HydrophobicContact CB-CG1 4.35Å; R881-I884 PolarHBondContact O-N 3.14Å
882	S	86.8	Confident	90.3	Very high	97 Å²	97	67.7 Å²	67.7	68%	0.678	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	2.4	174.5	59.2	0	0	0	0	114.1	I884	S882-I884 VanDerWaalsContact C-N 3.33Å
883	D	90.6	Very high	90	Very high	71 Å²	71	72.2 Å²	72.2	38%	0.38	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-14.2	170.7	63.8	-59.7	0	0	0	113.3	R881	R881-D883 WeakPolarHBondContact CA-OD1 3.39Å; R881-D883 IonicContact CZ-OD1 2.69Å; R881-D883 IonicContact CZ-OD2 2.67Å; R881-D883 IonicContact NE-OD1 3.17Å; R881-D883 PolarHBondContact NE-OD1 3.14Å; R881-D883 IonicContact NE-OD2 3.1Å; R881-D883 PolarHBondContact NE-OD2 3.12Å; R881-D883 IonicContact NH2-OD1 3.7Å; R881-D883 IonicContact NH2-OD2 3.55Å; R881-D883 PolarHBondContact NH2-OD2 3.29Å; R881-D883 PolarHBondContact O-N 2.99Å
884	I	91.3	Very high	89.8	Confident	10 Å²	10	68.5 Å²	68.5	5%	0.051	35%	0.346	C	S	.	.	S	Bend	trans	-86.8	117.2	179.1	-48.7	-177.3	0	0	0	110.6	I835 L844 L876 R881 S882 L886	I835-I884 HydrophobicContact CG2-CD1 3.58Å; L844-I884 HydrophobicContact CB-CG2 4.01Å; L876-I884 HydrophobicContact CD1-CB 4.15Å; L876-I884 HydrophobicContact CD1-CG2 4.46Å; L876-I884 HydrophobicContact CD2-CD1 4.27Å; R881-I884 HydrophobicContact CB-CD1 4.12Å; R881-I884 HydrophobicContact CB-CG1 4.35Å; R881-I884 PolarHBondContact O-N 3.14Å; S882-I884 VanDerWaalsContact C-N 3.33Å; I884-L886 PolarHBondContact O-N 3.16Å
885	E	91.1	Very high	89.6	Confident	86 Å²	86	66.1 Å²	66.1	40%	0.402	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	109.6	171.1	-168.9	-174.2	151	0	0	110.3	Y842 K843 L844 L887	Y842-E885 WeakPolarHBondContact O-CB 3.36Å; Y842-E885 PolarHBondContact O-N 2.93Å; K843-E885 WeakPolarHBondContact CA-O 3.5Å; K843-E885 HydrophobicContact CG-CB 4.21Å; K843-E885 IonicContact NZ-OE1 3.61Å; K843-E885 PolarHBondContact NZ-OE1 2.97Å; K843-E885 IonicContact NZ-OE2 3.64Å; K843-E885 PolarHBondContact NZ-OE2 2.79Å; L844-E885 PolarHBondContact N-O 2.76Å; E885-L887 HydrophobicContact CG-CD1 4.44Å; E885-L887 HydrophobicContact CG-CD2 4.28Å; E885-L887 HydrophobicContact CG-CG 4.23Å
886	L	88.6	Confident	89.3	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	130.2	172.9	-75.1	174.7	0	0	0	111.6	L832 L844 I846 S872 R873 L876 I884	L832-L886 HydrophobicContact CD2-CD2 4.3Å; L844-L886 HydrophobicContact CB-CD2 4.08Å; L844-L886 HydrophobicContact CD2-CD2 3.84Å; L844-L886 HydrophobicContact CG-CD2 4.09Å; L844-L886 WeakPolarHBondContact O-CA 3.47Å; I846-L886 HydrophobicContact CG2-CD2 3.98Å; S872-L886 VanDerWaalsContact CB-CD1 3.48Å; R873-L886 HydrophobicContact CG-CB 4.3Å; R873-L886 HydrophobicContact CG-CD1 3.85Å; R873-L886 PolarHBondContact NH2-O 3.13Å; L876-L886 HydrophobicContact CD1-CD1 3.55Å; L876-L886 HydrophobicContact CD1-CD2 4.17Å; L876-L886 HydrophobicContact CD1-CG 3.75Å; I884-L886 PolarHBondContact O-N 3.16Å
887	L	77.1	Confident	89	Confident	56 Å²	56	75.9 Å²	75.9	29%	0.293	39%	0.389	S	S	.	.			trans	-130.3	0	-175.1	-63.5	172	0	0	0	112.6	L844 H845 I846 R865 E885	L844-L887 PolarHBondContact O-N 3.4Å; L844-L887 VanDerWaalsContact O-N 3.1Å; H845-L887 WeakPolarHBondContact CA-O 3.49Å; H845-L887 WeakPolarHBondContact CE1-CD1 3.47Å; H845-L887 WeakPolarHBondContact ND1-CB 3.17Å; I846-L887 PolarHBondContact N-O 3.47Å; R865-L887 PolarHBondContact NH2-OXT 3.15Å; E885-L887 HydrophobicContact CG-CD1 4.44Å; E885-L887 HydrophobicContact CG-CD2 4.28Å; E885-L887 HydrophobicContact CG-CG 4.23Å

Retrieved 887 of 887 residues in 148.3 ms (Link to these results)

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