A0A3Q0KIJ7_SCHMA Loading...

Fanconi anemia group M protein

AlphaFold DB , UniProt , Accession A0A3Q0KIJ7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,394 aa.

						>A0A3Q0KIJ7_SCHMA|A0A3Q0KIJ7
MRQTSLLRSWTSLIPSHPIISNNHASTVNSSSKTLKSVDSDDIFVANILDKFNNVPESNTNPHKNEVCENAQIIIDALERKPVVYHPTANDSEHLEGFDVDAGAEWIYPSDSSIRKYQLNIIEQCLYKNTLVCLPTGLGKTFVAAVVIYNFFRWYPTGRFVFMAPTRPLVTQQLTSCSEFIGPLKENIAEVTGSIAQNKRKTIWSTYQVLFLTPQVLMNDLQTGVCPANSIRLLIFDEAHKATGNHAYCQVLRILTNPPHTHRQFRIVALSATPAADIEGVQTLIANLLISHLELRTDTSADVRPYTQHRELEAVVVPLGPELTRYRNQLIECIRMPLDRLYQRGALSECYDLRPEKLAKYTIIKAREKWSSQTFPSINSTENSSIQCDFALVICLLHGLELLVQHGLRPLYRYLEGVYSGNRASSLVRSQLNKLPNMNHLWTELAQRFGMNVECTDGTWKQELIHADLLHSQAPFLAGHPKLDKLRDILLGHFNFEDRKNTHEQSSTRAIVFTQFRDSVEEIMHMLKPLKPLIRPASFIGQGTRVNGSPQLTNQYESPNLKNSRLSNAHSGISQRDQIRVMDGFRSGVYNTLVSTCIGEEGIDVGQVDLIVCFDASKSPIQLMQRQGRTGRKRLGRIVVLLTEGREERNHAVSIARTSSVHKALLEGNAYCKLAFYPHNPRMVPIGVHPKLQFKCLRIEKVFTNQISGQKQPGVQKKSSYEDIYRLHAESVKLDRLHIRLHPLALGRIQHISKSDDVDNFNSDHPTVTDIYNLTSQERLAVFRETMQSSLVPGSNVGSSSSSQHLMSILRLVEMHRHSMTQLSYHALGIRKIDINTKMSELIKISSSLPSSQLDLHSPSQCHHDLDELTTNTLPAPEISDPVLDIIQDLRMVKGLVSNKIFFDPRLSELTDCTKQFTQVLHSINTNSHEPITVASLQTALNKWLEFMIGQNHSSPTVSTSPKLNLKLSIENSLLEAINTELLISEEDSLTMKGLHTIDSKFHDKQLALMSQSTEVPSFDVVKDIVQAFSLPSTVISLAQSTPFGRGCVKQPIISSSSQVNPDEALALLENSTIHLDASTLLDEELTILELPTTAQSVVFAGSPFPQLSGFHKSVDLFTFETKLSLGTELGDIIKPTQTTEKMDTFSDLDRLKNGYFSTASNSSLDSQIDWSPVEQTTEVLNTGDLLYSSSPIKLSNIEAVPGNEFKNNNFSCETSDKELSGTSHESLSEFTLLNGLNKKVRNKNTKHAGSELFLSQAECTSNDSSDQFHPEDQDIYDDSFINDEYTNVTCDSSRSDMKMYLQSIRSPQIFPRNVRNPWTNKRNILPKISEKCDDMSNSFIFSQTPEQDEYQMDSFCVDDDDSPSLHKETHKLIASKPNRRRVRTGTQIQQPFF
					

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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	28.1	Very low	29	Very low	244 Å²	244	173.4 Å²	173.4	100%	1.202	85%	0.85	S	S	*	*				0	129.3	0	-64.1	170	174.1	0	0	106.6
2	R	29.6	Very low	28.8	Very low	229 Å²	229	166.6 Å²	166.6	86%	0.864	83%	0.833	S	S	*	*			cis	-115.5	153.5	3.5	-73.5	176.5	167.6	158.3	-5.3	112.2
3	Q	30.4	Very low	28.8	Very low	174 Å²	174	166.2 Å²	166.2	81%	0.813	83%	0.834	S	S	*	*			trans	54.1	84	149.4	-71.3	167.6	-44.8	0	0	120	S5	Q3-S5 PolarHBondContact O-N 3.14Å
4	T	29.6	Very low	28.8	Very low	140 Å²	140	165.6 Å²	165.6	86%	0.859	83%	0.832	S	S	*	*			trans	-65.5	107.4	135.6	36	0	0	0	0	110.2
5	S	29.4	Very low	29	Very low	106 Å²	106	162.3 Å²	162.3	74%	0.741	83%	0.827	S	S	*	*			trans	-174	106.2	161.4	-87.6	0	0	0	0	113.2	Q3	Q3-S5 PolarHBondContact O-N 3.14Å
6	L	29.1	Very low	29	Very low	147 Å²	147	158.3 Å²	158.3	77%	0.77	82%	0.818	S	S	*	*			trans	-172.6	37.5	139.4	-108.1	166.9	0	0	0	114.4	R8	L6-R8 PolarHBondContact O-N 3.41Å
7	L	28.5	Very low	29.1	Very low	180 Å²	180	160 Å²	160	94%	0.942	82%	0.821	S	S	*	*			trans	-84.4	49.4	176	-143.3	173.9	0	0	0	111.2
8	R	27.5	Very low	29.1	Very low	228 Å²	228	156.9 Å²	156.9	86%	0.86	81%	0.813	S	S	*	*			trans	-153.5	30.7	-165.8	-136.2	178.8	-163.6	-177.9	5.1	117	L6	L6-R8 PolarHBondContact O-N 3.41Å
9	S	28.4	Very low	29	Very low	75 Å²	75	156.7 Å²	156.7	52%	0.524	81%	0.812	S	S	.	*	S	Bend	trans	-131.4	-3.5	-178.7	58.1	0	0	0	0	116.4
10	W	29.2	Very low	29	Very low	248 Å²	248	156.7 Å²	156.7	94%	0.939	81%	0.811	S	S	*	*	S	Bend	trans	-113.6	24.4	-177.8	-91.6	58.7	0	0	0	114.1
11	T	29.7	Very low	28.9	Very low	136 Å²	136	153.3 Å²	153.3	83%	0.834	80%	0.801	S	S	*	*	S	Bend	trans	-130.5	39.9	175.5	53.2	0	0	0	0	112.1
12	S	26	Very low	28.8	Very low	92 Å²	92	147.8 Å²	147.8	64%	0.643	78%	0.777	S	S	*	*			trans	-157	72.5	178.9	60.2	0	0	0	0	113.2
13	L	29.2	Very low	28.8	Very low	161 Å²	161	142.4 Å²	142.4	84%	0.843	77%	0.765	S	S	*	*			trans	-157.8	56.9	160.1	-114.1	171.3	0	0	0	111.5	P15	L13-P15 WeakPolarHBondContact O-CD 3.45Å
14	I	28.4	Very low	28.9	Very low	158 Å²	158	142.1 Å²	142.1	81%	0.81	76%	0.763	S	S	*	*			trans	-95.6	108.4	162.7	-61.9	174.4	0	0	0	106.8	S16	I14-S16 PolarHBondContact O-N 3.21Å
15	P	32.1	Very low	28.8	Very low	116 Å²	116	139.7 Å²	139.7	75%	0.753	76%	0.758	S	S	*	*			trans	-82	93.3	174	-0.2	19.3	0	0	0	108.6	L13 H17	L13-P15 WeakPolarHBondContact O-CD 3.45Å; P15-H17 PolarHBondContact O-N 2.99Å
16	S	28.6	Very low	28.9	Very low	99 Å²	99	140.2 Å²	140.2	69%	0.692	76%	0.761	S	S	*	*			trans	-78	98.3	176	57.8	0	0	0	0	111.1	I14	I14-S16 PolarHBondContact O-N 3.21Å
17	H	31.6	Very low	28.9	Very low	187 Å²	187	138.8 Å²	138.8	87%	0.866	76%	0.759	S	S	*	*			trans	-138.2	151.1	159.5	-88.6	-63.2	0	0	0	112	P15	P15-H17 PolarHBondContact O-N 2.99Å
18	P	28.9	Very low	29	Very low	104 Å²	104	136.1 Å²	136.1	68%	0.675	75%	0.75	S	S	*	*			trans	-96.7	159.2	-154.5	37.2	-37.6	0	0	0	115.3
19	I	26.3	Very low	29.1	Very low	154 Å²	154	132.1 Å²	132.1	79%	0.79	75%	0.745	S	S	*	*			trans	9.9	116.3	138.4	-37.2	172.8	0	0	0	115.8
20	I	28.8	Very low	29.2	Very low	155 Å²	155	133.7 Å²	133.7	80%	0.795	76%	0.756	S	S	*	*				-176	115.3	122.4	-93.6	157.1	0	0	0	111.3
21	S	27.1	Very low	29.3	Very low	87 Å²	87	128 Å²	128	61%	0.608	75%	0.754	S	S	*	*			trans	19.5	139.2	152.6	73.8	0	0	0	0	124.4
22	N	27.5	Very low	29.2	Very low	128 Å²	128	127 Å²	127	68%	0.684	75%	0.753	S	S	*	*				86.1	109.3	128.9	-70.5	7.7	0	0	0	123
23	N	28.4	Very low	29.6	Very low	115 Å²	115	131.8 Å²	131.8	62%	0.615	76%	0.762	S	S	*	*				94	145.9	115.1	-68.4	4.4	0	0	0	122.5
24	H	32.9	Very low	29.9	Very low	168 Å²	168	129.6 Å²	129.6	78%	0.778	76%	0.756	S	S	*	*			trans	64	111.9	165.1	-50.9	-51.2	0	0	0	115.8
25	A	28.2	Very low	29.9	Very low	90 Å²	90	128.4 Å²	128.4	74%	0.744	75%	0.75	S	S	*	*			cis	84.1	149.5	31.4	0	0	0	0	0	115.8
26	S	30.9	Very low	29.8	Very low	116 Å²	116	132 Å²	132	81%	0.811	75%	0.754	S	S	*	*			trans	76.2	156.6	-178.2	79.4	0	0	0	0	117.4
27	T	28	Very low	30.1	Very low	118 Å²	118	132.7 Å²	132.7	72%	0.724	76%	0.759	S	S	*	*			cis	-172.4	-177.6	-30.9	-79.4	0	0	0	0	105.8
28	V	31.9	Very low	30	Very low	124 Å²	124	130 Å²	130	75%	0.752	76%	0.755	S	S	*	*			trans	90.2	105.2	163.7	-174.7	0	0	0	0	112.9
29	N	28.7	Very low	30.4	Very low	144 Å²	144	131.7 Å²	131.7	77%	0.77	76%	0.758	S	S	*	*				61.2	144	64.8	-68.7	-7.9	0	0	0	113.3
30	S	30	Very low	31	Very low	108 Å²	108	128.6 Å²	128.6	76%	0.755	75%	0.75	S	S	*	*			cis	-174.3	143.3	-10.9	47.2	0	0	0	0	108.6
31	S	32	Very low	31.5	Very low	127 Å²	127	126.7 Å²	126.7	89%	0.888	74%	0.742	S	S	*	*			trans	-154.9	108.7	164.4	60.7	0	0	0	0	112.9
32	S	28.5	Very low	32.2	Very low	116 Å²	116	129 Å²	129	81%	0.811	75%	0.748	S	S	*	*			trans	-102.1	146	-178.5	55.9	0	0	0	0	113
33	K	34.4	Very low	32.8	Very low	193 Å²	193	128.4 Å²	128.4	84%	0.839	74%	0.743	S	S	*	*			trans	-160.7	111	157.4	-112.7	166.4	-174.8	177.4	0	113.5
34	T	34	Very low	33.4	Very low	115 Å²	115	130 Å²	130	71%	0.706	75%	0.745	S	S	*	*				49.9	133.8	128.8	62.2	0	0	0	0	120.5
35	L	28.9	Very low	33.8	Very low	132 Å²	132	126 Å²	126	69%	0.691	73%	0.732	S	S	*	*			cis	-173.6	149.2	3.2	-147.1	77.3	0	0	0	110.7
36	K	30.4	Very low	34.3	Very low	193 Å²	193	124.1 Å²	124.1	84%	0.839	72%	0.717	S	S	*	*			trans	60.6	136.8	164.1	-61.8	165.3	-178.2	175.3	0	116.2
37	S	34.8	Very low	34.8	Very low	113 Å²	113	123.1 Å²	123.1	79%	0.79	70%	0.702	S	S	*	*			cis	-123.4	-170.7	29.3	46.5	0	0	0	0	113.9
38	V	30.4	Very low	35.4	Very low	130 Å²	130	121.3 Å²	121.3	79%	0.788	69%	0.687	S	S	*	*			trans	-139	129.3	-175.4	177.8	0	0	0	0	109.7
39	D	36	Very low	35.7	Very low	140 Å²	140	120.1 Å²	120.1	75%	0.749	68%	0.676	S	S	*	*			trans	-123.7	166.3	164.4	-80.4	-59	0	0	0	109.5	D41	D39-D41 PolarHBondContact O-N 3.19Å
40	S	39.7	Very low	36.3	Very low	89 Å²	89	118.5 Å²	118.5	62%	0.622	67%	0.668	S	S	*	*	S	Bend	trans	-76.4	-16.8	-158.2	43.4	0	0	0	0	117.3
41	D	39.7	Very low	37	Very low	115 Å²	115	121.5 Å²	121.5	62%	0.615	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	-27.3	-150.5	-60.3	-5.6	0	0	0	113.4	D39 I43 F44	D39-D41 PolarHBondContact O-N 3.19Å; D41-I43 PolarHBondContact O-N 2.8Å; D41-I43 VanDerWaalsContact O-N 3.16Å; D41-F44 WeakPolarHBondContact O-CB 3.47Å; D41-F44 PolarHBondContact O-N 2.96Å
42	D	40.5	Very low	37.4	Very low	136 Å²	136	123.2 Å²	123.2	73%	0.727	66%	0.659	S	S	*	*	H	α-helix	trans	-58.5	-30.2	177.4	-72.1	-27.6	0	0	0	112.8	F44 V45 A46	D42-F44 VanDerWaalsContact C-N 3.3Å; D42-F44 PolarHBondContact O-N 3.21Å; D42-V45 PolarHBondContact O-N 3.43Å; D42-A46 WeakPolarHBondContact O-CB 3.47Å; D42-A46 PolarHBondContact O-N 3.36Å; D42-A46 VanDerWaalsContact O-N 3.08Å
43	I	41	Very low	37.8	Very low	115 Å²	115	123.5 Å²	123.5	59%	0.59	65%	0.651	S	S	*	*	H	α-helix	trans	-68.8	-30.3	179.8	-62.6	176.8	0	0	0	111	D41 N47	D41-I43 PolarHBondContact O-N 2.8Å; D41-I43 VanDerWaalsContact O-N 3.16Å; I43-N47 WeakPolarHBondContact O-CB 3.48Å; I43-N47 PolarHBondContact O-N 3.37Å; I43-N47 PolarHBondContact O-ND2 2.85Å
44	F	39.7	Very low	37.9	Very low	148 Å²	148	120.2 Å²	120.2	65%	0.649	64%	0.643	S	S	*	*	H	α-helix	trans	-72.8	-45	177.4	-172.7	-108.7	0	0	0	111.3	D41 D42 N47 I48	D41-F44 WeakPolarHBondContact O-CB 3.47Å; D41-F44 PolarHBondContact O-N 2.96Å; D42-F44 VanDerWaalsContact C-N 3.3Å; D42-F44 PolarHBondContact O-N 3.21Å; F44-N47 PolarHBondContact O-N 3.48Å; F44-I48 HydrophobicContact CD1-CD1 3.98Å; F44-I48 HydrophobicContact CE1-CD1 3.56Å; F44-I48 HydrophobicContact CZ-CD1 3.93Å; F44-I48 PolarHBondContact O-N 3.43Å
45	V	41.3	Very low	38	Very low	83 Å²	83	120.5 Å²	120.5	50%	0.503	64%	0.644	S	S	.	*	H	α-helix	trans	-63.4	-44.1	179.2	-176.9	0	0	0	0	111.2	D42 N47 I48 L49	D42-V45 PolarHBondContact O-N 3.43Å; V45-N47 PolarHBondContact O-N 3.02Å; V45-I48 PolarHBondContact O-N 3.24Å; V45-L49 HydrophobicContact CG1-CD1 4.08Å; V45-L49 PolarHBondContact O-N 3.38Å; V45-L49 VanDerWaalsContact O-N 3.13Å
46	A	39.4	Very low	38.3	Very low	52 Å²	52	120 Å²	120	43%	0.43	65%	0.648	S	S	.	*	H	α-helix	trans	-59.3	-44	176	0	0	0	0	0	112.7	D42 I48 L49 D50	D42-A46 WeakPolarHBondContact O-CB 3.47Å; D42-A46 PolarHBondContact O-N 3.36Å; D42-A46 VanDerWaalsContact O-N 3.08Å; A46-I48 PolarHBondContact O-N 3.15Å; A46-L49 PolarHBondContact O-N 2.95Å; A46-D50 PolarHBondContact O-N 3.05Å
47	N	41.6	Very low	38.3	Very low	95 Å²	95	120 Å²	120	51%	0.508	65%	0.652	S	S	.	*	H	α-helix	trans	-68.9	-17.2	179.4	-86.8	-79	0	0	0	114.4	I43 F44 V45	I43-N47 WeakPolarHBondContact O-CB 3.48Å; I43-N47 PolarHBondContact O-N 3.37Å; I43-N47 PolarHBondContact O-ND2 2.85Å; F44-N47 PolarHBondContact O-N 3.48Å; V45-N47 PolarHBondContact O-N 3.02Å
48	I	41.6	Very low	38.2	Very low	79 Å²	79	119.2 Å²	119.2	41%	0.405	65%	0.646	S	S	.	*	H	α-helix	trans	-81.7	-48.3	170.3	-69.1	173	0	0	0	109.7	F44 V45 A46 D50 K51 F52	F44-I48 HydrophobicContact CD1-CD1 3.98Å; F44-I48 HydrophobicContact CE1-CD1 3.56Å; F44-I48 HydrophobicContact CZ-CD1 3.93Å; F44-I48 PolarHBondContact O-N 3.43Å; V45-I48 PolarHBondContact O-N 3.24Å; A46-I48 PolarHBondContact O-N 3.15Å; I48-D50 PolarHBondContact O-N 3.15Å; I48-K51 PolarHBondContact O-N 3.15Å; I48-F52 HydrophobicContact CG2-CD2 4.22Å; I48-F52 HydrophobicContact CG2-CE2 4.17Å; I48-F52 PolarHBondContact O-N 3.16Å
49	L	37.7	Very low	38.3	Very low	99 Å²	99	120.1 Å²	120.1	52%	0.518	65%	0.646	S	S	.	*	H	α-helix	trans	-61.8	-41.4	-177.7	-71.3	167.4	0	0	0	113.1	V45 A46 K51 F52 N53	V45-L49 HydrophobicContact CG1-CD1 4.08Å; V45-L49 PolarHBondContact O-N 3.38Å; V45-L49 VanDerWaalsContact O-N 3.13Å; A46-L49 PolarHBondContact O-N 2.95Å; L49-K51 PolarHBondContact O-N 3.25Å; L49-F52 PolarHBondContact O-N 2.89Å; L49-N53 PolarHBondContact O-N 3.09Å; L49-N53 PolarHBondContact O-ND2 3.18Å
50	D	40.2	Very low	38	Very low	111 Å²	111	120.2 Å²	120.2	59%	0.594	65%	0.652	S	S	*	*	H	α-helix	trans	-63.5	-23.3	178.2	-100.7	-0.3	0	0	0	113.7	A46 I48 N54	A46-D50 PolarHBondContact O-N 3.05Å; I48-D50 PolarHBondContact O-N 3.15Å; D50-N54 PolarHBondContact O-ND2 2.74Å
51	K	45.2	Very low	37.5	Very low	170 Å²	170	121.5 Å²	121.5	74%	0.739	65%	0.652	S	S	*	*	H	α-helix	trans	-81.1	-22.3	174.3	-71.5	179.4	-179.2	172.9	0	113.5	I48 L49	I48-K51 PolarHBondContact O-N 3.15Å; L49-K51 PolarHBondContact O-N 3.25Å
52	F	39.7	Very low	37.2	Very low	164 Å²	164	121 Å²	121	72%	0.719	66%	0.655	S	S	*	*	H	α-helix	trans	-82.8	-29.7	177.4	-90	-86.5	0	0	0	113.1	I48 L49 N54	I48-F52 HydrophobicContact CG2-CD2 4.22Å; I48-F52 HydrophobicContact CG2-CE2 4.17Å; I48-F52 PolarHBondContact O-N 3.16Å; L49-F52 PolarHBondContact O-N 2.89Å; F52-N54 VanDerWaalsContact C-N 3.3Å; F52-N54 PolarHBondContact O-N 3.46Å
53	N	38	Very low	36.9	Very low	121 Å²	121	120.8 Å²	120.8	65%	0.647	65%	0.649	S	S	*	*	S	Bend	trans	-81.1	5.8	-172.3	-69.3	-34.3	0	0	0	115.8	L49	L49-N53 PolarHBondContact O-N 3.09Å; L49-N53 PolarHBondContact O-ND2 3.18Å
54	N	36.4	Very low	36.5	Very low	125 Å²	125	121.7 Å²	121.7	67%	0.668	65%	0.649	S	S	*	*			trans	-127.5	46.4	-165.9	-78	-68	0	0	0	115.1	D50 F52	D50-N54 PolarHBondContact O-ND2 2.74Å; F52-N54 VanDerWaalsContact C-N 3.3Å; F52-N54 PolarHBondContact O-N 3.46Å
55	V	36.3	Very low	36.4	Very low	121 Å²	121	119.8 Å²	119.8	73%	0.733	65%	0.646	S	S	*	*			trans	-133.6	124.8	169.5	-175	0	0	0	0	110.8
56	P	35.3	Very low	36.7	Very low	120 Å²	120	120.5 Å²	120.5	78%	0.779	64%	0.643	S	S	*	*			trans	-68.7	148.1	-174.7	-22	33.8	0	0	0	115.4	S58	P56-S58 PolarHBondContact O-N 3.01Å
57	E	29.9	Very low	37.1	Very low	195 Å²	195	123 Å²	123	91%	0.911	65%	0.654	S	S	*	*			trans	-76.7	118.4	177.8	-60.6	-175.1	130.7	0	0	112.7
58	S	32.2	Very low	37.4	Very low	95 Å²	95	122.9 Å²	122.9	66%	0.664	66%	0.659	S	S	*	*			trans	-161.8	151.6	148.3	48.6	0	0	0	0	111.4	P56	P56-S58 PolarHBondContact O-N 3.01Å
59	N	33.2	Very low	38.3	Very low	150 Å²	150	125.1 Å²	125.1	80%	0.802	67%	0.667	S	S	*	*			trans	58.1	124.9	175.6	-63.9	-10.9	0	0	0	118.2
60	T	29	Very low	39.7	Very low	141 Å²	141	122.3 Å²	122.3	87%	0.865	65%	0.653	S	S	*	*			trans	-82.6	124	-179.5	48.7	0	0	0	0	111.8
61	N	29.2	Very low	41	Very low	116 Å²	116	119.2 Å²	119.2	62%	0.62	64%	0.643	S	S	*	*			trans	-125.9	132.5	167.6	-93.1	-16.4	0	0	0	108.9	H63 K64	N61-H63 PolarHBondContact O-N 2.68Å; N61-K64 PolarHBondContact O-N 2.86Å; N61-K64 VanDerWaalsContact O-N 3.08Å
62	P	33.9	Very low	42.3	Very low	105 Å²	105	116.1 Å²	116.1	68%	0.682	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.9	-29.9	-175.1	22.9	-33.2	0	0	0	113.6	K64 N65	P62-K64 PolarHBondContact O-N 3Å; P62-K64 VanDerWaalsContact O-N 3.1Å; P62-N65 PolarHBondContact O-N 2.76Å
63	H	35.4	Very low	43.8	Very low	132 Å²	132	109.8 Å²	109.8	61%	0.611	60%	0.604	S	S	*	*	H	α-helix	trans	-59.6	-18.5	175.3	-73.3	-47.8	0	0	0	114.8	N61 N65 E66 V67	N61-H63 PolarHBondContact O-N 2.68Å; H63-N65 VanDerWaalsContact C-N 3.28Å; H63-N65 PolarHBondContact O-N 3.02Å; H63-E66 IonicContact CE1-OE2 2.64Å; H63-E66 IonicContact CG-OE2 3.75Å; H63-E66 IonicContact ND1-OE2 3.32Å; H63-E66 PolarHBondContact ND1-OE2 3.04Å; H63-V67 WeakPolarHBondContact O-CG2 3.34Å; H63-V67 PolarHBondContact O-N 3.47Å
64	K	31	Very low	45.6	Very low	133 Å²	133	106.3 Å²	106.3	58%	0.578	59%	0.585	S	S	*	*	H	α-helix	trans	-66.3	-30.2	173.3	-78.3	-174.3	173.5	176.1	0	112.3	N61 P62	N61-K64 PolarHBondContact O-N 2.86Å; N61-K64 VanDerWaalsContact O-N 3.08Å; P62-K64 PolarHBondContact O-N 3Å; P62-K64 VanDerWaalsContact O-N 3.1Å
65	N	38.6	Very low	47.5	Very low	109 Å²	109	103.9 Å²	103.9	58%	0.583	57%	0.572	S	S	*	*	H	α-helix	trans	-78.7	-45.9	-178.7	-69.3	22.4	0	0	0	111.4	P62 H63 V67 C68 E69	P62-N65 PolarHBondContact O-N 2.76Å; H63-N65 VanDerWaalsContact C-N 3.28Å; H63-N65 PolarHBondContact O-N 3.02Å; N65-V67 VanDerWaalsContact C-N 3.26Å; N65-V67 PolarHBondContact O-N 2.98Å; N65-C68 PolarHBondContact O-N 3.02Å; N65-E69 PolarHBondContact O-N 3.48Å
66	E	46.5	Very low	49.5	Very low	97 Å²	97	100.7 Å²	100.7	45%	0.453	55%	0.55	S	S	.	*	H	α-helix	trans	-55.6	-40.4	178.7	-67.7	-178.5	122.9	0	0	112.2	H63 C68 N70	H63-E66 IonicContact CE1-OE2 2.64Å; H63-E66 IonicContact CG-OE2 3.75Å; H63-E66 IonicContact ND1-OE2 3.32Å; H63-E66 PolarHBondContact ND1-OE2 3.04Å; E66-C68 VanDerWaalsContact C-N 3.34Å; E66-C68 PolarHBondContact O-N 2.91Å; E66-N70 WeakPolarHBondContact O-CB 3.47Å; E66-N70 PolarHBondContact O-N 2.85Å; E66-N70 PolarHBondContact O-ND2 2.79Å
67	V	48.6	Very low	51.4	Low	106 Å²	106	95.2 Å²	95.2	64%	0.642	52%	0.515	S	S	*	.	H	α-helix	trans	-65.1	-38.4	178.5	174.7	0	0	0	0	111.5	H63 N65 A71	H63-V67 WeakPolarHBondContact O-CG2 3.34Å; H63-V67 PolarHBondContact O-N 3.47Å; N65-V67 VanDerWaalsContact C-N 3.26Å; N65-V67 PolarHBondContact O-N 2.98Å; V67-A71 WeakPolarHBondContact O-CB 3.39Å; V67-A71 PolarHBondContact O-N 3.42Å; V67-A71 VanDerWaalsContact O-N 3.17Å
68	C	47.8	Very low	53.6	Low	91 Å²	91	90.8 Å²	90.8	62%	0.615	50%	0.497	S	S	*	.	H	α-helix	trans	-73.4	-39.8	179.9	-159.8	0	0	0	0	112.4	N65 E66 A71 Q72	N65-C68 PolarHBondContact O-N 3.02Å; E66-C68 VanDerWaalsContact C-N 3.34Å; E66-C68 PolarHBondContact O-N 2.91Å; C68-A71 PolarHBondContact O-N 2.86Å; C68-Q72 PolarHBondContact O-N 2.86Å
69	E	59.3	Low	55.6	Low	126 Å²	126	93.5 Å²	93.5	59%	0.589	50%	0.499	S	S	*	.	H	α-helix	trans	-65.3	-45.7	176.2	-71.4	179.1	-179.5	0	0	111.7	N65 A71 Q72 I73	N65-E69 PolarHBondContact O-N 3.48Å; E69-A71 VanDerWaalsContact C-N 3.29Å; E69-A71 PolarHBondContact O-N 3.03Å; E69-Q72 PolarHBondContact O-N 3.24Å; E69-I73 VanDerWaalsContact O-CG1 3.29Å; E69-I73 WeakPolarHBondContact O-CG1 3.37Å; E69-I73 PolarHBondContact O-N 3.33Å
70	N	67.7	Low	57.4	Low	40 Å²	40	89.6 Å²	89.6	21%	0.214	47%	0.474	C	S	.	.	H	α-helix	trans	-61.5	-37.1	175.9	-75.6	-67.7	0	0	0	111.7	E66 I73 I74 I114	E66-N70 WeakPolarHBondContact O-CB 3.47Å; E66-N70 PolarHBondContact O-N 2.85Å; E66-N70 PolarHBondContact O-ND2 2.79Å; N70-I73 PolarHBondContact O-N 3.5Å; N70-I74 WeakPolarHBondContact O-CB 3.28Å; N70-I74 WeakPolarHBondContact O-CD1 3.18Å; N70-I74 VanDerWaalsContact O-CG1 3.23Å; N70-I74 WeakPolarHBondContact O-CG1 3.06Å; N70-I74 PolarHBondContact O-N 3.33Å; N70-I114 HydrophobicContact CB-CD1 4.32Å; N70-I114 WeakPolarHBondContact OD1-CB 3.27Å; N70-I114 WeakPolarHBondContact OD1-CG1 3.49Å; N70-I114 PolarHBondContact OD1-N 3.46Å
71	A	68.1	Low	59.2	Low	46 Å²	46	91.8 Å²	91.8	38%	0.38	47%	0.471	S	S	.	.	H	α-helix	trans	-61.7	-46.6	177.5	0	0	0	0	0	112.3	V67 C68 E69 I74 I75	V67-A71 WeakPolarHBondContact O-CB 3.39Å; V67-A71 PolarHBondContact O-N 3.42Å; V67-A71 VanDerWaalsContact O-N 3.17Å; C68-A71 PolarHBondContact O-N 2.86Å; E69-A71 VanDerWaalsContact C-N 3.29Å; E69-A71 PolarHBondContact O-N 3.03Å; A71-I74 PolarHBondContact O-N 2.68Å; A71-I75 WeakPolarHBondContact O-CG1 3.33Å; A71-I75 PolarHBondContact O-N 2.94Å; A71-I75 VanDerWaalsContact O-N 3.09Å
72	Q	72.3	Confident	61	Low	105 Å²	105	91.2 Å²	91.2	49%	0.491	47%	0.473	S	S	.	.	H	α-helix	trans	-64.5	-42.2	176.3	-173.5	60	51.6	0	0	111.6	C68 E69 I74 I75 D76	C68-Q72 PolarHBondContact O-N 2.86Å; E69-Q72 PolarHBondContact O-N 3.24Å; Q72-I74 VanDerWaalsContact C-N 3.26Å; Q72-I74 PolarHBondContact O-N 3.41Å; Q72-I75 PolarHBondContact O-N 3.4Å; Q72-I75 VanDerWaalsContact O-N 3.17Å; Q72-D76 PolarHBondContact NE2-OD1 2.96Å; Q72-D76 WeakPolarHBondContact O-CB 3.28Å; Q72-D76 PolarHBondContact O-N 2.98Å
73	I	71.6	Confident	62.6	Low	32 Å²	32	87.9 Å²	87.9	16%	0.164	45%	0.451	C	S	.	.	H	α-helix	trans	-63.2	-32.4	178.1	-64.8	165.9	0	0	0	111.7	E69 N70 A77 I114	E69-I73 VanDerWaalsContact O-CG1 3.29Å; E69-I73 WeakPolarHBondContact O-CG1 3.37Å; E69-I73 PolarHBondContact O-N 3.33Å; N70-I73 PolarHBondContact O-N 3.5Å; I73-A77 WeakPolarHBondContact O-CB 3.47Å; I73-A77 PolarHBondContact O-N 3.23Å; I73-A77 VanDerWaalsContact O-N 3.09Å; I73-I114 HydrophobicContact CG2-CB 4.2Å; I73-I114 HydrophobicContact CG2-CG2 3.59Å
74	I	76.2	Confident	63.8	Low	48 Å²	48	86.6 Å²	86.6	25%	0.246	45%	0.452	C	S	.	.	H	α-helix	trans	-68.2	-45	173.4	-72.7	163.4	0	0	0	111	N70 A71 Q72 A77 L78 I114 F694	N70-I74 WeakPolarHBondContact O-CB 3.28Å; N70-I74 WeakPolarHBondContact O-CD1 3.18Å; N70-I74 VanDerWaalsContact O-CG1 3.23Å; N70-I74 WeakPolarHBondContact O-CG1 3.06Å; N70-I74 PolarHBondContact O-N 3.33Å; A71-I74 PolarHBondContact O-N 2.68Å; Q72-I74 VanDerWaalsContact C-N 3.26Å; Q72-I74 PolarHBondContact O-N 3.41Å; I74-A77 PolarHBondContact O-N 3.06Å; I74-L78 HydrophobicContact CG2-CD1 3.8Å; I74-L78 HydrophobicContact CG2-CG 4.46Å; I74-L78 WeakPolarHBondContact O-CG 3.48Å; I74-L78 PolarHBondContact O-N 3.44Å; I74-I114 HydrophobicContact CD1-CD1 3.7Å; I74-I114 HydrophobicContact CG1-CD1 3.56Å; I74-F694 HydrophobicContact CB-CD2 4.49Å; I74-F694 HydrophobicContact CB-CE2 4.18Å; I74-F694 HydrophobicContact CG1-CD1 4.28Å; I74-F694 HydrophobicContact CG1-CD2 4.08Å; I74-F694 HydrophobicContact CG1-CE1 4.17Å; I74-F694 HydrophobicContact CG1-CE2 3.95Å; I74-F694 HydrophobicContact CG1-CG 4.24Å; I74-F694 HydrophobicContact CG1-CZ 3.99Å; I74-F694 HydrophobicContact CG2-CD2 3.89Å; I74-F694 HydrophobicContact CG2-CE2 3.87Å
75	I	76.5	Confident	65.6	Low	74 Å²	74	81.9 Å²	81.9	38%	0.379	43%	0.431	S	S	.	.	H	α-helix	trans	-61.7	-54.6	177.7	-65.7	163.9	0	0	0	110	A71 Q72 A77 L78 E79	A71-I75 WeakPolarHBondContact O-CG1 3.33Å; A71-I75 PolarHBondContact O-N 2.94Å; A71-I75 VanDerWaalsContact O-N 3.09Å; Q72-I75 PolarHBondContact O-N 3.4Å; Q72-I75 VanDerWaalsContact O-N 3.17Å; I75-A77 PolarHBondContact O-N 2.94Å; I75-L78 PolarHBondContact O-N 3.44Å; I75-E79 HydrophobicContact CG2-CG 4.31Å; I75-E79 WeakPolarHBondContact CG2-OE1 3.23Å; I75-E79 PolarHBondContact O-N 3.49Å
76	D	76.8	Confident	67	Low	54 Å²	54	80.7 Å²	80.7	29%	0.289	42%	0.422	S	S	.	.	H	α-helix	trans	-46.2	-37.5	171.4	-90	45.4	0	0	0	113	Q72 R80 K116	Q72-D76 PolarHBondContact NE2-OD1 2.96Å; Q72-D76 WeakPolarHBondContact O-CB 3.28Å; Q72-D76 PolarHBondContact O-N 2.98Å; D76-R80 PolarHBondContact O-N 3.2Å; D76-K116 IonicContact OD2-NZ 3.49Å; D76-K116 PolarHBondContact OD2-NZ 2.89Å
77	A	76	Confident	68.1	Low	5 Å²	5	81 Å²	81	4%	0.041	43%	0.432	C	S	.	.	H	α-helix	trans	-86	-20.5	-175.6	0	0	0	0	0	114.3	I73 I74 I75 R80 L119 L692 F694	I73-A77 WeakPolarHBondContact O-CB 3.47Å; I73-A77 PolarHBondContact O-N 3.23Å; I73-A77 VanDerWaalsContact O-N 3.09Å; I74-A77 PolarHBondContact O-N 3.06Å; I75-A77 PolarHBondContact O-N 2.94Å; A77-R80 PolarHBondContact O-NH1 3.47Å; A77-L119 HydrophobicContact CB-CD1 3.6Å; A77-L692 HydrophobicContact CB-CD2 4.07Å; A77-F694 HydrophobicContact CB-CE2 4.34Å; A77-F694 HydrophobicContact CB-CZ 3.99Å
78	L	76.6	Confident	69.1	Low	101 Å²	101	77.8 Å²	77.8	53%	0.529	41%	0.413	S	S	.	.	H	α-helix	trans	-91.7	-28.8	175.6	-68.2	171.4	0	0	0	112.1	I74 I75 L692 F694	I74-L78 HydrophobicContact CG2-CD1 3.8Å; I74-L78 HydrophobicContact CG2-CG 4.46Å; I74-L78 WeakPolarHBondContact O-CG 3.48Å; I74-L78 PolarHBondContact O-N 3.44Å; I75-L78 PolarHBondContact O-N 3.44Å; L78-L692 HydrophobicContact CD2-CD2 4.45Å; L78-L692 HydrophobicContact CD2-CG 4.38Å; L78-F694 HydrophobicContact CD2-CE2 4.39Å; L78-F694 HydrophobicContact CG-CE2 4.31Å
79	E	73.3	Confident	70	Confident	153 Å²	153	78.5 Å²	78.5	72%	0.715	43%	0.426	S	S	*	.	H	α-helix	trans	-82.5	-15.6	176	-67	-179.5	176.6	0	0	113.6	I75 K81	I75-E79 HydrophobicContact CG2-CG 4.31Å; I75-E79 WeakPolarHBondContact CG2-OE1 3.23Å; I75-E79 PolarHBondContact O-N 3.49Å; E79-K81 PolarHBondContact O-N 3.22Å
80	R	70.5	Confident	70.5	Confident	68 Å²	68	75.1 Å²	75.1	26%	0.257	41%	0.411	S	S	.	.	S	Bend	trans	-58.3	136.7	178.1	-163.7	-156.8	-65.7	86.2	1.1	110.9	D76 A77 L119 N120	D76-R80 PolarHBondContact O-N 3.2Å; A77-R80 PolarHBondContact O-NH1 3.47Å; R80-L119 VanDerWaalsContact NH2-CD2 3.34Å; R80-N120 PolarHBondContact NH2-OD1 3.49Å
81	K	66.7	Low	70.8	Confident	186 Å²	186	74.4 Å²	74.4	81%	0.809	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-54.3	130.4	165.2	-66.7	179.8	-178.4	175.5	0	109.7	E79	E79-K81 PolarHBondContact O-N 3.22Å
82	P	67.1	Low	71.3	Confident	104 Å²	104	74.1 Å²	74.1	68%	0.675	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-58	149.7	174.1	-24.6	34.1	0	0	0	111.6	V84	P82-V84 PolarHBondContact O-N 3.39Å; P82-V84 VanDerWaalsContact O-N 3.11Å
83	V	67.1	Low	71.6	Confident	35 Å²	35	76.9 Å²	76.9	21%	0.212	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-57.3	118.1	174.1	172.2	0	0	0	0	110.1	Y85 E123	V83-Y85 PolarHBondContact O-N 3Å; V83-E123 VanDerWaalsContact CG2-CD 3.48Å; V83-E123 HydrophobicContact CG2-CG 3.85Å; V83-E123 WeakPolarHBondContact CG2-OE1 3.19Å
84	V	62.3	Low	72.1	Confident	105 Å²	105	82.2 Å²	82.2	64%	0.636	44%	0.44	S	S	*	.	P	Polyproline II helix	trans	-65.5	123.5	172.3	-168.4	0	0	0	0	107.9	P82 H86	P82-V84 PolarHBondContact O-N 3.39Å; P82-V84 VanDerWaalsContact O-N 3.11Å; V84-H86 VanDerWaalsContact CG1-CE1 3.44Å; V84-H86 WeakPolarHBondContact CG1-CE1 3.11Å; V84-H86 WeakPolarHBondContact CG1-NE2 3.21Å
85	Y	69	Low	72.7	Confident	35 Å²	35	80.7 Å²	80.7	14%	0.137	43%	0.432	C	S	.	.			trans	-118.8	122.7	178.5	178.8	-83.7	0	0	0	108.6	V83 D91 N680 R682	V83-Y85 PolarHBondContact O-N 3Å; Y85-D91 VanDerWaalsContact CE1-OD2 3.23Å; Y85-D91 WeakPolarHBondContact CE1-OD2 3.23Å; Y85-D91 PolarHBondContact OH-OD1 3.48Å; Y85-D91 PolarHBondContact OH-OD2 2.74Å; Y85-N680 PolarHBondContact OH-O 3.15Å; Y85-R682 HydrophobicContact CD1-CG 4Å; Y85-R682 HydrophobicContact CD2-CG 4.4Å; Y85-R682 HydrophobicContact CE1-CB 3.83Å; Y85-R682 VanDerWaalsContact CE1-CD 3.43Å; Y85-R682 HydrophobicContact CE1-CG 3.65Å; Y85-R682 HydrophobicContact CE2-CB 4.24Å; Y85-R682 HydrophobicContact CE2-CG 4.06Å; Y85-R682 HydrophobicContact CG-CG 4.37Å; Y85-R682 WeakPolarHBondContact OH-CB 3.13Å; Y85-R682 PolarHBondContact OH-N 3.05Å
86	H	67.9	Low	73.2	Confident	84 Å²	84	82.7 Å²	82.7	39%	0.389	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-93.6	117.3	-176.4	-52.7	-88	0	0	0	107.9	V84 T88 E1175	V84-H86 VanDerWaalsContact CG1-CE1 3.44Å; V84-H86 WeakPolarHBondContact CG1-CE1 3.11Å; V84-H86 WeakPolarHBondContact CG1-NE2 3.21Å; H86-T88 PolarHBondContact O-N 3.4Å; H86-E1175 IonicContact CE1-OE1 3.68Å; H86-E1175 PolarHBondContact CE1-OE1 2.72Å; H86-E1175 VanDerWaalsContact CE1-OE1 3.27Å; H86-E1175 IonicContact CE1-OE2 2.69Å; H86-E1175 PolarHBondContact CE1-OE2 2.77Å; H86-E1175 IonicContact CG-OE1 3.33Å; H86-E1175 VanDerWaalsContact ND1-CD 3.29Å; H86-E1175 IonicContact ND1-OE1 2.99Å; H86-E1175 PolarHBondContact ND1-OE1 3.1Å; H86-E1175 IonicContact ND1-OE2 3.37Å; H86-E1175 PolarHBondContact ND1-OE2 3.26Å
87	P	67.7	Low	73.8	Confident	103 Å²	103	81.6 Å²	81.6	67%	0.669	44%	0.441	S	S	*	.	P	Polyproline II helix	trans	-56.6	128.9	-177.3	-27.3	36.1	0	0	0	112.7
88	T	69.8	Low	74.6	Confident	38 Å²	38	82.5 Å²	82.5	23%	0.233	44%	0.444	C	S	.	.	P	Polyproline II helix	trans	-96.2	161.1	174.5	75.9	0	0	0	0	110.4	H86 N90 D91 N680	H86-T88 PolarHBondContact O-N 3.4Å; T88-N90 PolarHBondContact O-N 3.26Å; T88-N90 PolarHBondContact OG1-N 2.94Å; T88-D91 PolarHBondContact N-OD2 2.77Å; T88-D91 WeakPolarHBondContact O-CB 3.44Å; T88-D91 PolarHBondContact O-N 2.85Å; T88-D91 PolarHBondContact OG1-OD2 3.03Å; T88-D91 VanDerWaalsContact OG1-OD2 3.1Å; T88-N680 PolarHBondContact OG1-O 2.87Å
89	A	66.7	Low	75.4	Confident	107 Å²	107	80.4 Å²	80.4	88%	0.884	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-4.2	175.6	0	0	0	0	0	114.6
90	N	70	Confident	76.2	Confident	54 Å²	54	77.2 Å²	77.2	29%	0.289	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-5.6	175.7	-66.1	9.9	0	0	0	112.8	T88 H679	T88-N90 PolarHBondContact O-N 3.26Å; T88-N90 PolarHBondContact OG1-N 2.94Å; N90-H679 VanDerWaalsContact ND2-CB 3.33Å; N90-H679 WeakPolarHBondContact ND2-CB 3.46Å; N90-H679 PolarHBondContact ND2-ND1 2.92Å; N90-H679 PolarHBondContact OD1-ND1 3.34Å; N90-H679 VanDerWaalsContact OD1-ND1 3.14Å
91	D	75.1	Confident	77.2	Confident	25 Å²	25	80.6 Å²	80.6	13%	0.134	45%	0.448	C	S	.	.			trans	-83.9	147.1	-175.8	-64.3	-36.8	0	0	0	111.7	Y85 T88 R682 I686	Y85-D91 VanDerWaalsContact CE1-OD2 3.23Å; Y85-D91 WeakPolarHBondContact CE1-OD2 3.23Å; Y85-D91 PolarHBondContact OH-OD1 3.48Å; Y85-D91 PolarHBondContact OH-OD2 2.74Å; T88-D91 PolarHBondContact N-OD2 2.77Å; T88-D91 WeakPolarHBondContact O-CB 3.44Å; T88-D91 PolarHBondContact O-N 2.85Å; T88-D91 PolarHBondContact OG1-OD2 3.03Å; T88-D91 VanDerWaalsContact OG1-OD2 3.1Å; D91-R682 WeakPolarHBondContact OD1-CB 3.4Å; D91-R682 PolarHBondContact OD1-N 3.38Å; D91-I686 HydrophobicContact CB-CD1 4.07Å; D91-I686 HydrophobicContact CB-CG1 4.2Å
92	S	77.9	Confident	78.4	Confident	40 Å²	40	72.4 Å²	72.4	28%	0.28	41%	0.414	S	S	.	.			trans	-135.4	146.4	-170.6	-176.7	0	0	0	0	111.2	H94 P685 I686	S92-H94 WeakPolarHBondContact CB-O 3.26Å; S92-H94 PolarHBondContact OG-N 2.92Å; S92-H94 PolarHBondContact OG-O 3.23Å; S92-P685 WeakPolarHBondContact O-CA 3.38Å; S92-I686 PolarHBondContact O-N 3.21Å; S92-I686 VanDerWaalsContact O-N 3.13Å
93	E	79	Confident	79.4	Confident	163 Å²	163	67.4 Å²	67.4	76%	0.762	38%	0.382	S	S	*	.	S	Bend	trans	-70.3	-20.7	165.6	-63	178.6	171.2	0	0	111.7	I686	E93-I686 HydrophobicContact CG-CB 4.22Å
94	H	82.9	Confident	80.5	Confident	144 Å²	144	68.3 Å²	68.3	67%	0.667	39%	0.393	S	S	*	.			trans	-125.2	112.9	178.5	-175.2	-72	0	0	0	111	S92	S92-H94 WeakPolarHBondContact CB-O 3.26Å; S92-H94 PolarHBondContact OG-N 2.92Å; S92-H94 PolarHBondContact OG-O 3.23Å
95	L	88.5	Confident	82	Confident	17 Å²	17	64.8 Å²	64.8	9%	0.089	37%	0.37	C	S	.	.			trans	-110.1	122.4	171.6	-63.9	177.2	0	0	0	109.1	G97 F98 Y155 P685	L95-G97 PolarHBondContact O-N 2.84Å; L95-F98 HydrophobicContact CB-CB 3.96Å; L95-F98 VanDerWaalsContact O-CB 3.31Å; L95-F98 WeakPolarHBondContact O-CB 3.43Å; L95-F98 PolarHBondContact O-N 2.88Å; L95-F98 VanDerWaalsContact O-N 3.1Å; L95-Y155 WeakPolarHBondContact CD1-OH 3.5Å; L95-P685 HydrophobicContact CB-CG 4.37Å; L95-P685 HydrophobicContact CD1-CG 4.18Å; L95-P685 HydrophobicContact CG-CG 4.29Å
96	E	86.7	Confident	83.1	Confident	116 Å²	116	63.3 Å²	63.3	54%	0.542	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	123.3	-173.6	174.5	-160.1	-148.6	0	0	111.7	F98 R232	E96-F98 VanDerWaalsContact C-N 3.32Å; E96-R232 PolarHBondContact O-NE 2.86Å; E96-R232 PolarHBondContact O-NH2 3.37Å; E96-R232 IonicContact OE2-CZ 3.92Å; E96-R232 IonicContact OE2-NH2 2.71Å; E96-R232 PolarHBondContact OE2-NH2 2.82Å
97	G	88.5	Confident	84.3	Confident	31 Å²	31	59.6 Å²	59.6	32%	0.32	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.2	11.7	-178.8	0	0	0	0	0	114.6	L95 Y155 P156	L95-G97 PolarHBondContact O-N 2.84Å; G97-Y155 WeakPolarHBondContact O-CA 3.37Å; G97-P156 WeakPolarHBondContact O-CD 3.45Å
98	F	92.9	Very high	85.4	Confident	24 Å²	24	54.7 Å²	54.7	11%	0.105	32%	0.315	C	S	.	.			trans	-78.8	126.9	174.7	-171.1	-87.8	0	0	0	111.7	L95 E96 V100 W154 Y155 V684 P685	L95-F98 HydrophobicContact CB-CB 3.96Å; L95-F98 VanDerWaalsContact O-CB 3.31Å; L95-F98 WeakPolarHBondContact O-CB 3.43Å; L95-F98 PolarHBondContact O-N 2.88Å; L95-F98 VanDerWaalsContact O-N 3.1Å; E96-F98 VanDerWaalsContact C-N 3.32Å; F98-V100 HydrophobicContact CD1-CG2 4.37Å; F98-W154 CarbonylContact C-O 3.56Å; F98-W154 VanDerWaalsContact CA-O 3.25Å; F98-W154 WeakPolarHBondContact CA-O 3.49Å; F98-W154 HydrophobicContact CD2-CB 4.21Å; F98-W154 HydrophobicContact CE2-CB 3.82Å; F98-W154 HydrophobicContact CE2-CD2 4.32Å; F98-W154 HydrophobicContact CE2-CE3 4.41Å; F98-W154 HydrophobicContact CE2-CG 4.12Å; F98-W154 HydrophobicContact CZ-CB 4.46Å; F98-W154 HydrophobicContact CZ-CG 4.44Å; F98-Y155 HydrophobicContact CB-CD1 4.4Å; F98-Y155 HydrophobicContact CB-CE1 3.95Å; F98-Y155 HydrophobicContact CD2-CE1 4.05Å; F98-Y155 AromaticContact CD2-CE2 3.97Å; F98-Y155 HydrophobicContact CD2-CE2 3.97Å; F98-Y155 AromaticContact CD2-CZ 3.7Å; F98-V684 HydrophobicContact CE2-CG2 4.41Å; F98-V684 HydrophobicContact CZ-CG1 4.1Å; F98-P685 HydrophobicContact CB-CG 4.37Å; F98-P685 VanDerWaalsContact CD1-CD 3.44Å; F98-P685 HydrophobicContact CD1-CG 3.47Å; F98-P685 VanDerWaalsContact CD1-CG 3.47Å; F98-P685 HydrophobicContact CD2-CG 4.41Å; F98-P685 HydrophobicContact CE1-CG 3.76Å; F98-P685 HydrophobicContact CG-CG 3.84Å; F98-P685 HydrophobicContact CZ-CG 4.35Å
99	D	93.4	Very high	86.2	Confident	56 Å²	56	52.9 Å²	52.9	30%	0.299	30%	0.304	S	S	.	.			trans	-86.4	116	172.5	-178.9	-27.8	0	0	0	109.8	D101 A102 G103 W154 P156	D99-D101 PolarHBondContact OD1-N 3.25Å; D99-A102 HydrophobicContact CB-CB 3.9Å; D99-A102 VanDerWaalsContact CG-CB 3.46Å; D99-A102 PolarHBondContact OD1-N 3.24Å; D99-G103 WeakPolarHBondContact O-CA 3.16Å; D99-G103 PolarHBondContact O-N 3.37Å; D99-W154 PolarHBondContact N-O 3.24Å; D99-P156 HydrophobicContact CB-CG 3.87Å
100	V	90.7	Very high	86.9	Confident	86 Å²	86	50.4 Å²	50.4	52%	0.521	28%	0.28	S	S	.	.	H	α-helix	trans	-72.7	-35.4	-176.1	-178.8	0	0	0	0	112.3	F98 G103 A104 V688	F98-V100 HydrophobicContact CD1-CG2 4.37Å; V100-G103 CarbonylContact O-C 3.6Å; V100-G103 PolarHBondContact O-N 3.29Å; V100-A104 PolarHBondContact O-N 3.37Å; V100-A104 VanDerWaalsContact O-N 3.07Å; V100-V688 HydrophobicContact CG1-CG2 4.42Å
101	D	91.3	Very high	87	Confident	140 Å²	140	49.4 Å²	49.4	75%	0.749	27%	0.274	S	S	*	.	H	α-helix	trans	-74.6	-42.9	-178.8	-70.3	-31.3	0	0	0	110.3	D99 G103 A104	D99-D101 PolarHBondContact OD1-N 3.25Å; D101-G103 VanDerWaalsContact C-N 3.29Å; D101-A104 PolarHBondContact O-N 3.42Å
102	A	90.8	Very high	86.7	Confident	13 Å²	13	49.3 Å²	49.3	11%	0.107	28%	0.276	C	S	.	.	H	α-helix	trans	-66.4	-32.9	169.7	0	0	0	0	0	112.2	D99 A104 R153 W154	D99-A102 HydrophobicContact CB-CB 3.9Å; D99-A102 VanDerWaalsContact CG-CB 3.46Å; D99-A102 PolarHBondContact OD1-N 3.24Å; A102-A104 VanDerWaalsContact C-N 3.31Å; A102-A104 PolarHBondContact O-N 3.16Å; A102-R153 HydrophobicContact CB-CB 4.25Å; A102-R153 VanDerWaalsContact CB-O 3.31Å; A102-R153 WeakPolarHBondContact CB-O 3.26Å; A102-W154 VanDerWaalsContact O-CD1 3.26Å; A102-W154 PolarHBondContact O-NE1 2.78Å; A102-W154 VanDerWaalsContact O-NE1 3.13Å
103	G	89.3	Confident	86.7	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-69.7	-18.2	177.2	0	0	0	0	0	115.2	D99 V100 D101 E105 V688 P690	D99-G103 WeakPolarHBondContact O-CA 3.16Å; D99-G103 PolarHBondContact O-N 3.37Å; V100-G103 CarbonylContact O-C 3.6Å; V100-G103 PolarHBondContact O-N 3.29Å; D101-G103 VanDerWaalsContact C-N 3.29Å; G103-E105 PolarHBondContact O-N 3.39Å; G103-V688 WeakPolarHBondContact O-CG1 3.13Å; G103-P690 WeakPolarHBondContact O-CB 3.44Å; G103-P690 VanDerWaalsContact O-CG 3.3Å; G103-P690 WeakPolarHBondContact O-CG 3.04Å
104	A	90.7	Very high	86.9	Confident	53 Å²	53	42.8 Å²	42.8	44%	0.438	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-16.2	177.7	0	0	0	0	0	113.6	V100 D101 A102 K691	V100-A104 PolarHBondContact O-N 3.37Å; V100-A104 VanDerWaalsContact O-N 3.07Å; D101-A104 PolarHBondContact O-N 3.42Å; A102-A104 VanDerWaalsContact C-N 3.31Å; A102-A104 PolarHBondContact O-N 3.16Å; A104-K691 PolarHBondContact O-N 3.15Å
105	E	92.7	Very high	87.1	Confident	32 Å²	32	38.7 Å²	38.7	15%	0.15	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	142.8	-179.1	48.4	156.1	-102.1	0	0	113.5	G103 R153 W154 K691 Q693 K695	G103-E105 PolarHBondContact O-N 3.39Å; E105-R153 PolarHBondContact O-NH1 3.29Å; E105-R153 IonicContact OE1-CZ 2.64Å; E105-R153 IonicContact OE1-NH1 2.99Å; E105-R153 IonicContact OE1-NH2 3.56Å; E105-R153 PolarHBondContact OE1-NH2 3.04Å; E105-W154 PolarHBondContact O-NE1 3.36Å; E105-K691 CarbonylContact C-O 3.53Å; E105-K691 VanDerWaalsContact CA-O 3.27Å; E105-K691 WeakPolarHBondContact CA-O 3.41Å; E105-Q693 HydrophobicContact CB-CG 4.38Å; E105-Q693 PolarHBondContact OE2-NE2 3.46Å; E105-Q693 PolarHBondContact OE2-OE1 3Å; E105-Q693 VanDerWaalsContact OE2-OE1 3.1Å; E105-K695 IonicContact OE1-NZ 3.16Å; E105-K695 PolarHBondContact OE1-NZ 3.37Å; E105-K695 IonicContact OE2-NZ 2.9Å; E105-K695 PolarHBondContact OE2-NZ 2.93Å
106	W	93.1	Very high	87	Confident	4 Å²	4	41.9 Å²	41.9	2%	0.015	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	135.6	166.3	79	-89.7	0	0	0	110.7	Y108 L119 I122 E123 L126 N150 W154 P690 K691 L692 Q693	W106-Y108 HydrophobicContact CH2-CD2 4.44Å; W106-Y108 HydrophobicContact CZ3-CD2 4.13Å; W106-L119 HydrophobicContact CH2-CD2 4Å; W106-L119 HydrophobicContact CH2-CG 4.14Å; W106-L119 HydrophobicContact CZ2-CD2 4.21Å; W106-I122 HydrophobicContact CE3-CG2 4.25Å; W106-I122 HydrophobicContact CH2-CG2 4.1Å; W106-I122 HydrophobicContact CZ3-CB 4.35Å; W106-I122 HydrophobicContact CZ3-CG2 3.54Å; W106-E123 HydrophobicContact CH2-CB 4.32Å; W106-E123 HydrophobicContact CZ2-CB 3.98Å; W106-E123 HydrophobicContact CZ2-CG 4.12Å; W106-L126 HydrophobicContact CB-CD1 3.92Å; W106-L126 HydrophobicContact CD2-CD1 3.75Å; W106-L126 HydrophobicContact CE3-CD1 3.9Å; W106-L126 HydrophobicContact CG-CD1 3.83Å; W106-N150 WeakPolarHBondContact CA-OD1 3.14Å; W106-W154 HydrophobicContact CB-CH2 4.48Å; W106-W154 HydrophobicContact CB-CZ2 3.83Å; W106-P690 HydrophobicContact CB-CB 4.25Å; W106-K691 PolarHBondContact N-O 2.86Å; W106-L692 HydrophobicContact CD2-CD1 4.03Å; W106-L692 HydrophobicContact CE3-CD1 4.15Å; W106-L692 HydrophobicContact CH2-CD1 3.93Å; W106-L692 HydrophobicContact CZ2-CB 4.3Å; W106-L692 HydrophobicContact CZ2-CD1 3.77Å; W106-L692 HydrophobicContact CZ2-CD2 4.46Å; W106-L692 HydrophobicContact CZ2-CG 4.39Å; W106-L692 HydrophobicContact CZ3-CD1 4.09Å; W106-L692 CarbonylContact O-C 3.56Å; W106-Q693 PolarHBondContact O-N 3.4Å
107	I	91.8	Very high	87.2	Confident	5 Å²	5	36.3 Å²	36.3	3%	0.026	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	130.1	-174.1	-63.5	167.1	0	0	0	110.2	V146 Y149 N150 R153 Q693 K695 L697	I107-V146 WeakPolarHBondContact O-CG1 3.33Å; I107-Y149 HydrophobicContact CB-CD1 4.41Å; I107-Y149 HydrophobicContact CB-CE1 3.95Å; I107-Y149 HydrophobicContact CD1-CE1 3.8Å; I107-Y149 HydrophobicContact CG1-CE1 4.48Å; I107-Y149 HydrophobicContact CG2-CE1 4.01Å; I107-N150 PolarHBondContact N-OD1 3.43Å; I107-N150 PolarHBondContact O-ND2 3.27Å; I107-R153 VanDerWaalsContact CD1-CZ 3.44Å; I107-Q693 CarbonylContact C-O 3.52Å; I107-Q693 WeakPolarHBondContact CA-O 3.03Å; I107-K695 HydrophobicContact CD1-CD 3.83Å; I107-K695 HydrophobicContact CG1-CD 3.98Å; I107-K695 HydrophobicContact CG2-CB 3.83Å; I107-K695 HydrophobicContact CG2-CD 4.45Å; I107-K695 HydrophobicContact CG2-CG 4.23Å; I107-L697 HydrophobicContact CG2-CD2 3.98Å
108	Y	90.8	Very high	87.4	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	138.2	164.8	-169.6	-79.9	0	0	0	110.1	W106 S110 I114 L119 I122 F142 Q693 F694 K695	W106-Y108 HydrophobicContact CH2-CD2 4.44Å; W106-Y108 HydrophobicContact CZ3-CD2 4.13Å; Y108-S110 PolarHBondContact O-N 3.41Å; Y108-I114 HydrophobicContact CE1-CB 4.36Å; Y108-I114 HydrophobicContact CE1-CG1 4.1Å; Y108-I114 HydrophobicContact CE1-CG2 3.87Å; Y108-L119 HydrophobicContact CD2-CB 4.23Å; Y108-L119 HydrophobicContact CD2-CD1 4.48Å; Y108-L119 HydrophobicContact CD2-CG 4.03Å; Y108-L119 HydrophobicContact CE2-CB 3.74Å; Y108-L119 HydrophobicContact CE2-CG 4.06Å; Y108-I122 HydrophobicContact CD2-CD1 4.2Å; Y108-I122 HydrophobicContact CE2-CD1 3.85Å; Y108-F142 HydrophobicContact CE1-CZ 4.23Å; Y108-F142 HydrophobicContact CE2-CE1 4.14Å; Y108-F142 HydrophobicContact CE2-CZ 4.5Å; Y108-F142 AromaticContact CZ-CE1 3.85Å; Y108-F142 AromaticContact CZ-CZ 3.99Å; Y108-Q693 PolarHBondContact N-O 3.02Å; Y108-F694 AromaticContact CD1-CD1 3.77Å; Y108-F694 HydrophobicContact CD1-CD1 3.77Å; Y108-F694 AromaticContact CD1-CE1 3.65Å; Y108-F694 HydrophobicContact CD1-CE1 3.65Å; Y108-F694 HydrophobicContact CE1-CE1 4.34Å; Y108-F694 HydrophobicContact CG-CD1 4.2Å; Y108-F694 AromaticContact CG-CE1 3.96Å; Y108-F694 HydrophobicContact CG-CE1 3.96Å; Y108-F694 WeakPolarHBondContact O-CA 3.46Å; Y108-K695 PolarHBondContact O-N 3.01Å; Y108-K695 VanDerWaalsContact O-N 3.07Å
109	P	87.3	Confident	87.3	Confident	1 Å²	1	34 Å²	34	1%	0.006	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	119.4	-178.7	-12.9	27.4	0	0	0	112.5	D111 F142 V146 K695 L697	P109-D111 VanDerWaalsContact C-N 3.35Å; P109-D111 WeakPolarHBondContact CB-OD1 3.49Å; P109-F142 HydrophobicContact CB-CE2 4.41Å; P109-F142 HydrophobicContact CG-CE2 3.93Å; P109-F142 HydrophobicContact CG-CZ 3.96Å; P109-V146 HydrophobicContact CG-CG2 3.56Å; P109-K695 WeakPolarHBondContact CA-O 3.48Å; P109-L697 HydrophobicContact CB-CD1 4.2Å; P109-L697 HydrophobicContact CB-CG 4.21Å; P109-L697 HydrophobicContact CG-CD1 3.88Å; P109-L697 HydrophobicContact CG-CG 4.43Å
110	S	80.6	Confident	87.2	Confident	54 Å²	54	33.7 Å²	33.7	38%	0.378	19%	0.193	S	C	.	.	S	Bend	trans	-84.6	-5.2	176.1	62.1	0	0	0	0	114.5	Y108 S112 K695 C696	Y108-S110 PolarHBondContact O-N 3.41Å; S110-S112 PolarHBondContact O-N 3.29Å; S110-K695 PolarHBondContact N-O 2.89Å; S110-K695 PolarHBondContact OG-O 3.02Å; S110-C696 PolarHBondContact OG-N 2.98Å; S110-C696 VanDerWaalsContact OG-N 3.13Å
111	D	73.4	Confident	87.4	Confident	33 Å²	33	29.6 Å²	29.6	18%	0.176	17%	0.168	C	C	.	.	S	Bend	trans	-80.1	12.2	178.3	57.3	-93.3	0	0	0	114.7	P109 L697 R698	P109-D111 VanDerWaalsContact C-N 3.35Å; P109-D111 WeakPolarHBondContact CB-OD1 3.49Å; D111-L697 PolarHBondContact OD1-N 3.49Å; D111-R698 HydrophobicContact CB-CG 4.22Å; D111-R698 PolarHBondContact O-NH2 3.24Å; D111-R698 IonicContact OD2-CZ 2.75Å; D111-R698 IonicContact OD2-NE 2.73Å; D111-R698 PolarHBondContact OD2-NE 2.89Å; D111-R698 IonicContact OD2-NH2 3.73Å; D111-R698 PolarHBondContact OD2-NH2 2.88Å
112	S	69.3	Low	87.5	Confident	24 Å²	24	22.9 Å²	22.9	17%	0.168	13%	0.133	C	C	.	.	S	Bend	trans	-142.4	155.8	-175	69.6	0	0	0	0	111.8	S110 I114	S110-S112 PolarHBondContact O-N 3.29Å; S112-I114 PolarHBondContact O-N 2.88Å
113	S	77.9	Confident	87.6	Confident	60 Å²	60	23 Å²	23	42%	0.42	13%	0.131	S	C	.	.			trans	-56.5	110.3	176.1	61	0	0	0	0	110.2	R115	S113-R115 WeakPolarHBondContact O-CG 3.47Å; S113-R115 PolarHBondContact O-N 2.93Å
114	I	81.9	Confident	87.8	Confident	5 Å²	5	24.3 Å²	24.3	3%	0.026	14%	0.137	C	C	.	.			trans	-72.2	127.8	-173.4	-55.5	172.7	0	0	0	109	N70 I73 I74 Y108 S112 F694	N70-I114 HydrophobicContact CB-CD1 4.32Å; N70-I114 WeakPolarHBondContact OD1-CB 3.27Å; N70-I114 WeakPolarHBondContact OD1-CG1 3.49Å; N70-I114 PolarHBondContact OD1-N 3.46Å; I73-I114 HydrophobicContact CG2-CB 4.2Å; I73-I114 HydrophobicContact CG2-CG2 3.59Å; I74-I114 HydrophobicContact CD1-CD1 3.7Å; I74-I114 HydrophobicContact CG1-CD1 3.56Å; Y108-I114 HydrophobicContact CE1-CB 4.36Å; Y108-I114 HydrophobicContact CE1-CG1 4.1Å; Y108-I114 HydrophobicContact CE1-CG2 3.87Å; S112-I114 PolarHBondContact O-N 2.88Å; I114-F694 HydrophobicContact CD1-CD1 4.07Å; I114-F694 HydrophobicContact CD1-CE1 3.93Å; I114-F694 HydrophobicContact CG2-CE1 4.27Å
115	R	87.1	Confident	88	Confident	58 Å²	58	21.8 Å²	21.8	22%	0.219	12%	0.116	C	C	.	.			trans	-119.3	121	179.4	-48.1	-170.5	-170.6	161.3	2.9	110.6	S113 Y117 Q118 L119 Y306	S113-R115 WeakPolarHBondContact O-CG 3.47Å; S113-R115 PolarHBondContact O-N 2.93Å; R115-Y117 VanDerWaalsContact C-N 3.27Å; R115-Y117 HydrophobicContact CB-CD1 3.91Å; R115-Y117 HydrophobicContact CB-CE1 3.68Å; R115-Y117 WeakPolarHBondContact CD-OH 3.39Å; R115-Y117 HydrophobicContact CG-CE1 4.24Å; R115-Y117 PolarHBondContact NH1-OH 3.47Å; R115-Y117 PolarHBondContact O-N 3.3Å; R115-Q118 HydrophobicContact CB-CB 4.27Å; R115-Q118 HydrophobicContact CB-CG 3.99Å; R115-Q118 PolarHBondContact O-N 2.82Å; R115-L119 PolarHBondContact O-N 3.46Å; R115-L119 VanDerWaalsContact O-N 3.11Å; R115-Y306 HydrophobicContact CB-CE1 4.29Å; R115-Y306 HydrophobicContact CB-CE2 4.43Å; R115-Y306 HydrophobicContact CG-CD1 4.13Å; R115-Y306 HydrophobicContact CG-CE1 3.68Å
116	K	87.2	Confident	88	Confident	84 Å²	84	20.2 Å²	20.2	37%	0.365	11%	0.109	S	C	.	.	H	α-helix	trans	-54.4	-40	-175.7	-160.2	163.7	-175.1	170.6	0	112.6	D76 L119 N120	D76-K116 IonicContact OD2-NZ 3.49Å; D76-K116 PolarHBondContact OD2-NZ 2.89Å; K116-L119 PolarHBondContact O-N 3.4Å; K116-N120 VanDerWaalsContact O-CG 3.28Å; K116-N120 PolarHBondContact O-N 3.42Å; K116-N120 VanDerWaalsContact O-N 3.09Å; K116-N120 PolarHBondContact O-OD1 2.96Å
117	Y	91	Very high	87.9	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-64	-41	175.4	75.2	-93.7	0	0	0	113.1	R115 I121 L134 L138 D302 V303 Y306	R115-Y117 VanDerWaalsContact C-N 3.27Å; R115-Y117 HydrophobicContact CB-CD1 3.91Å; R115-Y117 HydrophobicContact CB-CE1 3.68Å; R115-Y117 WeakPolarHBondContact CD-OH 3.39Å; R115-Y117 HydrophobicContact CG-CE1 4.24Å; R115-Y117 PolarHBondContact NH1-OH 3.47Å; R115-Y117 PolarHBondContact O-N 3.3Å; Y117-I121 HydrophobicContact CD2-CD1 4.34Å; Y117-I121 WeakPolarHBondContact O-CB 3.48Å; Y117-I121 WeakPolarHBondContact O-CD1 3.49Å; Y117-I121 WeakPolarHBondContact O-CG1 3.45Å; Y117-I121 PolarHBondContact O-N 3.29Å; Y117-L134 HydrophobicContact CD2-CD2 4.41Å; Y117-L134 HydrophobicContact CE2-CD1 4.38Å; Y117-L138 HydrophobicContact CE2-CB 4.13Å; Y117-L138 WeakPolarHBondContact CE2-O 3.34Å; Y117-L138 PolarHBondContact OH-O 3.37Å; Y117-D302 WeakPolarHBondContact CB-OD2 3.39Å; Y117-D302 WeakPolarHBondContact CD1-O 3.42Å; Y117-V303 HydrophobicContact CD1-CG2 4.18Å; Y117-V303 HydrophobicContact CD2-CG2 4.24Å; Y117-V303 HydrophobicContact CE1-CG2 4.48Å; Y117-V303 HydrophobicContact CG-CG2 4.07Å; Y117-Y306 HydrophobicContact CD1-CD2 4.09Å; Y117-Y306 HydrophobicContact CD1-CE2 4.11Å; Y117-Y306 AromaticContact CE1-CD2 3.63Å; Y117-Y306 HydrophobicContact CE1-CD2 3.63Å; Y117-Y306 AromaticContact CE1-CE2 3.99Å; Y117-Y306 HydrophobicContact CE1-CE2 3.99Å; Y117-Y306 HydrophobicContact CE1-CG 4.1Å
118	Q	92.7	Very high	87.9	Confident	6 Å²	6	22.4 Å²	22.4	3%	0.028	12%	0.118	C	C	.	.	H	α-helix	trans	-67.4	-42.4	179.8	-65.6	178.4	-32.3	0	0	111.2	R115 I121 I122 L138 F142	R115-Q118 HydrophobicContact CB-CB 4.27Å; R115-Q118 HydrophobicContact CB-CG 3.99Å; R115-Q118 PolarHBondContact O-N 2.82Å; Q118-I121 PolarHBondContact O-N 2.93Å; Q118-I122 WeakPolarHBondContact O-CB 3.4Å; Q118-I122 VanDerWaalsContact O-CD1 3.32Å; Q118-I122 WeakPolarHBondContact O-CD1 3.43Å; Q118-I122 WeakPolarHBondContact O-CG1 3.34Å; Q118-I122 PolarHBondContact O-N 3.37Å; Q118-L138 PolarHBondContact NE2-O 3.45Å; Q118-F142 HydrophobicContact CB-CD1 4.43Å; Q118-F142 HydrophobicContact CB-CE1 4.43Å
119	L	91.3	Very high	88.1	Confident	1 Å²	1	22.6 Å²	22.6	1%	0.005	12%	0.119	C	C	.	.	H	α-helix	trans	-61	-51.7	177.5	-169.5	167.4	0	0	0	111.1	A77 R80 W106 Y108 R115 K116 I121 I122 E123 L692 F694	A77-L119 HydrophobicContact CB-CD1 3.6Å; R80-L119 VanDerWaalsContact NH2-CD2 3.34Å; W106-L119 HydrophobicContact CH2-CD2 4Å; W106-L119 HydrophobicContact CH2-CG 4.14Å; W106-L119 HydrophobicContact CZ2-CD2 4.21Å; Y108-L119 HydrophobicContact CD2-CB 4.23Å; Y108-L119 HydrophobicContact CD2-CD1 4.48Å; Y108-L119 HydrophobicContact CD2-CG 4.03Å; Y108-L119 HydrophobicContact CE2-CB 3.74Å; Y108-L119 HydrophobicContact CE2-CG 4.06Å; R115-L119 PolarHBondContact O-N 3.46Å; R115-L119 VanDerWaalsContact O-N 3.11Å; K116-L119 PolarHBondContact O-N 3.4Å; L119-I121 VanDerWaalsContact C-N 3.31Å; L119-I121 PolarHBondContact O-N 3.05Å; L119-I122 PolarHBondContact O-N 3.12Å; L119-E123 PolarHBondContact O-N 2.93Å; L119-L692 HydrophobicContact CD1-CD2 4.2Å; L119-L692 HydrophobicContact CD2-CD2 4.42Å; L119-F694 HydrophobicContact CD1-CE1 4.16Å; L119-F694 HydrophobicContact CD1-CZ 3.81Å
120	N	91	Very high	88.4	Confident	48 Å²	48	22.5 Å²	22.5	26%	0.257	12%	0.118	S	C	.	.	H	α-helix	trans	-59.4	-40.9	179	-68.8	10.1	0	0	0	112	R80 K116 E123 Q124	R80-N120 PolarHBondContact NH2-OD1 3.49Å; K116-N120 VanDerWaalsContact O-CG 3.28Å; K116-N120 PolarHBondContact O-N 3.42Å; K116-N120 VanDerWaalsContact O-N 3.09Å; K116-N120 PolarHBondContact O-OD1 2.96Å; N120-E123 PolarHBondContact O-N 2.91Å; N120-Q124 PolarHBondContact O-N 2.96Å
121	I	93.8	Very high	89.2	Confident	0 Å²	0	20 Å²	20	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-67.2	-43.7	178.1	-69.3	169.8	0	0	0	111.3	Y117 Q118 L119 E123 Q124 C125 V132 L134 V143 E294	Y117-I121 HydrophobicContact CD2-CD1 4.34Å; Y117-I121 WeakPolarHBondContact O-CB 3.48Å; Y117-I121 WeakPolarHBondContact O-CD1 3.49Å; Y117-I121 WeakPolarHBondContact O-CG1 3.45Å; Y117-I121 PolarHBondContact O-N 3.29Å; Q118-I121 PolarHBondContact O-N 2.93Å; L119-I121 VanDerWaalsContact C-N 3.31Å; L119-I121 PolarHBondContact O-N 3.05Å; I121-E123 VanDerWaalsContact C-N 3.29Å; I121-E123 PolarHBondContact O-N 3.11Å; I121-Q124 PolarHBondContact O-N 3.32Å; I121-C125 PolarHBondContact O-N 2.7Å; I121-C125 PolarHBondContact O-SG 3.27Å; I121-V132 HydrophobicContact CG2-CB 4.45Å; I121-V132 HydrophobicContact CG2-CG1 3.8Å; I121-V132 HydrophobicContact CG2-CG2 3.76Å; I121-L134 HydrophobicContact CD1-CD1 4.01Å; I121-L134 HydrophobicContact CD1-CD2 3.85Å; I121-L134 HydrophobicContact CD1-CG 4.22Å; I121-V143 HydrophobicContact CG2-CG1 3.9Å; I121-V143 HydrophobicContact CG2-CG2 4.31Å; I121-E294 HydrophobicContact CD1-CB 4.43Å; I121-E294 HydrophobicContact CG1-CB 4.04Å; I121-E294 HydrophobicContact CG1-CG 3.93Å; I121-E294 HydrophobicContact CG2-CB 4.42Å; I121-E294 HydrophobicContact CG2-CG 4.4Å
122	I	95	Very high	90.2	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-58.6	-43.7	176.2	-70.7	159.3	0	0	0	110.3	W106 Y108 Q118 L119 Q124 C125 L126 F142 V143 V146 V147	W106-I122 HydrophobicContact CE3-CG2 4.25Å; W106-I122 HydrophobicContact CH2-CG2 4.1Å; W106-I122 HydrophobicContact CZ3-CB 4.35Å; W106-I122 HydrophobicContact CZ3-CG2 3.54Å; Y108-I122 HydrophobicContact CD2-CD1 4.2Å; Y108-I122 HydrophobicContact CE2-CD1 3.85Å; Q118-I122 WeakPolarHBondContact O-CB 3.4Å; Q118-I122 VanDerWaalsContact O-CD1 3.32Å; Q118-I122 WeakPolarHBondContact O-CD1 3.43Å; Q118-I122 WeakPolarHBondContact O-CG1 3.34Å; Q118-I122 PolarHBondContact O-N 3.37Å; L119-I122 PolarHBondContact O-N 3.12Å; I122-Q124 PolarHBondContact O-N 3.06Å; I122-C125 PolarHBondContact O-N 3.5Å; I122-C125 VanDerWaalsContact O-N 3.13Å; I122-L126 WeakPolarHBondContact O-CG 3.35Å; I122-L126 PolarHBondContact O-N 3.12Å; I122-F142 HydrophobicContact CD1-CD1 4.39Å; I122-F142 HydrophobicContact CD1-CE1 4.11Å; I122-V143 HydrophobicContact CG1-CB 4.15Å; I122-V143 HydrophobicContact CG1-CG1 3.9Å; I122-V143 HydrophobicContact CG1-CG2 4.14Å; I122-V146 HydrophobicContact CD1-CB 3.8Å; I122-V146 HydrophobicContact CD1-CG1 4.04Å; I122-V146 HydrophobicContact CD1-CG2 4.03Å; I122-V146 HydrophobicContact CG1-CB 4.37Å; I122-V146 HydrophobicContact CG2-CB 4.36Å; I122-V146 HydrophobicContact CG2-CG1 3.87Å; I122-V147 HydrophobicContact CG2-CG2 4.23Å
123	E	92.8	Very high	91.3	Very high	15 Å²	15	17.3 Å²	17.3	7%	0.07	8%	0.084	C	C	.	.	H	α-helix	trans	-58.8	-43.6	178.2	-166.7	176.5	-175.8	0	0	112	V83 W106 L119 N120 I121 L126 Y127	V83-E123 VanDerWaalsContact CG2-CD 3.48Å; V83-E123 HydrophobicContact CG2-CG 3.85Å; V83-E123 WeakPolarHBondContact CG2-OE1 3.19Å; W106-E123 HydrophobicContact CH2-CB 4.32Å; W106-E123 HydrophobicContact CZ2-CB 3.98Å; W106-E123 HydrophobicContact CZ2-CG 4.12Å; L119-E123 PolarHBondContact O-N 2.93Å; N120-E123 PolarHBondContact O-N 2.91Å; I121-E123 VanDerWaalsContact C-N 3.29Å; I121-E123 PolarHBondContact O-N 3.11Å; E123-L126 PolarHBondContact O-N 2.96Å; E123-Y127 HydrophobicContact CG-CE2 4.31Å; E123-Y127 VanDerWaalsContact O-CD2 3.28Å; E123-Y127 WeakPolarHBondContact O-CD2 3.36Å
124	Q	92.3	Very high	91.8	Very high	27 Å²	27	14.4 Å²	14.4	13%	0.126	6%	0.064	C	C	.	.	H	α-helix	trans	-64.5	-42.8	173.4	-60.3	-59.8	-41.6	0	0	112.1	N120 I121 I122 L126 Y127 K128	N120-Q124 PolarHBondContact O-N 2.96Å; I121-Q124 PolarHBondContact O-N 3.32Å; I122-Q124 PolarHBondContact O-N 3.06Å; Q124-L126 PolarHBondContact O-N 2.93Å; Q124-Y127 PolarHBondContact O-N 2.91Å; Q124-K128 WeakPolarHBondContact O-CB 3.37Å; Q124-K128 PolarHBondContact O-N 2.94Å; Q124-K128 VanDerWaalsContact OE1-CE 3.27Å
125	C	94.8	Very high	91.8	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-63	-23.4	178.9	-67.7	0	0	0	0	114.2	I121 I122 V147 R266 V268	I121-C125 PolarHBondContact O-N 2.7Å; I121-C125 PolarHBondContact O-SG 3.27Å; I122-C125 PolarHBondContact O-N 3.5Å; I122-C125 VanDerWaalsContact O-N 3.13Å; C125-V147 HydrophobicContact CB-CG2 3.69Å; C125-R266 WeakPolarHBondContact O-CD 3.45Å; C125-R266 PolarHBondContact O-NE 3.01Å; C125-V268 HydrophobicContact CB-CG2 3.91Å
126	L	93.8	Very high	91.4	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-69.2	-49	172.7	-65.2	172.8	0	0	0	110.6	W106 I122 E123 Q124 V147 N150 F151 W154 R266	W106-L126 HydrophobicContact CB-CD1 3.92Å; W106-L126 HydrophobicContact CD2-CD1 3.75Å; W106-L126 HydrophobicContact CE3-CD1 3.9Å; W106-L126 HydrophobicContact CG-CD1 3.83Å; I122-L126 WeakPolarHBondContact O-CG 3.35Å; I122-L126 PolarHBondContact O-N 3.12Å; E123-L126 PolarHBondContact O-N 2.96Å; Q124-L126 PolarHBondContact O-N 2.93Å; L126-V147 HydrophobicContact CD2-CG1 4.49Å; L126-N150 HydrophobicContact CD2-CB 3.98Å; L126-F151 HydrophobicContact CD2-CD2 4.19Å; L126-F151 HydrophobicContact CD2-CE2 4.02Å; L126-W154 HydrophobicContact CB-CH2 4.12Å; L126-W154 HydrophobicContact CB-CZ3 4.24Å; L126-W154 HydrophobicContact CD1-CH2 3.95Å; L126-W154 HydrophobicContact CD2-CH2 3.92Å; L126-W154 HydrophobicContact CD2-CZ3 3.91Å; L126-W154 HydrophobicContact CG-CH2 4.2Å; L126-W154 HydrophobicContact CG-CZ3 4.48Å; L126-R266 PolarHBondContact O-NE 2.86Å; L126-R266 PolarHBondContact O-NH2 2.82Å
127	Y	90.2	Very high	90.9	Very high	15 Å²	15	11.5 Å²	11.5	6%	0.059	7%	0.069	C	C	.	.	H	α-helix	trans	-92.6	-16.9	-172.9	-58.8	-68.7	0	0	0	115.5	E123 Q124 R266 N680 R682 V684 P690	E123-Y127 HydrophobicContact CG-CE2 4.31Å; E123-Y127 VanDerWaalsContact O-CD2 3.28Å; E123-Y127 WeakPolarHBondContact O-CD2 3.36Å; Q124-Y127 PolarHBondContact O-N 2.91Å; Y127-R266 PolarHBondContact O-NH2 3.41Å; Y127-R266 VanDerWaalsContact O-NH2 3.1Å; Y127-N680 PolarHBondContact O-ND2 3.14Å; Y127-R682 HydrophobicContact CD1-CG 4.32Å; Y127-V684 HydrophobicContact CD1-CG2 4.41Å; Y127-V684 HydrophobicContact CE1-CG2 4.08Å; Y127-P690 HydrophobicContact CE1-CG 4.48Å; Y127-P690 WeakPolarHBondContact OH-CD 3.49Å
128	K	91.6	Very high	90.6	Very high	39 Å²	39	11.9 Å²	11.9	17%	0.17	7%	0.071	C	C	.	.	S	Bend	trans	-135.2	140.6	-172.7	-57.8	-179.2	-171.2	162.9	0	113.6	Q124 T130 R266 H292 N680	Q124-K128 WeakPolarHBondContact O-CB 3.37Å; Q124-K128 PolarHBondContact O-N 2.94Å; Q124-K128 VanDerWaalsContact OE1-CE 3.27Å; K128-T130 PolarHBondContact O-N 3.27Å; K128-T130 PolarHBondContact O-OG1 3.48Å; K128-R266 VanDerWaalsContact O-CD 3.31Å; K128-R266 WeakPolarHBondContact O-CD 3.34Å; K128-H292 HydrophobicContact CB-CB 3.89Å; K128-H292 HydrophobicContact CD-CB 3.67Å; K128-H292 HydrophobicContact CG-CB 4.44Å; K128-N680 VanDerWaalsContact CA-OD1 3.27Å; K128-N680 WeakPolarHBondContact CA-OD1 3.32Å
129	N	94.5	Very high	90.2	Very high	4 Å²	4	12.6 Å²	12.6	2%	0.021	8%	0.079	C	C	.	.			trans	-61.4	104	165	-75.8	2.1	0	0	0	109.5	R266 I267 L289 S291 H292 N680	N129-R266 PolarHBondContact OD1-NH1 3.08Å; N129-I267 WeakPolarHBondContact CA-O 3.41Å; N129-I267 HydrophobicContact CB-CB 4.18Å; N129-I267 PolarHBondContact OD1-N 3.39Å; N129-L289 WeakPolarHBondContact CB-O 3.46Å; N129-L289 PolarHBondContact ND2-O 3.24Å; N129-L289 VanDerWaalsContact ND2-O 3.14Å; N129-S291 PolarHBondContact N-OG 3.23Å; N129-S291 VanDerWaalsContact N-OG 3.14Å; N129-S291 PolarHBondContact O-N 3.48Å; N129-S291 PolarHBondContact O-OG 2.87Å; N129-S291 VanDerWaalsContact O-OG 3.1Å; N129-H292 PolarHBondContact O-N 2.79Å; N129-H292 VanDerWaalsContact O-N 3.09Å; N129-N680 PolarHBondContact N-OD1 3.39Å
130	T	95.4	Very high	90.2	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	131.2	-162.5	-58.7	0	0	0	0	111.9	K128 V132 I267 A269 H292 E294	K128-T130 PolarHBondContact O-N 3.27Å; K128-T130 PolarHBondContact O-OG1 3.48Å; T130-V132 HydrophobicContact CG2-CG2 3.83Å; T130-I267 PolarHBondContact N-O 2.87Å; T130-I267 VanDerWaalsContact N-O 3.11Å; T130-A269 PolarHBondContact O-N 2.78Å; T130-H292 WeakPolarHBondContact CA-O 3.45Å; T130-E294 HydrophobicContact CG2-CB 4.21Å; T130-E294 HydrophobicContact CG2-CG 3.99Å
131	L	95.7	Very high	90.2	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	114.7	164.5	176.3	57.7	0	0	0	109.4	A239 A269 L284 I290 H292 L293 E294	L131-A239 HydrophobicContact CD1-CB 4.36Å; L131-A269 HydrophobicContact CB-CB 4.47Å; L131-A269 HydrophobicContact CD1-CB 3.73Å; L131-L284 HydrophobicContact CD1-CD2 4.17Å; L131-L284 HydrophobicContact CD2-CD2 3.6Å; L131-L284 HydrophobicContact CD2-CG 4.15Å; L131-I290 HydrophobicContact CB-CD1 4.14Å; L131-I290 HydrophobicContact CB-CG1 4.23Å; L131-I290 HydrophobicContact CB-CG2 3.78Å; L131-H292 PolarHBondContact N-O 2.98Å; L131-L293 HydrophobicContact CB-CD1 4.16Å; L131-L293 HydrophobicContact CD2-CD1 4.03Å; L131-L293 HydrophobicContact CG-CD1 3.95Å; L131-E294 PolarHBondContact O-N 2.87Å
132	V	95.4	Very high	90.1	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	99.2	-178	-179	0	0	0	0	109.3	I121 T130 L134 V268 A269 L270 S271	I121-V132 HydrophobicContact CG2-CB 4.45Å; I121-V132 HydrophobicContact CG2-CG1 3.8Å; I121-V132 HydrophobicContact CG2-CG2 3.76Å; T130-V132 HydrophobicContact CG2-CG2 3.83Å; V132-L134 HydrophobicContact CG1-CD1 3.76Å; V132-L134 HydrophobicContact CG1-CG 3.78Å; V132-V268 HydrophobicContact CG2-CG1 4.38Å; V132-A269 PolarHBondContact N-O 3.19Å; V132-L270 HydrophobicContact CB-CD2 4.09Å; V132-L270 HydrophobicContact CG1-CD2 4.46Å; V132-L270 HydrophobicContact CG2-CD2 4.47Å; V132-S271 PolarHBondContact O-N 3.12Å
133	C	92.2	Very high	90.1	Very high	1 Å²	1	12.7 Å²	12.7	1%	0.007	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	95.4	177.9	-74	0	0	0	0	109.8	S271 E294 L295 R296	C133-S271 WeakPolarHBondContact CA-O 3.31Å; C133-E294 PolarHBondContact N-O 3.12Å; C133-L295 HydrophobicContact CB-CD1 3.54Å; C133-R296 PolarHBondContact O-N 3.35Å
134	L	89.1	Confident	90.2	Very high	0 Å²	0	12 Å²	12	0%	0	8%	0.076	C	C	.	.			trans	-125	128.3	-179.8	-70.3	179.3	0	0	0	111.3	Y117 I121 V132 T136 L138 K140 S271 R296	Y117-L134 HydrophobicContact CD2-CD2 4.41Å; Y117-L134 HydrophobicContact CE2-CD1 4.38Å; I121-L134 HydrophobicContact CD1-CD1 4.01Å; I121-L134 HydrophobicContact CD1-CD2 3.85Å; I121-L134 HydrophobicContact CD1-CG 4.22Å; V132-L134 HydrophobicContact CG1-CD1 3.76Å; V132-L134 HydrophobicContact CG1-CG 3.78Å; L134-T136 PolarHBondContact O-N 3.17Å; L134-L138 HydrophobicContact CB-CB 4.46Å; L134-K140 HydrophobicContact CB-CD 4.16Å; L134-K140 HydrophobicContact CB-CG 3.8Å; L134-K140 HydrophobicContact CD1-CG 4.27Å; L134-K140 WeakPolarHBondContact O-CD 3.31Å; L134-K140 WeakPolarHBondContact O-CE 3.41Å; L134-K140 PolarHBondContact O-NZ 3.48Å; L134-K140 VanDerWaalsContact O-NZ 3.14Å; L134-S271 PolarHBondContact N-O 2.73Å; L134-R296 HydrophobicContact CD2-CB 3.8Å; L134-R296 HydrophobicContact CD2-CG 3.9Å
135	P	81.3	Confident	90.2	Very high	14 Å²	14	10.7 Å²	10.7	9%	0.091	7%	0.071	C	C	.	.			trans	-45.8	135.4	168.7	-31.3	32.6	0	0	0	113.4	G137 L138 R296	P135-G137 PolarHBondContact O-N 2.89Å; P135-L138 HydrophobicContact CB-CD1 3.78Å; P135-L138 HydrophobicContact CB-CG 4.37Å; P135-L138 HydrophobicContact CG-CD1 3.95Å; P135-L138 WeakPolarHBondContact O-CB 3.42Å; P135-L138 WeakPolarHBondContact O-CG 3.48Å; P135-L138 PolarHBondContact O-N 3.02Å; P135-L138 VanDerWaalsContact O-N 3.16Å; P135-R296 VanDerWaalsContact CD-O 3.27Å; P135-R296 WeakPolarHBondContact CD-O 3.38Å
136	T	79.3	Confident	90.2	Very high	31 Å²	31	10.8 Å²	10.8	19%	0.19	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	130.2	-174	-71.4	0	0	0	0	111.2	L134 K140 G628	L134-T136 PolarHBondContact O-N 3.17Å; T136-K140 PolarHBondContact OG1-NZ 2.94Å; T136-K140 VanDerWaalsContact OG1-NZ 3.09Å; T136-G628 VanDerWaalsContact O-CA 3.3Å; T136-G628 WeakPolarHBondContact O-CA 3.39Å
137	G	76	Confident	90.3	Very high	41 Å²	41	10.8 Å²	10.8	42%	0.423	7%	0.071	S	C	.	.	T	Hydrogen-bonded Turn	trans	109.8	-20.6	-169.3	0	0	0	0	0	114.5	P135 G139	P135-G137 PolarHBondContact O-N 2.89Å; G137-G139 VanDerWaalsContact C-N 3.27Å; G137-G139 PolarHBondContact O-N 2.81Å
138	L	83.9	Confident	90.5	Very high	8 Å²	8	10.2 Å²	10.2	4%	0.042	7%	0.069	C	C	.	.	S	Bend	trans	-81	6.6	-176.7	-63.7	177.6	0	0	0	115.6	Y117 Q118 L134 P135 V303 T307	Y117-L138 HydrophobicContact CE2-CB 4.13Å; Y117-L138 WeakPolarHBondContact CE2-O 3.34Å; Y117-L138 PolarHBondContact OH-O 3.37Å; Q118-L138 PolarHBondContact NE2-O 3.45Å; L134-L138 HydrophobicContact CB-CB 4.46Å; P135-L138 HydrophobicContact CB-CD1 3.78Å; P135-L138 HydrophobicContact CB-CG 4.37Å; P135-L138 HydrophobicContact CG-CD1 3.95Å; P135-L138 WeakPolarHBondContact O-CB 3.42Å; P135-L138 WeakPolarHBondContact O-CG 3.48Å; P135-L138 PolarHBondContact O-N 3.02Å; P135-L138 VanDerWaalsContact O-N 3.16Å; L138-V303 HydrophobicContact CD1-CG1 3.48Å; L138-V303 VanDerWaalsContact CD1-CG1 3.48Å; L138-V303 HydrophobicContact CD1-CG2 4.22Å; L138-V303 HydrophobicContact CD2-CG1 3.9Å; L138-V303 HydrophobicContact CG-CG1 4.36Å; L138-T307 HydrophobicContact CD2-CG2 3.87Å
139	G	85.5	Confident	90.6	Very high	20 Å²	20	9.9 Å²	9.9	21%	0.206	7%	0.067	C	C	.	.			trans	88.6	37.6	172	0	0	0	0	0	116.1	G137 T141 F142 V143	G137-G139 VanDerWaalsContact C-N 3.27Å; G137-G139 PolarHBondContact O-N 2.81Å; G139-T141 PolarHBondContact O-N 3.05Å; G139-F142 WeakPolarHBondContact O-CA 3.48Å; G139-F142 WeakPolarHBondContact O-CB 3.48Å; G139-F142 PolarHBondContact O-N 2.93Å; G139-V143 PolarHBondContact O-N 2.97Å; G139-V143 VanDerWaalsContact O-N 3.1Å
140	K	91.6	Very high	90.7	Very high	15 Å²	15	9.7 Å²	9.7	7%	0.065	7%	0.066	C	C	.	.	H	α-helix	trans	-48.7	-44.3	169.1	-71	-178.6	-69	-154.9	0	112.3	L134 T136 F142 V143 A144 L270 S271 A272	L134-K140 HydrophobicContact CB-CD 4.16Å; L134-K140 HydrophobicContact CB-CG 3.8Å; L134-K140 HydrophobicContact CD1-CG 4.27Å; L134-K140 WeakPolarHBondContact O-CD 3.31Å; L134-K140 WeakPolarHBondContact O-CE 3.41Å; L134-K140 PolarHBondContact O-NZ 3.48Å; L134-K140 VanDerWaalsContact O-NZ 3.14Å; T136-K140 PolarHBondContact OG1-NZ 2.94Å; T136-K140 VanDerWaalsContact OG1-NZ 3.09Å; K140-F142 VanDerWaalsContact C-N 3.33Å; K140-F142 PolarHBondContact O-N 3.15Å; K140-V143 WeakPolarHBondContact O-CB 3.42Å; K140-V143 PolarHBondContact O-N 3Å; K140-A144 PolarHBondContact O-N 2.99Å; K140-L270 HydrophobicContact CB-CB 4.47Å; K140-L270 HydrophobicContact CB-CD1 4.38Å; K140-L270 HydrophobicContact CB-CD2 4.4Å; K140-L270 HydrophobicContact CD-CB 4.37Å; K140-S271 WeakPolarHBondContact CD-O 3.41Å; K140-S271 VanDerWaalsContact NZ-C 3.31Å; K140-S271 PolarHBondContact NZ-O 2.88Å; K140-A272 VanDerWaalsContact NZ-N 3.16Å
141	T	90.3	Very high	90.7	Very high	26 Å²	26	9.7 Å²	9.7	16%	0.16	7%	0.066	C	C	.	.	H	α-helix	trans	-62.1	-34.4	175.3	-43.1	0	0	0	0	113.6	G139 A144 A145 Q173	G139-T141 PolarHBondContact O-N 3.05Å; T141-A144 PolarHBondContact O-N 3.4Å; T141-A145 VanDerWaalsContact O-CB 3.3Å; T141-A145 WeakPolarHBondContact O-CB 3.35Å; T141-A145 PolarHBondContact O-N 3.1Å; T141-Q173 PolarHBondContact OG1-OE1 2.65Å
142	F	91.7	Very high	90.6	Very high	10 Å²	10	11.2 Å²	11.2	4%	0.044	7%	0.073	C	C	.	.	H	α-helix	trans	-69.8	-43.6	176.4	175.1	-96	0	0	0	111.2	Y108 P109 Q118 I122 G139 K140 A144 A145 V146 F180	Y108-F142 HydrophobicContact CE1-CZ 4.23Å; Y108-F142 HydrophobicContact CE2-CE1 4.14Å; Y108-F142 HydrophobicContact CE2-CZ 4.5Å; Y108-F142 AromaticContact CZ-CE1 3.85Å; Y108-F142 AromaticContact CZ-CZ 3.99Å; P109-F142 HydrophobicContact CB-CE2 4.41Å; P109-F142 HydrophobicContact CG-CE2 3.93Å; P109-F142 HydrophobicContact CG-CZ 3.96Å; Q118-F142 HydrophobicContact CB-CD1 4.43Å; Q118-F142 HydrophobicContact CB-CE1 4.43Å; I122-F142 HydrophobicContact CD1-CD1 4.39Å; I122-F142 HydrophobicContact CD1-CE1 4.11Å; G139-F142 WeakPolarHBondContact O-CA 3.48Å; G139-F142 WeakPolarHBondContact O-CB 3.48Å; G139-F142 PolarHBondContact O-N 2.93Å; K140-F142 VanDerWaalsContact C-N 3.33Å; K140-F142 PolarHBondContact O-N 3.15Å; F142-A144 VanDerWaalsContact C-N 3.32Å; F142-A144 PolarHBondContact O-N 3.38Å; F142-A145 PolarHBondContact O-N 3.49Å; F142-V146 HydrophobicContact CD1-CG2 4.43Å; F142-V146 HydrophobicContact CD2-CG2 4.47Å; F142-V146 HydrophobicContact CE1-CG2 4.07Å; F142-V146 HydrophobicContact CE2-CG2 4.12Å; F142-V146 HydrophobicContact CZ-CG2 3.91Å; F142-V146 WeakPolarHBondContact O-CG2 3.28Å; F142-V146 PolarHBondContact O-N 3.31Å; F142-F180 HydrophobicContact CB-CE2 4.45Å; F142-F180 AromaticContact CD2-CD1 3.68Å; F142-F180 HydrophobicContact CD2-CD1 3.68Å; F142-F180 HydrophobicContact CD2-CD2 4.4Å; F142-F180 AromaticContact CD2-CE1 3.71Å; F142-F180 HydrophobicContact CD2-CE1 3.71Å; F142-F180 HydrophobicContact CD2-CE2 4.43Å; F142-F180 HydrophobicContact CD2-CG 4.05Å; F142-F180 HydrophobicContact CD2-CZ 4.1Å; F142-F180 HydrophobicContact CE2-CD1 4.06Å; F142-F180 HydrophobicContact CE2-CE1 4.29Å
143	V	93.9	Very high	90.5	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-54.4	-50.6	172	172.3	0	0	0	0	110.2	I121 I122 G139 K140 A145 V146 V147	I121-V143 HydrophobicContact CG2-CG1 3.9Å; I121-V143 HydrophobicContact CG2-CG2 4.31Å; I122-V143 HydrophobicContact CG1-CB 4.15Å; I122-V143 HydrophobicContact CG1-CG1 3.9Å; I122-V143 HydrophobicContact CG1-CG2 4.14Å; G139-V143 PolarHBondContact O-N 2.97Å; G139-V143 VanDerWaalsContact O-N 3.1Å; K140-V143 WeakPolarHBondContact O-CB 3.42Å; K140-V143 PolarHBondContact O-N 3Å; V143-A145 PolarHBondContact O-N 3.16Å; V143-V146 PolarHBondContact O-N 3.09Å; V143-V147 WeakPolarHBondContact O-CG2 3.28Å; V143-V147 PolarHBondContact O-N 3.37Å; V143-V147 VanDerWaalsContact O-N 3.1Å
144	A	95.2	Very high	90.6	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-59.5	-43.1	176.4	0	0	0	0	0	113.2	K140 T141 F142 V146 V147 I148 F162 I235 L270	K140-A144 PolarHBondContact O-N 2.99Å; T141-A144 PolarHBondContact O-N 3.4Å; F142-A144 VanDerWaalsContact C-N 3.32Å; F142-A144 PolarHBondContact O-N 3.38Å; A144-V146 PolarHBondContact O-N 2.86Å; A144-V147 PolarHBondContact O-N 3.43Å; A144-I148 VanDerWaalsContact O-CG1 3.3Å; A144-I148 WeakPolarHBondContact O-CG1 3.36Å; A144-I148 PolarHBondContact O-N 2.84Å; A144-F162 HydrophobicContact CB-CD2 4.41Å; A144-F162 HydrophobicContact CB-CE2 3.85Å; A144-I235 HydrophobicContact CB-CD1 3.69Å; A144-I235 HydrophobicContact CB-CG2 4.21Å; A144-L270 HydrophobicContact CB-CD1 4.01Å
145	A	93.6	Very high	90.9	Very high	1 Å²	1	13.5 Å²	13.5	1%	0.008	8%	0.081	C	C	.	.	H	α-helix	trans	-63.4	-42.3	-179.3	0	0	0	0	0	112.6	T141 F142 V143 I148 Y149 C177 F180 I181	T141-A145 VanDerWaalsContact O-CB 3.3Å; T141-A145 WeakPolarHBondContact O-CB 3.35Å; T141-A145 PolarHBondContact O-N 3.1Å; F142-A145 PolarHBondContact O-N 3.49Å; V143-A145 PolarHBondContact O-N 3.16Å; A145-I148 PolarHBondContact O-N 3.45Å; A145-Y149 WeakPolarHBondContact O-CB 3.44Å; A145-Y149 PolarHBondContact O-N 3.46Å; A145-C177 HydrophobicContact CB-CB 4.45Å; A145-F180 HydrophobicContact CB-CB 4.02Å; A145-F180 HydrophobicContact CB-CD2 4.19Å; A145-F180 HydrophobicContact CB-CG 4.46Å; A145-I181 HydrophobicContact CB-CD1 4.08Å; A145-I181 HydrophobicContact CB-CG1 3.89Å; A145-I181 WeakPolarHBondContact O-CD1 3.34Å
146	V	93.8	Very high	91.5	Very high	2 Å²	2	15.8 Å²	15.8	1%	0.012	10%	0.096	C	C	.	.	H	α-helix	trans	-69.9	-36	177.6	-177.8	0	0	0	0	111.6	I107 P109 I122 F142 V143 A144 Y149 N150	I107-V146 WeakPolarHBondContact O-CG1 3.33Å; P109-V146 HydrophobicContact CG-CG2 3.56Å; I122-V146 HydrophobicContact CD1-CB 3.8Å; I122-V146 HydrophobicContact CD1-CG1 4.04Å; I122-V146 HydrophobicContact CD1-CG2 4.03Å; I122-V146 HydrophobicContact CG1-CB 4.37Å; I122-V146 HydrophobicContact CG2-CB 4.36Å; I122-V146 HydrophobicContact CG2-CG1 3.87Å; F142-V146 HydrophobicContact CD1-CG2 4.43Å; F142-V146 HydrophobicContact CD2-CG2 4.47Å; F142-V146 HydrophobicContact CE1-CG2 4.07Å; F142-V146 HydrophobicContact CE2-CG2 4.12Å; F142-V146 HydrophobicContact CZ-CG2 3.91Å; F142-V146 WeakPolarHBondContact O-CG2 3.28Å; F142-V146 PolarHBondContact O-N 3.31Å; V143-V146 PolarHBondContact O-N 3.09Å; A144-V146 PolarHBondContact O-N 2.86Å; V146-Y149 PolarHBondContact O-N 2.93Å; V146-N150 PolarHBondContact O-N 2.86Å; V146-N150 VanDerWaalsContact O-N 3.13Å; V146-N150 PolarHBondContact O-ND2 3.46Å
147	V	95.7	Very high	92	Very high	0 Å²	0	19 Å²	19	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-66.6	-45.6	173.9	177.6	0	0	0	0	111	I122 C125 L126 V143 A144 Y149 N150 F151 L233 V268	I122-V147 HydrophobicContact CG2-CG2 4.23Å; C125-V147 HydrophobicContact CB-CG2 3.69Å; L126-V147 HydrophobicContact CD2-CG1 4.49Å; V143-V147 WeakPolarHBondContact O-CG2 3.28Å; V143-V147 PolarHBondContact O-N 3.37Å; V143-V147 VanDerWaalsContact O-N 3.1Å; A144-V147 PolarHBondContact O-N 3.43Å; V147-Y149 VanDerWaalsContact C-N 3.32Å; V147-Y149 PolarHBondContact O-N 3.42Å; V147-N150 PolarHBondContact O-N 3.26Å; V147-F151 HydrophobicContact CG1-CD2 3.71Å; V147-F151 HydrophobicContact CG1-CE2 3.96Å; V147-F151 WeakPolarHBondContact O-CB 3.44Å; V147-F151 WeakPolarHBondContact O-CD2 3.47Å; V147-F151 PolarHBondContact O-N 2.9Å; V147-L233 HydrophobicContact CG1-CD1 4.02Å; V147-L233 HydrophobicContact CG1-CD2 3.97Å; V147-V268 HydrophobicContact CG1-CG2 4.16Å
148	I	95.2	Very high	92.9	Very high	2 Å²	2	17.1 Å²	17.1	1%	0.01	10%	0.096	C	C	.	.	H	α-helix	trans	-56	-46.4	174.1	-70.8	165.6	0	0	0	110.7	A144 A145 N150 F151 F152 F162 I181 V209 F211 L233 I235	A144-I148 VanDerWaalsContact O-CG1 3.3Å; A144-I148 WeakPolarHBondContact O-CG1 3.36Å; A144-I148 PolarHBondContact O-N 2.84Å; A145-I148 PolarHBondContact O-N 3.45Å; I148-N150 PolarHBondContact O-N 2.86Å; I148-F151 PolarHBondContact O-N 3.03Å; I148-F152 VanDerWaalsContact O-CB 3.27Å; I148-F152 WeakPolarHBondContact O-CB 3.42Å; I148-F152 PolarHBondContact O-N 3.35Å; I148-F162 HydrophobicContact CD1-CD2 4.22Å; I148-I181 HydrophobicContact CB-CD1 3.89Å; I148-I181 HydrophobicContact CG2-CD1 3.7Å; I148-V209 HydrophobicContact CG2-CG1 3.98Å; I148-V209 HydrophobicContact CG2-CG2 3.96Å; I148-F211 HydrophobicContact CD1-CZ 4.41Å; I148-L233 HydrophobicContact CG1-CD2 3.91Å; I148-I235 HydrophobicContact CD1-CD1 3.95Å; I148-I235 HydrophobicContact CG1-CD1 3.76Å
149	Y	94.3	Very high	93.4	Very high	32 Å²	32	18.6 Å²	18.6	13%	0.125	10%	0.101	C	C	.	.	H	α-helix	trans	-62	-42.3	-178.4	-179.4	-114.5	0	0	0	112.8	I107 A145 V146 V147 R153 I181 L184 L697	I107-Y149 HydrophobicContact CB-CD1 4.41Å; I107-Y149 HydrophobicContact CB-CE1 3.95Å; I107-Y149 HydrophobicContact CD1-CE1 3.8Å; I107-Y149 HydrophobicContact CG1-CE1 4.48Å; I107-Y149 HydrophobicContact CG2-CE1 4.01Å; A145-Y149 WeakPolarHBondContact O-CB 3.44Å; A145-Y149 PolarHBondContact O-N 3.46Å; V146-Y149 PolarHBondContact O-N 2.93Å; V147-Y149 VanDerWaalsContact C-N 3.32Å; V147-Y149 PolarHBondContact O-N 3.42Å; Y149-R153 HydrophobicContact CE2-CG 4.48Å; Y149-R153 WeakPolarHBondContact O-CG 3.31Å; Y149-R153 PolarHBondContact O-N 2.93Å; Y149-I181 HydrophobicContact CD2-CG2 3.43Å; Y149-I181 VanDerWaalsContact CD2-CG2 3.43Å; Y149-I181 HydrophobicContact CE2-CG2 4.35Å; Y149-I181 HydrophobicContact CG-CG2 3.95Å; Y149-L184 HydrophobicContact CD2-CD1 4.34Å; Y149-L184 HydrophobicContact CD2-CG 4.42Å; Y149-L697 HydrophobicContact CD1-CD1 3.56Å; Y149-L697 HydrophobicContact CD1-CD2 4.29Å; Y149-L697 HydrophobicContact CE1-CD1 3.67Å; Y149-L697 HydrophobicContact CE1-CD2 3.5Å; Y149-L697 HydrophobicContact CE1-CG 4.27Å; Y149-L697 HydrophobicContact CE2-CD2 4.49Å; Y149-L697 HydrophobicContact CG-CD1 4.02Å
150	N	95	Very high	94	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-71.6	-43.7	178	-74.8	-72.9	0	0	0	112	W106 I107 L126 V146 V147 I148 F152 R153 W154	W106-N150 WeakPolarHBondContact CA-OD1 3.14Å; I107-N150 PolarHBondContact N-OD1 3.43Å; I107-N150 PolarHBondContact O-ND2 3.27Å; L126-N150 HydrophobicContact CD2-CB 3.98Å; V146-N150 PolarHBondContact O-N 2.86Å; V146-N150 VanDerWaalsContact O-N 3.13Å; V146-N150 PolarHBondContact O-ND2 3.46Å; V147-N150 PolarHBondContact O-N 3.26Å; I148-N150 PolarHBondContact O-N 2.86Å; N150-F152 VanDerWaalsContact C-N 3.3Å; N150-F152 PolarHBondContact O-N 3.28Å; N150-R153 PolarHBondContact O-N 2.89Å; N150-W154 WeakPolarHBondContact O-CB 3.44Å; N150-W154 PolarHBondContact O-N 2.84Å
151	F	95.3	Very high	94.2	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-62.2	-35.6	174.5	-91.8	-98.7	0	0	0	112.9	L126 V147 I148 W154 Y155 F160 L233 R266 M683	L126-F151 HydrophobicContact CD2-CD2 4.19Å; L126-F151 HydrophobicContact CD2-CE2 4.02Å; V147-F151 HydrophobicContact CG1-CD2 3.71Å; V147-F151 HydrophobicContact CG1-CE2 3.96Å; V147-F151 WeakPolarHBondContact O-CB 3.44Å; V147-F151 WeakPolarHBondContact O-CD2 3.47Å; V147-F151 PolarHBondContact O-N 2.9Å; I148-F151 PolarHBondContact O-N 3.03Å; F151-W154 HydrophobicContact CE2-CZ3 4.44Å; F151-W154 PolarHBondContact O-N 3.23Å; F151-Y155 AromaticContact CD1-CD2 3.95Å; F151-Y155 HydrophobicContact CD1-CD2 3.95Å; F151-Y155 HydrophobicContact CD1-CE2 4.05Å; F151-Y155 HydrophobicContact CE1-CD2 4.44Å; F151-Y155 HydrophobicContact CE1-CE2 4.07Å; F151-Y155 PolarHBondContact O-N 3.44Å; F151-F160 HydrophobicContact CB-CD1 3.89Å; F151-F160 HydrophobicContact CB-CE1 3.79Å; F151-F160 VanDerWaalsContact O-CE1 3.3Å; F151-F160 WeakPolarHBondContact O-CE1 3.19Å; F151-F160 VanDerWaalsContact O-CZ 3.29Å; F151-F160 WeakPolarHBondContact O-CZ 3.44Å; F151-L233 HydrophobicContact CB-CD2 4.05Å; F151-L233 HydrophobicContact CD1-CB 4.17Å; F151-L233 HydrophobicContact CD2-CD1 4.5Å; F151-L233 HydrophobicContact CD2-CD2 4.37Å; F151-L233 HydrophobicContact CG-CB 4.34Å; F151-L233 HydrophobicContact CG-CD2 4.15Å; F151-R266 HydrophobicContact CE1-CB 3.71Å; F151-R266 HydrophobicContact CE1-CG 4.47Å; F151-R266 HydrophobicContact CE2-CB 4.28Å; F151-R266 HydrophobicContact CE2-CG 4.16Å; F151-R266 HydrophobicContact CZ-CB 3.46Å; F151-R266 VanDerWaalsContact CZ-CB 3.46Å; F151-R266 HydrophobicContact CZ-CG 3.77Å; F151-M683 HydrophobicContact CE1-CB 3.88Å; F151-M683 HydrophobicContact CE1-CE 4.2Å; F151-M683 HydrophobicContact CE1-CG 4.23Å; F151-M683 HydrophobicContact CZ-CB 3.88Å; F151-M683 HydrophobicContact CZ-CG 4.34Å
152	F	94.2	Very high	94.6	Very high	33 Å²	33	15.9 Å²	15.9	15%	0.145	8%	0.082	C	C	.	.	H	α-helix	trans	-59.9	-45.8	173.2	179	-81.2	0	0	0	111.8	I148 N150 Y155 F160 L184 N187 Q208 V209	I148-F152 VanDerWaalsContact O-CB 3.27Å; I148-F152 WeakPolarHBondContact O-CB 3.42Å; I148-F152 PolarHBondContact O-N 3.35Å; N150-F152 VanDerWaalsContact C-N 3.3Å; N150-F152 PolarHBondContact O-N 3.28Å; F152-Y155 CarbonylContact O-C 3.56Å; F152-F160 HydrophobicContact CB-CE2 4.1Å; F152-F160 HydrophobicContact CB-CZ 4.44Å; F152-F160 HydrophobicContact CD2-CD2 4.32Å; F152-F160 AromaticContact CD2-CE2 3.87Å; F152-F160 HydrophobicContact CD2-CE2 3.87Å; F152-F160 HydrophobicContact CG-CE2 4.38Å; F152-L184 HydrophobicContact CB-CD1 3.72Å; F152-L184 HydrophobicContact CD1-CD1 3.99Å; F152-L184 HydrophobicContact CD1-CD2 3.4Å; F152-L184 HydrophobicContact CD1-CG 4.35Å; F152-L184 HydrophobicContact CD2-CD1 3.75Å; F152-L184 HydrophobicContact CD2-CD2 4.01Å; F152-L184 HydrophobicContact CE1-CD2 3.4Å; F152-L184 HydrophobicContact CE2-CD1 4.45Å; F152-L184 HydrophobicContact CE2-CD2 3.98Å; F152-L184 HydrophobicContact CG-CD1 3.5Å; F152-L184 HydrophobicContact CG-CD2 3.75Å; F152-L184 HydrophobicContact CG-CG 4.3Å; F152-L184 HydrophobicContact CZ-CD2 3.72Å; F152-N187 HydrophobicContact CE2-CB 4.04Å; F152-N187 VanDerWaalsContact CZ-ND2 3.34Å; F152-N187 WeakPolarHBondContact CZ-ND2 3.39Å; F152-Q208 HydrophobicContact CD2-CB 4.34Å; F152-Q208 HydrophobicContact CE2-CB 4.01Å; F152-Q208 HydrophobicContact CE2-CG 4.37Å; F152-Q208 VanDerWaalsContact CE2-OE1 3.24Å; F152-V209 HydrophobicContact CD2-CG2 4.21Å
153	R	93.8	Very high	94.8	Very high	46 Å²	46	15.4 Å²	15.4	17%	0.174	8%	0.08	C	C	.	.	H	α-helix	trans	-65.7	-43.6	177	-68.9	175.1	65.3	-125.1	3	112	A102 E105 I107 Y149 N150	A102-R153 HydrophobicContact CB-CB 4.25Å; A102-R153 VanDerWaalsContact CB-O 3.31Å; A102-R153 WeakPolarHBondContact CB-O 3.26Å; E105-R153 PolarHBondContact O-NH1 3.29Å; E105-R153 IonicContact OE1-CZ 2.64Å; E105-R153 IonicContact OE1-NH1 2.99Å; E105-R153 IonicContact OE1-NH2 3.56Å; E105-R153 PolarHBondContact OE1-NH2 3.04Å; I107-R153 VanDerWaalsContact CD1-CZ 3.44Å; Y149-R153 HydrophobicContact CE2-CG 4.48Å; Y149-R153 WeakPolarHBondContact O-CG 3.31Å; Y149-R153 PolarHBondContact O-N 2.93Å; N150-R153 PolarHBondContact O-N 2.89Å
154	W	95.1	Very high	94.8	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-73.5	-25.8	-176.5	-65	-10.1	0	0	0	113.6	F98 D99 A102 E105 W106 L126 N150 F151 V684 P690	F98-W154 CarbonylContact C-O 3.56Å; F98-W154 VanDerWaalsContact CA-O 3.25Å; F98-W154 WeakPolarHBondContact CA-O 3.49Å; F98-W154 HydrophobicContact CD2-CB 4.21Å; F98-W154 HydrophobicContact CE2-CB 3.82Å; F98-W154 HydrophobicContact CE2-CD2 4.32Å; F98-W154 HydrophobicContact CE2-CE3 4.41Å; F98-W154 HydrophobicContact CE2-CG 4.12Å; F98-W154 HydrophobicContact CZ-CB 4.46Å; F98-W154 HydrophobicContact CZ-CG 4.44Å; D99-W154 PolarHBondContact N-O 3.24Å; A102-W154 VanDerWaalsContact O-CD1 3.26Å; A102-W154 PolarHBondContact O-NE1 2.78Å; A102-W154 VanDerWaalsContact O-NE1 3.13Å; E105-W154 PolarHBondContact O-NE1 3.36Å; W106-W154 HydrophobicContact CB-CH2 4.48Å; W106-W154 HydrophobicContact CB-CZ2 3.83Å; L126-W154 HydrophobicContact CB-CH2 4.12Å; L126-W154 HydrophobicContact CB-CZ3 4.24Å; L126-W154 HydrophobicContact CD1-CH2 3.95Å; L126-W154 HydrophobicContact CD2-CH2 3.92Å; L126-W154 HydrophobicContact CD2-CZ3 3.91Å; L126-W154 HydrophobicContact CG-CH2 4.2Å; L126-W154 HydrophobicContact CG-CZ3 4.48Å; N150-W154 WeakPolarHBondContact O-CB 3.44Å; N150-W154 PolarHBondContact O-N 2.84Å; F151-W154 HydrophobicContact CE2-CZ3 4.44Å; F151-W154 PolarHBondContact O-N 3.23Å; W154-V684 HydrophobicContact CE3-CG2 4.15Å; W154-V684 HydrophobicContact CH2-CG2 3.92Å; W154-V684 HydrophobicContact CZ3-CG2 3.6Å; W154-P690 HydrophobicContact CH2-CB 4.21Å; W154-P690 HydrophobicContact CH2-CG 3.81Å; W154-P690 HydrophobicContact CZ2-CB 3.68Å; W154-P690 HydrophobicContact CZ2-CG 3.6Å
155	Y	95.3	Very high	94.6	Very high	2 Å²	2	16.1 Å²	16.1	1%	0.008	8%	0.084	C	C	.	.			trans	-126.5	76.1	178.6	-69.2	-81.5	0	0	0	111.8	L95 G97 F98 F151 F152 T157 G158 F160 R232 M683	L95-Y155 WeakPolarHBondContact CD1-OH 3.5Å; G97-Y155 WeakPolarHBondContact O-CA 3.37Å; F98-Y155 HydrophobicContact CB-CD1 4.4Å; F98-Y155 HydrophobicContact CB-CE1 3.95Å; F98-Y155 HydrophobicContact CD2-CE1 4.05Å; F98-Y155 AromaticContact CD2-CE2 3.97Å; F98-Y155 HydrophobicContact CD2-CE2 3.97Å; F98-Y155 AromaticContact CD2-CZ 3.7Å; F151-Y155 AromaticContact CD1-CD2 3.95Å; F151-Y155 HydrophobicContact CD1-CD2 3.95Å; F151-Y155 HydrophobicContact CD1-CE2 4.05Å; F151-Y155 HydrophobicContact CE1-CD2 4.44Å; F151-Y155 HydrophobicContact CE1-CE2 4.07Å; F151-Y155 PolarHBondContact O-N 3.44Å; F152-Y155 CarbonylContact O-C 3.56Å; Y155-T157 PolarHBondContact O-N 3.27Å; Y155-G158 PolarHBondContact O-N 3.38Å; Y155-F160 WeakPolarHBondContact O-CZ 3.15Å; Y155-R232 HydrophobicContact CD1-CG 3.83Å; Y155-R232 HydrophobicContact CD2-CB 4.14Å; Y155-R232 HydrophobicContact CD2-CG 4.29Å; Y155-R232 HydrophobicContact CE1-CG 4.25Å; Y155-R232 HydrophobicContact CG-CB 4.15Å; Y155-R232 HydrophobicContact CG-CG 3.85Å; Y155-M683 HydrophobicContact CE2-CE 3.98Å; Y155-M683 WeakPolarHBondContact OH-CE 3.37Å; Y155-M683 PolarHBondContact OH-O 2.94Å
156	P	92.3	Very high	94.2	Very high	62 Å²	62	16.9 Å²	16.9	40%	0.403	9%	0.089	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-17.1	-176	-26.9	36.4	0	0	0	115.8	G97 D99 Q208	G97-P156 WeakPolarHBondContact O-CD 3.45Å; D99-P156 HydrophobicContact CB-CG 3.87Å; P156-Q208 PolarHBondContact O-NE2 3.43Å
157	T	91.4	Very high	93.8	Very high	98 Å²	98	20.2 Å²	20.2	60%	0.601	10%	0.102	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.8	-4	173.4	55.9	0	0	0	0	114	Y155	Y155-T157 PolarHBondContact O-N 3.27Å
158	G	93.7	Very high	93.2	Very high	2 Å²	2	23 Å²	23	2%	0.021	12%	0.12	C	C	.	.			trans	-73.4	161.1	-175.9	0	0	0	0	0	113.9	Y155 F160 Q208	Y155-G158 PolarHBondContact O-N 3.38Å; G158-F160 VanDerWaalsContact O-CE2 3.32Å; G158-F160 WeakPolarHBondContact O-CE2 3.33Å; G158-Q208 PolarHBondContact O-NE2 3.28Å
159	R	95.3	Very high	92.7	Very high	39 Å²	39	23.6 Å²	23.6	15%	0.147	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	140.6	168.3	-50.5	-62.1	169.4	165.9	-4	109.9	W204 S205 Y207 Q208 L210 S230 I231 R232	R159-W204 HydrophobicContact CB-CZ3 4.48Å; R159-W204 PolarHBondContact NE-O 3.44Å; R159-W204 PolarHBondContact NH1-O 3.33Å; R159-W204 PolarHBondContact NH2-O 3.42Å; R159-S205 PolarHBondContact NH1-O 3.26Å; R159-S205 PolarHBondContact NH2-O 3.29Å; R159-Y207 VanDerWaalsContact NH1-C 3.31Å; R159-Y207 PolarHBondContact NH1-O 3.31Å; R159-Q208 CarbonylContact C-O 3.51Å; R159-Q208 WeakPolarHBondContact CA-O 3.08Å; R159-L210 HydrophobicContact CB-CD1 4.31Å; R159-S230 WeakPolarHBondContact CG-OG 3.32Å; R159-S230 PolarHBondContact N-O 2.69Å; R159-I231 WeakPolarHBondContact O-CA 3.09Å; R159-R232 PolarHBondContact O-N 2.97Å
160	F	96.5	Very high	92.6	Very high	2 Å²	2	22.2 Å²	22.2	1%	0.009	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	113.8	-173.5	-41.4	-77.5	0	0	0	107.9	F151 F152 Y155 G158 Q208 V209 L210 R232 L233	F151-F160 HydrophobicContact CB-CD1 3.89Å; F151-F160 HydrophobicContact CB-CE1 3.79Å; F151-F160 VanDerWaalsContact O-CE1 3.3Å; F151-F160 WeakPolarHBondContact O-CE1 3.19Å; F151-F160 VanDerWaalsContact O-CZ 3.29Å; F151-F160 WeakPolarHBondContact O-CZ 3.44Å; F152-F160 HydrophobicContact CB-CE2 4.1Å; F152-F160 HydrophobicContact CB-CZ 4.44Å; F152-F160 HydrophobicContact CD2-CD2 4.32Å; F152-F160 AromaticContact CD2-CE2 3.87Å; F152-F160 HydrophobicContact CD2-CE2 3.87Å; F152-F160 HydrophobicContact CG-CE2 4.38Å; Y155-F160 WeakPolarHBondContact O-CZ 3.15Å; G158-F160 VanDerWaalsContact O-CE2 3.32Å; G158-F160 WeakPolarHBondContact O-CE2 3.33Å; F160-Q208 HydrophobicContact CD2-CB 4.35Å; F160-Q208 WeakPolarHBondContact CD2-O 3.37Å; F160-Q208 HydrophobicContact CE2-CB 4.27Å; F160-Q208 PolarHBondContact N-O 3.36Å; F160-V209 HydrophobicContact CB-CG2 4.49Å; F160-V209 HydrophobicContact CD2-CG2 3.98Å; F160-V209 WeakPolarHBondContact O-CA 3.33Å; F160-L210 PolarHBondContact O-N 2.93Å; F160-R232 HydrophobicContact CE1-CB 4.12Å; F160-L233 HydrophobicContact CB-CB 4.26Å; F160-L233 HydrophobicContact CD1-CB 3.82Å
161	V	97.3	Very high	92.3	Very high	2 Å²	2	24.9 Å²	24.9	1%	0.012	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	123.6	-172.2	-165.7	0	0	0	0	110.3	M163 W204 L210 L212 L217 L233 L234 I235	V161-M163 HydrophobicContact CG1-CG 3.98Å; V161-W204 HydrophobicContact CG2-CH2 3.9Å; V161-W204 HydrophobicContact CG2-CZ3 4.22Å; V161-L210 WeakPolarHBondContact CA-O 3.43Å; V161-L212 HydrophobicContact CG1-CD1 3.91Å; V161-L212 HydrophobicContact CG1-CD2 3.79Å; V161-L212 HydrophobicContact CG1-CG 3.72Å; V161-L217 HydrophobicContact CG1-CD2 4.26Å; V161-L233 PolarHBondContact N-O 2.97Å; V161-L234 HydrophobicContact CB-CD2 3.91Å; V161-L234 HydrophobicContact CG2-CD2 4.13Å; V161-I235 PolarHBondContact O-N 3.19Å
162	F	97.5	Very high	91.8	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	119.1	168.4	-168.8	-69.9	0	0	0	108.8	A144 I148 A164 Q173 L210 F211 L212 I235 D237 L270	A144-F162 HydrophobicContact CB-CD2 4.41Å; A144-F162 HydrophobicContact CB-CE2 3.85Å; I148-F162 HydrophobicContact CD1-CD2 4.22Å; F162-A164 HydrophobicContact CE1-CB 4.33Å; F162-Q173 HydrophobicContact CD1-CB 4.21Å; F162-Q173 HydrophobicContact CE1-CB 3.56Å; F162-Q173 HydrophobicContact CE1-CG 3.66Å; F162-Q173 HydrophobicContact CZ-CB 3.75Å; F162-Q173 HydrophobicContact CZ-CG 3.76Å; F162-L210 PolarHBondContact N-O 3.37Å; F162-F211 HydrophobicContact CB-CD1 3.6Å; F162-F211 HydrophobicContact CB-CE1 3.57Å; F162-F211 HydrophobicContact CB-CG 4.14Å; F162-F211 HydrophobicContact CB-CZ 4.1Å; F162-F211 AromaticContact CD1-CD1 3.79Å; F162-F211 HydrophobicContact CD1-CD1 3.79Å; F162-F211 AromaticContact CD1-CE1 3.88Å; F162-F211 HydrophobicContact CD1-CE1 3.88Å; F162-F211 AromaticContact CD2-CE1 3.86Å; F162-F211 HydrophobicContact CD2-CE1 3.86Å; F162-F211 HydrophobicContact CD2-CZ 4.48Å; F162-F211 AromaticContact CG-CD1 3.72Å; F162-F211 HydrophobicContact CG-CD1 3.72Å; F162-F211 AromaticContact CG-CE1 3.48Å; F162-F211 HydrophobicContact CG-CE1 3.48Å; F162-F211 VanDerWaalsContact CG-CE1 3.48Å; F162-F211 HydrophobicContact CG-CZ 4.32Å; F162-F211 WeakPolarHBondContact O-CA 3.42Å; F162-L212 PolarHBondContact O-N 3.39Å; F162-I235 HydrophobicContact CD2-CB 3.95Å; F162-I235 HydrophobicContact CD2-CD1 4.33Å; F162-I235 HydrophobicContact CD2-CG2 3.79Å; F162-I235 HydrophobicContact CE2-CB 4.41Å; F162-I235 HydrophobicContact CE2-CG2 3.73Å; F162-I235 HydrophobicContact CG-CB 4.43Å; F162-I235 HydrophobicContact CZ-CG2 4.41Å; F162-D237 HydrophobicContact CE1-CB 3.8Å; F162-D237 HydrophobicContact CZ-CB 3.9Å; F162-L270 HydrophobicContact CE2-CD1 4.31Å; F162-L270 HydrophobicContact CZ-CD1 4.35Å
163	M	97.2	Very high	91.7	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	135.5	178.8	-58.9	-175.4	-82.8	0	0	111.3	V161 L212 P214 L217 L234 I235 F236 D237 Y248 V251	V161-M163 HydrophobicContact CG1-CG 3.98Å; M163-L212 WeakPolarHBondContact CA-O 3.26Å; M163-L212 HydrophobicContact CG-CD1 3.78Å; M163-L212 HydrophobicContact SD-CD1 4.45Å; M163-P214 HydrophobicContact SD-CB 4.11Å; M163-L217 HydrophobicContact CE-CD2 4.41Å; M163-L217 HydrophobicContact SD-CD2 3.71Å; M163-L234 HydrophobicContact CE-CB 4.37Å; M163-L234 HydrophobicContact CE-CD2 4.23Å; M163-I235 PolarHBondContact N-O 3.24Å; M163-F236 HydrophobicContact CE-CD1 3.63Å; M163-F236 HydrophobicContact CE-CD2 4.18Å; M163-F236 HydrophobicContact CE-CE1 3.31Å; M163-F236 HydrophobicContact CE-CE2 3.89Å; M163-F236 HydrophobicContact CE-CG 4.05Å; M163-F236 HydrophobicContact CE-CZ 3.45Å; M163-F236 VanDerWaalsContact CE-CZ 3.45Å; M163-D237 WeakPolarHBondContact O-CB 3.37Å; M163-D237 PolarHBondContact O-N 3.04Å; M163-Y248 HydrophobicContact CB-CE1 3.83Å; M163-Y248 PolarHBondContact O-OH 3.14Å; M163-V251 HydrophobicContact CE-CG1 4.29Å; M163-V251 HydrophobicContact SD-CG1 4.33Å; M163-V251 HydrophobicContact SD-CG2 4.45Å
164	A	94	Very high	91.6	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.14	C	C	.	.			trans	-135.7	152.3	168.2	0	0	0	0	0	110.6	F162 T166 L169 V170 L212 T213 P214 D237 Y248	F162-A164 HydrophobicContact CE1-CB 4.33Å; A164-T166 VanDerWaalsContact C-N 3.35Å; A164-T166 PolarHBondContact O-N 3.26Å; A164-L169 HydrophobicContact CB-CB 4.1Å; A164-L169 HydrophobicContact CB-CD2 4.05Å; A164-L169 HydrophobicContact CB-CG 3.83Å; A164-V170 HydrophobicContact CB-CG2 3.91Å; A164-L212 PolarHBondContact N-O 3.32Å; A164-T213 WeakPolarHBondContact O-CA 3.31Å; A164-P214 VanDerWaalsContact O-CD 3.22Å; A164-P214 WeakPolarHBondContact O-CD 3.37Å; A164-D237 HydrophobicContact CB-CB 4.08Å; A164-Y248 WeakPolarHBondContact CA-OH 3.49Å
165	P	89.7	Confident	91.2	Very high	15 Å²	15	29.2 Å²	29.2	10%	0.097	16%	0.163	C	C	.	.	S	Bend	trans	-66.4	-32.6	-170.7	-23.3	35.5	0	0	0	114	E238 K241 Y248	P165-E238 HydrophobicContact CG-CB 4.47Å; P165-K241 HydrophobicContact CB-CD 4.23Å; P165-K241 HydrophobicContact CG-CD 3.99Å; P165-Y248 VanDerWaalsContact CD-OH 3.29Å; P165-Y248 WeakPolarHBondContact CD-OH 3.21Å; P165-Y248 HydrophobicContact CG-CE2 4.48Å
166	T	85.6	Confident	90.8	Very high	18 Å²	18	30.7 Å²	30.7	11%	0.11	17%	0.173	C	C	.	.	S	Bend	trans	-122.5	144.8	-173.9	69.8	0	0	0	0	112.4	A164 L169 V170 P1271	A164-T166 VanDerWaalsContact C-N 3.35Å; A164-T166 PolarHBondContact O-N 3.26Å; T166-L169 WeakPolarHBondContact O-CB 3.33Å; T166-L169 PolarHBondContact O-N 2.8Å; T166-L169 VanDerWaalsContact O-N 3.08Å; T166-V170 PolarHBondContact O-N 2.92Å; T166-P1271 HydrophobicContact CG2-CB 4.3Å; T166-P1271 HydrophobicContact CG2-CG 4.04Å
167	R	85.6	Confident	90.5	Very high	72 Å²	72	27.8 Å²	27.8	27%	0.272	15%	0.154	S	C	.	.	H	α-helix	trans	-52.2	-46.3	179.2	-70.9	173.1	166.8	-140.4	-7.1	113.8	L169 V170 T171 S194 T213	R167-L169 VanDerWaalsContact C-N 3.25Å; R167-L169 PolarHBondContact O-N 2.96Å; R167-V170 WeakPolarHBondContact O-CB 3.29Å; R167-V170 PolarHBondContact O-N 3.33Å; R167-V170 VanDerWaalsContact O-N 3.14Å; R167-T171 PolarHBondContact O-N 3.11Å; R167-T171 PolarHBondContact O-OG1 3Å; R167-T171 VanDerWaalsContact O-OG1 3.07Å; R167-S194 PolarHBondContact NH1-OG 2.95Å; R167-S194 VanDerWaalsContact NH1-OG 3.15Å; R167-S194 PolarHBondContact NH2-OG 3.04Å; R167-T213 HydrophobicContact CG-CG2 3.98Å
168	P	82.6	Confident	90.3	Very high	58 Å²	58	24.1 Å²	24.1	38%	0.377	13%	0.133	S	C	.	.	H	α-helix	trans	-60.7	-35.1	178.7	-23.4	35.7	0	0	0	112.9	T171 Q172	P168-T171 PolarHBondContact O-N 3.3Å; P168-Q172 WeakPolarHBondContact O-CB 3.31Å; P168-Q172 PolarHBondContact O-N 2.83Å
169	L	86.2	Confident	89.7	Confident	14 Å²	14	30.2 Å²	30.2	7%	0.073	16%	0.161	C	C	.	.	H	α-helix	trans	-70.3	-39.6	176	-169.4	52.4	0	0	0	111.4	A164 T166 R167 T171 Q172 Q173	A164-L169 HydrophobicContact CB-CB 4.1Å; A164-L169 HydrophobicContact CB-CD2 4.05Å; A164-L169 HydrophobicContact CB-CG 3.83Å; T166-L169 WeakPolarHBondContact O-CB 3.33Å; T166-L169 PolarHBondContact O-N 2.8Å; T166-L169 VanDerWaalsContact O-N 3.08Å; R167-L169 VanDerWaalsContact C-N 3.25Å; R167-L169 PolarHBondContact O-N 2.96Å; L169-T171 PolarHBondContact O-N 3.43Å; L169-Q172 PolarHBondContact O-N 3.21Å; L169-Q173 HydrophobicContact CD1-CG 3.91Å; L169-Q173 HydrophobicContact CG-CG 4.17Å; L169-Q173 WeakPolarHBondContact O-CB 3.39Å; L169-Q173 VanDerWaalsContact O-CG 3.24Å; L169-Q173 WeakPolarHBondContact O-CG 3.25Å; L169-Q173 PolarHBondContact O-N 3.42Å
170	V	91.1	Very high	89	Confident	3 Å²	3	30.7 Å²	30.7	2%	0.018	16%	0.164	C	C	.	.	H	α-helix	trans	-55.4	-51.2	171.8	177.8	0	0	0	0	110.6	A164 T166 R167 Q172 Q173 L174 E190 F211 L212 T213	A164-V170 HydrophobicContact CB-CG2 3.91Å; T166-V170 PolarHBondContact O-N 2.92Å; R167-V170 WeakPolarHBondContact O-CB 3.29Å; R167-V170 PolarHBondContact O-N 3.33Å; R167-V170 VanDerWaalsContact O-N 3.14Å; V170-Q172 VanDerWaalsContact C-N 3.34Å; V170-Q172 PolarHBondContact O-N 3.29Å; V170-Q173 PolarHBondContact O-N 2.9Å; V170-L174 VanDerWaalsContact O-CB 3.25Å; V170-L174 WeakPolarHBondContact O-CB 3.21Å; V170-L174 PolarHBondContact O-N 2.59Å; V170-E190 HydrophobicContact CG1-CG 4.1Å; V170-F211 VanDerWaalsContact CG1-C 3.44Å; V170-F211 HydrophobicContact CG1-CB 3.82Å; V170-L212 VanDerWaalsContact CG2-C 3.5Å; V170-L212 WeakPolarHBondContact CG2-O 3.16Å; V170-T213 HydrophobicContact CG2-CG2 3.84Å
171	T	88.1	Confident	88.1	Confident	56 Å²	56	30.7 Å²	30.7	34%	0.344	16%	0.164	S	C	.	.	H	α-helix	trans	-63	-38.3	178.1	-37.6	0	0	0	0	112	R167 P168 L169 T175 E190	R167-T171 PolarHBondContact O-N 3.11Å; R167-T171 PolarHBondContact O-OG1 3Å; R167-T171 VanDerWaalsContact O-OG1 3.07Å; P168-T171 PolarHBondContact O-N 3.3Å; L169-T171 PolarHBondContact O-N 3.43Å; T171-T175 WeakPolarHBondContact O-CB 3.26Å; T171-T175 PolarHBondContact O-N 3.46Å; T171-T175 PolarHBondContact O-OG1 2.8Å; T171-E190 WeakPolarHBondContact CB-OE1 3.49Å; T171-E190 PolarHBondContact OG1-OE1 2.93Å
172	Q	86.3	Confident	86.8	Confident	58 Å²	58	31.1 Å²	31.1	27%	0.271	17%	0.169	S	C	.	.	H	α-helix	trans	-66.5	-45.5	177.6	-174.1	-175.2	-60.9	0	0	112.4	P168 L169 V170 T175 S176	P168-Q172 WeakPolarHBondContact O-CB 3.31Å; P168-Q172 PolarHBondContact O-N 2.83Å; L169-Q172 PolarHBondContact O-N 3.21Å; V170-Q172 VanDerWaalsContact C-N 3.34Å; V170-Q172 PolarHBondContact O-N 3.29Å; Q172-T175 PolarHBondContact O-N 3.37Å; Q172-S176 WeakPolarHBondContact O-CB 3.48Å; Q172-S176 PolarHBondContact O-N 2.77Å; Q172-S176 PolarHBondContact O-OG 2.96Å
173	Q	91	Very high	85.5	Confident	10 Å²	10	34 Å²	34	5%	0.047	19%	0.188	C	C	.	.	H	α-helix	trans	-70.7	-37.9	179.6	-61.2	-68.2	23.3	0	0	110.9	T141 F162 L169 V170 S176 C177 F211 D237	T141-Q173 PolarHBondContact OG1-OE1 2.65Å; F162-Q173 HydrophobicContact CD1-CB 4.21Å; F162-Q173 HydrophobicContact CE1-CB 3.56Å; F162-Q173 HydrophobicContact CE1-CG 3.66Å; F162-Q173 HydrophobicContact CZ-CB 3.75Å; F162-Q173 HydrophobicContact CZ-CG 3.76Å; L169-Q173 HydrophobicContact CD1-CG 3.91Å; L169-Q173 HydrophobicContact CG-CG 4.17Å; L169-Q173 WeakPolarHBondContact O-CB 3.39Å; L169-Q173 VanDerWaalsContact O-CG 3.24Å; L169-Q173 WeakPolarHBondContact O-CG 3.25Å; L169-Q173 PolarHBondContact O-N 3.42Å; V170-Q173 PolarHBondContact O-N 2.9Å; Q173-S176 PolarHBondContact O-N 3.12Å; Q173-C177 WeakPolarHBondContact O-CB 3.4Å; Q173-C177 PolarHBondContact O-N 3.21Å; Q173-C177 PolarHBondContact O-SG 2.69Å; Q173-C177 VanDerWaalsContact O-SG 3.37Å; Q173-F211 HydrophobicContact CB-CD1 4.48Å; Q173-F211 HydrophobicContact CB-CE1 4.3Å; Q173-D237 PolarHBondContact NE2-OD2 2.75Å
174	L	91.6	Very high	84.7	Confident	25 Å²	25	34.4 Å²	34.4	13%	0.131	19%	0.19	C	C	.	.	H	α-helix	trans	-54.8	-51.4	168.9	167.7	59.1	0	0	0	111.9	V170 S176 S178 I188 E190 F211	V170-L174 VanDerWaalsContact O-CB 3.25Å; V170-L174 WeakPolarHBondContact O-CB 3.21Å; V170-L174 PolarHBondContact O-N 2.59Å; L174-S176 VanDerWaalsContact C-N 3.35Å; L174-S176 PolarHBondContact O-N 3.48Å; L174-S178 VanDerWaalsContact O-CB 3.29Å; L174-S178 WeakPolarHBondContact O-CB 3.29Å; L174-S178 PolarHBondContact O-N 2.77Å; L174-S178 PolarHBondContact O-OG 3.48Å; L174-I188 HydrophobicContact CD1-CG2 3.28Å; L174-E190 HydrophobicContact CD2-CB 3.69Å; L174-E190 HydrophobicContact CD2-CG 4.08Å; L174-F211 HydrophobicContact CB-CB 4.11Å; L174-F211 HydrophobicContact CB-CD1 3.86Å; L174-F211 HydrophobicContact CB-CD2 4.24Å; L174-F211 HydrophobicContact CB-CE1 4.36Å; L174-F211 HydrophobicContact CB-CG 3.81Å; L174-F211 HydrophobicContact CD1-CD2 3.68Å; L174-F211 HydrophobicContact CD1-CE2 3.99Å; L174-F211 HydrophobicContact CD1-CG 4.1Å; L174-F211 HydrophobicContact CG-CG 4.48Å
175	T	87.9	Confident	83.9	Confident	78 Å²	78	40.3 Å²	40.3	48%	0.479	22%	0.215	S	C	.	.	H	α-helix	trans	-59.6	-47.9	179.2	-55.7	0	0	0	0	110.6	T171 Q172 S178 E179	T171-T175 WeakPolarHBondContact O-CB 3.26Å; T171-T175 PolarHBondContact O-N 3.46Å; T171-T175 PolarHBondContact O-OG1 2.8Å; Q172-T175 PolarHBondContact O-N 3.37Å; T175-S178 WeakPolarHBondContact O-CB 3.41Å; T175-S178 PolarHBondContact O-N 3.42Å; T175-E179 PolarHBondContact O-N 2.92Å
176	S	85.4	Confident	83.6	Confident	33 Å²	33	47.8 Å²	47.8	23%	0.231	25%	0.249	C	C	.	.	H	α-helix	trans	-63.9	-46.8	-178.4	-56.4	0	0	0	0	112.6	Q172 Q173 L174 S178 E179 F180	Q172-S176 WeakPolarHBondContact O-CB 3.48Å; Q172-S176 PolarHBondContact O-N 2.77Å; Q172-S176 PolarHBondContact O-OG 2.96Å; Q173-S176 PolarHBondContact O-N 3.12Å; L174-S176 VanDerWaalsContact C-N 3.35Å; L174-S176 PolarHBondContact O-N 3.48Å; S176-S178 VanDerWaalsContact C-N 3.28Å; S176-S178 PolarHBondContact O-N 2.92Å; S176-E179 PolarHBondContact O-N 3.47Å; S176-F180 WeakPolarHBondContact O-CD2 3.41Å
177	C	87.6	Confident	83.8	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-63.5	-34.2	175.3	-72.3	0	0	0	0	111.8	A145 Q173 E179 F180 I181 F211	A145-C177 HydrophobicContact CB-CB 4.45Å; Q173-C177 WeakPolarHBondContact O-CB 3.4Å; Q173-C177 PolarHBondContact O-N 3.21Å; Q173-C177 PolarHBondContact O-SG 2.69Å; Q173-C177 VanDerWaalsContact O-SG 3.37Å; C177-E179 PolarHBondContact O-N 2.88Å; C177-F180 PolarHBondContact O-N 3.17Å; C177-I181 WeakPolarHBondContact O-CG1 3.46Å; C177-I181 PolarHBondContact O-N 3.48Å; C177-F211 HydrophobicContact CB-CE1 4.23Å; C177-F211 HydrophobicContact CB-CZ 3.64Å
178	S	85.9	Confident	84.1	Confident	22 Å²	22	46.9 Å²	46.9	15%	0.154	25%	0.249	C	C	.	.	H	α-helix	trans	-69.1	-13.9	177.7	-60.1	0	0	0	0	114.1	L174 T175 S176 K185	L174-S178 VanDerWaalsContact O-CB 3.29Å; L174-S178 WeakPolarHBondContact O-CB 3.29Å; L174-S178 PolarHBondContact O-N 2.77Å; L174-S178 PolarHBondContact O-OG 3.48Å; T175-S178 WeakPolarHBondContact O-CB 3.41Å; T175-S178 PolarHBondContact O-N 3.42Å; S176-S178 VanDerWaalsContact C-N 3.28Å; S176-S178 PolarHBondContact O-N 2.92Å; S178-K185 WeakPolarHBondContact O-CE 3.14Å; S178-K185 PolarHBondContact O-NZ 3.01Å
179	E	82.4	Confident	84.6	Confident	130 Å²	130	44.7 Å²	44.7	61%	0.607	24%	0.236	S	C	*	.	H	α-helix	trans	-79.9	-43.4	170.9	-66.4	-173.6	168.1	0	0	111.6	T175 S176 C177	T175-E179 PolarHBondContact O-N 2.92Å; S176-E179 PolarHBondContact O-N 3.47Å; C177-E179 PolarHBondContact O-N 2.88Å
180	F	79.2	Confident	85	Confident	48 Å²	48	47 Å²	47	21%	0.211	25%	0.246	C	C	.	.	H	α-helix	trans	-76.2	-44.3	178.9	-58.4	-64.8	0	0	0	112.7	F142 A145 S176 C177 G182	F142-F180 HydrophobicContact CB-CE2 4.45Å; F142-F180 AromaticContact CD2-CD1 3.68Å; F142-F180 HydrophobicContact CD2-CD1 3.68Å; F142-F180 HydrophobicContact CD2-CD2 4.4Å; F142-F180 AromaticContact CD2-CE1 3.71Å; F142-F180 HydrophobicContact CD2-CE1 3.71Å; F142-F180 HydrophobicContact CD2-CE2 4.43Å; F142-F180 HydrophobicContact CD2-CG 4.05Å; F142-F180 HydrophobicContact CD2-CZ 4.1Å; F142-F180 HydrophobicContact CE2-CD1 4.06Å; F142-F180 HydrophobicContact CE2-CE1 4.29Å; A145-F180 HydrophobicContact CB-CB 4.02Å; A145-F180 HydrophobicContact CB-CD2 4.19Å; A145-F180 HydrophobicContact CB-CG 4.46Å; S176-F180 WeakPolarHBondContact O-CD2 3.41Å; C177-F180 PolarHBondContact O-N 3.17Å; F180-G182 VanDerWaalsContact C-N 3.31Å; F180-G182 PolarHBondContact O-N 2.86Å
181	I	78.3	Confident	85.1	Confident	2 Å²	2	46.9 Å²	46.9	1%	0.01	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	51	-177.7	-26.7	170.8	0	0	0	111.6	A145 I148 Y149 C177 P183 L184	A145-I181 HydrophobicContact CB-CD1 4.08Å; A145-I181 HydrophobicContact CB-CG1 3.89Å; A145-I181 WeakPolarHBondContact O-CD1 3.34Å; I148-I181 HydrophobicContact CB-CD1 3.89Å; I148-I181 HydrophobicContact CG2-CD1 3.7Å; Y149-I181 HydrophobicContact CD2-CG2 3.43Å; Y149-I181 VanDerWaalsContact CD2-CG2 3.43Å; Y149-I181 HydrophobicContact CE2-CG2 4.35Å; Y149-I181 HydrophobicContact CG-CG2 3.95Å; C177-I181 WeakPolarHBondContact O-CG1 3.46Å; C177-I181 PolarHBondContact O-N 3.48Å; I181-P183 VanDerWaalsContact C-N 3.27Å; I181-P183 VanDerWaalsContact O-N 3.1Å; I181-L184 HydrophobicContact CG2-CB 4.07Å; I181-L184 HydrophobicContact CG2-CD1 3.65Å; I181-L184 HydrophobicContact CG2-CG 3.59Å; I181-L184 PolarHBondContact O-N 3.41Å
182	G	69.6	Low	85.3	Confident	11 Å²	11	45.5 Å²	45.5	11%	0.113	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-43.9	-40.3	179.2	0	0	0	0	0	116.1	F180 L184 K185	F180-G182 VanDerWaalsContact C-N 3.31Å; F180-G182 PolarHBondContact O-N 2.86Å; G182-L184 PolarHBondContact O-N 2.7Å; G182-K185 WeakPolarHBondContact O-CD 3.35Å; G182-K185 WeakPolarHBondContact O-CG 3.32Å
183	P	71.3	Confident	85.2	Confident	62 Å²	62	44.2 Å²	44.2	40%	0.403	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-70.1	-19.7	-179.5	-23.2	35.8	0	0	0	115.9	I181 L697 I699	I181-P183 VanDerWaalsContact C-N 3.27Å; I181-P183 VanDerWaalsContact O-N 3.1Å; P183-L697 WeakPolarHBondContact CD-O 3.5Å; P183-I699 HydrophobicContact CG-CD1 4.42Å; P183-I699 HydrophobicContact CG-CG1 4.46Å
184	L	79.6	Confident	85.1	Confident	8 Å²	8	47.2 Å²	47.2	4%	0.042	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-91.9	6.4	-174	-62.7	-168.4	0	0	0	114.6	Y149 F152 I181 G182 E186 N187 I188 V209	Y149-L184 HydrophobicContact CD2-CD1 4.34Å; Y149-L184 HydrophobicContact CD2-CG 4.42Å; F152-L184 HydrophobicContact CB-CD1 3.72Å; F152-L184 HydrophobicContact CD1-CD1 3.99Å; F152-L184 HydrophobicContact CD1-CD2 3.4Å; F152-L184 HydrophobicContact CD1-CG 4.35Å; F152-L184 HydrophobicContact CD2-CD1 3.75Å; F152-L184 HydrophobicContact CD2-CD2 4.01Å; F152-L184 HydrophobicContact CE1-CD2 3.4Å; F152-L184 HydrophobicContact CE2-CD1 4.45Å; F152-L184 HydrophobicContact CE2-CD2 3.98Å; F152-L184 HydrophobicContact CG-CD1 3.5Å; F152-L184 HydrophobicContact CG-CD2 3.75Å; F152-L184 HydrophobicContact CG-CG 4.3Å; F152-L184 HydrophobicContact CZ-CD2 3.72Å; I181-L184 HydrophobicContact CG2-CB 4.07Å; I181-L184 HydrophobicContact CG2-CD1 3.65Å; I181-L184 HydrophobicContact CG2-CG 3.59Å; I181-L184 PolarHBondContact O-N 3.41Å; G182-L184 PolarHBondContact O-N 2.7Å; L184-E186 PolarHBondContact O-N 2.9Å; L184-N187 PolarHBondContact O-N 2.68Å; L184-I188 HydrophobicContact CB-CD1 3.95Å; L184-I188 HydrophobicContact CB-CG1 4.24Å; L184-I188 WeakPolarHBondContact O-CD1 3.28Å; L184-I188 WeakPolarHBondContact O-CG1 3.18Å; L184-I188 PolarHBondContact O-N 3.07Å; L184-V209 HydrophobicContact CD1-CG2 4.37Å
185	K	77.1	Confident	85	Confident	123 Å²	123	48 Å²	48	54%	0.535	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-24.7	-171.2	-78.7	172.7	177.5	160.2	0	115.8	S178 G182	S178-K185 WeakPolarHBondContact O-CE 3.14Å; S178-K185 PolarHBondContact O-NZ 3.01Å; G182-K185 WeakPolarHBondContact O-CD 3.35Å; G182-K185 WeakPolarHBondContact O-CG 3.32Å
186	E	84.1	Confident	85.2	Confident	172 Å²	172	47.3 Å²	47.3	80%	0.804	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-21.6	178.2	-60.4	-177.6	171.5	0	0	112.3	L184 Y207	L184-E186 PolarHBondContact O-N 2.9Å; E186-Y207 VanDerWaalsContact O-CE1 3.31Å; E186-Y207 WeakPolarHBondContact O-CE1 3.49Å
187	N	89.6	Confident	85.4	Confident	53 Å²	53	49.7 Å²	49.7	28%	0.283	28%	0.275	S	S	.	.	S	Bend	trans	-104.5	6	-176.2	-66.6	-25.6	0	0	0	114	F152 L184 Q208 V209	F152-N187 HydrophobicContact CE2-CB 4.04Å; F152-N187 VanDerWaalsContact CZ-ND2 3.34Å; F152-N187 WeakPolarHBondContact CZ-ND2 3.39Å; L184-N187 PolarHBondContact O-N 2.68Å; N187-Q208 PolarHBondContact O-N 3.13Å; N187-V209 PolarHBondContact O-N 3.44Å
188	I	92.1	Very high	85.5	Confident	18 Å²	18	56.1 Å²	56.1	9%	0.092	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	135.8	178.9	-60.7	158.8	0	0	0	110.9	L174 L184 V209 F211	L174-I188 HydrophobicContact CD1-CG2 3.28Å; L184-I188 HydrophobicContact CB-CD1 3.95Å; L184-I188 HydrophobicContact CB-CG1 4.24Å; L184-I188 WeakPolarHBondContact O-CD1 3.28Å; L184-I188 WeakPolarHBondContact O-CG1 3.18Å; L184-I188 PolarHBondContact O-N 3.07Å; I188-V209 CarbonylContact C-O 3.6Å; I188-V209 VanDerWaalsContact CA-O 3.31Å; I188-V209 WeakPolarHBondContact CA-O 3.15Å; I188-V209 HydrophobicContact CB-CB 4.4Å; I188-V209 HydrophobicContact CG1-CB 3.81Å; I188-V209 HydrophobicContact CG1-CG1 4.12Å; I188-V209 HydrophobicContact CG1-CG2 4.3Å; I188-V209 HydrophobicContact CG2-CG1 4.48Å; I188-F211 HydrophobicContact CG2-CD2 3.7Å; I188-F211 HydrophobicContact CG2-CE2 3.74Å
189	A	93	Very high	85.9	Confident	12 Å²	12	62 Å²	62	10%	0.099	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	150.5	172.9	0	0	0	0	0	113.9	I203 Y207 V209 F211	A189-I203 HydrophobicContact CB-CG2 3.85Å; A189-Y207 HydrophobicContact CB-CD1 3.82Å; A189-Y207 HydrophobicContact CB-CD2 3.83Å; A189-Y207 HydrophobicContact CB-CE1 4.35Å; A189-Y207 HydrophobicContact CB-CE2 4.35Å; A189-Y207 HydrophobicContact CB-CG 3.53Å; A189-V209 PolarHBondContact N-O 3.45Å; A189-F211 PolarHBondContact O-N 2.9Å
190	E	94.3	Very high	86.4	Confident	63 Å²	63	57 Å²	57	29%	0.294	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	122.8	166.8	-162.4	175.5	-169.5	0	0	109.8	V170 T171 L174 T192 F211	V170-E190 HydrophobicContact CG1-CG 4.1Å; T171-E190 WeakPolarHBondContact CB-OE1 3.49Å; T171-E190 PolarHBondContact OG1-OE1 2.93Å; L174-E190 HydrophobicContact CD2-CB 3.69Å; L174-E190 HydrophobicContact CD2-CG 4.08Å; E190-T192 HydrophobicContact CG-CG2 4.18Å; E190-F211 CarbonylContact C-O 3.58Å; E190-F211 WeakPolarHBondContact CA-O 3.45Å
191	V	93.7	Very high	87	Confident	1 Å²	1	61 Å²	61	1%	0.006	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	110.4	177.5	-157.9	0	0	0	0	110.1	R200 I203 L210 F211 L212 V216	V191-R200 HydrophobicContact CG1-CG 4Å; V191-I203 HydrophobicContact CG2-CG2 4Å; V191-L210 HydrophobicContact CG2-CB 4.23Å; V191-L210 HydrophobicContact CG2-CD2 3.81Å; V191-F211 PolarHBondContact N-O 3.26Å; V191-L212 HydrophobicContact CB-CB 4.04Å; V191-L212 HydrophobicContact CB-CD2 4.36Å; V191-L212 HydrophobicContact CG2-CD2 4.46Å; V191-L212 WeakPolarHBondContact O-CB 3.48Å; V191-V216 HydrophobicContact CB-CG1 4.29Å; V191-V216 HydrophobicContact CG1-CG1 3.79Å
192	T	90.7	Very high	87.8	Confident	27 Å²	27	64.8 Å²	64.8	17%	0.166	35%	0.348	C	S	.	.			trans	-109.6	146.1	177.8	72.3	0	0	0	0	110.5	E190 S194 I195	E190-T192 HydrophobicContact CG-CG2 4.18Å; T192-S194 PolarHBondContact O-N 3.34Å; T192-S194 PolarHBondContact OG1-OG 3.19Å; T192-I195 WeakPolarHBondContact O-CB 3.37Å; T192-I195 WeakPolarHBondContact O-CG1 3.16Å; T192-I195 PolarHBondContact O-N 2.7Å
193	G	85.1	Confident	89	Confident	30 Å²	30	65.7 Å²	65.7	31%	0.309	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-6.3	178.8	0	0	0	0	0	115.5
194	S	88.3	Confident	90	Very high	74 Å²	74	62.8 Å²	62.8	52%	0.517	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-7.4	171.4	28.7	0	0	0	0	113.5	R167 T192	R167-S194 PolarHBondContact NH1-OG 2.95Å; R167-S194 VanDerWaalsContact NH1-OG 3.15Å; R167-S194 PolarHBondContact NH2-OG 3.04Å; T192-S194 PolarHBondContact O-N 3.34Å; T192-S194 PolarHBondContact OG1-OG 3.19Å
195	I	91	Very high	90.6	Very high	42 Å²	42	66 Å²	66	22%	0.215	35%	0.354	C	S	.	.	S	Bend	trans	-82.3	123.1	170.8	-57.4	173.9	0	0	0	108.1	T192 K199 R200 I203	T192-I195 WeakPolarHBondContact O-CB 3.37Å; T192-I195 WeakPolarHBondContact O-CG1 3.16Å; T192-I195 PolarHBondContact O-N 2.7Å; I195-K199 HydrophobicContact CG2-CB 3.75Å; I195-R200 HydrophobicContact CB-CG 3.97Å; I195-R200 HydrophobicContact CG2-CG 3.76Å; I195-R200 WeakPolarHBondContact O-CG 3.34Å; I195-R200 PolarHBondContact O-NH1 3.12Å; I195-I203 HydrophobicContact CD1-CD1 3.97Å; I195-I203 HydrophobicContact CG2-CD1 4.06Å
196	A	90.7	Very high	91.3	Very high	63 Å²	63	64 Å²	64	52%	0.521	35%	0.352	S	S	.	.			trans	-56.7	141.7	177.8	0	0	0	0	0	112	N198 K199 R200	A196-N198 VanDerWaalsContact C-N 3.33Å; A196-N198 PolarHBondContact O-N 3.08Å; A196-K199 WeakPolarHBondContact O-CA 3.48Å; A196-K199 WeakPolarHBondContact O-CB 3.48Å; A196-K199 PolarHBondContact O-N 3.43Å; A196-R200 PolarHBondContact O-N 2.8Å
197	Q	89.8	Confident	91.8	Very high	82 Å²	82	59.6 Å²	59.6	38%	0.383	33%	0.329	S	S	.	.	H	α-helix	trans	-53.1	-43.4	-170.5	-167.3	178	10.8	0	0	113.7	K199 R200 K201 T223 V225	Q197-K199 VanDerWaalsContact C-N 3.29Å; Q197-K199 PolarHBondContact O-N 3.3Å; Q197-R200 WeakPolarHBondContact O-CA 3.33Å; Q197-R200 WeakPolarHBondContact O-CB 3.25Å; Q197-R200 PolarHBondContact O-N 2.81Å; Q197-K201 PolarHBondContact O-N 3.3Å; Q197-T223 PolarHBondContact NE2-OG1 2.83Å; Q197-V225 HydrophobicContact CG-CG2 3.58Å
198	N	90.9	Very high	92	Very high	135 Å²	135	58.4 Å²	58.4	72%	0.722	32%	0.321	S	S	*	.	H	α-helix	trans	-60.4	-36.9	176.4	-65.6	-1.1	0	0	0	112.5	A196 K201 T202	A196-N198 VanDerWaalsContact C-N 3.33Å; A196-N198 PolarHBondContact O-N 3.08Å; N198-K201 WeakPolarHBondContact O-CB 3.48Å; N198-K201 PolarHBondContact O-N 2.88Å; N198-T202 PolarHBondContact O-N 3.22Å; N198-T202 PolarHBondContact O-OG1 3.3Å
199	K	92.4	Very high	92.1	Very high	145 Å²	145	57.6 Å²	57.6	63%	0.63	32%	0.317	S	S	*	.	H	α-helix	trans	-73.2	-33.2	174.3	-64.1	-170.8	177.2	-173.8	0	111.8	I195 A196 Q197 K201 T202 I203	I195-K199 HydrophobicContact CG2-CB 3.75Å; A196-K199 WeakPolarHBondContact O-CA 3.48Å; A196-K199 WeakPolarHBondContact O-CB 3.48Å; A196-K199 PolarHBondContact O-N 3.43Å; Q197-K199 VanDerWaalsContact C-N 3.29Å; Q197-K199 PolarHBondContact O-N 3.3Å; K199-K201 VanDerWaalsContact C-N 3.34Å; K199-T202 PolarHBondContact O-N 2.64Å; K199-I203 WeakPolarHBondContact O-CG1 3.45Å; K199-I203 PolarHBondContact O-N 3.32Å
200	R	93.3	Very high	92.3	Very high	27 Å²	27	57 Å²	57	10%	0.102	31%	0.313	C	S	.	.	H	α-helix	trans	-62.1	-41.6	171	-58.9	-161.1	-56.4	-97	8.8	111.1	V191 I195 A196 Q197 T202 I203 W204 D220 V225	V191-R200 HydrophobicContact CG1-CG 4Å; I195-R200 HydrophobicContact CB-CG 3.97Å; I195-R200 HydrophobicContact CG2-CG 3.76Å; I195-R200 WeakPolarHBondContact O-CG 3.34Å; I195-R200 PolarHBondContact O-NH1 3.12Å; A196-R200 PolarHBondContact O-N 2.8Å; Q197-R200 WeakPolarHBondContact O-CA 3.33Å; Q197-R200 WeakPolarHBondContact O-CB 3.25Å; Q197-R200 PolarHBondContact O-N 2.81Å; R200-T202 VanDerWaalsContact C-N 3.32Å; R200-T202 PolarHBondContact O-N 3.37Å; R200-I203 WeakPolarHBondContact O-CB 3.34Å; R200-I203 PolarHBondContact O-N 3.47Å; R200-I203 VanDerWaalsContact O-N 3.09Å; R200-W204 PolarHBondContact O-N 3.18Å; R200-D220 IonicContact CZ-OD1 3.87Å; R200-D220 IonicContact NE-OD1 3.27Å; R200-D220 PolarHBondContact NE-OD1 3.08Å; R200-D220 IonicContact NE-OD2 3.89Å; R200-D220 PolarHBondContact NE-OD2 2.91Å; R200-D220 VanDerWaalsContact NE-OD2 3.14Å; R200-D220 IonicContact NH2-OD1 2.76Å; R200-D220 PolarHBondContact NH2-OD1 3.15Å; R200-V225 HydrophobicContact CB-CG1 4.24Å
201	K	92.9	Very high	92.4	Very high	131 Å²	131	54.1 Å²	54.1	57%	0.57	30%	0.299	S	S	*	.	H	α-helix	trans	-57.2	-42.6	174	-165.8	169.4	-177.3	169.6	0	112.3	Q197 N198 K199 W204 S205 V225	Q197-K201 PolarHBondContact O-N 3.3Å; N198-K201 WeakPolarHBondContact O-CB 3.48Å; N198-K201 PolarHBondContact O-N 2.88Å; K199-K201 VanDerWaalsContact C-N 3.34Å; K201-W204 PolarHBondContact O-N 3.27Å; K201-S205 PolarHBondContact O-N 3.34Å; K201-S205 VanDerWaalsContact O-N 3.15Å; K201-V225 HydrophobicContact CB-CG1 4.07Å
202	T	93.9	Very high	92.5	Very high	82 Å²	82	54 Å²	54	50%	0.503	30%	0.299	S	S	.	.	H	α-helix	trans	-62.7	-46.1	172.4	-46.1	0	0	0	0	111.7	N198 K199 R200 W204 S205 T206	N198-T202 PolarHBondContact O-N 3.22Å; N198-T202 PolarHBondContact O-OG1 3.3Å; K199-T202 PolarHBondContact O-N 2.64Å; R200-T202 VanDerWaalsContact C-N 3.32Å; R200-T202 PolarHBondContact O-N 3.37Å; T202-W204 VanDerWaalsContact C-N 3.33Å; T202-W204 PolarHBondContact O-N 2.95Å; T202-S205 PolarHBondContact O-N 3.49Å; T202-S205 PolarHBondContact O-OG 2.94Å; T202-T206 PolarHBondContact O-N 3.14Å; T202-T206 PolarHBondContact O-OG1 3.19Å; T202-T206 VanDerWaalsContact O-OG1 3.12Å
203	I	94.3	Very high	92.8	Very high	29 Å²	29	53.7 Å²	53.7	15%	0.149	30%	0.296	C	S	.	.	H	α-helix	trans	-58.9	-43.8	177.5	-67.3	163.7	0	0	0	111.4	A189 V191 I195 K199 R200 S205 T206 Y207 L210	A189-I203 HydrophobicContact CB-CG2 3.85Å; V191-I203 HydrophobicContact CG2-CG2 4Å; I195-I203 HydrophobicContact CD1-CD1 3.97Å; I195-I203 HydrophobicContact CG2-CD1 4.06Å; K199-I203 WeakPolarHBondContact O-CG1 3.45Å; K199-I203 PolarHBondContact O-N 3.32Å; R200-I203 WeakPolarHBondContact O-CB 3.34Å; R200-I203 PolarHBondContact O-N 3.47Å; R200-I203 VanDerWaalsContact O-N 3.09Å; I203-S205 VanDerWaalsContact C-N 3.27Å; I203-S205 PolarHBondContact O-N 2.83Å; I203-T206 PolarHBondContact O-N 2.85Å; I203-Y207 HydrophobicContact CB-CD2 4.36Å; I203-Y207 HydrophobicContact CG2-CD2 3.89Å; I203-Y207 PolarHBondContact O-N 3.49Å; I203-L210 HydrophobicContact CG2-CD2 4.1Å
204	W	93.9	Very high	93.3	Very high	2 Å²	2	52.5 Å²	52.5	1%	0.008	28%	0.283	C	S	.	.	H	α-helix	trans	-61.8	-29.1	175.1	-81.3	113.1	0	0	0	113.7	R159 V161 R200 K201 T202 L210 L212 L217 D220 C226	R159-W204 HydrophobicContact CB-CZ3 4.48Å; R159-W204 PolarHBondContact NE-O 3.44Å; R159-W204 PolarHBondContact NH1-O 3.33Å; R159-W204 PolarHBondContact NH2-O 3.42Å; V161-W204 HydrophobicContact CG2-CH2 3.9Å; V161-W204 HydrophobicContact CG2-CZ3 4.22Å; R200-W204 PolarHBondContact O-N 3.18Å; K201-W204 PolarHBondContact O-N 3.27Å; T202-W204 VanDerWaalsContact C-N 3.33Å; T202-W204 PolarHBondContact O-N 2.95Å; W204-L210 HydrophobicContact CD2-CD2 3.8Å; W204-L210 HydrophobicContact CE3-CD1 3.97Å; W204-L210 HydrophobicContact CE3-CD2 3.66Å; W204-L210 HydrophobicContact CE3-CG 4.47Å; W204-L210 HydrophobicContact CG-CD2 4.45Å; W204-L210 HydrophobicContact CH2-CD1 4.33Å; W204-L210 HydrophobicContact CH2-CD2 4.1Å; W204-L210 HydrophobicContact CZ2-CD2 4.24Å; W204-L210 HydrophobicContact CZ3-CD1 3.66Å; W204-L210 HydrophobicContact CZ3-CD2 3.83Å; W204-L210 HydrophobicContact CZ3-CG 4.28Å; W204-L212 HydrophobicContact CH2-CD2 4.29Å; W204-L212 HydrophobicContact CZ2-CD2 3.97Å; W204-L217 HydrophobicContact CH2-CD1 3.75Å; W204-L217 HydrophobicContact CZ2-CD1 3.81Å; W204-D220 PolarHBondContact NE1-OD2 3.35Å; W204-C226 HydrophobicContact CD2-CB 4.17Å; W204-C226 HydrophobicContact CH2-CB 4.33Å; W204-C226 VanDerWaalsContact CH2-SG 3.56Å; W204-C226 HydrophobicContact CZ2-CB 3.92Å
205	S	91.7	Very high	93.6	Very high	75 Å²	75	53 Å²	53	52%	0.524	28%	0.278	S	S	.	.	H	α-helix	trans	-77.2	-42.9	171.1	63.3	0	0	0	0	112.7	R159 K201 T202 I203	R159-S205 PolarHBondContact NH1-O 3.26Å; R159-S205 PolarHBondContact NH2-O 3.29Å; K201-S205 PolarHBondContact O-N 3.34Å; K201-S205 VanDerWaalsContact O-N 3.15Å; T202-S205 PolarHBondContact O-N 3.49Å; T202-S205 PolarHBondContact O-OG 2.94Å; I203-S205 VanDerWaalsContact C-N 3.27Å; I203-S205 PolarHBondContact O-N 2.83Å
206	T	92.4	Very high	93.8	Very high	80 Å²	80	51.5 Å²	51.5	49%	0.491	27%	0.27	S	S	.	.	H	α-helix	trans	-81.6	-42.8	-170.8	-54.7	0	0	0	0	114	T202 I203	T202-T206 PolarHBondContact O-N 3.14Å; T202-T206 PolarHBondContact O-OG1 3.19Å; T202-T206 VanDerWaalsContact O-OG1 3.12Å; I203-T206 PolarHBondContact O-N 2.85Å
207	Y	93.4	Very high	94.1	Very high	81 Å²	81	48.5 Å²	48.5	32%	0.318	25%	0.245	S	C	.	.			trans	-106	139.1	-169.3	-64.9	-88.1	0	0	0	112.3	R159 E186 A189 I203	R159-Y207 VanDerWaalsContact NH1-C 3.31Å; R159-Y207 PolarHBondContact NH1-O 3.31Å; E186-Y207 VanDerWaalsContact O-CE1 3.31Å; E186-Y207 WeakPolarHBondContact O-CE1 3.49Å; A189-Y207 HydrophobicContact CB-CD1 3.82Å; A189-Y207 HydrophobicContact CB-CD2 3.83Å; A189-Y207 HydrophobicContact CB-CE1 4.35Å; A189-Y207 HydrophobicContact CB-CE2 4.35Å; A189-Y207 HydrophobicContact CB-CG 3.53Å; I203-Y207 HydrophobicContact CB-CD2 4.36Å; I203-Y207 HydrophobicContact CG2-CD2 3.89Å; I203-Y207 PolarHBondContact O-N 3.49Å
208	Q	93.6	Very high	94.3	Very high	28 Å²	28	45.2 Å²	45.2	13%	0.131	23%	0.23	C	C	.	.	S	Bend	trans	-96.3	-32.7	-174.7	-64.7	-172.3	-101.1	0	0	113.2	F152 P156 G158 R159 F160 N187 L210	F152-Q208 HydrophobicContact CD2-CB 4.34Å; F152-Q208 HydrophobicContact CE2-CB 4.01Å; F152-Q208 HydrophobicContact CE2-CG 4.37Å; F152-Q208 VanDerWaalsContact CE2-OE1 3.24Å; P156-Q208 PolarHBondContact O-NE2 3.43Å; G158-Q208 PolarHBondContact O-NE2 3.28Å; R159-Q208 CarbonylContact C-O 3.51Å; R159-Q208 WeakPolarHBondContact CA-O 3.08Å; F160-Q208 HydrophobicContact CD2-CB 4.35Å; F160-Q208 WeakPolarHBondContact CD2-O 3.37Å; F160-Q208 HydrophobicContact CE2-CB 4.27Å; F160-Q208 PolarHBondContact N-O 3.36Å; N187-Q208 PolarHBondContact O-N 3.13Å; Q208-L210 WeakPolarHBondContact O-CD1 3.2Å
209	V	95.2	Very high	94.5	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.006	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	116.9	178.4	-175.8	0	0	0	0	108.4	I148 F152 F160 L184 N187 I188 A189 F211	I148-V209 HydrophobicContact CG2-CG1 3.98Å; I148-V209 HydrophobicContact CG2-CG2 3.96Å; F152-V209 HydrophobicContact CD2-CG2 4.21Å; F160-V209 HydrophobicContact CB-CG2 4.49Å; F160-V209 HydrophobicContact CD2-CG2 3.98Å; F160-V209 WeakPolarHBondContact O-CA 3.33Å; L184-V209 HydrophobicContact CD1-CG2 4.37Å; N187-V209 PolarHBondContact O-N 3.44Å; I188-V209 CarbonylContact C-O 3.6Å; I188-V209 VanDerWaalsContact CA-O 3.31Å; I188-V209 WeakPolarHBondContact CA-O 3.15Å; I188-V209 HydrophobicContact CB-CB 4.4Å; I188-V209 HydrophobicContact CG1-CB 3.81Å; I188-V209 HydrophobicContact CG1-CG1 4.12Å; I188-V209 HydrophobicContact CG1-CG2 4.3Å; I188-V209 HydrophobicContact CG2-CG1 4.48Å; A189-V209 PolarHBondContact N-O 3.45Å; V209-F211 HydrophobicContact CG1-CD2 4.21Å; V209-F211 HydrophobicContact CG1-CE2 3.64Å
210	L	96	Very high	94.6	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	121.4	-173	-56.7	97.4	0	0	0	110.7	R159 F160 V161 F162 V191 I203 W204 Q208 L212	R159-L210 HydrophobicContact CB-CD1 4.31Å; F160-L210 PolarHBondContact O-N 2.93Å; V161-L210 WeakPolarHBondContact CA-O 3.43Å; F162-L210 PolarHBondContact N-O 3.37Å; V191-L210 HydrophobicContact CG2-CB 4.23Å; V191-L210 HydrophobicContact CG2-CD2 3.81Å; I203-L210 HydrophobicContact CG2-CD2 4.1Å; W204-L210 HydrophobicContact CD2-CD2 3.8Å; W204-L210 HydrophobicContact CE3-CD1 3.97Å; W204-L210 HydrophobicContact CE3-CD2 3.66Å; W204-L210 HydrophobicContact CE3-CG 4.47Å; W204-L210 HydrophobicContact CG-CD2 4.45Å; W204-L210 HydrophobicContact CH2-CD1 4.33Å; W204-L210 HydrophobicContact CH2-CD2 4.1Å; W204-L210 HydrophobicContact CZ2-CD2 4.24Å; W204-L210 HydrophobicContact CZ3-CD1 3.66Å; W204-L210 HydrophobicContact CZ3-CD2 3.83Å; W204-L210 HydrophobicContact CZ3-CG 4.28Å; Q208-L210 WeakPolarHBondContact O-CD1 3.2Å; L210-L212 HydrophobicContact CB-CD2 4.5Å
211	F	96.8	Very high	94.7	Very high	1 Å²	1	33.8 Å²	33.8	0%	0.004	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	118.9	174.8	-76.1	-98.7	0	0	0	108.9	I148 F162 V170 Q173 L174 C177 I188 A189 E190 V191 V209	I148-F211 HydrophobicContact CD1-CZ 4.41Å; F162-F211 HydrophobicContact CB-CD1 3.6Å; F162-F211 HydrophobicContact CB-CE1 3.57Å; F162-F211 HydrophobicContact CB-CG 4.14Å; F162-F211 HydrophobicContact CB-CZ 4.1Å; F162-F211 AromaticContact CD1-CD1 3.79Å; F162-F211 HydrophobicContact CD1-CD1 3.79Å; F162-F211 AromaticContact CD1-CE1 3.88Å; F162-F211 HydrophobicContact CD1-CE1 3.88Å; F162-F211 AromaticContact CD2-CE1 3.86Å; F162-F211 HydrophobicContact CD2-CE1 3.86Å; F162-F211 HydrophobicContact CD2-CZ 4.48Å; F162-F211 AromaticContact CG-CD1 3.72Å; F162-F211 HydrophobicContact CG-CD1 3.72Å; F162-F211 AromaticContact CG-CE1 3.48Å; F162-F211 HydrophobicContact CG-CE1 3.48Å; F162-F211 VanDerWaalsContact CG-CE1 3.48Å; F162-F211 HydrophobicContact CG-CZ 4.32Å; F162-F211 WeakPolarHBondContact O-CA 3.42Å; V170-F211 VanDerWaalsContact CG1-C 3.44Å; V170-F211 HydrophobicContact CG1-CB 3.82Å; Q173-F211 HydrophobicContact CB-CD1 4.48Å; Q173-F211 HydrophobicContact CB-CE1 4.3Å; L174-F211 HydrophobicContact CB-CB 4.11Å; L174-F211 HydrophobicContact CB-CD1 3.86Å; L174-F211 HydrophobicContact CB-CD2 4.24Å; L174-F211 HydrophobicContact CB-CE1 4.36Å; L174-F211 HydrophobicContact CB-CG 3.81Å; L174-F211 HydrophobicContact CD1-CD2 3.68Å; L174-F211 HydrophobicContact CD1-CE2 3.99Å; L174-F211 HydrophobicContact CD1-CG 4.1Å; L174-F211 HydrophobicContact CG-CG 4.48Å; C177-F211 HydrophobicContact CB-CE1 4.23Å; C177-F211 HydrophobicContact CB-CZ 3.64Å; I188-F211 HydrophobicContact CG2-CD2 3.7Å; I188-F211 HydrophobicContact CG2-CE2 3.74Å; A189-F211 PolarHBondContact O-N 2.9Å; E190-F211 CarbonylContact C-O 3.58Å; E190-F211 WeakPolarHBondContact CA-O 3.45Å; V191-F211 PolarHBondContact N-O 3.26Å; V209-F211 HydrophobicContact CG1-CD2 4.21Å; V209-F211 HydrophobicContact CG1-CE2 3.64Å
212	L	97.1	Very high	94.7	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	164.4	-173.4	56.9	77.8	0	0	0	113.8	V161 F162 M163 A164 V170 V191 W204 L210 V216 L217	V161-L212 HydrophobicContact CG1-CD1 3.91Å; V161-L212 HydrophobicContact CG1-CD2 3.79Å; V161-L212 HydrophobicContact CG1-CG 3.72Å; F162-L212 PolarHBondContact O-N 3.39Å; M163-L212 WeakPolarHBondContact CA-O 3.26Å; M163-L212 HydrophobicContact CG-CD1 3.78Å; M163-L212 HydrophobicContact SD-CD1 4.45Å; A164-L212 PolarHBondContact N-O 3.32Å; V170-L212 VanDerWaalsContact CG2-C 3.5Å; V170-L212 WeakPolarHBondContact CG2-O 3.16Å; V191-L212 HydrophobicContact CB-CB 4.04Å; V191-L212 HydrophobicContact CB-CD2 4.36Å; V191-L212 HydrophobicContact CG2-CD2 4.46Å; V191-L212 WeakPolarHBondContact O-CB 3.48Å; W204-L212 HydrophobicContact CH2-CD2 4.29Å; W204-L212 HydrophobicContact CZ2-CD2 3.97Å; L210-L212 HydrophobicContact CB-CD2 4.5Å; L212-V216 HydrophobicContact CB-CB 4.44Å; L212-L217 HydrophobicContact CD1-CB 3.66Å; L212-L217 HydrophobicContact CD2-CB 4.16Å
213	T	95.6	Very high	94.6	Very high	19 Å²	19	32.5 Å²	32.5	12%	0.117	17%	0.173	C	C	.	.			trans	-82.9	139.9	166	50.1	0	0	0	0	109.7	A164 R167 V170 Q215 V216	A164-T213 WeakPolarHBondContact O-CA 3.31Å; R167-T213 HydrophobicContact CG-CG2 3.98Å; V170-T213 HydrophobicContact CG2-CG2 3.84Å; T213-Q215 VanDerWaalsContact C-N 3.26Å; T213-Q215 PolarHBondContact O-N 3.4Å; T213-Q215 VanDerWaalsContact O-N 3.07Å; T213-V216 WeakPolarHBondContact O-CB 3.43Å; T213-V216 PolarHBondContact O-N 3.19Å; T213-V216 WeakPolarHBondContact OG1-CG2 3.05Å
214	P	96.1	Very high	94.4	Very high	5 Å²	5	33.6 Å²	33.6	3%	0.032	19%	0.192	C	C	.	.	H	α-helix	trans	-56.4	-34.2	-168.6	22.6	-35.6	0	0	0	114.6	M163 A164 V216 L217 M218 A247 Y248	M163-P214 HydrophobicContact SD-CB 4.11Å; A164-P214 VanDerWaalsContact O-CD 3.22Å; A164-P214 WeakPolarHBondContact O-CD 3.37Å; P214-V216 PolarHBondContact O-N 2.93Å; P214-V216 VanDerWaalsContact O-N 3.15Å; P214-L217 PolarHBondContact O-N 3.22Å; P214-L217 VanDerWaalsContact O-N 3.1Å; P214-M218 WeakPolarHBondContact O-CB 3.25Å; P214-M218 PolarHBondContact O-N 3.19Å; P214-A247 HydrophobicContact CB-CB 3.87Å; P214-A247 HydrophobicContact CG-CB 4.02Å; P214-Y248 HydrophobicContact CB-CD1 3.53Å; P214-Y248 HydrophobicContact CB-CE1 3.65Å; P214-Y248 HydrophobicContact CG-CD1 3.76Å; P214-Y248 HydrophobicContact CG-CE1 3.54Å
215	Q	94.1	Very high	94.4	Very high	86 Å²	86	34.1 Å²	34.1	40%	0.402	20%	0.195	S	C	.	.	H	α-helix	trans	-54.6	-31.8	174	-163	64.7	45.5	0	0	113.7	T213 M218 N219	T213-Q215 VanDerWaalsContact C-N 3.26Å; T213-Q215 PolarHBondContact O-N 3.4Å; T213-Q215 VanDerWaalsContact O-N 3.07Å; Q215-M218 VanDerWaalsContact NE2-CE 3.27Å; Q215-M218 PolarHBondContact NE2-SD 3.06Å; Q215-M218 VanDerWaalsContact NE2-SD 3.4Å; Q215-N219 PolarHBondContact NE2-OD1 2.79Å; Q215-N219 WeakPolarHBondContact O-CB 3.46Å; Q215-N219 PolarHBondContact O-N 3.41Å; Q215-N219 PolarHBondContact O-OD1 3.06Å
216	V	95.9	Very high	94.4	Very high	9 Å²	9	30.8 Å²	30.8	6%	0.055	17%	0.172	C	C	.	.	H	α-helix	trans	-70.5	-43	178.7	176.6	0	0	0	0	110.6	V191 L212 T213 P214 D220	V191-V216 HydrophobicContact CB-CG1 4.29Å; V191-V216 HydrophobicContact CG1-CG1 3.79Å; L212-V216 HydrophobicContact CB-CB 4.44Å; T213-V216 WeakPolarHBondContact O-CB 3.43Å; T213-V216 PolarHBondContact O-N 3.19Å; T213-V216 WeakPolarHBondContact OG1-CG2 3.05Å; P214-V216 PolarHBondContact O-N 2.93Å; P214-V216 VanDerWaalsContact O-N 3.15Å; V216-D220 VanDerWaalsContact O-CB 3.28Å; V216-D220 WeakPolarHBondContact O-CB 3.19Å; V216-D220 VanDerWaalsContact O-CG 3.31Å; V216-D220 PolarHBondContact O-N 3.48Å
217	L	96.2	Very high	94.4	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-68.5	-41.7	175.3	176.5	63.3	0	0	0	111.3	V161 M163 W204 L212 P214 N219 D220 L221 C226 I231 L234 V251	V161-L217 HydrophobicContact CG1-CD2 4.26Å; M163-L217 HydrophobicContact CE-CD2 4.41Å; M163-L217 HydrophobicContact SD-CD2 3.71Å; W204-L217 HydrophobicContact CH2-CD1 3.75Å; W204-L217 HydrophobicContact CZ2-CD1 3.81Å; L212-L217 HydrophobicContact CD1-CB 3.66Å; L212-L217 HydrophobicContact CD2-CB 4.16Å; P214-L217 PolarHBondContact O-N 3.22Å; P214-L217 VanDerWaalsContact O-N 3.1Å; L217-N219 PolarHBondContact O-N 3.36Å; L217-D220 PolarHBondContact O-N 3.45Å; L217-L221 HydrophobicContact CD1-CD1 3.9Å; L217-L221 HydrophobicContact CD1-CD2 4.39Å; L217-L221 HydrophobicContact CD1-CG 3.8Å; L217-L221 HydrophobicContact CD2-CD1 4.41Å; L217-L221 HydrophobicContact CG-CD1 3.79Å; L217-L221 HydrophobicContact CG-CG 4.16Å; L217-L221 WeakPolarHBondContact O-CB 3.18Å; L217-L221 VanDerWaalsContact O-CG 3.29Å; L217-L221 WeakPolarHBondContact O-CG 3.45Å; L217-L221 PolarHBondContact O-N 3.2Å; L217-C226 HydrophobicContact CD1-CB 4.29Å; L217-I231 HydrophobicContact CD1-CD1 4.34Å; L217-L234 HydrophobicContact CD2-CD2 4.22Å; L217-V251 HydrophobicContact CB-CG2 4.27Å; L217-V251 HydrophobicContact CD2-CG1 3.57Å; L217-V251 HydrophobicContact CD2-CG2 4.14Å; L217-V251 HydrophobicContact CG-CG1 4.23Å; L217-V251 HydrophobicContact CG-CG2 4.13Å
218	M	95.1	Very high	94.4	Very high	14 Å²	14	26 Å²	26	7%	0.069	15%	0.153	C	C	.	.	H	α-helix	trans	-54.3	-53.8	175.5	-172.9	-172	129.7	0	0	111	P214 Q215 D220 L221 Q222 A247 Q250 V251 I254	P214-M218 WeakPolarHBondContact O-CB 3.25Å; P214-M218 PolarHBondContact O-N 3.19Å; Q215-M218 VanDerWaalsContact NE2-CE 3.27Å; Q215-M218 PolarHBondContact NE2-SD 3.06Å; Q215-M218 VanDerWaalsContact NE2-SD 3.4Å; M218-D220 PolarHBondContact O-N 3.08Å; M218-L221 PolarHBondContact O-N 2.96Å; M218-Q222 WeakPolarHBondContact O-CG 3.5Å; M218-Q222 PolarHBondContact O-N 3.49Å; M218-A247 HydrophobicContact SD-CB 4.16Å; M218-Q250 HydrophobicContact CG-CB 4.11Å; M218-Q250 HydrophobicContact SD-CB 3.75Å; M218-Q250 HydrophobicContact SD-CG 4.25Å; M218-Q250 PolarHBondContact SD-OE1 3.03Å; M218-Q250 VanDerWaalsContact SD-OE1 3.39Å; M218-V251 HydrophobicContact CB-CG2 3.96Å; M218-I254 HydrophobicContact CG-CD1 3.75Å
219	N	94.3	Very high	94.4	Very high	64 Å²	64	29 Å²	29	34%	0.342	17%	0.169	S	C	.	.	H	α-helix	trans	-65.8	-37.4	178.7	-65.6	22.1	0	0	0	112.3	Q215 L217 T223	Q215-N219 PolarHBondContact NE2-OD1 2.79Å; Q215-N219 WeakPolarHBondContact O-CB 3.46Å; Q215-N219 PolarHBondContact O-N 3.41Å; Q215-N219 PolarHBondContact O-OD1 3.06Å; L217-N219 PolarHBondContact O-N 3.36Å; N219-T223 WeakPolarHBondContact O-CB 3.46Å; N219-T223 WeakPolarHBondContact O-CG2 3.42Å; N219-T223 PolarHBondContact O-N 3.45Å; N219-T223 PolarHBondContact O-OG1 3.05Å
220	D	95.6	Very high	94.3	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-73.5	-26.6	178.5	-77.4	-4.7	0	0	0	112.9	R200 W204 V216 L217 M218 G224 V225 C226	R200-D220 IonicContact CZ-OD1 3.87Å; R200-D220 IonicContact NE-OD1 3.27Å; R200-D220 PolarHBondContact NE-OD1 3.08Å; R200-D220 IonicContact NE-OD2 3.89Å; R200-D220 PolarHBondContact NE-OD2 2.91Å; R200-D220 VanDerWaalsContact NE-OD2 3.14Å; R200-D220 IonicContact NH2-OD1 2.76Å; R200-D220 PolarHBondContact NH2-OD1 3.15Å; W204-D220 PolarHBondContact NE1-OD2 3.35Å; V216-D220 VanDerWaalsContact O-CB 3.28Å; V216-D220 WeakPolarHBondContact O-CB 3.19Å; V216-D220 VanDerWaalsContact O-CG 3.31Å; V216-D220 PolarHBondContact O-N 3.48Å; L217-D220 PolarHBondContact O-N 3.45Å; M218-D220 PolarHBondContact O-N 3.08Å; D220-G224 PolarHBondContact O-N 2.96Å; D220-V225 HydrophobicContact CB-CB 4.01Å; D220-V225 HydrophobicContact CB-CG1 4.2Å; D220-V225 PolarHBondContact O-N 2.86Å; D220-C226 HydrophobicContact CB-CB 3.92Å; D220-C226 PolarHBondContact O-N 2.83Å
221	L	94.7	Very high	94.3	Very high	3 Å²	3	30.3 Å²	30.3	2%	0.016	18%	0.179	C	C	.	.	H	α-helix	trans	-76.1	-41.4	171.6	-75.6	171.3	0	0	0	112.1	L217 M218 T223 G224 C226 A228 I231 V251 I254 L255 H260	L217-L221 HydrophobicContact CD1-CD1 3.9Å; L217-L221 HydrophobicContact CD1-CD2 4.39Å; L217-L221 HydrophobicContact CD1-CG 3.8Å; L217-L221 HydrophobicContact CD2-CD1 4.41Å; L217-L221 HydrophobicContact CG-CD1 3.79Å; L217-L221 HydrophobicContact CG-CG 4.16Å; L217-L221 WeakPolarHBondContact O-CB 3.18Å; L217-L221 VanDerWaalsContact O-CG 3.29Å; L217-L221 WeakPolarHBondContact O-CG 3.45Å; L217-L221 PolarHBondContact O-N 3.2Å; M218-L221 PolarHBondContact O-N 2.96Å; L221-T223 VanDerWaalsContact C-N 3.32Å; L221-G224 PolarHBondContact O-N 2.97Å; L221-C226 HydrophobicContact CD2-CB 4.01Å; L221-C226 HydrophobicContact CG-CB 4.3Å; L221-A228 HydrophobicContact CD2-CB 3.72Å; L221-I231 HydrophobicContact CD2-CD1 4.38Å; L221-V251 HydrophobicContact CD1-CG1 4.3Å; L221-I254 HydrophobicContact CB-CG2 3.78Å; L221-I254 HydrophobicContact CD1-CG2 4.46Å; L221-L255 HydrophobicContact CD2-CD1 4.23Å; L221-H260 PolarHBondContact O-NE2 3.25Å; L221-H260 VanDerWaalsContact O-NE2 3.14Å
222	Q	92.5	Very high	94.2	Very high	111 Å²	111	30.7 Å²	30.7	52%	0.519	18%	0.18	S	C	.	.	H	α-helix	trans	-61.9	-39.5	174.4	-75.2	171.3	-35.1	0	0	111.8	M218 I254	M218-Q222 WeakPolarHBondContact O-CG 3.5Å; M218-Q222 PolarHBondContact O-N 3.49Å; Q222-I254 HydrophobicContact CG-CD1 3.83Å
223	T	91.6	Very high	94.2	Very high	74 Å²	74	30.7 Å²	30.7	45%	0.454	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	9.6	-176.5	59.2	0	0	0	0	114.7	Q197 N219 L221 V225	Q197-T223 PolarHBondContact NE2-OG1 2.83Å; N219-T223 WeakPolarHBondContact O-CB 3.46Å; N219-T223 WeakPolarHBondContact O-CG2 3.42Å; N219-T223 PolarHBondContact O-N 3.45Å; N219-T223 PolarHBondContact O-OG1 3.05Å; L221-T223 VanDerWaalsContact C-N 3.32Å; T223-V225 PolarHBondContact O-N 2.83Å; T223-V225 VanDerWaalsContact O-N 3.16Å; T223-V225 WeakPolarHBondContact OG1-CG2 3.46Å
224	G	91.2	Very high	94.3	Very high	52 Å²	52	29.8 Å²	29.8	54%	0.536	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.9	20.5	178.7	0	0	0	0	0	114.8	D220 L221	D220-G224 PolarHBondContact O-N 2.96Å; L221-G224 PolarHBondContact O-N 2.97Å
225	V	92.3	Very high	94.4	Very high	14 Å²	14	29.6 Å²	29.6	9%	0.085	17%	0.173	C	C	.	.			trans	-82.7	-36.9	178.7	171.8	0	0	0	0	110.9	Q197 R200 K201 D220 T223	Q197-V225 HydrophobicContact CG-CG2 3.58Å; R200-V225 HydrophobicContact CB-CG1 4.24Å; K201-V225 HydrophobicContact CB-CG1 4.07Å; D220-V225 HydrophobicContact CB-CB 4.01Å; D220-V225 HydrophobicContact CB-CG1 4.2Å; D220-V225 PolarHBondContact O-N 2.86Å; T223-V225 PolarHBondContact O-N 2.83Å; T223-V225 VanDerWaalsContact O-N 3.16Å; T223-V225 WeakPolarHBondContact OG1-CG2 3.46Å
226	C	93.1	Very high	94.5	Very high	4 Å²	4	25.5 Å²	25.5	3%	0.027	15%	0.154	C	C	.	.	S	Bend	trans	-84.7	124.3	174.1	173.3	0	0	0	0	110.3	W204 L217 D220 L221 A228	W204-C226 HydrophobicContact CD2-CB 4.17Å; W204-C226 HydrophobicContact CH2-CB 4.33Å; W204-C226 VanDerWaalsContact CH2-SG 3.56Å; W204-C226 HydrophobicContact CZ2-CB 3.92Å; L217-C226 HydrophobicContact CD1-CB 4.29Å; D220-C226 HydrophobicContact CB-CB 3.92Å; D220-C226 PolarHBondContact O-N 2.83Å; L221-C226 HydrophobicContact CD2-CB 4.01Å; L221-C226 HydrophobicContact CG-CB 4.3Å; C226-A228 VanDerWaalsContact C-N 3.29Å; C226-A228 PolarHBondContact O-N 2.87Å
227	P	93	Very high	94.5	Very high	58 Å²	58	25.2 Å²	25.2	38%	0.377	15%	0.152	S	C	.	.			trans	-73.3	79.6	174.5	29.4	-33.4	0	0	0	111.2	N229 S230	P227-N229 PolarHBondContact O-N 3.25Å; P227-S230 WeakPolarHBondContact CG-OG 3.31Å; P227-S230 WeakPolarHBondContact O-CB 3.46Å; P227-S230 PolarHBondContact O-N 3.21Å; P227-S230 PolarHBondContact O-OG 3.47Å
228	A	93.3	Very high	94.2	Very high	4 Å²	4	26.4 Å²	26.4	3%	0.033	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-44.7	-50.2	-169.9	0	0	0	0	0	115	L221 C226 S230 I231 L255 H260 H262	L221-A228 HydrophobicContact CD2-CB 3.72Å; C226-A228 VanDerWaalsContact C-N 3.29Å; C226-A228 PolarHBondContact O-N 2.87Å; A228-S230 PolarHBondContact O-N 2.89Å; A228-S230 VanDerWaalsContact O-N 3.13Å; A228-I231 WeakPolarHBondContact O-CB 3.47Å; A228-I231 WeakPolarHBondContact O-CG1 3.47Å; A228-I231 PolarHBondContact O-N 2.94Å; A228-L255 HydrophobicContact CB-CD1 3.81Å; A228-H260 HydrophobicContact CB-CB 4.24Å; A228-H260 VanDerWaalsContact CB-ND1 3.3Å; A228-H260 WeakPolarHBondContact CB-ND1 3.34Å; A228-H262 PolarHBondContact O-CD2 3.06Å
229	N	92	Very high	94.1	Very high	90 Å²	90	25.8 Å²	25.8	48%	0.481	15%	0.154	S	C	.	.	G	3₁₀ helix	trans	-63	-21.9	-176.6	-61	6.2	0	0	0	113.6	P227 I231 H262	P227-N229 PolarHBondContact O-N 3.25Å; N229-I231 VanDerWaalsContact C-N 3.32Å; N229-H262 PolarHBondContact O-NE2 3.2Å
230	S	93.7	Very high	93.9	Very high	29 Å²	29	24.1 Å²	24.1	20%	0.203	15%	0.145	C	C	.	.	G	3₁₀ helix	trans	-80.7	-9.8	177.6	71.8	0	0	0	0	113.8	R159 P227 A228 R232	R159-S230 WeakPolarHBondContact CG-OG 3.32Å; R159-S230 PolarHBondContact N-O 2.69Å; P227-S230 WeakPolarHBondContact CG-OG 3.31Å; P227-S230 WeakPolarHBondContact O-CB 3.46Å; P227-S230 PolarHBondContact O-N 3.21Å; P227-S230 PolarHBondContact O-OG 3.47Å; A228-S230 PolarHBondContact O-N 2.89Å; A228-S230 VanDerWaalsContact O-N 3.13Å; S230-R232 PolarHBondContact O-N 3.26Å
231	I	95.8	Very high	93.5	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	120.3	173.8	-62	174.6	0	0	0	108.6	R159 L217 L221 A228 N229 L234 L255 H262	R159-I231 WeakPolarHBondContact O-CA 3.09Å; L217-I231 HydrophobicContact CD1-CD1 4.34Å; L221-I231 HydrophobicContact CD2-CD1 4.38Å; A228-I231 WeakPolarHBondContact O-CB 3.47Å; A228-I231 WeakPolarHBondContact O-CG1 3.47Å; A228-I231 PolarHBondContact O-N 2.94Å; N229-I231 VanDerWaalsContact C-N 3.32Å; I231-L234 HydrophobicContact CG2-CD2 3.58Å; I231-L234 HydrophobicContact CG2-CG 3.84Å; I231-L255 HydrophobicContact CD1-CD1 4.27Å; I231-L255 HydrophobicContact CD1-CD2 4.39Å; I231-H262 PolarHBondContact O-NE2 3.12Å
232	R	95.9	Very high	93.4	Very high	9 Å²	9	25.7 Å²	25.7	3%	0.034	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	-19.2	176.2	-64.4	-63.7	-172.1	-140.9	-7.1	113.4	E96 Y155 R159 F160 S230 Q264 F265 R266 M683	E96-R232 PolarHBondContact O-NE 2.86Å; E96-R232 PolarHBondContact O-NH2 3.37Å; E96-R232 IonicContact OE2-CZ 3.92Å; E96-R232 IonicContact OE2-NH2 2.71Å; E96-R232 PolarHBondContact OE2-NH2 2.82Å; Y155-R232 HydrophobicContact CD1-CG 3.83Å; Y155-R232 HydrophobicContact CD2-CB 4.14Å; Y155-R232 HydrophobicContact CD2-CG 4.29Å; Y155-R232 HydrophobicContact CE1-CG 4.25Å; Y155-R232 HydrophobicContact CG-CB 4.15Å; Y155-R232 HydrophobicContact CG-CG 3.85Å; R159-R232 PolarHBondContact O-N 2.97Å; F160-R232 HydrophobicContact CE1-CB 4.12Å; S230-R232 PolarHBondContact O-N 3.26Å; R232-Q264 PolarHBondContact NH1-O 2.86Å; R232-F265 WeakPolarHBondContact O-CA 3.46Å; R232-R266 PolarHBondContact O-N 2.97Å; R232-M683 HydrophobicContact CB-CE 4.23Å
233	L	97	Very high	93.1	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	131.1	176.8	-178.1	64	0	0	0	110.9	V147 I148 F151 F160 V161 I235 R266 V268	V147-L233 HydrophobicContact CG1-CD1 4.02Å; V147-L233 HydrophobicContact CG1-CD2 3.97Å; I148-L233 HydrophobicContact CG1-CD2 3.91Å; F151-L233 HydrophobicContact CB-CD2 4.05Å; F151-L233 HydrophobicContact CD1-CB 4.17Å; F151-L233 HydrophobicContact CD2-CD1 4.5Å; F151-L233 HydrophobicContact CD2-CD2 4.37Å; F151-L233 HydrophobicContact CG-CB 4.34Å; F151-L233 HydrophobicContact CG-CD2 4.15Å; F160-L233 HydrophobicContact CB-CB 4.26Å; F160-L233 HydrophobicContact CD1-CB 3.82Å; V161-L233 PolarHBondContact N-O 2.97Å; L233-I235 HydrophobicContact CD1-CG1 4.31Å; L233-I235 HydrophobicContact CD2-CD1 4.11Å; L233-I235 HydrophobicContact CD2-CG1 4.21Å; L233-I235 HydrophobicContact CG-CD1 4.46Å; L233-I235 HydrophobicContact CG-CG1 4.02Å; L233-R266 WeakPolarHBondContact CA-O 3.43Å; L233-R266 HydrophobicContact CD1-CB 3.75Å; L233-R266 HydrophobicContact CD1-CG 3.61Å; L233-V268 HydrophobicContact CD1-CG2 4.22Å
234	L	97.5	Very high	92.8	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	125.2	167.5	-65.7	-179.7	0	0	0	109.5	V161 M163 L217 I231 F236 L252 L255 F265 R266 I267 V268	V161-L234 HydrophobicContact CB-CD2 3.91Å; V161-L234 HydrophobicContact CG2-CD2 4.13Å; M163-L234 HydrophobicContact CE-CB 4.37Å; M163-L234 HydrophobicContact CE-CD2 4.23Å; L217-L234 HydrophobicContact CD2-CD2 4.22Å; I231-L234 HydrophobicContact CG2-CD2 3.58Å; I231-L234 HydrophobicContact CG2-CG 3.84Å; L234-F236 HydrophobicContact CB-CD2 4.36Å; L234-F236 HydrophobicContact CB-CE2 3.61Å; L234-F236 HydrophobicContact CB-CZ 4.24Å; L234-F236 HydrophobicContact CD1-CE2 4.25Å; L234-F236 HydrophobicContact CD1-CZ 4.12Å; L234-L252 HydrophobicContact CD1-CD2 3.79Å; L234-L255 HydrophobicContact CD1-CD2 3.89Å; L234-F265 HydrophobicContact CD1-CD2 3.95Å; L234-F265 HydrophobicContact CD1-CE2 3.81Å; L234-F265 HydrophobicContact CG-CD2 4.24Å; L234-R266 PolarHBondContact N-O 3.38Å; L234-I267 WeakPolarHBondContact O-CA 3.49Å; L234-V268 PolarHBondContact O-N 2.81Å
235	I	97.9	Very high	92.6	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.005	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	128.7	171.8	-52.9	-163	0	0	0	109.4	A144 I148 V161 F162 M163 L233 V268 L270	A144-I235 HydrophobicContact CB-CD1 3.69Å; A144-I235 HydrophobicContact CB-CG2 4.21Å; I148-I235 HydrophobicContact CD1-CD1 3.95Å; I148-I235 HydrophobicContact CG1-CD1 3.76Å; V161-I235 PolarHBondContact O-N 3.19Å; F162-I235 HydrophobicContact CD2-CB 3.95Å; F162-I235 HydrophobicContact CD2-CD1 4.33Å; F162-I235 HydrophobicContact CD2-CG2 3.79Å; F162-I235 HydrophobicContact CE2-CB 4.41Å; F162-I235 HydrophobicContact CE2-CG2 3.73Å; F162-I235 HydrophobicContact CG-CB 4.43Å; F162-I235 HydrophobicContact CZ-CG2 4.41Å; M163-I235 PolarHBondContact N-O 3.24Å; L233-I235 HydrophobicContact CD1-CG1 4.31Å; L233-I235 HydrophobicContact CD2-CD1 4.11Å; L233-I235 HydrophobicContact CD2-CG1 4.21Å; L233-I235 HydrophobicContact CG-CD1 4.46Å; L233-I235 HydrophobicContact CG-CG1 4.02Å; I235-V268 VanDerWaalsContact CA-O 3.3Å; I235-V268 WeakPolarHBondContact CA-O 3.18Å; I235-V268 HydrophobicContact CG1-CB 4.25Å; I235-L270 HydrophobicContact CG2-CD1 3.78Å; I235-L270 HydrophobicContact CG2-CG 4.11Å
236	F	96.9	Very high	92.6	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	109	-179.1	-61.8	-106.1	0	0	0	109.1	M163 L234 A239 Y248 L252 I267 V268 L270 L288	M163-F236 HydrophobicContact CE-CD1 3.63Å; M163-F236 HydrophobicContact CE-CD2 4.18Å; M163-F236 HydrophobicContact CE-CE1 3.31Å; M163-F236 HydrophobicContact CE-CE2 3.89Å; M163-F236 HydrophobicContact CE-CG 4.05Å; M163-F236 HydrophobicContact CE-CZ 3.45Å; M163-F236 VanDerWaalsContact CE-CZ 3.45Å; L234-F236 HydrophobicContact CB-CD2 4.36Å; L234-F236 HydrophobicContact CB-CE2 3.61Å; L234-F236 HydrophobicContact CB-CZ 4.24Å; L234-F236 HydrophobicContact CD1-CE2 4.25Å; L234-F236 HydrophobicContact CD1-CZ 4.12Å; F236-A239 HydrophobicContact CB-CB 4.32Å; F236-Y248 AromaticContact CD1-CD1 3.65Å; F236-Y248 HydrophobicContact CD1-CD1 3.65Å; F236-Y248 HydrophobicContact CD1-CD2 4.1Å; F236-Y248 HydrophobicContact CD1-CE1 4.12Å; F236-Y248 AromaticContact CD1-CG 3.65Å; F236-Y248 HydrophobicContact CD1-CG 3.65Å; F236-Y248 HydrophobicContact CE1-CD1 4.13Å; F236-Y248 HydrophobicContact CE1-CG 4.16Å; F236-L252 HydrophobicContact CE1-CD1 4.25Å; F236-L252 HydrophobicContact CE1-CG 4.39Å; F236-L252 HydrophobicContact CE2-CD1 4.46Å; F236-L252 HydrophobicContact CZ-CD1 3.72Å; F236-L252 HydrophobicContact CZ-CD2 4.01Å; F236-L252 HydrophobicContact CZ-CG 3.79Å; F236-I267 HydrophobicContact CD2-CG2 3.94Å; F236-I267 HydrophobicContact CE2-CG1 4.38Å; F236-I267 HydrophobicContact CE2-CG2 3.84Å; F236-V268 PolarHBondContact N-O 3.36Å; F236-L270 PolarHBondContact O-N 3.01Å; F236-L288 HydrophobicContact CD1-CD2 3.81Å; F236-L288 HydrophobicContact CE1-CD2 3.69Å; F236-L288 HydrophobicContact CG-CD1 4.48Å; F236-L288 HydrophobicContact CG-CD2 4.28Å; F236-L288 HydrophobicContact CZ-CD2 4.08Å
237	D	94.5	Very high	92.6	Very high	2 Å²	2	25.2 Å²	25.2	1%	0.011	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	145.3	176.1	-164.2	27.7	0	0	0	112.1	F162 M163 A164 Q173 A239 Y248	F162-D237 HydrophobicContact CE1-CB 3.8Å; F162-D237 HydrophobicContact CZ-CB 3.9Å; M163-D237 WeakPolarHBondContact O-CB 3.37Å; M163-D237 PolarHBondContact O-N 3.04Å; A164-D237 HydrophobicContact CB-CB 4.08Å; Q173-D237 PolarHBondContact NE2-OD2 2.75Å; D237-A239 VanDerWaalsContact C-N 3.28Å; D237-A239 PolarHBondContact O-N 2.85Å; D237-Y248 PolarHBondContact O-OH 3.3Å
238	E	90.8	Very high	92.8	Very high	26 Å²	26	22.5 Å²	22.5	12%	0.121	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	44.7	52.6	-166.2	-61.1	-60.1	166.2	0	0	112.5	P165 H240 K241 L270 Q625	P165-E238 HydrophobicContact CG-CB 4.47Å; E238-H240 PolarHBondContact O-N 2.78Å; E238-H240 IonicContact OE2-CE1 2.67Å; E238-H240 PolarHBondContact OE2-CE1 2.81Å; E238-H240 IonicContact OE2-ND1 3.16Å; E238-H240 PolarHBondContact OE2-ND1 3.02Å; E238-K241 PolarHBondContact O-N 3.01Å; E238-K241 VanDerWaalsContact O-N 3.16Å; E238-L270 WeakPolarHBondContact CA-O 3.39Å; E238-L270 PolarHBondContact N-O 2.74Å; E238-L270 VanDerWaalsContact N-O 3.08Å; E238-Q625 PolarHBondContact OE2-NE2 2.83Å; E238-Q625 VanDerWaalsContact OE2-NE2 3.13Å
239	A	93.2	Very high	92.8	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.131	C	C	.	.	G	3₁₀ helix	trans	-57	-19.3	-171.9	0	0	0	0	0	115.4	L131 F236 D237 K241 A242 A269 L270 L284 L288	L131-A239 HydrophobicContact CD1-CB 4.36Å; F236-A239 HydrophobicContact CB-CB 4.32Å; D237-A239 VanDerWaalsContact C-N 3.28Å; D237-A239 PolarHBondContact O-N 2.85Å; A239-K241 PolarHBondContact O-N 3.41Å; A239-A242 WeakPolarHBondContact O-CB 3.38Å; A239-A242 PolarHBondContact O-N 3.41Å; A239-A269 HydrophobicContact CB-CB 3.73Å; A239-L270 WeakPolarHBondContact CB-O 3.38Å; A239-L270 PolarHBondContact N-O 2.97Å; A239-L284 WeakPolarHBondContact O-CD1 3.45Å; A239-L288 HydrophobicContact CB-CD1 3.87Å
240	H	89.2	Confident	92.9	Very high	30 Å²	30	20.9 Å²	20.9	14%	0.139	12%	0.121	C	C	.	.	G	3₁₀ helix	trans	-57.9	-17.6	174.5	64.4	-94.6	0	0	0	113.4	E238 A242 S271	E238-H240 PolarHBondContact O-N 2.78Å; E238-H240 IonicContact OE2-CE1 2.67Å; E238-H240 PolarHBondContact OE2-CE1 2.81Å; E238-H240 IonicContact OE2-ND1 3.16Å; E238-H240 PolarHBondContact OE2-ND1 3.02Å; H240-A242 PolarHBondContact O-N 3.41Å; H240-S271 PolarHBondContact ND1-OG 2.95Å
241	K	88	Confident	93	Very high	35 Å²	35	19.5 Å²	19.5	15%	0.152	11%	0.111	C	C	.	.	G	3₁₀ helix	trans	-74.9	-0.2	170.7	-59.5	-162.3	176.5	-165.3	0	114.5	P165 E238 A239 T243 H246 E601	P165-K241 HydrophobicContact CB-CD 4.23Å; P165-K241 HydrophobicContact CG-CD 3.99Å; E238-K241 PolarHBondContact O-N 3.01Å; E238-K241 VanDerWaalsContact O-N 3.16Å; A239-K241 PolarHBondContact O-N 3.41Å; K241-T243 PolarHBondContact O-N 3.14Å; K241-H246 VanDerWaalsContact O-CB 3.24Å; K241-H246 WeakPolarHBondContact O-CB 3.47Å; K241-H246 PolarHBondContact O-ND1 3.44Å; K241-E601 WeakPolarHBondContact CE-OE1 3.48Å; K241-E601 IonicContact NZ-OE1 2.71Å; K241-E601 PolarHBondContact NZ-OE1 2.98Å; K241-E601 IonicContact NZ-OE2 3.71Å; K241-E601 PolarHBondContact NZ-OE2 2.76Å
242	A	91.4	Very high	92.9	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.112	C	C	.	.			trans	-81.6	58.8	176.9	0	0	0	0	0	112.3	A239 H240 Y248 C249 L284 N287 L288	A239-A242 WeakPolarHBondContact O-CB 3.38Å; A239-A242 PolarHBondContact O-N 3.41Å; H240-A242 PolarHBondContact O-N 3.41Å; A242-Y248 HydrophobicContact CB-CD2 4.1Å; A242-C249 PolarHBondContact O-SG 2.96Å; A242-L284 HydrophobicContact CB-CD1 3.75Å; A242-N287 PolarHBondContact O-ND2 3.38Å; A242-L288 HydrophobicContact CB-CD1 3.75Å; A242-L288 HydrophobicContact CB-CD2 3.58Å; A242-L288 HydrophobicContact CB-CG 3.59Å
243	T	87.3	Confident	92.8	Very high	44 Å²	44	22.6 Å²	22.6	27%	0.27	12%	0.123	S	C	.	.			trans	-111	159.7	178.5	46.4	0	0	0	0	110.8	K241 N245 H246	K241-T243 PolarHBondContact O-N 3.14Å; T243-N245 PolarHBondContact O-N 3.35Å; T243-N245 VanDerWaalsContact O-N 3.11Å; T243-H246 WeakPolarHBondContact O-CB 3.39Å; T243-H246 PolarHBondContact O-N 2.83Å
244	G	85.5	Confident	92.6	Very high	49 Å²	49	24 Å²	24	51%	0.505	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.7	-113.1	171.7	0	0	0	0	0	115.3	R253	G244-R253 PolarHBondContact O-NH2 3.24Å
245	N	87.2	Confident	92.4	Very high	116 Å²	116	24 Å²	24	62%	0.62	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	-112.8	15	-179.5	-77.1	-22.8	0	0	0	114	T243 Q250 R253	T243-N245 PolarHBondContact O-N 3.35Å; T243-N245 VanDerWaalsContact O-N 3.11Å; N245-Q250 PolarHBondContact O-NE2 3.07Å; N245-R253 PolarHBondContact OD1-NH1 3.45Å
246	H	91.8	Very high	92.1	Very high	30 Å²	30	24.8 Å²	24.8	14%	0.139	14%	0.136	C	C	.	.			trans	-56.9	148.6	176	177.1	-111.3	0	0	0	111.5	K241 T243 Y248 C249 Q250	K241-H246 VanDerWaalsContact O-CB 3.24Å; K241-H246 WeakPolarHBondContact O-CB 3.47Å; K241-H246 PolarHBondContact O-ND1 3.44Å; T243-H246 WeakPolarHBondContact O-CB 3.39Å; T243-H246 PolarHBondContact O-N 2.83Å; H246-Y248 AromaticContact CE1-CD1 3.98Å; H246-Y248 AromaticContact CE1-CD2 3.43Å; H246-Y248 VanDerWaalsContact CE1-CD2 3.43Å; H246-Y248 WeakPolarHBondContact CE1-CD2 3.33Å; H246-Y248 AromaticContact CE1-CE2 3.81Å; H246-Y248 AromaticContact CE1-CG 3.53Å; H246-Y248 AromaticContact ND1-CD2 3.54Å; H246-Y248 AromaticContact ND1-CG 3.54Å; H246-Y248 PolarHBondContact O-N 3.11Å; H246-C249 WeakPolarHBondContact O-CB 3.42Å; H246-C249 PolarHBondContact O-N 3.18Å; H246-Q250 PolarHBondContact O-N 2.97Å
247	A	93.1	Very high	91.8	Very high	7 Å²	7	28.3 Å²	28.3	6%	0.058	15%	0.154	C	C	.	.	H	α-helix	trans	-56.5	-24.6	-171	0	0	0	0	0	114.5	P214 M218 Q250 V251	P214-A247 HydrophobicContact CB-CB 3.87Å; P214-A247 HydrophobicContact CG-CB 4.02Å; M218-A247 HydrophobicContact SD-CB 4.16Å; A247-Q250 PolarHBondContact O-N 2.63Å; A247-V251 WeakPolarHBondContact O-CB 3.37Å; A247-V251 WeakPolarHBondContact O-CG2 3.32Å; A247-V251 PolarHBondContact O-N 3.46Å
248	Y	96.3	Very high	91.4	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-59.1	-44.5	170.2	-70.8	-20.1	0	0	0	113.1	M163 A164 P165 P214 F236 D237 A242 H246 L252	M163-Y248 HydrophobicContact CB-CE1 3.83Å; M163-Y248 PolarHBondContact O-OH 3.14Å; A164-Y248 WeakPolarHBondContact CA-OH 3.49Å; P165-Y248 VanDerWaalsContact CD-OH 3.29Å; P165-Y248 WeakPolarHBondContact CD-OH 3.21Å; P165-Y248 HydrophobicContact CG-CE2 4.48Å; P214-Y248 HydrophobicContact CB-CD1 3.53Å; P214-Y248 HydrophobicContact CB-CE1 3.65Å; P214-Y248 HydrophobicContact CG-CD1 3.76Å; P214-Y248 HydrophobicContact CG-CE1 3.54Å; F236-Y248 AromaticContact CD1-CD1 3.65Å; F236-Y248 HydrophobicContact CD1-CD1 3.65Å; F236-Y248 HydrophobicContact CD1-CD2 4.1Å; F236-Y248 HydrophobicContact CD1-CE1 4.12Å; F236-Y248 AromaticContact CD1-CG 3.65Å; F236-Y248 HydrophobicContact CD1-CG 3.65Å; F236-Y248 HydrophobicContact CE1-CD1 4.13Å; F236-Y248 HydrophobicContact CE1-CG 4.16Å; D237-Y248 PolarHBondContact O-OH 3.3Å; A242-Y248 HydrophobicContact CB-CD2 4.1Å; H246-Y248 AromaticContact CE1-CD1 3.98Å; H246-Y248 AromaticContact CE1-CD2 3.43Å; H246-Y248 VanDerWaalsContact CE1-CD2 3.43Å; H246-Y248 WeakPolarHBondContact CE1-CD2 3.33Å; H246-Y248 AromaticContact CE1-CE2 3.81Å; H246-Y248 AromaticContact CE1-CG 3.53Å; H246-Y248 AromaticContact ND1-CD2 3.54Å; H246-Y248 AromaticContact ND1-CG 3.54Å; H246-Y248 PolarHBondContact O-N 3.11Å; Y248-L252 PolarHBondContact O-N 2.99Å
249	C	94.5	Very high	91.2	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.014	22%	0.216	C	C	.	.	H	α-helix	trans	-67.8	-41.2	177.3	-55	0	0	0	0	110.4	A242 H246 L252 R253	A242-C249 PolarHBondContact O-SG 2.96Å; H246-C249 WeakPolarHBondContact O-CB 3.42Å; H246-C249 PolarHBondContact O-N 3.18Å; C249-L252 PolarHBondContact O-N 3.26Å; C249-R253 VanDerWaalsContact O-CG 3.31Å; C249-R253 WeakPolarHBondContact O-CG 3.26Å; C249-R253 PolarHBondContact O-N 3.47Å
250	Q	93.6	Very high	90.9	Very high	58 Å²	58	39.2 Å²	39.2	27%	0.271	22%	0.224	S	C	.	.	H	α-helix	trans	-64.3	-44.9	179.2	-58.6	-162.5	40.1	0	0	112.1	M218 N245 H246 A247 L252 R253 I254	M218-Q250 HydrophobicContact CG-CB 4.11Å; M218-Q250 HydrophobicContact SD-CB 3.75Å; M218-Q250 HydrophobicContact SD-CG 4.25Å; M218-Q250 PolarHBondContact SD-OE1 3.03Å; M218-Q250 VanDerWaalsContact SD-OE1 3.39Å; N245-Q250 PolarHBondContact O-NE2 3.07Å; H246-Q250 PolarHBondContact O-N 2.97Å; A247-Q250 PolarHBondContact O-N 2.63Å; Q250-L252 VanDerWaalsContact C-N 3.31Å; Q250-L252 PolarHBondContact O-N 3.31Å; Q250-R253 PolarHBondContact O-N 3.19Å; Q250-I254 HydrophobicContact CB-CD1 4.46Å; Q250-I254 WeakPolarHBondContact O-CB 3.35Å; Q250-I254 WeakPolarHBondContact O-CD1 3.45Å; Q250-I254 VanDerWaalsContact O-CG1 3.23Å; Q250-I254 WeakPolarHBondContact O-CG1 3.3Å; Q250-I254 PolarHBondContact O-N 2.89Å
251	V	95.4	Very high	90.9	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-52.7	-47.4	175.1	160.9	0	0	0	0	111.7	M163 L217 M218 L221 A247 L255	M163-V251 HydrophobicContact CE-CG1 4.29Å; M163-V251 HydrophobicContact SD-CG1 4.33Å; M163-V251 HydrophobicContact SD-CG2 4.45Å; L217-V251 HydrophobicContact CB-CG2 4.27Å; L217-V251 HydrophobicContact CD2-CG1 3.57Å; L217-V251 HydrophobicContact CD2-CG2 4.14Å; L217-V251 HydrophobicContact CG-CG1 4.23Å; L217-V251 HydrophobicContact CG-CG2 4.13Å; M218-V251 HydrophobicContact CB-CG2 3.96Å; L221-V251 HydrophobicContact CD1-CG1 4.3Å; A247-V251 WeakPolarHBondContact O-CB 3.37Å; A247-V251 WeakPolarHBondContact O-CG2 3.32Å; A247-V251 PolarHBondContact O-N 3.46Å; V251-L255 VanDerWaalsContact O-CB 3.3Å; V251-L255 WeakPolarHBondContact O-CB 3.26Å; V251-L255 PolarHBondContact O-N 3.35Å
252	L	94.1	Very high	91	Very high	4 Å²	4	41 Å²	41	2%	0.021	24%	0.239	C	C	.	.	H	α-helix	trans	-70.5	-43.5	179.6	-72.9	174	0	0	0	112.2	L234 F236 Y248 C249 Q250 I254 L255 T256 F265 I267 N287 L288	L234-L252 HydrophobicContact CD1-CD2 3.79Å; F236-L252 HydrophobicContact CE1-CD1 4.25Å; F236-L252 HydrophobicContact CE1-CG 4.39Å; F236-L252 HydrophobicContact CE2-CD1 4.46Å; F236-L252 HydrophobicContact CZ-CD1 3.72Å; F236-L252 HydrophobicContact CZ-CD2 4.01Å; F236-L252 HydrophobicContact CZ-CG 3.79Å; Y248-L252 PolarHBondContact O-N 2.99Å; C249-L252 PolarHBondContact O-N 3.26Å; Q250-L252 VanDerWaalsContact C-N 3.31Å; Q250-L252 PolarHBondContact O-N 3.31Å; L252-I254 VanDerWaalsContact C-N 3.33Å; L252-I254 PolarHBondContact O-N 2.98Å; L252-L255 PolarHBondContact O-N 3.19Å; L252-L255 VanDerWaalsContact O-N 3.11Å; L252-T256 PolarHBondContact O-N 3.47Å; L252-T256 PolarHBondContact O-OG1 2.64Å; L252-T256 VanDerWaalsContact O-OG1 3.07Å; L252-F265 HydrophobicContact CD2-CE2 3.68Å; L252-F265 HydrophobicContact CD2-CZ 3.8Å; L252-I267 HydrophobicContact CD1-CD1 4.18Å; L252-I267 HydrophobicContact CD2-CD1 4.03Å; L252-N287 VanDerWaalsContact CD1-O 3.25Å; L252-N287 WeakPolarHBondContact CD1-O 3.39Å; L252-L288 HydrophobicContact CD1-CD2 3.64Å
253	R	93.1	Very high	90.7	Very high	70 Å²	70	44.5 Å²	44.5	26%	0.264	25%	0.252	S	S	.	.	H	α-helix	trans	-54.5	-47.8	174.5	-71.8	173.8	-169.9	152.1	11.2	111.3	G244 N245 C249 Q250 L255 N257 Y1301	G244-R253 PolarHBondContact O-NH2 3.24Å; N245-R253 PolarHBondContact OD1-NH1 3.45Å; C249-R253 VanDerWaalsContact O-CG 3.31Å; C249-R253 WeakPolarHBondContact O-CG 3.26Å; C249-R253 PolarHBondContact O-N 3.47Å; Q250-R253 PolarHBondContact O-N 3.19Å; R253-L255 VanDerWaalsContact C-N 3.33Å; R253-L255 PolarHBondContact O-N 3Å; R253-N257 WeakPolarHBondContact O-CB 3.4Å; R253-N257 PolarHBondContact O-N 2.93Å; R253-N257 PolarHBondContact O-ND2 3.49Å; R253-Y1301 PolarHBondContact NE-OH 3.27Å
254	I	93.4	Very high	90.8	Very high	30 Å²	30	45.8 Å²	45.8	15%	0.154	26%	0.255	C	S	.	.	H	α-helix	trans	-63.7	-38.4	178.3	-64.8	157	0	0	0	111.3	M218 L221 Q222 Q250 L252 H260	M218-I254 HydrophobicContact CG-CD1 3.75Å; L221-I254 HydrophobicContact CB-CG2 3.78Å; L221-I254 HydrophobicContact CD1-CG2 4.46Å; Q222-I254 HydrophobicContact CG-CD1 3.83Å; Q250-I254 HydrophobicContact CB-CD1 4.46Å; Q250-I254 WeakPolarHBondContact O-CB 3.35Å; Q250-I254 WeakPolarHBondContact O-CD1 3.45Å; Q250-I254 VanDerWaalsContact O-CG1 3.23Å; Q250-I254 WeakPolarHBondContact O-CG1 3.3Å; Q250-I254 PolarHBondContact O-N 2.89Å; L252-I254 VanDerWaalsContact C-N 3.33Å; L252-I254 PolarHBondContact O-N 2.98Å; I254-H260 PolarHBondContact O-CD2 2.99Å
255	L	93.6	Very high	91.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-74.8	-39.2	-176.4	-167.4	61	0	0	0	113.1	L221 A228 I231 L234 V251 L252 R253 T261 H262 F265	L221-L255 HydrophobicContact CD2-CD1 4.23Å; A228-L255 HydrophobicContact CB-CD1 3.81Å; I231-L255 HydrophobicContact CD1-CD1 4.27Å; I231-L255 HydrophobicContact CD1-CD2 4.39Å; L234-L255 HydrophobicContact CD1-CD2 3.89Å; V251-L255 VanDerWaalsContact O-CB 3.3Å; V251-L255 WeakPolarHBondContact O-CB 3.26Å; V251-L255 PolarHBondContact O-N 3.35Å; L252-L255 PolarHBondContact O-N 3.19Å; L252-L255 VanDerWaalsContact O-N 3.11Å; R253-L255 VanDerWaalsContact C-N 3.33Å; R253-L255 PolarHBondContact O-N 3Å; L255-T261 PolarHBondContact O-N 3.44Å; L255-H262 HydrophobicContact CD1-CB 4.07Å; L255-H262 HydrophobicContact CG-CB 4.21Å; L255-H262 PolarHBondContact O-N 3.32Å; L255-F265 HydrophobicContact CD2-CD1 3.99Å; L255-F265 HydrophobicContact CD2-CE1 3.64Å; L255-F265 HydrophobicContact CD2-CE2 4.27Å; L255-F265 HydrophobicContact CD2-CG 4.45Å; L255-F265 HydrophobicContact CD2-CZ 3.8Å; L255-F265 HydrophobicContact CG-CE1 4.04Å; L255-F265 HydrophobicContact CG-CZ 4.44Å
256	T	91.8	Very high	91.6	Very high	18 Å²	18	38.2 Å²	38.2	11%	0.11	20%	0.203	C	C	.	.	H	α-helix	trans	-90.6	-16.3	-174.8	61.6	0	0	0	0	115.2	L252 F265 L289	L252-T256 PolarHBondContact O-N 3.47Å; L252-T256 PolarHBondContact O-OG1 2.64Å; L252-T256 VanDerWaalsContact O-OG1 3.07Å; T256-F265 HydrophobicContact CG2-CE1 4.3Å; T256-F265 HydrophobicContact CG2-CZ 4.08Å; T256-L289 HydrophobicContact CG2-CD1 3.89Å
257	N	91.1	Very high	91.8	Very high	73 Å²	73	36.8 Å²	36.8	39%	0.39	20%	0.196	S	C	.	.	S	Bend	trans	-102.4	171.2	-179	-58.4	0.9	0	0	0	110	R253 H260 T261	R253-N257 WeakPolarHBondContact O-CB 3.4Å; R253-N257 PolarHBondContact O-N 2.93Å; R253-N257 PolarHBondContact O-ND2 3.49Å; N257-H260 PolarHBondContact O-N 2.7Å; N257-H260 VanDerWaalsContact O-N 3.13Å; N257-T261 PolarHBondContact O-N 3.45Å
258	P	85.5	Confident	92	Very high	108 Å²	108	36.5 Å²	36.5	70%	0.701	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.3	143.3	167.3	-25.5	36.2	0	0	0	111.3	T261	P258-T261 HydrophobicContact CG-CG2 4.08Å
259	P	85.6	Confident	92	Very high	112 Å²	112	36.5 Å²	36.5	73%	0.727	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	cis	-83.2	-15.2	7	33.4	-36.7	0	0	0	115
260	H	87.2	Confident	92.1	Very high	38 Å²	38	36.4 Å²	36.4	18%	0.176	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-44.3	-168.6	-64.1	-63.3	0	0	0	113.3	L221 A228 I254 N257 H262	L221-H260 PolarHBondContact O-NE2 3.25Å; L221-H260 VanDerWaalsContact O-NE2 3.14Å; A228-H260 HydrophobicContact CB-CB 4.24Å; A228-H260 VanDerWaalsContact CB-ND1 3.3Å; A228-H260 WeakPolarHBondContact CB-ND1 3.34Å; I254-H260 PolarHBondContact O-CD2 2.99Å; N257-H260 PolarHBondContact O-N 2.7Å; N257-H260 VanDerWaalsContact O-N 3.13Å; H260-H262 PolarHBondContact O-N 3.08Å
261	T	88.5	Confident	92	Very high	86 Å²	86	33.6 Å²	33.6	53%	0.528	18%	0.18	S	C	.	.			trans	53.2	18.3	-178.7	63.1	0	0	0	0	115.9	L255 N257 P258	L255-T261 PolarHBondContact O-N 3.44Å; N257-T261 PolarHBondContact O-N 3.45Å; P258-T261 HydrophobicContact CG-CG2 4.08Å
262	H	90.7	Very high	91.5	Very high	15 Å²	15	33.7 Å²	33.7	7%	0.069	18%	0.181	C	C	.	.			trans	-70.6	135.9	-175.8	-176.5	32.2	0	0	0	111.1	A228 N229 I231 L255 H260 Q264 F265	A228-H262 PolarHBondContact O-CD2 3.06Å; N229-H262 PolarHBondContact O-NE2 3.2Å; I231-H262 PolarHBondContact O-NE2 3.12Å; L255-H262 HydrophobicContact CD1-CB 4.07Å; L255-H262 HydrophobicContact CG-CB 4.21Å; L255-H262 PolarHBondContact O-N 3.32Å; H260-H262 PolarHBondContact O-N 3.08Å; H262-Q264 PolarHBondContact CE1-N 3.33Å; H262-Q264 PolarHBondContact CE1-O 2.84Å; H262-Q264 VanDerWaalsContact CE1-O 3.23Å; H262-Q264 PolarHBondContact ND1-N 3.35Å; H262-F265 AromaticContact CD2-CD1 3.78Å; H262-F265 AromaticContact NE2-CD1 3.93Å; H262-F265 WeakPolarHBondContact O-CE1 3.48Å
263	R	86.2	Confident	90.8	Very high	75 Å²	75	33.5 Å²	33.5	28%	0.283	18%	0.18	S	C	.	.			trans	-138.8	4.5	177.5	-63.9	-171.9	-179.5	-170.2	0.3	113.9	F265	R263-F265 PolarHBondContact O-N 3.03Å
264	Q	89.2	Confident	90.1	Very high	71 Å²	71	30.2 Å²	30.2	33%	0.332	17%	0.167	S	C	.	.			trans	-99.7	66.7	-179.9	-70.9	-173.2	-10	0	0	111.7	R232 H262 M683	R232-Q264 PolarHBondContact NH1-O 2.86Å; H262-Q264 PolarHBondContact CE1-N 3.33Å; H262-Q264 PolarHBondContact CE1-O 2.84Å; H262-Q264 VanDerWaalsContact CE1-O 3.23Å; H262-Q264 PolarHBondContact ND1-N 3.35Å; Q264-M683 WeakPolarHBondContact O-CE 3.29Å
265	F	93.3	Very high	89.5	Confident	6 Å²	6	29.4 Å²	29.4	3%	0.026	17%	0.165	C	C	.	.			trans	-146	152.5	175.9	61	-89.6	0	0	0	111.6	R232 L234 L252 L255 T256 H262 R263 I267	R232-F265 WeakPolarHBondContact O-CA 3.46Å; L234-F265 HydrophobicContact CD1-CD2 3.95Å; L234-F265 HydrophobicContact CD1-CE2 3.81Å; L234-F265 HydrophobicContact CG-CD2 4.24Å; L252-F265 HydrophobicContact CD2-CE2 3.68Å; L252-F265 HydrophobicContact CD2-CZ 3.8Å; L255-F265 HydrophobicContact CD2-CD1 3.99Å; L255-F265 HydrophobicContact CD2-CE1 3.64Å; L255-F265 HydrophobicContact CD2-CE2 4.27Å; L255-F265 HydrophobicContact CD2-CG 4.45Å; L255-F265 HydrophobicContact CD2-CZ 3.8Å; L255-F265 HydrophobicContact CG-CE1 4.04Å; L255-F265 HydrophobicContact CG-CZ 4.44Å; T256-F265 HydrophobicContact CG2-CE1 4.3Å; T256-F265 HydrophobicContact CG2-CZ 4.08Å; H262-F265 AromaticContact CD2-CD1 3.78Å; H262-F265 AromaticContact NE2-CD1 3.93Å; H262-F265 WeakPolarHBondContact O-CE1 3.48Å; R263-F265 PolarHBondContact O-N 3.03Å; F265-I267 HydrophobicContact CD2-CG1 3.97Å; F265-I267 HydrophobicContact CE2-CD1 3.82Å; F265-I267 HydrophobicContact CE2-CG1 3.69Å
266	R	95.5	Very high	88.5	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	142	171.5	174.7	62.4	65.4	-114	-7.9	110.9	C125 L126 Y127 K128 N129 F151 R232 L233 L234 V268 N680 P681 R682 M683	C125-R266 WeakPolarHBondContact O-CD 3.45Å; C125-R266 PolarHBondContact O-NE 3.01Å; L126-R266 PolarHBondContact O-NE 2.86Å; L126-R266 PolarHBondContact O-NH2 2.82Å; Y127-R266 PolarHBondContact O-NH2 3.41Å; Y127-R266 VanDerWaalsContact O-NH2 3.1Å; K128-R266 VanDerWaalsContact O-CD 3.31Å; K128-R266 WeakPolarHBondContact O-CD 3.34Å; N129-R266 PolarHBondContact OD1-NH1 3.08Å; F151-R266 HydrophobicContact CE1-CB 3.71Å; F151-R266 HydrophobicContact CE1-CG 4.47Å; F151-R266 HydrophobicContact CE2-CB 4.28Å; F151-R266 HydrophobicContact CE2-CG 4.16Å; F151-R266 HydrophobicContact CZ-CB 3.46Å; F151-R266 VanDerWaalsContact CZ-CB 3.46Å; F151-R266 HydrophobicContact CZ-CG 3.77Å; R232-R266 PolarHBondContact O-N 2.97Å; L233-R266 WeakPolarHBondContact CA-O 3.43Å; L233-R266 HydrophobicContact CD1-CB 3.75Å; L233-R266 HydrophobicContact CD1-CG 3.61Å; L234-R266 PolarHBondContact N-O 3.38Å; R266-V268 HydrophobicContact CG-CG2 4.26Å; R266-N680 PolarHBondContact NH1-OD1 3.47Å; R266-P681 VanDerWaalsContact CZ-O 3.29Å; R266-P681 PolarHBondContact NH1-O 3.29Å; R266-P681 PolarHBondContact NH2-O 2.88Å; R266-R682 PolarHBondContact NH2-O 3.43Å; R266-M683 HydrophobicContact CB-CG 4.19Å
267	I	96.5	Very high	88	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	131.6	167.5	-62.2	174.1	0	0	0	110.1	N129 T130 L234 F236 L252 F265 L288 L289 I290	N129-I267 WeakPolarHBondContact CA-O 3.41Å; N129-I267 HydrophobicContact CB-CB 4.18Å; N129-I267 PolarHBondContact OD1-N 3.39Å; T130-I267 PolarHBondContact N-O 2.87Å; T130-I267 VanDerWaalsContact N-O 3.11Å; L234-I267 WeakPolarHBondContact O-CA 3.49Å; F236-I267 HydrophobicContact CD2-CG2 3.94Å; F236-I267 HydrophobicContact CE2-CG1 4.38Å; F236-I267 HydrophobicContact CE2-CG2 3.84Å; L252-I267 HydrophobicContact CD1-CD1 4.18Å; L252-I267 HydrophobicContact CD2-CD1 4.03Å; F265-I267 HydrophobicContact CD2-CG1 3.97Å; F265-I267 HydrophobicContact CE2-CD1 3.82Å; F265-I267 HydrophobicContact CE2-CG1 3.69Å; I267-L288 WeakPolarHBondContact CD1-O 3.38Å; I267-L289 HydrophobicContact CD1-CB 3.88Å; I267-L289 HydrophobicContact CD1-CD1 4.37Å; I267-L289 HydrophobicContact CD1-CG 4.42Å; I267-I290 HydrophobicContact CG2-CD1 4.09Å
268	V	97.4	Very high	87.6	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	109	163.6	179.8	0	0	0	0	108.5	C125 V132 V147 L233 L234 I235 F236 R266 L270	C125-V268 HydrophobicContact CB-CG2 3.91Å; V132-V268 HydrophobicContact CG2-CG1 4.38Å; V147-V268 HydrophobicContact CG1-CG2 4.16Å; L233-V268 HydrophobicContact CD1-CG2 4.22Å; L234-V268 PolarHBondContact O-N 2.81Å; I235-V268 VanDerWaalsContact CA-O 3.3Å; I235-V268 WeakPolarHBondContact CA-O 3.18Å; I235-V268 HydrophobicContact CG1-CB 4.25Å; F236-V268 PolarHBondContact N-O 3.36Å; R266-V268 HydrophobicContact CG-CG2 4.26Å; V268-L270 HydrophobicContact CG1-CD2 3.76Å; V268-L270 HydrophobicContact CG1-CG 4.44Å
269	A	96.8	Very high	87.7	Confident	0 Å²	0	36 Å²	36	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	125	177.7	0	0	0	0	0	109.4	T130 L131 V132 A239 L288 I290	T130-A269 PolarHBondContact O-N 2.78Å; L131-A269 HydrophobicContact CB-CB 4.47Å; L131-A269 HydrophobicContact CD1-CB 3.73Å; V132-A269 PolarHBondContact N-O 3.19Å; A239-A269 HydrophobicContact CB-CB 3.73Å; A269-L288 HydrophobicContact CB-CD1 3.74Å; A269-I290 HydrophobicContact CB-CD1 3.91Å
270	L	95.6	Very high	87.7	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	129.3	-177.2	-52.4	173.9	0	0	0	109.6	V132 K140 A144 F162 I235 F236 E238 A239 V268	V132-L270 HydrophobicContact CB-CD2 4.09Å; V132-L270 HydrophobicContact CG1-CD2 4.46Å; V132-L270 HydrophobicContact CG2-CD2 4.47Å; K140-L270 HydrophobicContact CB-CB 4.47Å; K140-L270 HydrophobicContact CB-CD1 4.38Å; K140-L270 HydrophobicContact CB-CD2 4.4Å; K140-L270 HydrophobicContact CD-CB 4.37Å; A144-L270 HydrophobicContact CB-CD1 4.01Å; F162-L270 HydrophobicContact CE2-CD1 4.31Å; F162-L270 HydrophobicContact CZ-CD1 4.35Å; I235-L270 HydrophobicContact CG2-CD1 3.78Å; I235-L270 HydrophobicContact CG2-CG 4.11Å; F236-L270 PolarHBondContact O-N 3.01Å; E238-L270 WeakPolarHBondContact CA-O 3.39Å; E238-L270 PolarHBondContact N-O 2.74Å; E238-L270 VanDerWaalsContact N-O 3.08Å; A239-L270 WeakPolarHBondContact CB-O 3.38Å; A239-L270 PolarHBondContact N-O 2.97Å; V268-L270 HydrophobicContact CG1-CD2 3.76Å; V268-L270 HydrophobicContact CG1-CG 4.44Å
271	S	91.6	Very high	87.8	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	161	173.4	-164.8	0	0	0	0	112.9	V132 C133 L134 K140 H240 T273	V132-S271 PolarHBondContact O-N 3.12Å; C133-S271 WeakPolarHBondContact CA-O 3.31Å; L134-S271 PolarHBondContact N-O 2.73Å; K140-S271 WeakPolarHBondContact CD-O 3.41Å; K140-S271 VanDerWaalsContact NZ-C 3.31Å; K140-S271 PolarHBondContact NZ-O 2.88Å; H240-S271 PolarHBondContact ND1-OG 2.95Å; S271-T273 VanDerWaalsContact CB-O 3.27Å; S271-T273 WeakPolarHBondContact CB-O 3.32Å; S271-T273 PolarHBondContact OG-N 2.95Å; S271-T273 PolarHBondContact OG-O 3.07Å
272	A	84.4	Confident	87.9	Confident	2 Å²	2	28.1 Å²	28.1	2%	0.017	15%	0.148	C	C	.	.	S	Bend	trans	-77.6	-30.4	166.7	0	0	0	0	0	112.5	K140 Q625	K140-A272 VanDerWaalsContact NZ-N 3.16Å; A272-Q625 HydrophobicContact CB-CG 4.17Å
273	T	80.7	Confident	87.9	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.161	C	C	.	.			trans	-144.1	143.8	-174.5	48.5	0	0	0	0	109	S271 I621 M624	S271-T273 VanDerWaalsContact CB-O 3.27Å; S271-T273 WeakPolarHBondContact CB-O 3.32Å; S271-T273 PolarHBondContact OG-N 2.95Å; S271-T273 PolarHBondContact OG-O 3.07Å; T273-I621 HydrophobicContact CG2-CG1 4.42Å; T273-I621 WeakPolarHBondContact OG1-CG1 3.45Å; T273-I621 WeakPolarHBondContact OG1-CG2 3.33Å; T273-M624 HydrophobicContact CG2-CB 4.32Å; T273-M624 HydrophobicContact CG2-CE 3.73Å; T273-M624 HydrophobicContact CG2-CG 4.5Å; T273-M624 HydrophobicContact CG2-SD 3.47Å; T273-M624 WeakPolarHBondContact CG2-SD 3.42Å
274	P	78.1	Confident	88.2	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.149	C	C	.	.	S	Bend	trans	-71.4	-54	179.7	29.4	-33.3	0	0	0	111.3	V281 L284 V661 L665	P274-V281 HydrophobicContact CB-CG1 4.28Å; P274-V281 HydrophobicContact CB-CG2 3.65Å; P274-V281 HydrophobicContact CG-CG2 3.93Å; P274-L284 WeakPolarHBondContact O-CD2 3.25Å; P274-V661 HydrophobicContact CG-CG1 4.4Å; P274-L665 HydrophobicContact CG-CD1 3.82Å
275	A	80.6	Confident	88.3	Confident	13 Å²	13	23.2 Å²	23.2	11%	0.107	13%	0.133	C	C	.	.			trans	-160.6	-174.1	171.1	0	0	0	0	0	110.1	V281	A275-V281 HydrophobicContact CB-CG2 3.73Å
276	A	73.3	Confident	88.3	Confident	52 Å²	52	25.6 Å²	25.6	43%	0.43	15%	0.153	S	C	.	.	S	Bend	trans	-79.8	-25.6	175.6	0	0	0	0	0	113.8	V661	A276-V661 WeakPolarHBondContact O-CG2 3.46Å
277	D	79.4	Confident	88.2	Confident	81 Å²	81	26.8 Å²	26.8	43%	0.433	16%	0.16	S	C	.	.	S	Bend	trans	-144.1	-179.9	-179.6	59	16.6	0	0	0	110.8	G280 V281	D277-G280 WeakPolarHBondContact OD1-CA 3.26Å; D277-G280 PolarHBondContact OD1-N 3.29Å; D277-V281 WeakPolarHBondContact O-CG2 3.41Å; D277-V281 PolarHBondContact O-N 2.82Å
278	I	84.2	Confident	88	Confident	72 Å²	72	26.8 Å²	26.8	37%	0.369	16%	0.16	S	C	.	.	H	α-helix	trans	-74.6	-32	-178.5	-63.1	165.9	0	0	0	111.7	V281 Q282 A664 A670 L674	I278-V281 PolarHBondContact O-N 2.72Å; I278-Q282 PolarHBondContact O-N 2.8Å; I278-A664 HydrophobicContact CD1-CB 4.4Å; I278-A670 HydrophobicContact CD1-CB 3.78Å; I278-A670 HydrophobicContact CG1-CB 4.39Å; I278-L674 HydrophobicContact CG2-CD2 4.35Å
279	E	86.6	Confident	87.8	Confident	133 Å²	133	27.8 Å²	27.8	62%	0.621	17%	0.165	S	C	*	.	H	α-helix	trans	-67	-44.1	-180	-172.2	164.7	177.3	0	0	111.1	V281 Q282 T283	E279-V281 VanDerWaalsContact C-N 3.28Å; E279-V281 PolarHBondContact O-N 3.38Å; E279-Q282 WeakPolarHBondContact O-CA 3.35Å; E279-Q282 WeakPolarHBondContact O-CB 3.31Å; E279-Q282 PolarHBondContact O-N 3Å; E279-T283 PolarHBondContact O-N 3.3Å; E279-T283 PolarHBondContact O-OG1 2.88Å; E279-T283 VanDerWaalsContact O-OG1 3.07Å
280	G	86.3	Confident	87.7	Confident	18 Å²	18	27.8 Å²	27.8	19%	0.186	17%	0.165	C	C	.	.	H	α-helix	trans	-59.7	-33.5	171	0	0	0	0	0	113.5	D277 L284	D277-G280 WeakPolarHBondContact OD1-CA 3.26Å; D277-G280 PolarHBondContact OD1-N 3.29Å; G280-L284 VanDerWaalsContact O-CB 3.26Å; G280-L284 WeakPolarHBondContact O-CB 3.48Å; G280-L284 PolarHBondContact O-N 3.25Å
281	V	88.2	Confident	87.5	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-66.6	-42.2	172.2	-178	0	0	0	0	110.9	P274 A275 D277 I278 E279 L284 I285 L665 L674	P274-V281 HydrophobicContact CB-CG1 4.28Å; P274-V281 HydrophobicContact CB-CG2 3.65Å; P274-V281 HydrophobicContact CG-CG2 3.93Å; A275-V281 HydrophobicContact CB-CG2 3.73Å; D277-V281 WeakPolarHBondContact O-CG2 3.41Å; D277-V281 PolarHBondContact O-N 2.82Å; I278-V281 PolarHBondContact O-N 2.72Å; E279-V281 VanDerWaalsContact C-N 3.28Å; E279-V281 PolarHBondContact O-N 3.38Å; V281-L284 PolarHBondContact O-N 2.61Å; V281-I285 HydrophobicContact CG1-CD1 3.89Å; V281-I285 HydrophobicContact CG1-CG1 4.46Å; V281-I285 WeakPolarHBondContact O-CB 3.48Å; V281-I285 VanDerWaalsContact O-CG1 3.3Å; V281-I285 WeakPolarHBondContact O-CG1 3.36Å; V281-I285 PolarHBondContact O-N 3.48Å; V281-L665 HydrophobicContact CG2-CD1 4.34Å; V281-L674 HydrophobicContact CG1-CD1 4.16Å; V281-L674 HydrophobicContact CG1-CD2 4.24Å
282	Q	91.2	Very high	87.6	Confident	52 Å²	52	29.7 Å²	29.7	24%	0.243	18%	0.177	C	C	.	.	H	α-helix	trans	-65.7	-40.7	176.9	-176.9	58.1	77.7	0	0	112.2	I278 E279 I285 A286 L674 A675	I278-Q282 PolarHBondContact O-N 2.8Å; E279-Q282 WeakPolarHBondContact O-CA 3.35Å; E279-Q282 WeakPolarHBondContact O-CB 3.31Å; E279-Q282 PolarHBondContact O-N 3Å; Q282-I285 PolarHBondContact O-N 2.88Å; Q282-A286 WeakPolarHBondContact O-CB 3.48Å; Q282-A286 PolarHBondContact O-N 3.21Å; Q282-L674 HydrophobicContact CB-CD2 4.34Å; Q282-A675 PolarHBondContact NE2-O 3.4Å
283	T	90.9	Very high	87.9	Confident	56 Å²	56	30.1 Å²	30.1	34%	0.344	18%	0.178	S	C	.	.	H	α-helix	trans	-61.5	-44.3	173.3	-57.9	0	0	0	0	111.2	E279 A286 N287	E279-T283 PolarHBondContact O-N 3.3Å; E279-T283 PolarHBondContact O-OG1 2.88Å; E279-T283 VanDerWaalsContact O-OG1 3.07Å; T283-A286 PolarHBondContact O-N 3.23Å; T283-N287 WeakPolarHBondContact O-CB 3.48Å; T283-N287 VanDerWaalsContact O-CG 3.31Å; T283-N287 PolarHBondContact O-N 3.13Å
284	L	91.6	Very high	88.5	Confident	3 Å²	3	31 Å²	31	2%	0.016	18%	0.183	C	C	.	.	H	α-helix	trans	-62.9	-42.8	176.5	178.5	60	0	0	0	112.2	L131 A239 A242 P274 G280 V281 A286 N287 L288	L131-L284 HydrophobicContact CD1-CD2 4.17Å; L131-L284 HydrophobicContact CD2-CD2 3.6Å; L131-L284 HydrophobicContact CD2-CG 4.15Å; A239-L284 WeakPolarHBondContact O-CD1 3.45Å; A242-L284 HydrophobicContact CB-CD1 3.75Å; P274-L284 WeakPolarHBondContact O-CD2 3.25Å; G280-L284 VanDerWaalsContact O-CB 3.26Å; G280-L284 WeakPolarHBondContact O-CB 3.48Å; G280-L284 PolarHBondContact O-N 3.25Å; V281-L284 PolarHBondContact O-N 2.61Å; L284-A286 VanDerWaalsContact C-N 3.33Å; L284-A286 PolarHBondContact O-N 2.99Å; L284-N287 PolarHBondContact O-N 3.38Å; L284-L288 HydrophobicContact CD1-CD1 3.54Å; L284-L288 HydrophobicContact CD1-CG 3.91Å; L284-L288 WeakPolarHBondContact O-CB 3.24Å; L284-L288 PolarHBondContact O-N 3.13Å
285	I	92.7	Very high	89.1	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-61.4	-42.1	176.5	-76	169.4	0	0	0	111.2	V281 Q282 L289 I290 L674 A675 F676	V281-I285 HydrophobicContact CG1-CD1 3.89Å; V281-I285 HydrophobicContact CG1-CG1 4.46Å; V281-I285 WeakPolarHBondContact O-CB 3.48Å; V281-I285 VanDerWaalsContact O-CG1 3.3Å; V281-I285 WeakPolarHBondContact O-CG1 3.36Å; V281-I285 PolarHBondContact O-N 3.48Å; Q282-I285 PolarHBondContact O-N 2.88Å; I285-L289 PolarHBondContact O-N 3.37Å; I285-L289 VanDerWaalsContact O-N 3.15Å; I285-I290 HydrophobicContact CB-CB 4.34Å; I285-I290 HydrophobicContact CG1-CB 4.16Å; I285-I290 HydrophobicContact CG1-CG2 4.31Å; I285-I290 HydrophobicContact CG2-CB 4.25Å; I285-I290 PolarHBondContact O-N 3.42Å; I285-L674 HydrophobicContact CD1-CB 4.23Å; I285-L674 HydrophobicContact CD1-CD1 3.88Å; I285-L674 HydrophobicContact CD1-CD2 4.25Å; I285-L674 HydrophobicContact CD1-CG 4.35Å; I285-A675 WeakPolarHBondContact CG2-O 3.24Å; I285-F676 HydrophobicContact CD1-CD1 4.25Å; I285-F676 HydrophobicContact CD1-CE1 3.86Å; I285-F676 HydrophobicContact CD1-CZ 4.34Å; I285-F676 HydrophobicContact CG2-CD1 4.35Å
286	A	92	Very high	89.4	Confident	55 Å²	55	33.1 Å²	33.1	46%	0.455	19%	0.189	S	C	.	.	H	α-helix	trans	-68.9	-47	176.9	0	0	0	0	0	112.3	Q282 T283 L284 L288 L289	Q282-A286 WeakPolarHBondContact O-CB 3.48Å; Q282-A286 PolarHBondContact O-N 3.21Å; T283-A286 PolarHBondContact O-N 3.23Å; L284-A286 VanDerWaalsContact C-N 3.33Å; L284-A286 PolarHBondContact O-N 2.99Å; A286-L288 PolarHBondContact O-N 2.85Å; A286-L289 PolarHBondContact O-N 2.89Å
287	N	93.2	Very high	89.9	Confident	25 Å²	25	31.4 Å²	31.4	13%	0.134	17%	0.173	C	C	.	.	H	α-helix	trans	-66.5	-36.2	-177.9	-76.4	-16.8	0	0	0	113.1	A242 L252 T283 L284	A242-N287 PolarHBondContact O-ND2 3.38Å; L252-N287 VanDerWaalsContact CD1-O 3.25Å; L252-N287 WeakPolarHBondContact CD1-O 3.39Å; T283-N287 WeakPolarHBondContact O-CB 3.48Å; T283-N287 VanDerWaalsContact O-CG 3.31Å; T283-N287 PolarHBondContact O-N 3.13Å; L284-N287 PolarHBondContact O-N 3.38Å
288	L	94	Very high	89.7	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.2	15.6	-179.8	-62.3	-172.7	0	0	0	114.2	F236 A239 A242 L252 I267 A269 L284 A286 I290	F236-L288 HydrophobicContact CD1-CD2 3.81Å; F236-L288 HydrophobicContact CE1-CD2 3.69Å; F236-L288 HydrophobicContact CG-CD1 4.48Å; F236-L288 HydrophobicContact CG-CD2 4.28Å; F236-L288 HydrophobicContact CZ-CD2 4.08Å; A239-L288 HydrophobicContact CB-CD1 3.87Å; A242-L288 HydrophobicContact CB-CD1 3.75Å; A242-L288 HydrophobicContact CB-CD2 3.58Å; A242-L288 HydrophobicContact CB-CG 3.59Å; L252-L288 HydrophobicContact CD1-CD2 3.64Å; I267-L288 WeakPolarHBondContact CD1-O 3.38Å; A269-L288 HydrophobicContact CB-CD1 3.74Å; L284-L288 HydrophobicContact CD1-CD1 3.54Å; L284-L288 HydrophobicContact CD1-CG 3.91Å; L284-L288 WeakPolarHBondContact O-CB 3.24Å; L284-L288 PolarHBondContact O-N 3.13Å; A286-L288 PolarHBondContact O-N 2.85Å; L288-I290 HydrophobicContact CB-CD1 3.79Å; L288-I290 HydrophobicContact CB-CG1 3.81Å; L288-I290 WeakPolarHBondContact O-CD1 3.45Å; L288-I290 PolarHBondContact O-N 2.92Å; L288-I290 VanDerWaalsContact O-N 3.16Å
289	L	93.4	Very high	89.5	Confident	21 Å²	21	31.5 Å²	31.5	11%	0.11	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.3	43.2	173.4	-48.1	177	0	0	0	113.2	N129 T256 I267 I285 A286 Y677	N129-L289 WeakPolarHBondContact CB-O 3.46Å; N129-L289 PolarHBondContact ND2-O 3.24Å; N129-L289 VanDerWaalsContact ND2-O 3.14Å; T256-L289 HydrophobicContact CG2-CD1 3.89Å; I267-L289 HydrophobicContact CD1-CB 3.88Å; I267-L289 HydrophobicContact CD1-CD1 4.37Å; I267-L289 HydrophobicContact CD1-CG 4.42Å; I285-L289 PolarHBondContact O-N 3.37Å; I285-L289 VanDerWaalsContact O-N 3.15Å; A286-L289 PolarHBondContact O-N 2.89Å; L289-Y677 HydrophobicContact CB-CD1 3.71Å; L289-Y677 HydrophobicContact CB-CD2 4.46Å; L289-Y677 HydrophobicContact CB-CE1 3.87Å; L289-Y677 HydrophobicContact CB-CG 4.01Å; L289-Y677 HydrophobicContact CD1-CE1 4.47Å; L289-Y677 HydrophobicContact CD2-CD2 4Å; L289-Y677 HydrophobicContact CD2-CE1 4.28Å; L289-Y677 HydrophobicContact CD2-CE2 3.73Å; L289-Y677 HydrophobicContact CD2-CG 4.41Å; L289-Y677 HydrophobicContact CG-CE1 4.43Å
290	I	94.1	Very high	89.4	Confident	0 Å²	0	26 Å²	26	0%	0	15%	0.154	C	C	.	.			trans	-82.1	127.3	-170.7	-57.9	-61.8	0	0	0	110.8	L131 I267 A269 I285 L288 H292 Y677	L131-I290 HydrophobicContact CB-CD1 4.14Å; L131-I290 HydrophobicContact CB-CG1 4.23Å; L131-I290 HydrophobicContact CB-CG2 3.78Å; I267-I290 HydrophobicContact CG2-CD1 4.09Å; A269-I290 HydrophobicContact CB-CD1 3.91Å; I285-I290 HydrophobicContact CB-CB 4.34Å; I285-I290 HydrophobicContact CG1-CB 4.16Å; I285-I290 HydrophobicContact CG1-CG2 4.31Å; I285-I290 HydrophobicContact CG2-CB 4.25Å; I285-I290 PolarHBondContact O-N 3.42Å; L288-I290 HydrophobicContact CB-CD1 3.79Å; L288-I290 HydrophobicContact CB-CG1 3.81Å; L288-I290 WeakPolarHBondContact O-CD1 3.45Å; L288-I290 PolarHBondContact O-N 2.92Å; L288-I290 VanDerWaalsContact O-N 3.16Å; I290-H292 WeakPolarHBondContact CG2-O 3.25Å; I290-Y677 WeakPolarHBondContact O-CB 3.38Å; I290-Y677 PolarHBondContact O-N 2.88Å
291	S	92.1	Very high	89.3	Confident	24 Å²	24	29.1 Å²	29.1	17%	0.168	18%	0.178	C	C	.	.			trans	-104.2	-13.2	177.6	61.8	0	0	0	0	113.7	N129 Y677 N680	N129-S291 PolarHBondContact N-OG 3.23Å; N129-S291 VanDerWaalsContact N-OG 3.14Å; N129-S291 PolarHBondContact O-N 3.48Å; N129-S291 PolarHBondContact O-OG 2.87Å; N129-S291 VanDerWaalsContact O-OG 3.1Å; S291-Y677 WeakPolarHBondContact CB-O 3.3Å; S291-N680 PolarHBondContact OG-OD1 3.23Å
292	H	92.1	Very high	89.3	Confident	17 Å²	17	31.3 Å²	31.3	8%	0.079	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	145.2	-177.7	-169.2	69.3	0	0	0	112.1	K128 N129 T130 L131 I290 E294	K128-H292 HydrophobicContact CB-CB 3.89Å; K128-H292 HydrophobicContact CD-CB 3.67Å; K128-H292 HydrophobicContact CG-CB 4.44Å; N129-H292 PolarHBondContact O-N 2.79Å; N129-H292 VanDerWaalsContact O-N 3.09Å; T130-H292 WeakPolarHBondContact CA-O 3.45Å; L131-H292 PolarHBondContact N-O 2.98Å; I290-H292 WeakPolarHBondContact CG2-O 3.25Å; H292-E294 IonicContact CD2-OE1 3.13Å; H292-E294 IonicContact CE1-OE1 3.67Å; H292-E294 IonicContact NE2-OE1 2.74Å; H292-E294 PolarHBondContact NE2-OE1 2.92Å
293	L	92.2	Very high	89	Confident	10 Å²	10	28.8 Å²	28.8	5%	0.052	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	111.4	-179.9	169.1	60.1	0	0	0	110.8	L131 L295 Y671 L674 F676	L131-L293 HydrophobicContact CB-CD1 4.16Å; L131-L293 HydrophobicContact CD2-CD1 4.03Å; L131-L293 HydrophobicContact CG-CD1 3.95Å; L293-L295 HydrophobicContact CD1-CB 4.4Å; L293-L295 HydrophobicContact CG-CB 4.41Å; L293-Y671 HydrophobicContact CB-CE2 4.19Å; L293-Y671 HydrophobicContact CD2-CD2 4.35Å; L293-Y671 HydrophobicContact CD2-CE2 4.35Å; L293-L674 HydrophobicContact CD2-CD1 4.24Å; L293-F676 HydrophobicContact CB-CE1 3.85Å; L293-F676 HydrophobicContact CB-CZ 4.08Å
294	E	92	Very high	88.6	Confident	20 Å²	20	33.3 Å²	33.3	9%	0.093	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	93.2	170.4	-77.5	-62.1	151.4	0	0	110	I121 T130 L131 C133 H292 R296	I121-E294 HydrophobicContact CD1-CB 4.43Å; I121-E294 HydrophobicContact CG1-CB 4.04Å; I121-E294 HydrophobicContact CG1-CG 3.93Å; I121-E294 HydrophobicContact CG2-CB 4.42Å; I121-E294 HydrophobicContact CG2-CG 4.4Å; T130-E294 HydrophobicContact CG2-CB 4.21Å; T130-E294 HydrophobicContact CG2-CG 3.99Å; L131-E294 PolarHBondContact O-N 2.87Å; C133-E294 PolarHBondContact N-O 3.12Å; H292-E294 IonicContact CD2-OE1 3.13Å; H292-E294 IonicContact CE1-OE1 3.67Å; H292-E294 IonicContact NE2-OE1 2.74Å; H292-E294 PolarHBondContact NE2-OE1 2.92Å; E294-R296 IonicContact OE2-CZ 2.72Å; E294-R296 IonicContact OE2-NH1 3.47Å; E294-R296 PolarHBondContact OE2-NH1 3.38Å; E294-R296 IonicContact OE2-NH2 3.47Å; E294-R296 PolarHBondContact OE2-NH2 2.91Å
295	L	90.4	Very high	88.2	Confident	14 Å²	14	38 Å²	38	7%	0.073	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	131.1	174.6	-179.6	61.9	0	0	0	110.4	C133 L293 L665 L666	C133-L295 HydrophobicContact CB-CD1 3.54Å; L293-L295 HydrophobicContact CD1-CB 4.4Å; L293-L295 HydrophobicContact CG-CB 4.41Å; L295-L665 HydrophobicContact CD2-CB 3.65Å; L295-L665 HydrophobicContact CD2-CD1 4.1Å; L295-L666 HydrophobicContact CD2-CD2 4.02Å; L295-L666 HydrophobicContact CD2-CG 3.97Å; L295-L666 HydrophobicContact CG-CD2 4.18Å
296	R	87.7	Confident	87.6	Confident	43 Å²	43	41.8 Å²	41.8	16%	0.162	23%	0.234	C	C	.	.			trans	-133.6	156.3	162.1	-57.8	-67.1	-178.7	-70.5	-12.8	111.2	C133 L134 P135 E294 D302 V303	C133-R296 PolarHBondContact O-N 3.35Å; L134-R296 HydrophobicContact CD2-CB 3.8Å; L134-R296 HydrophobicContact CD2-CG 3.9Å; P135-R296 VanDerWaalsContact CD-O 3.27Å; P135-R296 WeakPolarHBondContact CD-O 3.38Å; E294-R296 IonicContact OE2-CZ 2.72Å; E294-R296 IonicContact OE2-NH1 3.47Å; E294-R296 PolarHBondContact OE2-NH1 3.38Å; E294-R296 IonicContact OE2-NH2 3.47Å; E294-R296 PolarHBondContact OE2-NH2 2.91Å; R296-D302 WeakPolarHBondContact CD-OD1 3.32Å; R296-D302 IonicContact CZ-OD2 3.24Å; R296-D302 IonicContact NE-OD1 2.77Å; R296-D302 IonicContact NE-OD2 2.87Å; R296-D302 PolarHBondContact NE-OD2 3.49Å; R296-D302 IonicContact NH2-OD2 3.49Å; R296-V303 HydrophobicContact CB-CG2 3.81Å; R296-V303 HydrophobicContact CG-CG2 4.05Å
297	T	82.8	Confident	86.7	Confident	15 Å²	15	40.5 Å²	40.5	9%	0.092	22%	0.22	C	C	.	.			trans	-112.1	166.9	168.9	50.9	0	0	0	0	110.2	T299 S300 V303 L666	T297-T299 WeakPolarHBondContact CB-OG1 3.25Å; T297-T299 PolarHBondContact O-N 3.07Å; T297-T299 PolarHBondContact OG1-OG1 2.99Å; T297-S300 PolarHBondContact N-OG 3.12Å; T297-S300 VanDerWaalsContact O-CB 3.27Å; T297-S300 WeakPolarHBondContact O-CB 3.47Å; T297-S300 PolarHBondContact O-N 3.36Å; T297-S300 VanDerWaalsContact O-N 3.12Å; T297-S300 PolarHBondContact O-OG 2.98Å; T297-S300 PolarHBondContact OG1-N 3.46Å; T297-S300 VanDerWaalsContact OG1-N 3.14Å; T297-S300 PolarHBondContact OG1-OG 3.19Å; T297-V303 WeakPolarHBondContact O-CB 3.49Å; T297-V303 WeakPolarHBondContact O-CG1 3.13Å; T297-L666 HydrophobicContact CG2-CD1 3.83Å
298	D	76.7	Confident	85.7	Confident	67 Å²	67	43 Å²	43	36%	0.358	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-27.8	164.2	54.9	-7.9	0	0	0	112.8	S300 T307	D298-S300 VanDerWaalsContact C-N 3.35Å; D298-T307 HydrophobicContact CB-CG2 4.14Å; D298-T307 PolarHBondContact O-OG1 3.46Å
299	T	79	Confident	84.5	Confident	89 Å²	89	50.4 Å²	50.4	55%	0.546	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-14.4	172.8	56.4	0	0	0	0	114.8	T297 R304	T297-T299 WeakPolarHBondContact CB-OG1 3.25Å; T297-T299 PolarHBondContact O-N 3.07Å; T297-T299 PolarHBondContact OG1-OG1 2.99Å; T299-R304 PolarHBondContact O-NE 3.2Å; T299-R304 PolarHBondContact O-NH2 3.47Å
300	S	85	Confident	83.4	Confident	18 Å²	18	51.4 Å²	51.4	13%	0.126	27%	0.268	C	S	.	.	S	Bend	trans	-64.8	139.4	-176.7	-65	0	0	0	0	111.9	T297 D298 D302 V303 R304	T297-S300 PolarHBondContact N-OG 3.12Å; T297-S300 VanDerWaalsContact O-CB 3.27Å; T297-S300 WeakPolarHBondContact O-CB 3.47Å; T297-S300 PolarHBondContact O-N 3.36Å; T297-S300 VanDerWaalsContact O-N 3.12Å; T297-S300 PolarHBondContact O-OG 2.98Å; T297-S300 PolarHBondContact OG1-N 3.46Å; T297-S300 VanDerWaalsContact OG1-N 3.14Å; T297-S300 PolarHBondContact OG1-OG 3.19Å; D298-S300 VanDerWaalsContact C-N 3.35Å; S300-D302 VanDerWaalsContact C-N 3.29Å; S300-D302 PolarHBondContact O-N 2.85Å; S300-V303 PolarHBondContact O-N 3.32Å; S300-R304 WeakPolarHBondContact O-CB 3.14Å; S300-R304 PolarHBondContact O-N 3.4Å
301	A	85.3	Confident	82.6	Confident	82 Å²	82	56.7 Å²	56.7	68%	0.678	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-31.6	-167.1	0	0	0	0	0	114.3
302	D	86.4	Confident	82.2	Confident	46 Å²	46	58.9 Å²	58.9	25%	0.246	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-20	177.1	60.8	-17.8	0	0	0	113.6	Y117 R296 S300 Y306	Y117-D302 WeakPolarHBondContact CB-OD2 3.39Å; Y117-D302 WeakPolarHBondContact CD1-O 3.42Å; R296-D302 WeakPolarHBondContact CD-OD1 3.32Å; R296-D302 IonicContact CZ-OD2 3.24Å; R296-D302 IonicContact NE-OD1 2.77Å; R296-D302 IonicContact NE-OD2 2.87Å; R296-D302 PolarHBondContact NE-OD2 3.49Å; R296-D302 IonicContact NH2-OD2 3.49Å; S300-D302 VanDerWaalsContact C-N 3.29Å; S300-D302 PolarHBondContact O-N 2.85Å; D302-Y306 WeakPolarHBondContact O-CD2 3.4Å; D302-Y306 VanDerWaalsContact O-CE2 3.29Å; D302-Y306 WeakPolarHBondContact O-CE2 3.32Å
303	V	85.4	Confident	82.1	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-35.5	178.2	168.8	0	0	0	0	112.4	Y117 L138 R296 T297 S300 P305 Y306 T307	Y117-V303 HydrophobicContact CD1-CG2 4.18Å; Y117-V303 HydrophobicContact CD2-CG2 4.24Å; Y117-V303 HydrophobicContact CE1-CG2 4.48Å; Y117-V303 HydrophobicContact CG-CG2 4.07Å; L138-V303 HydrophobicContact CD1-CG1 3.48Å; L138-V303 VanDerWaalsContact CD1-CG1 3.48Å; L138-V303 HydrophobicContact CD1-CG2 4.22Å; L138-V303 HydrophobicContact CD2-CG1 3.9Å; L138-V303 HydrophobicContact CG-CG1 4.36Å; R296-V303 HydrophobicContact CB-CG2 3.81Å; R296-V303 HydrophobicContact CG-CG2 4.05Å; T297-V303 WeakPolarHBondContact O-CB 3.49Å; T297-V303 WeakPolarHBondContact O-CG1 3.13Å; S300-V303 PolarHBondContact O-N 3.32Å; V303-P305 VanDerWaalsContact C-N 3.33Å; V303-P305 VanDerWaalsContact O-N 3.14Å; V303-Y306 WeakPolarHBondContact O-CA 3.22Å; V303-Y306 WeakPolarHBondContact O-CB 3.36Å; V303-Y306 PolarHBondContact O-N 2.98Å; V303-T307 HydrophobicContact CG1-CG2 3.75Å
304	R	82.6	Confident	82	Confident	151 Å²	151	63.1 Å²	63.1	57%	0.57	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-49.5	-37.6	-173.8	-164	-175.2	-57.5	165.7	2.2	115.4	T299 S300 Y306 T307	T299-R304 PolarHBondContact O-NE 3.2Å; T299-R304 PolarHBondContact O-NH2 3.47Å; S300-R304 WeakPolarHBondContact O-CB 3.14Å; S300-R304 PolarHBondContact O-N 3.4Å; R304-Y306 PolarHBondContact O-N 3.45Å; R304-T307 WeakPolarHBondContact CA-OG1 3.38Å; R304-T307 PolarHBondContact O-N 2.95Å; R304-T307 PolarHBondContact O-OG1 3Å
305	P	84	Confident	82.1	Confident	100 Å²	100	62.9 Å²	62.9	65%	0.649	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-64.2	-19.9	175.8	-22.8	35.2	0	0	0	114.4	V303	V303-P305 VanDerWaalsContact C-N 3.33Å; V303-P305 VanDerWaalsContact O-N 3.14Å
306	Y	79.2	Confident	82.2	Confident	80 Å²	80	65.1 Å²	65.1	31%	0.314	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-105.7	5.3	-174.2	-49.6	-84.2	0	0	0	113.2	R115 Y117 D302 V303 R304	R115-Y306 HydrophobicContact CB-CE1 4.29Å; R115-Y306 HydrophobicContact CB-CE2 4.43Å; R115-Y306 HydrophobicContact CG-CD1 4.13Å; R115-Y306 HydrophobicContact CG-CE1 3.68Å; Y117-Y306 HydrophobicContact CD1-CD2 4.09Å; Y117-Y306 HydrophobicContact CD1-CE2 4.11Å; Y117-Y306 AromaticContact CE1-CD2 3.63Å; Y117-Y306 HydrophobicContact CE1-CD2 3.63Å; Y117-Y306 AromaticContact CE1-CE2 3.99Å; Y117-Y306 HydrophobicContact CE1-CE2 3.99Å; Y117-Y306 HydrophobicContact CE1-CG 4.1Å; D302-Y306 WeakPolarHBondContact O-CD2 3.4Å; D302-Y306 VanDerWaalsContact O-CE2 3.29Å; D302-Y306 WeakPolarHBondContact O-CE2 3.32Å; V303-Y306 WeakPolarHBondContact O-CA 3.22Å; V303-Y306 WeakPolarHBondContact O-CB 3.36Å; V303-Y306 PolarHBondContact O-N 2.98Å; R304-Y306 PolarHBondContact O-N 3.45Å
307	T	74.3	Confident	82.5	Confident	28 Å²	28	63.5 Å²	63.5	17%	0.172	34%	0.341	C	S	.	.			trans	-124.4	133.5	179.7	49.8	0	0	0	0	110.8	L138 D298 V303 R304	L138-T307 HydrophobicContact CD2-CG2 3.87Å; D298-T307 HydrophobicContact CB-CG2 4.14Å; D298-T307 PolarHBondContact O-OG1 3.46Å; V303-T307 HydrophobicContact CG1-CG2 3.75Å; R304-T307 WeakPolarHBondContact CA-OG1 3.38Å; R304-T307 PolarHBondContact O-N 2.95Å; R304-T307 PolarHBondContact O-OG1 3Å
308	Q	70.8	Confident	83	Confident	79 Å²	79	66.3 Å²	66.3	37%	0.369	36%	0.359	S	S	.	.			trans	-92.3	152.5	168.6	-65.2	-175.9	4.4	0	0	110.6	R310 G631 K633 R634	Q308-R310 PolarHBondContact O-N 3.14Å; Q308-G631 PolarHBondContact N-O 3Å; Q308-K633 VanDerWaalsContact NE2-C 3.27Å; Q308-K633 PolarHBondContact NE2-O 3.44Å; Q308-K633 VanDerWaalsContact OE1-C 3.25Å; Q308-K633 PolarHBondContact OE1-O 2.94Å; Q308-R634 PolarHBondContact OE1-O 3.01Å
309	H	68.3	Low	83.6	Confident	154 Å²	154	63.7 Å²	63.7	71%	0.713	35%	0.345	S	S	*	.			trans	-58.1	137.3	177.9	-166.4	-78.4	0	0	0	110.9	L635	H309-L635 HydrophobicContact CB-CD2 4.36Å; H309-L635 WeakPolarHBondContact O-CD2 3.3Å
310	R	72.4	Confident	84.2	Confident	43 Å²	43	60.8 Å²	60.8	16%	0.162	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	135.7	174.7	-66	178.3	176.5	121.6	-1.7	109.3	Q308 Q627 T630 G636	Q308-R310 PolarHBondContact O-N 3.14Å; R310-Q627 VanDerWaalsContact CZ-O 3.23Å; R310-Q627 PolarHBondContact NE-O 3.31Å; R310-Q627 PolarHBondContact NH2-O 3.02Å; R310-T630 PolarHBondContact NE-O 2.81Å; R310-T630 VanDerWaalsContact NE-O 3.14Å; R310-T630 PolarHBondContact NH2-O 3.16Å; R310-G636 WeakPolarHBondContact CA-O 3.46Å
311	E	77.1	Confident	84.4	Confident	111 Å²	111	65.7 Å²	65.7	52%	0.519	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	111.8	174.1	-174.3	170.8	-138.5	0	0	108.7	G636 R637 I638	E311-G636 PolarHBondContact N-O 3.42Å; E311-R637 HydrophobicContact CB-CG 4.44Å; E311-I638 PolarHBondContact O-N 3.36Å
312	L	83.1	Confident	84.6	Confident	70 Å²	70	66.5 Å²	66.5	37%	0.366	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	111.9	172.5	-178.8	66.3	0	0	0	108.9	L623 I638 V640 I655	L312-L623 HydrophobicContact CD1-CD1 4.49Å; L312-I638 WeakPolarHBondContact CA-O 3.44Å; L312-I638 HydrophobicContact CD1-CB 4.07Å; L312-I638 HydrophobicContact CD1-CG2 3.78Å; L312-V640 HydrophobicContact CD1-CG2 4.09Å; L312-I655 HydrophobicContact CD2-CD1 3.99Å
313	E	88.9	Confident	84.9	Confident	55 Å²	55	64.6 Å²	64.6	26%	0.257	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	110	-173.7	-172	-170	159.1	0	0	109.8	V315 R637 I638 V639 V640	E313-V315 HydrophobicContact CG-CG2 3.83Å; E313-V315 WeakPolarHBondContact OE1-CG2 3.44Å; E313-R637 IonicContact OE1-NH2 3.61Å; E313-R637 PolarHBondContact OE1-NH2 2.97Å; E313-R637 IonicContact OE2-CZ 3.95Å; E313-R637 IonicContact OE2-NE 3.37Å; E313-R637 PolarHBondContact OE2-NE 3.31Å; E313-R637 IonicContact OE2-NH2 3.23Å; E313-R637 PolarHBondContact OE2-NH2 2.63Å; E313-I638 PolarHBondContact N-O 2.72Å; E313-V639 HydrophobicContact CB-CG1 4.42Å; E313-V639 HydrophobicContact CB-CG2 4.35Å; E313-V639 CarbonylContact O-C 3.59Å; E313-V639 WeakPolarHBondContact O-CA 3.5Å; E313-V640 PolarHBondContact O-N 3.37Å
314	A	90.5	Very high	85.2	Confident	60 Å²	60	66.8 Å²	66.8	50%	0.496	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	111.2	171.1	0	0	0	0	0	109.4	L642	A314-L642 HydrophobicContact CB-CD1 4.02Å
315	V	93.5	Very high	85.8	Confident	16 Å²	16	65.9 Å²	65.9	10%	0.097	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	101.8	179.9	174.2	0	0	0	0	108.5	E313 V317 K485 V639 V640 L641 L642	E313-V315 HydrophobicContact CG-CG2 3.83Å; E313-V315 WeakPolarHBondContact OE1-CG2 3.44Å; V315-V317 HydrophobicContact CG1-CG2 4.1Å; V315-K485 HydrophobicContact CG1-CD 4.29Å; V315-K485 VanDerWaalsContact CG1-CE 3.44Å; V315-K485 HydrophobicContact CG1-CG 3.9Å; V315-V639 HydrophobicContact CB-CG1 4.14Å; V315-V639 HydrophobicContact CG2-CG1 3.48Å; V315-V639 VanDerWaalsContact CG2-CG1 3.48Å; V315-V640 PolarHBondContact N-O 3.07Å; V315-L641 HydrophobicContact CB-CD2 3.99Å; V315-L641 HydrophobicContact CG1-CD2 3.92Å; V315-L642 PolarHBondContact O-N 2.83Å
316	V	93.6	Very high	86.2	Confident	61 Å²	61	61.4 Å²	61.4	37%	0.37	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	129.8	172.3	-173.4	0	0	0	0	109.1	L642 E644 E648	V316-L642 CarbonylContact C-O 3.55Å; V316-L642 WeakPolarHBondContact CA-O 3.48Å; V316-E644 HydrophobicContact CG1-CB 3.88Å; V316-E644 HydrophobicContact CG1-CG 4.29Å; V316-E648 HydrophobicContact CG2-CG 3.94Å
317	V	93.9	Very high	86.8	Confident	9 Å²	9	60.9 Å²	60.9	6%	0.055	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	119.1	-177.9	-177.2	0	0	0	0	108.3	V315 P481 K482 K485 L641 L642 T643 E644	V315-V317 HydrophobicContact CG1-CG2 4.1Å; V317-P481 HydrophobicContact CG1-CB 3.88Å; V317-K482 HydrophobicContact CB-CG 4.14Å; V317-K482 HydrophobicContact CG1-CG 4.26Å; V317-K482 HydrophobicContact CG2-CG 4.19Å; V317-K485 HydrophobicContact CG2-CB 4.24Å; V317-K485 HydrophobicContact CG2-CG 4.11Å; V317-L641 HydrophobicContact CG2-CD2 4.32Å; V317-L642 PolarHBondContact N-O 3.47Å; V317-T643 WeakPolarHBondContact O-CA 3.42Å; V317-E644 PolarHBondContact O-N 2.77Å; V317-E644 VanDerWaalsContact O-N 3.12Å
318	P	93.6	Very high	87.7	Confident	73 Å²	73	63.2 Å²	63.2	47%	0.474	33%	0.332	S	S	.	.			trans	-70.2	148.5	174.9	29.7	-34.6	0	0	0	110.4	G320	P318-G320 PolarHBondContact O-N 3.08Å; P318-G320 VanDerWaalsContact O-N 3.12Å
319	L	88.8	Confident	88.7	Confident	13 Å²	13	61.1 Å²	61.1	7%	0.068	32%	0.323	C	S	.	.			trans	-59.2	-23.3	177.7	-76.1	168.6	0	0	0	113.7	L323 V404 P481 T643	L319-L323 HydrophobicContact CB-CB 4.14Å; L319-L323 HydrophobicContact CD2-CB 4.14Å; L319-L323 HydrophobicContact CD2-CD1 3.82Å; L319-L323 WeakPolarHBondContact O-CB 3.04Å; L319-L323 WeakPolarHBondContact O-CD1 3.33Å; L319-V404 HydrophobicContact CD2-CG1 4.46Å; L319-V404 HydrophobicContact CD2-CG2 4.5Å; L319-P481 WeakPolarHBondContact O-CG 3.43Å; L319-T643 HydrophobicContact CD2-CG2 3.66Å; L319-T643 HydrophobicContact CG-CG2 3.78Å
320	G	90.5	Very high	89.9	Confident	27 Å²	27	53.9 Å²	53.9	28%	0.278	29%	0.289	S	S	.	.	H	α-helix	trans	71.4	170	-170.3	0	0	0	0	0	112.9	P318 E322 T324	P318-G320 PolarHBondContact O-N 3.08Å; P318-G320 VanDerWaalsContact O-N 3.12Å; G320-E322 VanDerWaalsContact C-N 3.27Å; G320-E322 PolarHBondContact O-N 2.87Å; G320-T324 VanDerWaalsContact O-CB 3.31Å; G320-T324 WeakPolarHBondContact O-CB 3.31Å; G320-T324 PolarHBondContact O-N 3.19Å; G320-T324 PolarHBondContact O-OG1 3.48Å
321	P	91.3	Very high	90.8	Very high	121 Å²	121	52.1 Å²	52.1	79%	0.786	28%	0.283	S	S	*	.	H	α-helix	trans	-65.5	-32.8	-173	26.4	-34.7	0	0	0	112.5	T324 R325	P321-T324 PolarHBondContact O-N 3.48Å; P321-R325 PolarHBondContact O-N 2.9Å
322	E	89.2	Confident	91.5	Very high	100 Å²	100	50.5 Å²	50.5	47%	0.467	28%	0.275	S	S	.	.	H	α-helix	trans	-78.1	-48.5	-169.6	-156.8	-175.6	-151.6	0	0	112.5	G320 T324 R325 Y326 R448	G320-E322 VanDerWaalsContact C-N 3.27Å; G320-E322 PolarHBondContact O-N 2.87Å; E322-T324 PolarHBondContact O-N 2.88Å; E322-R325 WeakPolarHBondContact O-CB 3.26Å; E322-R325 PolarHBondContact O-N 3.21Å; E322-R325 VanDerWaalsContact O-N 3.16Å; E322-Y326 WeakPolarHBondContact O-CD2 3.31Å; E322-Y326 PolarHBondContact O-N 3.04Å; E322-R448 IonicContact OE1-CZ 3.18Å; E322-R448 IonicContact OE1-NH1 2.77Å; E322-R448 PolarHBondContact OE1-NH1 2.97Å; E322-R448 IonicContact OE1-NH2 2.74Å; E322-R448 IonicContact OE2-CZ 2.86Å; E322-R448 IonicContact OE2-NH1 3.72Å; E322-R448 PolarHBondContact OE2-NH1 3.23Å; E322-R448 IonicContact OE2-NH2 3.6Å; E322-R448 PolarHBondContact OE2-NH2 2.97Å
323	L	91.3	Very high	92	Very high	6 Å²	6	47.1 Å²	47.1	3%	0.031	26%	0.258	C	S	.	.	H	α-helix	trans	-63	-34.2	170.3	-66.2	-178.9	0	0	0	111.7	L319 R325 Y326 R327 L403 L408 H480	L319-L323 HydrophobicContact CB-CB 4.14Å; L319-L323 HydrophobicContact CD2-CB 4.14Å; L319-L323 HydrophobicContact CD2-CD1 3.82Å; L319-L323 WeakPolarHBondContact O-CB 3.04Å; L319-L323 WeakPolarHBondContact O-CD1 3.33Å; L323-R325 VanDerWaalsContact C-N 3.27Å; L323-R325 PolarHBondContact O-N 3.18Å; L323-Y326 PolarHBondContact O-N 2.68Å; L323-R327 WeakPolarHBondContact O-CB 3.39Å; L323-R327 PolarHBondContact O-N 2.92Å; L323-L403 HydrophobicContact CD2-CD1 3.79Å; L323-L408 HydrophobicContact CD2-CD1 3.68Å; L323-L408 HydrophobicContact CD2-CD2 4.43Å; L323-L408 HydrophobicContact CD2-CG 3.61Å; L323-H480 HydrophobicContact CD1-CB 4.43Å; L323-H480 WeakPolarHBondContact CD1-CD2 3.38Å
324	T	93.1	Very high	92.1	Very high	45 Å²	45	44.5 Å²	44.5	28%	0.276	25%	0.245	S	C	.	.	H	α-helix	trans	-61.1	-36.6	175.6	-59.2	0	0	0	0	111.5	G320 P321 E322 N328	G320-T324 VanDerWaalsContact O-CB 3.31Å; G320-T324 WeakPolarHBondContact O-CB 3.31Å; G320-T324 PolarHBondContact O-N 3.19Å; G320-T324 PolarHBondContact O-OG1 3.48Å; P321-T324 PolarHBondContact O-N 3.48Å; E322-T324 PolarHBondContact O-N 2.88Å; T324-N328 WeakPolarHBondContact O-CB 3.49Å; T324-N328 PolarHBondContact O-N 3.46Å; T324-N328 PolarHBondContact O-ND2 2.98Å; T324-N328 PolarHBondContact O-OD1 3.3Å
325	R	93.5	Very high	92.2	Very high	132 Å²	132	46.3 Å²	46.3	50%	0.498	24%	0.239	S	C	.	.	H	α-helix	trans	-61	-54.2	171.2	171.9	-176.7	166.9	158	2	112.1	P321 E322 L323 R327 N328 Q329 E444	P321-R325 PolarHBondContact O-N 2.9Å; E322-R325 WeakPolarHBondContact O-CB 3.26Å; E322-R325 PolarHBondContact O-N 3.21Å; E322-R325 VanDerWaalsContact O-N 3.16Å; L323-R325 VanDerWaalsContact C-N 3.27Å; L323-R325 PolarHBondContact O-N 3.18Å; R325-R327 VanDerWaalsContact C-N 3.33Å; R325-R327 PolarHBondContact O-N 2.94Å; R325-N328 PolarHBondContact O-N 2.97Å; R325-Q329 WeakPolarHBondContact O-CG 3.49Å; R325-Q329 PolarHBondContact O-N 3.12Å; R325-E444 IonicContact CZ-OE1 3Å; R325-E444 IonicContact CZ-OE2 2.84Å; R325-E444 IonicContact NE-OE1 3.18Å; R325-E444 PolarHBondContact NE-OE1 3.42Å; R325-E444 IonicContact NE-OE2 2.75Å; R325-E444 PolarHBondContact NE-OE2 3.26Å; R325-E444 IonicContact NH1-OE1 2.72Å; R325-E444 IonicContact NH2-OE1 3.01Å; R325-E444 PolarHBondContact NH2-OE1 2.71Å; R325-E444 IonicContact NH2-OE2 2.74Å; R325-E444 PolarHBondContact NH2-OE2 3.24Å
326	Y	92.4	Very high	92.1	Very high	7 Å²	7	49.7 Å²	49.7	3%	0.027	26%	0.255	C	S	.	.	H	α-helix	trans	-62.8	-39.1	179.5	-76.3	-85.1	0	0	0	112.3	E322 L323 Q329 L330 L408 L441 E444 L445	E322-Y326 WeakPolarHBondContact O-CD2 3.31Å; E322-Y326 PolarHBondContact O-N 3.04Å; L323-Y326 PolarHBondContact O-N 2.68Å; Y326-Q329 PolarHBondContact O-N 3.18Å; Y326-L330 WeakPolarHBondContact O-CB 3.42Å; Y326-L330 PolarHBondContact O-N 3.41Å; Y326-L408 HydrophobicContact CD1-CD2 3.82Å; Y326-L408 HydrophobicContact CD2-CD1 4.01Å; Y326-L408 HydrophobicContact CD2-CD2 3.81Å; Y326-L408 HydrophobicContact CE1-CD2 4.18Å; Y326-L408 HydrophobicContact CE2-CD1 4.04Å; Y326-L408 HydrophobicContact CE2-CD2 4.22Å; Y326-L408 HydrophobicContact CG-CD2 3.61Å; Y326-L441 HydrophobicContact CD1-CD1 4.29Å; Y326-E444 HydrophobicContact CE1-CB 4.32Å; Y326-E444 HydrophobicContact CE1-CG 4.27Å; Y326-E444 WeakPolarHBondContact OH-CG 3.28Å; Y326-E444 PolarHBondContact OH-OE1 3.49Å; Y326-L445 HydrophobicContact CD1-CB 4.48Å; Y326-L445 HydrophobicContact CD1-CD1 4.1Å; Y326-L445 HydrophobicContact CD1-CG 4.41Å; Y326-L445 HydrophobicContact CE1-CB 3.84Å; Y326-L445 HydrophobicContact CE1-CD1 4.24Å; Y326-L445 HydrophobicContact CE1-CG 4.05Å
327	R	92.9	Very high	92	Very high	69 Å²	69	46.8 Å²	46.8	26%	0.26	24%	0.238	S	C	.	.	H	α-helix	trans	-58.4	-48.9	174.8	178.9	-165.5	158	-162.2	-9.2	110.4	L323 R325 L330 I331 L400 L403 V404	L323-R327 WeakPolarHBondContact O-CB 3.39Å; L323-R327 PolarHBondContact O-N 2.92Å; R325-R327 VanDerWaalsContact C-N 3.33Å; R325-R327 PolarHBondContact O-N 2.94Å; R327-L330 PolarHBondContact O-N 3.38Å; R327-I331 HydrophobicContact CG-CD1 3.87Å; R327-I331 VanDerWaalsContact O-CG1 3.26Å; R327-I331 WeakPolarHBondContact O-CG1 3.41Å; R327-I331 PolarHBondContact O-N 2.94Å; R327-L400 HydrophobicContact CG-CD1 3.79Å; R327-L403 HydrophobicContact CB-CD2 4.18Å; R327-V404 HydrophobicContact CG-CG2 4.38Å
328	N	93.3	Very high	91.9	Very high	77 Å²	77	46.4 Å²	46.4	41%	0.412	24%	0.235	S	C	.	.	H	α-helix	trans	-66	-44.9	-179.7	-68	-4.8	0	0	0	111.3	T324 R325 L330 I331 E332	T324-N328 WeakPolarHBondContact O-CB 3.49Å; T324-N328 PolarHBondContact O-N 3.46Å; T324-N328 PolarHBondContact O-ND2 2.98Å; T324-N328 PolarHBondContact O-OD1 3.3Å; R325-N328 PolarHBondContact O-N 2.97Å; N328-L330 VanDerWaalsContact C-N 3.29Å; N328-L330 PolarHBondContact O-N 3.04Å; N328-I331 PolarHBondContact O-N 3.41Å; N328-E332 WeakPolarHBondContact O-CG 3.28Å; N328-E332 PolarHBondContact O-N 3.1Å
329	Q	92.2	Very high	91.8	Very high	35 Å²	35	46 Å²	46	16%	0.164	23%	0.229	C	C	.	.	H	α-helix	trans	-54.5	-44.4	173.3	-73.5	175.9	-11.3	0	0	111.8	R325 Y326 E332 C333 L441 E444	R325-Q329 WeakPolarHBondContact O-CG 3.49Å; R325-Q329 PolarHBondContact O-N 3.12Å; Y326-Q329 PolarHBondContact O-N 3.18Å; Q329-E332 PolarHBondContact O-N 3.43Å; Q329-C333 PolarHBondContact O-N 3.41Å; Q329-C333 PolarHBondContact O-SG 3.08Å; Q329-L441 HydrophobicContact CB-CD1 3.63Å; Q329-E444 PolarHBondContact NE2-OE2 2.74Å
330	L	92	Very high	91.9	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-70.2	-35.1	179.4	-174	57.2	0	0	0	112.6	Y326 R327 N328 C333 I334 L396 L400 L403 L411 L441	Y326-L330 WeakPolarHBondContact O-CB 3.42Å; Y326-L330 PolarHBondContact O-N 3.41Å; R327-L330 PolarHBondContact O-N 3.38Å; N328-L330 VanDerWaalsContact C-N 3.29Å; N328-L330 PolarHBondContact O-N 3.04Å; L330-C333 WeakPolarHBondContact O-CB 3.28Å; L330-C333 PolarHBondContact O-N 3.31Å; L330-I334 HydrophobicContact CG-CD1 4.35Å; L330-I334 WeakPolarHBondContact O-CD1 3.32Å; L330-I334 WeakPolarHBondContact O-CG1 3.18Å; L330-I334 PolarHBondContact O-N 2.85Å; L330-I334 VanDerWaalsContact O-N 3.08Å; L330-L396 HydrophobicContact CD1-CD2 3.77Å; L330-L400 HydrophobicContact CB-CD1 4.49Å; L330-L400 HydrophobicContact CD2-CB 3.98Å; L330-L400 HydrophobicContact CD2-CD1 4.13Å; L330-L400 HydrophobicContact CG-CB 4.49Å; L330-L400 HydrophobicContact CG-CD1 4.39Å; L330-L403 HydrophobicContact CD2-CD2 4.27Å; L330-L411 HydrophobicContact CD2-CD2 4.28Å; L330-L441 HydrophobicContact CB-CD1 4.23Å; L330-L441 HydrophobicContact CD1-CD2 4.12Å
331	I	93.1	Very high	92	Very high	6 Å²	6	47.2 Å²	47.2	3%	0.031	23%	0.225	C	C	.	.	H	α-helix	trans	-61.5	-43.7	172.4	-73.6	167.5	0	0	0	111.2	R327 N328 C333 I334 R335 P355 E356 L400	R327-I331 HydrophobicContact CG-CD1 3.87Å; R327-I331 VanDerWaalsContact O-CG1 3.26Å; R327-I331 WeakPolarHBondContact O-CG1 3.41Å; R327-I331 PolarHBondContact O-N 2.94Å; N328-I331 PolarHBondContact O-N 3.41Å; I331-C333 VanDerWaalsContact C-N 3.25Å; I331-C333 PolarHBondContact O-N 2.96Å; I331-I334 PolarHBondContact O-N 3.33Å; I331-I334 VanDerWaalsContact O-N 3.08Å; I331-R335 PolarHBondContact O-N 3.2Å; I331-R335 VanDerWaalsContact O-N 3.12Å; I331-P355 HydrophobicContact CG1-CB 4.32Å; I331-P355 HydrophobicContact CG2-CB 4.29Å; I331-P355 HydrophobicContact CG2-CG 4.1Å; I331-E356 HydrophobicContact CD1-CB 4.07Å; I331-L400 HydrophobicContact CG1-CD1 4.07Å; I331-L400 HydrophobicContact CG1-CD2 4.03Å
332	E	91.7	Very high	91.9	Very high	77 Å²	77	47.4 Å²	47.4	36%	0.36	21%	0.21	S	C	.	.	H	α-helix	trans	-60.5	-36.6	174.3	-59.1	-49.8	150.3	0	0	112	N328 Q329 I334 R335	N328-E332 WeakPolarHBondContact O-CG 3.28Å; N328-E332 PolarHBondContact O-N 3.1Å; Q329-E332 PolarHBondContact O-N 3.43Å; E332-I334 VanDerWaalsContact C-N 3.3Å; E332-I334 PolarHBondContact O-N 3.17Å; E332-R335 PolarHBondContact O-N 3.47Å; E332-R335 IonicContact OE1-CZ 2.73Å; E332-R335 IonicContact OE1-NH1 3.2Å; E332-R335 PolarHBondContact OE1-NH1 3.38Å; E332-R335 IonicContact OE1-NH2 3.49Å; E332-R335 IonicContact OE2-CZ 2.83Å; E332-R335 IonicContact OE2-NE 3.91Å; E332-R335 IonicContact OE2-NH1 3.86Å; E332-R335 PolarHBondContact OE2-NH1 3.02Å
333	C	91.9	Very high	91.9	Very high	0 Å²	0	50 Å²	50	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-68.3	-27.8	176.1	-59.6	0	0	0	0	112.9	Q329 L330 I331 P337 P436 M438	Q329-C333 PolarHBondContact O-N 3.41Å; Q329-C333 PolarHBondContact O-SG 3.08Å; L330-C333 WeakPolarHBondContact O-CB 3.28Å; L330-C333 PolarHBondContact O-N 3.31Å; I331-C333 VanDerWaalsContact C-N 3.25Å; I331-C333 PolarHBondContact O-N 2.96Å; C333-P337 WeakPolarHBondContact O-CD 3.29Å; C333-P436 PolarHBondContact SG-O 3.43Å; C333-P436 VanDerWaalsContact SG-O 3.35Å; C333-M438 HydrophobicContact CB-CG 3.92Å; C333-M438 HydrophobicContact CB-SD 3.57Å; C333-M438 VanDerWaalsContact CB-SD 3.57Å
334	I	92.8	Very high	91.7	Very high	0 Å²	0	54 Å²	54	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-79.5	-32.3	177.3	-64.4	156.7	0	0	0	112.2	L330 I331 E332 M336 P337 L338 P355 V393 L396 L397 L400	L330-I334 HydrophobicContact CG-CD1 4.35Å; L330-I334 WeakPolarHBondContact O-CD1 3.32Å; L330-I334 WeakPolarHBondContact O-CG1 3.18Å; L330-I334 PolarHBondContact O-N 2.85Å; L330-I334 VanDerWaalsContact O-N 3.08Å; I331-I334 PolarHBondContact O-N 3.33Å; I331-I334 VanDerWaalsContact O-N 3.08Å; E332-I334 VanDerWaalsContact C-N 3.3Å; E332-I334 PolarHBondContact O-N 3.17Å; I334-M336 PolarHBondContact O-N 2.73Å; I334-P337 WeakPolarHBondContact O-CD 3.39Å; I334-P337 VanDerWaalsContact O-CG 3.3Å; I334-P337 WeakPolarHBondContact O-CG 3.45Å; I334-L338 VanDerWaalsContact O-CB 3.22Å; I334-L338 WeakPolarHBondContact O-CB 3.4Å; I334-L338 PolarHBondContact O-N 3.3Å; I334-L338 VanDerWaalsContact O-N 3.12Å; I334-P355 HydrophobicContact CB-CB 4.01Å; I334-P355 HydrophobicContact CB-CG 4.03Å; I334-P355 HydrophobicContact CD1-CB 4.07Å; I334-P355 HydrophobicContact CG2-CB 3.73Å; I334-P355 HydrophobicContact CG2-CG 3.76Å; I334-V393 HydrophobicContact CG2-CG1 4.48Å; I334-L396 HydrophobicContact CD1-CB 4.14Å; I334-L396 HydrophobicContact CG1-CB 3.44Å; I334-L396 VanDerWaalsContact CG1-CB 3.44Å; I334-L396 HydrophobicContact CG1-CD1 4.18Å; I334-L396 HydrophobicContact CG1-CG 4.4Å; I334-L397 HydrophobicContact CD1-CD2 4.23Å; I334-L397 HydrophobicContact CG2-CD2 4.38Å; I334-L400 HydrophobicContact CD1-CB 4.17Å; I334-L400 HydrophobicContact CD1-CD2 3.84Å
335	R	91.6	Very high	91.3	Very high	97 Å²	97	53.7 Å²	53.7	37%	0.366	24%	0.243	S	C	.	.	H	α-helix	trans	-57.4	-51.2	-179.5	-72.6	176.8	-176.4	154.8	5.8	112.2	I331 E332 L338 D339 P355	I331-R335 PolarHBondContact O-N 3.2Å; I331-R335 VanDerWaalsContact O-N 3.12Å; E332-R335 PolarHBondContact O-N 3.47Å; E332-R335 IonicContact OE1-CZ 2.73Å; E332-R335 IonicContact OE1-NH1 3.2Å; E332-R335 PolarHBondContact OE1-NH1 3.38Å; E332-R335 IonicContact OE1-NH2 3.49Å; E332-R335 IonicContact OE2-CZ 2.83Å; E332-R335 IonicContact OE2-NE 3.91Å; E332-R335 IonicContact OE2-NH1 3.86Å; E332-R335 PolarHBondContact OE2-NH1 3.02Å; R335-L338 CarbonylContact O-C 3.6Å; R335-L338 WeakPolarHBondContact O-CA 3.29Å; R335-L338 WeakPolarHBondContact O-CB 3.03Å; R335-L338 PolarHBondContact O-N 3.24Å; R335-D339 WeakPolarHBondContact O-CB 3.47Å; R335-D339 VanDerWaalsContact O-CG 3.26Å; R335-D339 PolarHBondContact O-N 2.9Å; R335-P355 HydrophobicContact CG-CG 4.27Å
336	M	90.6	Very high	90.9	Very high	88 Å²	88	47.7 Å²	47.7	43%	0.433	22%	0.222	S	C	.	.	H	α-helix	trans	-55.4	-41.2	-177.2	-76.4	-62.3	-57.8	0	0	116.4	I334 R340 L435 P436	I334-M336 PolarHBondContact O-N 2.73Å; M336-R340 VanDerWaalsContact O-CG 3.32Å; M336-R340 WeakPolarHBondContact O-CG 3.21Å; M336-R340 PolarHBondContact O-NE 2.9Å; M336-L435 HydrophobicContact CB-CD2 4.22Å; M336-P436 HydrophobicContact CG-CG 3.76Å
337	P	92.3	Very high	90.7	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-77.6	-32.1	169.8	28.2	-34.1	0	0	0	113.6	C333 I334 R340 L341 L392 V393 L396 L435	C333-P337 WeakPolarHBondContact O-CD 3.29Å; I334-P337 WeakPolarHBondContact O-CD 3.39Å; I334-P337 VanDerWaalsContact O-CG 3.3Å; I334-P337 WeakPolarHBondContact O-CG 3.45Å; P337-R340 PolarHBondContact O-N 2.75Å; P337-L341 WeakPolarHBondContact O-CG 3.33Å; P337-L341 PolarHBondContact O-N 2.91Å; P337-L392 HydrophobicContact CB-CB 4.12Å; P337-L392 HydrophobicContact CB-CD1 4.49Å; P337-L392 HydrophobicContact CG-CB 4.39Å; P337-V393 HydrophobicContact CB-CG2 3.87Å; P337-V393 HydrophobicContact CG-CG2 3.94Å; P337-L396 HydrophobicContact CG-CD1 4.34Å; P337-L435 HydrophobicContact CG-CD1 4.38Å; P337-L435 HydrophobicContact CG-CD2 4.48Å
338	L	92.2	Very high	89.7	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-66.3	-46.4	178.4	-170.6	76.1	0	0	0	112.4	I334 R335 R340 L341 Y342 L347 L353 P355 L358 I363 V393	I334-L338 VanDerWaalsContact O-CB 3.22Å; I334-L338 WeakPolarHBondContact O-CB 3.4Å; I334-L338 PolarHBondContact O-N 3.3Å; I334-L338 VanDerWaalsContact O-N 3.12Å; R335-L338 CarbonylContact O-C 3.6Å; R335-L338 WeakPolarHBondContact O-CA 3.29Å; R335-L338 WeakPolarHBondContact O-CB 3.03Å; R335-L338 PolarHBondContact O-N 3.24Å; L338-R340 VanDerWaalsContact C-N 3.25Å; L338-R340 PolarHBondContact O-N 3.26Å; L338-L341 WeakPolarHBondContact O-CB 3.46Å; L338-L341 PolarHBondContact O-N 3Å; L338-Y342 PolarHBondContact O-N 2.76Å; L338-L347 HydrophobicContact CD1-CD1 3.51Å; L338-L347 HydrophobicContact CG-CD1 4.14Å; L338-L353 HydrophobicContact CD2-CB 4.18Å; L338-L353 WeakPolarHBondContact CD2-O 3.14Å; L338-P355 HydrophobicContact CD2-CG 4.33Å; L338-L358 HydrophobicContact CD1-CD1 3.76Å; L338-L358 HydrophobicContact CD2-CD1 3.62Å; L338-L358 HydrophobicContact CG-CD1 4.36Å; L338-I363 HydrophobicContact CD1-CD1 4.15Å; L338-V393 HydrophobicContact CB-CG2 4.23Å; L338-V393 HydrophobicContact CD1-CG1 4.04Å; L338-V393 HydrophobicContact CD1-CG2 4.32Å
339	D	90.6	Very high	88.8	Confident	65 Å²	65	50 Å²	50	35%	0.348	24%	0.243	S	C	.	.	H	α-helix	trans	-60	-37.4	176.6	-64.9	-34.7	0	0	0	111.1	R335 L341 Y342 Q343	R335-D339 WeakPolarHBondContact O-CB 3.47Å; R335-D339 VanDerWaalsContact O-CG 3.26Å; R335-D339 PolarHBondContact O-N 2.9Å; D339-L341 VanDerWaalsContact C-N 3.32Å; D339-L341 PolarHBondContact O-N 2.9Å; D339-Y342 PolarHBondContact O-N 2.98Å; D339-Q343 VanDerWaalsContact O-CB 3.3Å; D339-Q343 WeakPolarHBondContact O-CB 3.16Å; D339-Q343 WeakPolarHBondContact O-CG 3.3Å; D339-Q343 PolarHBondContact O-N 2.83Å
340	R	91.3	Very high	88	Confident	65 Å²	65	49.1 Å²	49.1	25%	0.245	24%	0.24	C	C	.	.	H	α-helix	trans	-73.1	-18.5	176.4	-70.9	-176.8	-60.4	118.9	5.9	114	M336 P337 L338 R344 D389	M336-R340 VanDerWaalsContact O-CG 3.32Å; M336-R340 WeakPolarHBondContact O-CG 3.21Å; M336-R340 PolarHBondContact O-NE 2.9Å; P337-R340 PolarHBondContact O-N 2.75Å; L338-R340 VanDerWaalsContact C-N 3.25Å; L338-R340 PolarHBondContact O-N 3.26Å; R340-R344 VanDerWaalsContact O-CD 3.24Å; R340-R344 WeakPolarHBondContact O-CD 3.13Å; R340-R344 VanDerWaalsContact O-CG 3.27Å; R340-R344 WeakPolarHBondContact O-CG 3.32Å; R340-R344 PolarHBondContact O-NH1 3.37Å; R340-D389 IonicContact CZ-OD1 3.91Å; R340-D389 IonicContact CZ-OD2 3.53Å; R340-D389 IonicContact NH1-OD1 3.75Å; R340-D389 PolarHBondContact NH1-OD1 3.31Å; R340-D389 IonicContact NH1-OD2 2.67Å; R340-D389 PolarHBondContact NH1-OD2 2.93Å; R340-D389 IonicContact NH2-OD1 2.69Å; R340-D389 PolarHBondContact NH2-OD1 3.16Å
341	L	92.1	Very high	87.1	Confident	0 Å²	0	57 Å²	57	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-80.9	-45.4	167.3	-68.8	170.4	0	0	0	110.5	P337 L338 D339 R344 G345 A346 L347 I386 D389 F390 V393	P337-L341 WeakPolarHBondContact O-CG 3.33Å; P337-L341 PolarHBondContact O-N 2.91Å; L338-L341 WeakPolarHBondContact O-CB 3.46Å; L338-L341 PolarHBondContact O-N 3Å; D339-L341 VanDerWaalsContact C-N 3.32Å; D339-L341 PolarHBondContact O-N 2.9Å; L341-R344 PolarHBondContact O-N 2.8Å; L341-G345 PolarHBondContact O-N 3Å; L341-A346 HydrophobicContact CB-CB 4.39Å; L341-A346 HydrophobicContact CD2-CB 4.31Å; L341-A346 WeakPolarHBondContact O-CB 3.48Å; L341-A346 PolarHBondContact O-N 2.95Å; L341-L347 HydrophobicContact CB-CD1 3.57Å; L341-L347 HydrophobicContact CB-CG 3.85Å; L341-L347 HydrophobicContact CD1-CD1 4.18Å; L341-I386 HydrophobicContact CD2-CG2 3.93Å; L341-D389 HydrophobicContact CD2-CB 3.84Å; L341-D389 HydrophobicContact CG-CB 4.04Å; L341-F390 HydrophobicContact CD1-CD1 3.72Å; L341-F390 HydrophobicContact CD1-CE1 4.09Å; L341-F390 HydrophobicContact CD1-CG 4.14Å; L341-F390 HydrophobicContact CD2-CD1 4.12Å; L341-F390 HydrophobicContact CD2-CD2 3.83Å; L341-F390 HydrophobicContact CD2-CE1 4.26Å; L341-F390 HydrophobicContact CD2-CE2 4Å; L341-F390 HydrophobicContact CD2-CG 3.9Å; L341-F390 HydrophobicContact CD2-CZ 4.21Å; L341-V393 HydrophobicContact CD1-CB 4.46Å; L341-V393 HydrophobicContact CD1-CG2 3.89Å
342	Y	90.2	Very high	86.4	Confident	124 Å²	124	59 Å²	59	49%	0.486	28%	0.282	S	S	.	.	H	α-helix	trans	-62.5	-46.4	179.5	-177.9	-108	0	0	0	112.7	L338 D339 R344 G345 L347 L353	L338-Y342 PolarHBondContact O-N 2.76Å; D339-Y342 PolarHBondContact O-N 2.98Å; Y342-R344 PolarHBondContact O-N 3.29Å; Y342-R344 VanDerWaalsContact O-N 3.12Å; Y342-G345 PolarHBondContact O-N 2.99Å; Y342-L347 HydrophobicContact CD2-CB 4.35Å; Y342-L353 HydrophobicContact CD1-CD1 3.9Å; Y342-L353 HydrophobicContact CD2-CD1 3.61Å; Y342-L353 HydrophobicContact CD2-CD2 4.24Å; Y342-L353 HydrophobicContact CD2-CG 4.48Å; Y342-L353 HydrophobicContact CE1-CD1 4.2Å; Y342-L353 HydrophobicContact CE2-CD1 3.93Å; Y342-L353 HydrophobicContact CG-CD1 3.58Å
343	Q	88.6	Confident	86.1	Confident	155 Å²	155	57.5 Å²	57.5	72%	0.724	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-22	176.1	-73.5	168.7	11.8	0	0	113.8	D339	D339-Q343 VanDerWaalsContact O-CB 3.3Å; D339-Q343 WeakPolarHBondContact O-CB 3.16Å; D339-Q343 WeakPolarHBondContact O-CG 3.3Å; D339-Q343 PolarHBondContact O-N 2.83Å
344	R	86.9	Confident	85.8	Confident	90 Å²	90	63.2 Å²	63.2	34%	0.34	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	8.8	176.5	-64.6	177.4	-179.3	146.7	-16.6	113.1	R340 L341 Y342 A346 S385 I386 D389	R340-R344 VanDerWaalsContact O-CD 3.24Å; R340-R344 WeakPolarHBondContact O-CD 3.13Å; R340-R344 VanDerWaalsContact O-CG 3.27Å; R340-R344 WeakPolarHBondContact O-CG 3.32Å; R340-R344 PolarHBondContact O-NH1 3.37Å; L341-R344 PolarHBondContact O-N 2.8Å; Y342-R344 PolarHBondContact O-N 3.29Å; Y342-R344 VanDerWaalsContact O-N 3.12Å; R344-A346 PolarHBondContact O-N 3.19Å; R344-S385 PolarHBondContact NH2-OG 2.93Å; R344-I386 HydrophobicContact CB-CD1 4.37Å; R344-I386 VanDerWaalsContact CD-CG1 3.42Å; R344-D389 IonicContact CZ-OD2 3.2Å; R344-D389 IonicContact NH1-OD2 3.7Å; R344-D389 PolarHBondContact NH1-OD2 2.99Å; R344-D389 IonicContact NH2-OD2 2.8Å
345	G	85	Confident	85.5	Confident	38 Å²	38	63.3 Å²	63.3	39%	0.392	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.6	-1	-179.1	0	0	0	0	0	115.2	L341 Y342 L347 S348	L341-G345 PolarHBondContact O-N 3Å; Y342-G345 PolarHBondContact O-N 2.99Å; G345-L347 PolarHBondContact O-N 3.46Å; G345-L347 VanDerWaalsContact O-N 3.14Å; G345-S348 PolarHBondContact O-N 3.12Å; G345-S348 PolarHBondContact O-OG 3.42Å
346	A	85.6	Confident	85.2	Confident	7 Å²	7	61.8 Å²	61.8	6%	0.058	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-1.7	-172.6	0	0	0	0	0	114.7	L341 R344 W370 I386 F390	L341-A346 HydrophobicContact CB-CB 4.39Å; L341-A346 HydrophobicContact CD2-CB 4.31Å; L341-A346 WeakPolarHBondContact O-CB 3.48Å; L341-A346 PolarHBondContact O-N 2.95Å; R344-A346 PolarHBondContact O-N 3.19Å; A346-W370 HydrophobicContact CB-CD2 3.93Å; A346-W370 HydrophobicContact CB-CE3 3.52Å; A346-W370 HydrophobicContact CB-CH2 4.34Å; A346-W370 HydrophobicContact CB-CZ3 3.73Å; A346-I386 HydrophobicContact CB-CG2 4.25Å; A346-F390 HydrophobicContact CB-CE2 4.12Å; A346-F390 HydrophobicContact CB-CZ 3.84Å
347	L	86.9	Confident	84.8	Confident	2 Å²	2	63 Å²	63	1%	0.01	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-133.2	33.1	177	-64.2	174.6	0	0	0	111.6	L338 L341 Y342 G345 E349 C350 L353 I363 A366 F390	L338-L347 HydrophobicContact CD1-CD1 3.51Å; L338-L347 HydrophobicContact CG-CD1 4.14Å; L341-L347 HydrophobicContact CB-CD1 3.57Å; L341-L347 HydrophobicContact CB-CG 3.85Å; L341-L347 HydrophobicContact CD1-CD1 4.18Å; Y342-L347 HydrophobicContact CD2-CB 4.35Å; G345-L347 PolarHBondContact O-N 3.46Å; G345-L347 VanDerWaalsContact O-N 3.14Å; L347-E349 PolarHBondContact O-N 3.04Å; L347-C350 HydrophobicContact CB-CB 4.14Å; L347-C350 WeakPolarHBondContact O-CB 3.43Å; L347-C350 PolarHBondContact O-N 2.96Å; L347-L353 HydrophobicContact CB-CD2 4.42Å; L347-L353 HydrophobicContact CD1-CD2 4.28Å; L347-I363 HydrophobicContact CD2-CD1 3.81Å; L347-A366 HydrophobicContact CD2-CB 3.73Å; L347-F390 HydrophobicContact CD2-CE1 4.16Å
348	S	73.8	Confident	84.5	Confident	88 Å²	88	63.8 Å²	63.8	62%	0.615	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-25.8	-175.3	49.9	0	0	0	0	115.1	G345	G345-S348 PolarHBondContact O-N 3.12Å; G345-S348 PolarHBondContact O-OG 3.42Å
349	E	73.4	Confident	84	Confident	111 Å²	111	64 Å²	64	52%	0.519	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	3.2	177.1	-67.4	170.7	144.7	0	0	113.5	L347 Y351 K369	L347-E349 PolarHBondContact O-N 3.04Å; E349-Y351 VanDerWaalsContact O-CD2 3.31Å; E349-Y351 WeakPolarHBondContact O-CD2 3.49Å; E349-Y351 VanDerWaalsContact O-CE2 3.3Å; E349-Y351 WeakPolarHBondContact O-CE2 3.47Å; E349-Y351 PolarHBondContact O-N 3.5Å; E349-K369 IonicContact OE1-NZ 3.11Å; E349-K369 PolarHBondContact OE1-NZ 3.33Å; E349-K369 WeakPolarHBondContact OE2-CD 3.48Å; E349-K369 IonicContact OE2-NZ 3.67Å; E349-K369 PolarHBondContact OE2-NZ 3.41Å
350	C	76.2	Confident	83.8	Confident	16 Å²	16	62.6 Å²	62.6	11%	0.108	30%	0.295	C	S	.	.			trans	-95.5	87	-178.7	-67.2	0	0	0	0	111.7	L347 D352 L353	L347-C350 HydrophobicContact CB-CB 4.14Å; L347-C350 WeakPolarHBondContact O-CB 3.43Å; L347-C350 PolarHBondContact O-N 2.96Å; C350-D352 VanDerWaalsContact C-N 3.3Å; C350-D352 PolarHBondContact O-N 2.72Å; C350-L353 HydrophobicContact CB-CD2 3.82Å
351	Y	71.4	Confident	83.5	Confident	168 Å²	168	63 Å²	63	66%	0.659	30%	0.297	S	S	*	.	S	Bend	trans	-63.5	-27.3	-178.7	-57.8	-81.3	0	0	0	114.8	E349 Y1286	E349-Y351 VanDerWaalsContact O-CD2 3.31Å; E349-Y351 WeakPolarHBondContact O-CD2 3.49Å; E349-Y351 VanDerWaalsContact O-CE2 3.3Å; E349-Y351 WeakPolarHBondContact O-CE2 3.47Å; E349-Y351 PolarHBondContact O-N 3.5Å; Y351-Y1286 HydrophobicContact CD2-CE2 4.27Å; Y351-Y1286 AromaticContact CE2-CE2 3.7Å; Y351-Y1286 HydrophobicContact CE2-CE2 3.7Å; Y351-Y1286 PolarHBondContact OH-OH 2.9Å; Y351-Y1286 VanDerWaalsContact OH-OH 3.12Å
352	D	80.2	Confident	83.3	Confident	48 Å²	48	65 Å²	65	26%	0.257	31%	0.309	S	S	.	.			trans	-122.8	91.1	-178.7	-161.3	-25.2	0	0	0	111.3	C350 R354 K357 L358	C350-D352 VanDerWaalsContact C-N 3.3Å; C350-D352 PolarHBondContact O-N 2.72Å; D352-R354 PolarHBondContact O-N 2.86Å; D352-R354 VanDerWaalsContact O-N 3.1Å; D352-R354 WeakPolarHBondContact OD1-CB 3.36Å; D352-R354 IonicContact OD1-CZ 2.65Å; D352-R354 PolarHBondContact OD1-N 3.34Å; D352-R354 IonicContact OD1-NE 2.8Å; D352-R354 PolarHBondContact OD1-NE 2.82Å; D352-R354 IonicContact OD1-NH2 3.16Å; D352-R354 PolarHBondContact OD1-NH2 2.64Å; D352-R354 IonicContact OD2-CZ 3.12Å; D352-R354 IonicContact OD2-NE 3.37Å; D352-R354 PolarHBondContact OD2-NE 2.94Å; D352-R354 IonicContact OD2-NH2 3.78Å; D352-R354 PolarHBondContact OD2-NH2 2.84Å; D352-K357 WeakPolarHBondContact OD2-CD 3.48Å; D352-K357 WeakPolarHBondContact OD2-CE 3.22Å; D352-K357 IonicContact OD2-NZ 2.69Å; D352-K357 PolarHBondContact OD2-NZ 3.33Å; D352-L358 WeakPolarHBondContact O-CD2 3.5Å
353	L	84	Confident	83.4	Confident	44 Å²	44	59.1 Å²	59.1	23%	0.23	29%	0.286	C	S	.	.			trans	-77.2	18.5	-176.9	-62.4	171.7	0	0	0	114.1	L338 Y342 L347 C350 P355	L338-L353 HydrophobicContact CD2-CB 4.18Å; L338-L353 WeakPolarHBondContact CD2-O 3.14Å; Y342-L353 HydrophobicContact CD1-CD1 3.9Å; Y342-L353 HydrophobicContact CD2-CD1 3.61Å; Y342-L353 HydrophobicContact CD2-CD2 4.24Å; Y342-L353 HydrophobicContact CD2-CG 4.48Å; Y342-L353 HydrophobicContact CE1-CD1 4.2Å; Y342-L353 HydrophobicContact CE2-CD1 3.93Å; Y342-L353 HydrophobicContact CG-CD1 3.58Å; L347-L353 HydrophobicContact CB-CD2 4.42Å; L347-L353 HydrophobicContact CD1-CD2 4.28Å; C350-L353 HydrophobicContact CB-CD2 3.82Å; L353-P355 VanDerWaalsContact O-CD 3.32Å; L353-P355 WeakPolarHBondContact O-CD 3.48Å
354	R	86.3	Confident	83.4	Confident	120 Å²	120	53.3 Å²	53.3	45%	0.453	26%	0.26	S	S	.	.			trans	-75.1	118.3	176.7	-81.8	178.6	-74.5	-158	-7.8	111.3	D352 E356 K357 L358	D352-R354 PolarHBondContact O-N 2.86Å; D352-R354 VanDerWaalsContact O-N 3.1Å; D352-R354 WeakPolarHBondContact OD1-CB 3.36Å; D352-R354 IonicContact OD1-CZ 2.65Å; D352-R354 PolarHBondContact OD1-N 3.34Å; D352-R354 IonicContact OD1-NE 2.8Å; D352-R354 PolarHBondContact OD1-NE 2.82Å; D352-R354 IonicContact OD1-NH2 3.16Å; D352-R354 PolarHBondContact OD1-NH2 2.64Å; D352-R354 IonicContact OD2-CZ 3.12Å; D352-R354 IonicContact OD2-NE 3.37Å; D352-R354 PolarHBondContact OD2-NE 2.94Å; D352-R354 IonicContact OD2-NH2 3.78Å; D352-R354 PolarHBondContact OD2-NH2 2.84Å; R354-E356 HydrophobicContact CB-CG 4.42Å; R354-E356 WeakPolarHBondContact CD-OE1 3.5Å; R354-E356 PolarHBondContact O-N 3.1Å; R354-E356 VanDerWaalsContact O-N 3.12Å; R354-K357 HydrophobicContact CB-CB 4.28Å; R354-K357 PolarHBondContact O-N 3.08Å; R354-L358 PolarHBondContact O-N 2.98Å; R354-L358 VanDerWaalsContact O-N 3.07Å
355	P	85.5	Confident	83.5	Confident	3 Å²	3	53.6 Å²	53.6	2%	0.019	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-31.3	-179.7	-29	38.6	0	0	0	114.4	I331 I334 R335 L338 L353 K357 L397 L400	I331-P355 HydrophobicContact CG1-CB 4.32Å; I331-P355 HydrophobicContact CG2-CB 4.29Å; I331-P355 HydrophobicContact CG2-CG 4.1Å; I334-P355 HydrophobicContact CB-CB 4.01Å; I334-P355 HydrophobicContact CB-CG 4.03Å; I334-P355 HydrophobicContact CD1-CB 4.07Å; I334-P355 HydrophobicContact CG2-CB 3.73Å; I334-P355 HydrophobicContact CG2-CG 3.76Å; R335-P355 HydrophobicContact CG-CG 4.27Å; L338-P355 HydrophobicContact CD2-CG 4.33Å; L353-P355 VanDerWaalsContact O-CD 3.32Å; L353-P355 WeakPolarHBondContact O-CD 3.48Å; P355-K357 VanDerWaalsContact C-N 3.26Å; P355-K357 PolarHBondContact O-N 3.02Å; P355-L397 HydrophobicContact CB-CD2 4.38Å; P355-L397 WeakPolarHBondContact O-CD2 3.35Å; P355-L400 HydrophobicContact CB-CD2 4.44Å
356	E	85	Confident	83.7	Confident	64 Å²	64	52.6 Å²	52.6	30%	0.299	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-11.4	176.5	66	-85.2	-165.7	0	0	115.1	I331 R354	I331-E356 HydrophobicContact CD1-CB 4.07Å; R354-E356 HydrophobicContact CB-CG 4.42Å; R354-E356 WeakPolarHBondContact CD-OE1 3.5Å; R354-E356 PolarHBondContact O-N 3.1Å; R354-E356 VanDerWaalsContact O-N 3.12Å
357	K	83.2	Confident	83.9	Confident	115 Å²	115	54.5 Å²	54.5	50%	0.5	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	-39.2	176.2	-84.1	-174.3	160.8	-153.1	0	113.2	D352 R354 P355 R646	D352-K357 WeakPolarHBondContact OD2-CD 3.48Å; D352-K357 WeakPolarHBondContact OD2-CE 3.22Å; D352-K357 IonicContact OD2-NZ 2.69Å; D352-K357 PolarHBondContact OD2-NZ 3.33Å; R354-K357 HydrophobicContact CB-CB 4.28Å; R354-K357 PolarHBondContact O-N 3.08Å; P355-K357 VanDerWaalsContact C-N 3.26Å; P355-K357 PolarHBondContact O-N 3.02Å; K357-R646 PolarHBondContact O-NH1 3.25Å; K357-R646 VanDerWaalsContact O-NH1 3.08Å
358	L	85.7	Confident	83.9	Confident	15 Å²	15	59.2 Å²	59.2	8%	0.079	28%	0.279	C	S	.	.			trans	-51.7	138.5	-177	-73.8	167.4	0	0	0	111.9	L338 D352 R354 I363 L397 R646	L338-L358 HydrophobicContact CD1-CD1 3.76Å; L338-L358 HydrophobicContact CD2-CD1 3.62Å; L338-L358 HydrophobicContact CG-CD1 4.36Å; D352-L358 WeakPolarHBondContact O-CD2 3.5Å; R354-L358 PolarHBondContact O-N 2.98Å; R354-L358 VanDerWaalsContact O-N 3.07Å; L358-I363 HydrophobicContact CD1-CD1 4.4Å; L358-I363 HydrophobicContact CD2-CD1 4.37Å; L358-L397 HydrophobicContact CB-CD1 4.41Å; L358-R646 PolarHBondContact O-NH1 2.96Å
359	A	82.5	Confident	84.6	Confident	6 Å²	6	58.7 Å²	58.7	5%	0.05	27%	0.266	C	S	.	.			trans	-86.5	145.3	169.6	0	0	0	0	0	110.2	Y361 T362 I363 R646	A359-Y361 PolarHBondContact O-N 2.98Å; A359-T362 WeakPolarHBondContact CB-OG1 3.32Å; A359-T362 WeakPolarHBondContact O-CB 3.36Å; A359-T362 PolarHBondContact O-N 2.84Å; A359-T362 VanDerWaalsContact O-N 3.08Å; A359-I363 PolarHBondContact O-N 3.34Å; A359-R646 VanDerWaalsContact CB-NH2 3.34Å
360	K	85.9	Confident	85.2	Confident	36 Å²	36	54.2 Å²	54.2	16%	0.157	24%	0.244	C	C	.	.	H	α-helix	trans	-47.7	-47.2	165.9	-176	-169.8	72.1	-172.3	0	110.2	T362 I363 I364 I394 E1259 D1278	K360-T362 PolarHBondContact O-N 3.43Å; K360-I363 PolarHBondContact O-N 3.22Å; K360-I364 HydrophobicContact CG-CD1 3.98Å; K360-I364 WeakPolarHBondContact O-CG1 3.35Å; K360-I364 PolarHBondContact O-N 3.14Å; K360-I394 HydrophobicContact CG-CG2 4.44Å; K360-E1259 IonicContact NZ-OE1 2.86Å; K360-E1259 PolarHBondContact NZ-OE1 3.15Å; K360-D1278 IonicContact NZ-OD2 3.01Å
361	Y	83.9	Confident	85.6	Confident	74 Å²	74	56.5 Å²	56.5	29%	0.29	26%	0.26	S	S	.	.	H	α-helix	trans	-60.7	-38	177.4	-172.3	-111.3	0	0	0	114.6	A359 I363 I364 K365 D1278 S1280	A359-Y361 PolarHBondContact O-N 2.98Å; Y361-I363 VanDerWaalsContact C-N 3.29Å; Y361-I363 PolarHBondContact O-N 3.33Å; Y361-I364 PolarHBondContact O-N 3.44Å; Y361-K365 HydrophobicContact CD1-CD 4.24Å; Y361-K365 HydrophobicContact CE1-CD 3.59Å; Y361-K365 HydrophobicContact CE1-CG 4.3Å; Y361-K365 PolarHBondContact O-N 3.23Å; Y361-K365 WeakPolarHBondContact OH-CE 3.43Å; Y361-K365 PolarHBondContact OH-NZ 3.44Å; Y361-D1278 HydrophobicContact CD2-CB 4.27Å; Y361-D1278 HydrophobicContact CG-CB 4.49Å; Y361-S1280 WeakPolarHBondContact CB-OG 3.37Å; Y361-S1280 WeakPolarHBondContact CD1-OG 3.22Å
362	T	88.8	Confident	86.1	Confident	41 Å²	41	53 Å²	53	25%	0.252	26%	0.26	S	S	.	.	H	α-helix	trans	-60.2	-41.8	177	-46.9	0	0	0	0	111.2	A359 K360 A366	A359-T362 WeakPolarHBondContact CB-OG1 3.32Å; A359-T362 WeakPolarHBondContact O-CB 3.36Å; A359-T362 PolarHBondContact O-N 2.84Å; A359-T362 VanDerWaalsContact O-N 3.08Å; K360-T362 PolarHBondContact O-N 3.43Å; T362-A366 WeakPolarHBondContact O-CB 3.23Å; T362-A366 PolarHBondContact O-N 2.79Å
363	I	91.7	Very high	85.9	Confident	0 Å²	0	55 Å²	55	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-74.5	-33.3	178.7	-55	-57.4	0	0	0	111.6	L338 L347 L358 A359 K360 Y361 R367 F390 V393 I394 L397	L338-I363 HydrophobicContact CD1-CD1 4.15Å; L347-I363 HydrophobicContact CD2-CD1 3.81Å; L358-I363 HydrophobicContact CD1-CD1 4.4Å; L358-I363 HydrophobicContact CD2-CD1 4.37Å; A359-I363 PolarHBondContact O-N 3.34Å; K360-I363 PolarHBondContact O-N 3.22Å; Y361-I363 VanDerWaalsContact C-N 3.29Å; Y361-I363 PolarHBondContact O-N 3.33Å; I363-R367 WeakPolarHBondContact O-CB 3.21Å; I363-R367 PolarHBondContact O-N 3.48Å; I363-F390 HydrophobicContact CG2-CD1 3.82Å; I363-F390 HydrophobicContact CG2-CE1 4.39Å; I363-V393 HydrophobicContact CB-CG1 4.46Å; I363-V393 HydrophobicContact CD1-CG1 4.33Å; I363-V393 HydrophobicContact CG1-CG1 3.93Å; I363-V393 HydrophobicContact CG2-CB 4.26Å; I363-V393 HydrophobicContact CG2-CG1 3.89Å; I363-I394 HydrophobicContact CB-CG1 4.27Å; I363-I394 HydrophobicContact CG2-CD1 4.29Å; I363-I394 HydrophobicContact CG2-CG1 3.77Å; I363-L397 HydrophobicContact CG1-CD1 3.73Å
364	I	89.5	Confident	84.9	Confident	34 Å²	34	59.5 Å²	59.5	17%	0.174	30%	0.298	C	S	.	.	H	α-helix	trans	-62.9	-50.5	171.7	-69.9	167.2	0	0	0	110.4	K360 Y361 A366 R367 E368 I394	K360-I364 HydrophobicContact CG-CD1 3.98Å; K360-I364 WeakPolarHBondContact O-CG1 3.35Å; K360-I364 PolarHBondContact O-N 3.14Å; Y361-I364 PolarHBondContact O-N 3.44Å; I364-A366 PolarHBondContact O-N 3.12Å; I364-R367 WeakPolarHBondContact O-CA 3.32Å; I364-R367 WeakPolarHBondContact O-CB 3.47Å; I364-R367 PolarHBondContact O-N 3.08Å; I364-R367 VanDerWaalsContact O-N 3.1Å; I364-E368 HydrophobicContact CG2-CG 4.44Å; I364-E368 WeakPolarHBondContact CG2-OE1 3.33Å; I364-E368 WeakPolarHBondContact O-CG 3.49Å; I364-E368 PolarHBondContact O-N 3.28Å; I364-I394 HydrophobicContact CG1-CD1 3.84Å; I364-I394 HydrophobicContact CG1-CG1 4.24Å
365	K	88.1	Confident	84	Confident	96 Å²	96	57.3 Å²	57.3	42%	0.417	29%	0.292	S	S	.	.	H	α-helix	trans	-60.9	-40.4	175.9	-91.5	-173.3	157.5	164.1	0	113.4	Y361 R367 E368 K369	Y361-K365 HydrophobicContact CD1-CD 4.24Å; Y361-K365 HydrophobicContact CE1-CD 3.59Å; Y361-K365 HydrophobicContact CE1-CG 4.3Å; Y361-K365 PolarHBondContact O-N 3.23Å; Y361-K365 WeakPolarHBondContact OH-CE 3.43Å; Y361-K365 PolarHBondContact OH-NZ 3.44Å; K365-R367 VanDerWaalsContact C-N 3.32Å; K365-R367 PolarHBondContact O-N 3.1Å; K365-E368 PolarHBondContact O-N 3.34Å; K365-K369 WeakPolarHBondContact O-CB 3.43Å; K365-K369 PolarHBondContact O-N 2.97Å
366	A	89.4	Confident	82.9	Confident	17 Å²	17	63.7 Å²	63.7	14%	0.14	33%	0.333	C	S	.	.	H	α-helix	trans	-62.9	-39.1	174.3	0	0	0	0	0	111.9	L347 T362 I364 W370 F390	L347-A366 HydrophobicContact CD2-CB 3.73Å; T362-A366 WeakPolarHBondContact O-CB 3.23Å; T362-A366 PolarHBondContact O-N 2.79Å; I364-A366 PolarHBondContact O-N 3.12Å; A366-W370 WeakPolarHBondContact O-CB 3.31Å; A366-W370 PolarHBondContact O-N 2.86Å; A366-F390 HydrophobicContact CB-CE1 4.04Å; A366-F390 HydrophobicContact CB-CZ 4.47Å
367	R	90.4	Very high	82	Confident	46 Å²	46	65.5 Å²	65.5	17%	0.174	35%	0.353	C	S	.	.	H	α-helix	trans	-65.2	-44.1	173.5	-176.1	-168.3	175	-128	-7.3	112	I363 I364 K365 W370 S371 F390 L1253	I363-R367 WeakPolarHBondContact O-CB 3.21Å; I363-R367 PolarHBondContact O-N 3.48Å; I364-R367 WeakPolarHBondContact O-CA 3.32Å; I364-R367 WeakPolarHBondContact O-CB 3.47Å; I364-R367 PolarHBondContact O-N 3.08Å; I364-R367 VanDerWaalsContact O-N 3.1Å; K365-R367 VanDerWaalsContact C-N 3.32Å; K365-R367 PolarHBondContact O-N 3.1Å; R367-W370 PolarHBondContact O-N 3.44Å; R367-S371 VanDerWaalsContact O-CB 3.32Å; R367-S371 WeakPolarHBondContact O-CB 3.39Å; R367-S371 PolarHBondContact O-N 2.8Å; R367-S371 PolarHBondContact O-OG 2.91Å; R367-F390 HydrophobicContact CB-CB 4.31Å; R367-F390 HydrophobicContact CB-CD1 3.75Å; R367-F390 HydrophobicContact CB-CD2 4.06Å; R367-F390 HydrophobicContact CB-CE1 3.95Å; R367-F390 HydrophobicContact CB-CE2 4.24Å; R367-F390 HydrophobicContact CB-CG 3.81Å; R367-F390 HydrophobicContact CB-CZ 4.18Å; R367-F390 HydrophobicContact CG-CB 4.08Å; R367-F390 HydrophobicContact CG-CD1 4.35Å; R367-F390 HydrophobicContact CG-CD2 3.89Å; R367-F390 HydrophobicContact CG-CE2 4.35Å; R367-F390 HydrophobicContact CG-CG 3.88Å; R367-L1253 PolarHBondContact NH2-O 3.48Å
368	E	87.6	Confident	81.5	Confident	102 Å²	102	62.3 Å²	62.3	48%	0.477	34%	0.341	S	S	.	.	H	α-helix	trans	-60.7	-51.8	177.9	-72.9	162.2	175.3	0	0	110.5	I364 K365 W370 S371 S372	I364-E368 HydrophobicContact CG2-CG 4.44Å; I364-E368 WeakPolarHBondContact CG2-OE1 3.33Å; I364-E368 WeakPolarHBondContact O-CG 3.49Å; I364-E368 PolarHBondContact O-N 3.28Å; K365-E368 PolarHBondContact O-N 3.34Å; E368-W370 PolarHBondContact O-N 2.87Å; E368-S371 CarbonylContact O-C 3.55Å; E368-S371 PolarHBondContact O-N 3.14Å; E368-S372 PolarHBondContact O-N 3.22Å
369	K	87.1	Confident	81.1	Confident	77 Å²	77	66.5 Å²	66.5	34%	0.335	36%	0.363	S	S	.	.	H	α-helix	trans	-58.3	-44.7	175.7	-169	-173.8	-172.6	-170.3	0	112.4	E349 K365 S371 S372 Q373	E349-K369 IonicContact OE1-NZ 3.11Å; E349-K369 PolarHBondContact OE1-NZ 3.33Å; E349-K369 WeakPolarHBondContact OE2-CD 3.48Å; E349-K369 IonicContact OE2-NZ 3.67Å; E349-K369 PolarHBondContact OE2-NZ 3.41Å; K365-K369 WeakPolarHBondContact O-CB 3.43Å; K365-K369 PolarHBondContact O-N 2.97Å; K369-S371 VanDerWaalsContact C-N 3.26Å; K369-S371 PolarHBondContact O-N 3.47Å; K369-S372 PolarHBondContact O-N 2.98Å; K369-S372 PolarHBondContact O-OG 3.03Å; K369-Q373 WeakPolarHBondContact O-CG 3.41Å; K369-Q373 PolarHBondContact O-N 3.24Å
370	W	86.1	Confident	80.9	Confident	16 Å²	16	70.7 Å²	70.7	6%	0.061	39%	0.392	C	S	.	.	H	α-helix	trans	-60.9	-37.1	174.8	179.5	-87.1	0	0	0	112.2	A346 A366 R367 E368 Q373 F375 I378 N383 I386 F390	A346-W370 HydrophobicContact CB-CD2 3.93Å; A346-W370 HydrophobicContact CB-CE3 3.52Å; A346-W370 HydrophobicContact CB-CH2 4.34Å; A346-W370 HydrophobicContact CB-CZ3 3.73Å; A366-W370 WeakPolarHBondContact O-CB 3.31Å; A366-W370 PolarHBondContact O-N 2.86Å; R367-W370 PolarHBondContact O-N 3.44Å; E368-W370 PolarHBondContact O-N 2.87Å; W370-Q373 PolarHBondContact O-N 2.71Å; W370-F375 HydrophobicContact CD2-CD2 4.46Å; W370-F375 AromaticContact CD2-CE2 3.63Å; W370-F375 HydrophobicContact CD2-CE2 3.63Å; W370-F375 HydrophobicContact CD2-CZ 4.2Å; W370-F375 AromaticContact CE2-CE2 3.76Å; W370-F375 AromaticContact CE3-CE2 3.58Å; W370-F375 HydrophobicContact CE3-CE2 3.58Å; W370-F375 AromaticContact CE3-CZ 3.66Å; W370-F375 HydrophobicContact CE3-CZ 3.66Å; W370-F375 HydrophobicContact CG-CE2 4.3Å; W370-F375 HydrophobicContact CH2-CD2 4.19Å; W370-F375 AromaticContact CH2-CE2 3.89Å; W370-F375 HydrophobicContact CH2-CE2 3.89Å; W370-F375 HydrophobicContact CH2-CZ 4.11Å; W370-F375 AromaticContact CZ2-CD2 3.99Å; W370-F375 HydrophobicContact CZ2-CD2 3.99Å; W370-F375 AromaticContact CZ2-CE2 3.88Å; W370-F375 HydrophobicContact CZ2-CE2 3.88Å; W370-F375 HydrophobicContact CZ3-CD2 4.48Å; W370-F375 HydrophobicContact CZ3-CE1 4.32Å; W370-F375 AromaticContact CZ3-CE2 3.73Å; W370-F375 HydrophobicContact CZ3-CE2 3.73Å; W370-F375 AromaticContact CZ3-CZ 3.63Å; W370-F375 HydrophobicContact CZ3-CZ 3.63Å; W370-I378 HydrophobicContact CH2-CD1 3.47Å; W370-I378 VanDerWaalsContact CH2-CD1 3.47Å; W370-I378 HydrophobicContact CZ2-CD1 3.41Å; W370-I378 VanDerWaalsContact CZ2-CD1 3.41Å; W370-N383 PolarHBondContact NE1-OD1 3.22Å; W370-I386 HydrophobicContact CD2-CG2 4.34Å; W370-I386 HydrophobicContact CG-CG2 4.5Å; W370-I386 HydrophobicContact CH2-CD1 4.08Å; W370-I386 HydrophobicContact CZ2-CD1 3.39Å; W370-I386 HydrophobicContact CZ2-CG2 4.2Å; W370-F390 HydrophobicContact CB-CE2 3.96Å; W370-F390 HydrophobicContact CB-CZ 4.08Å; W370-F390 AromaticContact CG-CE2 3.88Å; W370-F390 HydrophobicContact CG-CE2 3.88Å; W370-F390 HydrophobicContact CG-CZ 4.37Å
371	S	84.7	Confident	80.7	Confident	64 Å²	64	74.2 Å²	74.2	45%	0.448	42%	0.417	S	S	.	.	H	α-helix	trans	-77.2	-25.7	-178.9	-52.5	0	0	0	0	112.8	R367 E368 K369 Q373 Q387	R367-S371 VanDerWaalsContact O-CB 3.32Å; R367-S371 WeakPolarHBondContact O-CB 3.39Å; R367-S371 PolarHBondContact O-N 2.8Å; R367-S371 PolarHBondContact O-OG 2.91Å; E368-S371 CarbonylContact O-C 3.55Å; E368-S371 PolarHBondContact O-N 3.14Å; K369-S371 VanDerWaalsContact C-N 3.26Å; K369-S371 PolarHBondContact O-N 3.47Å; S371-Q373 VanDerWaalsContact C-N 3.34Å; S371-Q387 PolarHBondContact OG-NE2 3.43Å
372	S	82.2	Confident	80.7	Confident	94 Å²	94	75 Å²	75	66%	0.657	42%	0.423	S	S	*	.	H	α-helix	trans	-80.6	-13.7	173.1	69	0	0	0	0	113.5	E368 K369	E368-S372 PolarHBondContact O-N 3.22Å; K369-S372 PolarHBondContact O-N 2.98Å; K369-S372 PolarHBondContact O-OG 3.03Å
373	Q	76.7	Confident	80.5	Confident	90 Å²	90	76.1 Å²	76.1	42%	0.421	43%	0.428	S	S	.	.	S	Bend	trans	-95.3	114.6	-179	-74	-179.3	-28.1	0	0	111	K369 W370 S371 F375	K369-Q373 WeakPolarHBondContact O-CG 3.41Å; K369-Q373 PolarHBondContact O-N 3.24Å; W370-Q373 PolarHBondContact O-N 2.71Å; S371-Q373 VanDerWaalsContact C-N 3.34Å; Q373-F375 HydrophobicContact CB-CD2 4.28Å; Q373-F375 HydrophobicContact CB-CE1 4.3Å; Q373-F375 HydrophobicContact CB-CE2 3.57Å; Q373-F375 HydrophobicContact CB-CZ 3.58Å; Q373-F375 HydrophobicContact CG-CZ 4.48Å; Q373-F375 WeakPolarHBondContact O-CD2 3.28Å; Q373-F375 WeakPolarHBondContact O-CE2 3.47Å; Q373-F375 PolarHBondContact O-N 2.69Å
374	T	62.3	Low	80.1	Confident	139 Å²	139	79 Å²	79	85%	0.853	45%	0.448	S	S	*	.			trans	-77.2	103.8	173.3	39.4	0	0	0	0	110.3	P376	T374-P376 WeakPolarHBondContact O-CD 3.16Å
375	F	68.6	Low	80.1	Confident	74 Å²	74	79 Å²	79	33%	0.325	45%	0.451	S	S	.	.			trans	-94.3	109.4	177.4	-61.4	-79	0	0	0	111.2	W370 Q373 S377 I378	W370-F375 HydrophobicContact CD2-CD2 4.46Å; W370-F375 AromaticContact CD2-CE2 3.63Å; W370-F375 HydrophobicContact CD2-CE2 3.63Å; W370-F375 HydrophobicContact CD2-CZ 4.2Å; W370-F375 AromaticContact CE2-CE2 3.76Å; W370-F375 AromaticContact CE3-CE2 3.58Å; W370-F375 HydrophobicContact CE3-CE2 3.58Å; W370-F375 AromaticContact CE3-CZ 3.66Å; W370-F375 HydrophobicContact CE3-CZ 3.66Å; W370-F375 HydrophobicContact CG-CE2 4.3Å; W370-F375 HydrophobicContact CH2-CD2 4.19Å; W370-F375 AromaticContact CH2-CE2 3.89Å; W370-F375 HydrophobicContact CH2-CE2 3.89Å; W370-F375 HydrophobicContact CH2-CZ 4.11Å; W370-F375 AromaticContact CZ2-CD2 3.99Å; W370-F375 HydrophobicContact CZ2-CD2 3.99Å; W370-F375 AromaticContact CZ2-CE2 3.88Å; W370-F375 HydrophobicContact CZ2-CE2 3.88Å; W370-F375 HydrophobicContact CZ3-CD2 4.48Å; W370-F375 HydrophobicContact CZ3-CE1 4.32Å; W370-F375 AromaticContact CZ3-CE2 3.73Å; W370-F375 HydrophobicContact CZ3-CE2 3.73Å; W370-F375 AromaticContact CZ3-CZ 3.63Å; W370-F375 HydrophobicContact CZ3-CZ 3.63Å; Q373-F375 HydrophobicContact CB-CD2 4.28Å; Q373-F375 HydrophobicContact CB-CE1 4.3Å; Q373-F375 HydrophobicContact CB-CE2 3.57Å; Q373-F375 HydrophobicContact CB-CZ 3.58Å; Q373-F375 HydrophobicContact CG-CZ 4.48Å; Q373-F375 WeakPolarHBondContact O-CD2 3.28Å; Q373-F375 WeakPolarHBondContact O-CE2 3.47Å; Q373-F375 PolarHBondContact O-N 2.69Å; F375-S377 PolarHBondContact O-N 3.37Å; F375-S377 VanDerWaalsContact O-N 3.09Å; F375-I378 HydrophobicContact CB-CB 4.26Å; F375-I378 HydrophobicContact CB-CD1 3.58Å; F375-I378 HydrophobicContact CB-CG1 3.76Å; F375-I378 HydrophobicContact CD1-CD1 4.37Å; F375-I378 HydrophobicContact CD2-CD1 4Å; F375-I378 HydrophobicContact CG-CD1 3.74Å; F375-I378 HydrophobicContact CG-CG1 4.45Å; F375-I378 PolarHBondContact O-N 3.1Å
376	P	60.9	Low	80.2	Confident	138 Å²	138	74.6 Å²	74.6	90%	0.896	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-11.5	-175.5	-21.5	34.8	0	0	0	115	T374	T374-P376 WeakPolarHBondContact O-CD 3.16Å
377	S	67.4	Low	80.2	Confident	101 Å²	101	74.5 Å²	74.5	71%	0.706	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	-4.5	-173	53.9	0	0	0	0	114.9	F375	F375-S377 PolarHBondContact O-N 3.37Å; F375-S377 VanDerWaalsContact O-N 3.09Å
378	I	71.4	Confident	80.3	Confident	48 Å²	48	72.6 Å²	72.6	25%	0.246	42%	0.422	C	S	.	.			trans	-105.9	120.7	-168.8	-57.6	-174.6	0	0	0	110.4	W370 F375 E382 N383 I386	W370-I378 HydrophobicContact CH2-CD1 3.47Å; W370-I378 VanDerWaalsContact CH2-CD1 3.47Å; W370-I378 HydrophobicContact CZ2-CD1 3.41Å; W370-I378 VanDerWaalsContact CZ2-CD1 3.41Å; F375-I378 HydrophobicContact CB-CB 4.26Å; F375-I378 HydrophobicContact CB-CD1 3.58Å; F375-I378 HydrophobicContact CB-CG1 3.76Å; F375-I378 HydrophobicContact CD1-CD1 4.37Å; F375-I378 HydrophobicContact CD2-CD1 4Å; F375-I378 HydrophobicContact CG-CD1 3.74Å; F375-I378 HydrophobicContact CG-CG1 4.45Å; F375-I378 PolarHBondContact O-N 3.1Å; I378-E382 HydrophobicContact CG2-CB 3.84Å; I378-N383 HydrophobicContact CG2-CB 4.19Å; I378-I386 HydrophobicContact CG2-CD1 4.46Å
379	N	77.7	Confident	80.5	Confident	104 Å²	104	67.8 Å²	67.8	56%	0.556	40%	0.4	S	S	*	.			trans	-67.9	150.6	-179.2	-63.8	-83.2	0	0	0	111.2	T381 E382 N383	N379-T381 PolarHBondContact O-N 3.45Å; N379-T381 VanDerWaalsContact O-N 3.15Å; N379-E382 HydrophobicContact CB-CB 4.5Å; N379-E382 HydrophobicContact CB-CG 4.15Å; N379-E382 VanDerWaalsContact CB-OE2 3.29Å; N379-E382 WeakPolarHBondContact CB-OE2 3.32Å; N379-E382 PolarHBondContact N-OE2 3.42Å; N379-E382 PolarHBondContact ND2-OE2 3.46Å; N379-E382 WeakPolarHBondContact O-CA 3.32Å; N379-E382 WeakPolarHBondContact O-CB 3.49Å; N379-E382 PolarHBondContact O-N 3.04Å; N379-N383 PolarHBondContact O-N 3.49Å
380	S	78.9	Confident	80.8	Confident	94 Å²	94	64.1 Å²	64.1	66%	0.657	38%	0.384	S	S	*	.	H	α-helix	trans	-54.7	-36	178.5	57.4	0	0	0	0	113.1	S384	S380-S384 VanDerWaalsContact O-CB 3.32Å; S380-S384 WeakPolarHBondContact O-CB 3.3Å; S380-S384 PolarHBondContact O-N 3.03Å; S380-S384 PolarHBondContact O-OG 3.09Å
381	T	81.9	Confident	81.1	Confident	110 Å²	110	63.7 Å²	63.7	68%	0.675	38%	0.384	S	S	*	.	H	α-helix	trans	-64.9	-37.1	172.9	-56	0	0	0	0	112.9	N379 S385	N379-T381 PolarHBondContact O-N 3.45Å; N379-T381 VanDerWaalsContact O-N 3.15Å; T381-S385 PolarHBondContact O-N 2.84Å
382	E	82.9	Confident	81.4	Confident	89 Å²	89	60.7 Å²	60.7	42%	0.416	36%	0.363	S	S	.	.	H	α-helix	trans	-75.4	-44.9	-179.9	-65.2	174.7	123.7	0	0	110.9	I378 N379 S384 S385 I386	I378-E382 HydrophobicContact CG2-CB 3.84Å; N379-E382 HydrophobicContact CB-CB 4.5Å; N379-E382 HydrophobicContact CB-CG 4.15Å; N379-E382 VanDerWaalsContact CB-OE2 3.29Å; N379-E382 WeakPolarHBondContact CB-OE2 3.32Å; N379-E382 PolarHBondContact N-OE2 3.42Å; N379-E382 PolarHBondContact ND2-OE2 3.46Å; N379-E382 WeakPolarHBondContact O-CA 3.32Å; N379-E382 WeakPolarHBondContact O-CB 3.49Å; N379-E382 PolarHBondContact O-N 3.04Å; E382-S384 VanDerWaalsContact C-N 3.26Å; E382-S384 PolarHBondContact O-N 3.47Å; E382-S385 WeakPolarHBondContact O-CA 3.45Å; E382-S385 WeakPolarHBondContact O-CB 3.06Å; E382-S385 PolarHBondContact O-N 3.4Å; E382-I386 WeakPolarHBondContact O-CG1 3.4Å; E382-I386 PolarHBondContact O-N 2.82Å
383	N	85.1	Confident	82	Confident	66 Å²	66	56.2 Å²	56.2	35%	0.353	33%	0.331	S	S	.	.	H	α-helix	trans	-58.8	-40.3	172	-166	11.8	0	0	0	110.9	W370 I378 N379 S385 I386 Q387	W370-N383 PolarHBondContact NE1-OD1 3.22Å; I378-N383 HydrophobicContact CG2-CB 4.19Å; N379-N383 PolarHBondContact O-N 3.49Å; N383-S385 VanDerWaalsContact C-N 3.33Å; N383-S385 PolarHBondContact O-N 3.45Å; N383-I386 PolarHBondContact O-N 3.33Å; N383-I386 VanDerWaalsContact O-N 3.15Å; N383-Q387 WeakPolarHBondContact O-CB 3.47Å; N383-Q387 WeakPolarHBondContact O-CG 3.39Å; N383-Q387 PolarHBondContact O-N 2.88Å
384	S	84.1	Confident	82.7	Confident	61 Å²	61	53.5 Å²	53.5	43%	0.427	32%	0.32	S	S	.	.	H	α-helix	trans	-61	-36.8	172.5	-61	0	0	0	0	113.1	S380 E382 C388	S380-S384 VanDerWaalsContact O-CB 3.32Å; S380-S384 WeakPolarHBondContact O-CB 3.3Å; S380-S384 PolarHBondContact O-N 3.03Å; S380-S384 PolarHBondContact O-OG 3.09Å; E382-S384 VanDerWaalsContact C-N 3.26Å; E382-S384 PolarHBondContact O-N 3.47Å; S384-C388 WeakPolarHBondContact O-CB 3.41Å; S384-C388 PolarHBondContact O-N 2.64Å; S384-C388 VanDerWaalsContact O-N 3.15Å
385	S	88.7	Confident	84.1	Confident	34 Å²	34	47.3 Å²	47.3	24%	0.238	28%	0.282	C	S	.	.	H	α-helix	trans	-67	-43.4	171.7	-175.7	0	0	0	0	111.6	R344 T381 E382 N383 C388 D389	R344-S385 PolarHBondContact NH2-OG 2.93Å; T381-S385 PolarHBondContact O-N 2.84Å; E382-S385 WeakPolarHBondContact O-CA 3.45Å; E382-S385 WeakPolarHBondContact O-CB 3.06Å; E382-S385 PolarHBondContact O-N 3.4Å; N383-S385 VanDerWaalsContact C-N 3.33Å; N383-S385 PolarHBondContact O-N 3.45Å; S385-C388 WeakPolarHBondContact O-CB 3.47Å; S385-C388 PolarHBondContact O-N 3.2Å; S385-D389 WeakPolarHBondContact O-CB 3.29Å; S385-D389 PolarHBondContact O-N 3.07Å; S385-D389 PolarHBondContact OG-OD2 3.45Å
386	I	90.3	Very high	85.3	Confident	3 Å²	3	43.9 Å²	43.9	2%	0.015	27%	0.267	C	S	.	.	H	α-helix	trans	-64.2	-46.5	-178.2	-67.7	166	0	0	0	110.5	L341 R344 A346 W370 I378 E382 N383 C388 D389 F390	L341-I386 HydrophobicContact CD2-CG2 3.93Å; R344-I386 HydrophobicContact CB-CD1 4.37Å; R344-I386 VanDerWaalsContact CD-CG1 3.42Å; A346-I386 HydrophobicContact CB-CG2 4.25Å; W370-I386 HydrophobicContact CD2-CG2 4.34Å; W370-I386 HydrophobicContact CG-CG2 4.5Å; W370-I386 HydrophobicContact CH2-CD1 4.08Å; W370-I386 HydrophobicContact CZ2-CD1 3.39Å; W370-I386 HydrophobicContact CZ2-CG2 4.2Å; I378-I386 HydrophobicContact CG2-CD1 4.46Å; E382-I386 WeakPolarHBondContact O-CG1 3.4Å; E382-I386 PolarHBondContact O-N 2.82Å; N383-I386 PolarHBondContact O-N 3.33Å; N383-I386 VanDerWaalsContact O-N 3.15Å; I386-C388 VanDerWaalsContact C-N 3.28Å; I386-C388 PolarHBondContact O-N 2.91Å; I386-D389 PolarHBondContact O-N 2.83Å; I386-D389 VanDerWaalsContact O-N 3.08Å; I386-F390 HydrophobicContact CG2-CD2 3.78Å; I386-F390 HydrophobicContact CG2-CE2 3.59Å; I386-F390 VanDerWaalsContact O-CD2 3.31Å; I386-F390 WeakPolarHBondContact O-CD2 3.41Å; I386-F390 PolarHBondContact O-N 3.25Å
387	Q	89.5	Confident	86.8	Confident	14 Å²	14	37.8 Å²	37.8	7%	0.065	23%	0.227	C	C	.	.	H	α-helix	trans	-59.6	-37.5	173.6	-68.6	-71.5	-20.4	0	0	112.2	S371 N383 A391 L1253	S371-Q387 PolarHBondContact OG-NE2 3.43Å; N383-Q387 WeakPolarHBondContact O-CB 3.47Å; N383-Q387 WeakPolarHBondContact O-CG 3.39Å; N383-Q387 PolarHBondContact O-N 2.88Å; Q387-A391 WeakPolarHBondContact O-CB 3.36Å; Q387-A391 PolarHBondContact O-N 3.01Å; Q387-L1253 HydrophobicContact CB-CD1 3.87Å; Q387-L1253 HydrophobicContact CG-CD1 4.33Å
388	C	91.2	Very high	88	Confident	6 Å²	6	34.5 Å²	34.5	4%	0.041	20%	0.2	C	C	.	.	H	α-helix	trans	-69.9	-34.7	173.9	-169.5	0	0	0	0	113	S384 S385 I386 A391 L392 L427	S384-C388 WeakPolarHBondContact O-CB 3.41Å; S384-C388 PolarHBondContact O-N 2.64Å; S384-C388 VanDerWaalsContact O-N 3.15Å; S385-C388 WeakPolarHBondContact O-CB 3.47Å; S385-C388 PolarHBondContact O-N 3.2Å; I386-C388 VanDerWaalsContact C-N 3.28Å; I386-C388 PolarHBondContact O-N 2.91Å; C388-A391 WeakPolarHBondContact O-CB 3.29Å; C388-A391 PolarHBondContact O-N 3.47Å; C388-L392 WeakPolarHBondContact O-CG 3.28Å; C388-L392 PolarHBondContact O-N 3.47Å; C388-L427 HydrophobicContact CB-CD2 3.88Å; C388-L427 HydrophobicContact CB-CG 4.38Å
389	D	92.8	Very high	88.9	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-73.5	-38	179	-67.2	-39.3	0	0	0	111.2	R340 L341 R344 S385 I386 A391 L392 V393	R340-D389 IonicContact CZ-OD1 3.91Å; R340-D389 IonicContact CZ-OD2 3.53Å; R340-D389 IonicContact NH1-OD1 3.75Å; R340-D389 PolarHBondContact NH1-OD1 3.31Å; R340-D389 IonicContact NH1-OD2 2.67Å; R340-D389 PolarHBondContact NH1-OD2 2.93Å; R340-D389 IonicContact NH2-OD1 2.69Å; R340-D389 PolarHBondContact NH2-OD1 3.16Å; L341-D389 HydrophobicContact CD2-CB 3.84Å; L341-D389 HydrophobicContact CG-CB 4.04Å; R344-D389 IonicContact CZ-OD2 3.2Å; R344-D389 IonicContact NH1-OD2 3.7Å; R344-D389 PolarHBondContact NH1-OD2 2.99Å; R344-D389 IonicContact NH2-OD2 2.8Å; S385-D389 WeakPolarHBondContact O-CB 3.29Å; S385-D389 PolarHBondContact O-N 3.07Å; S385-D389 PolarHBondContact OG-OD2 3.45Å; I386-D389 PolarHBondContact O-N 2.83Å; I386-D389 VanDerWaalsContact O-N 3.08Å; D389-A391 VanDerWaalsContact C-N 3.34Å; D389-A391 PolarHBondContact O-N 3.21Å; D389-L392 PolarHBondContact O-N 2.8Å; D389-V393 WeakPolarHBondContact O-CG2 3.5Å; D389-V393 PolarHBondContact O-N 2.75Å
390	F	93.7	Very high	89.7	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-56.2	-46.9	165.3	-82.2	-62.2	0	0	0	111.5	L341 A346 L347 I363 A366 R367 W370 I386 L392 V393 I394	L341-F390 HydrophobicContact CD1-CD1 3.72Å; L341-F390 HydrophobicContact CD1-CE1 4.09Å; L341-F390 HydrophobicContact CD1-CG 4.14Å; L341-F390 HydrophobicContact CD2-CD1 4.12Å; L341-F390 HydrophobicContact CD2-CD2 3.83Å; L341-F390 HydrophobicContact CD2-CE1 4.26Å; L341-F390 HydrophobicContact CD2-CE2 4Å; L341-F390 HydrophobicContact CD2-CG 3.9Å; L341-F390 HydrophobicContact CD2-CZ 4.21Å; A346-F390 HydrophobicContact CB-CE2 4.12Å; A346-F390 HydrophobicContact CB-CZ 3.84Å; L347-F390 HydrophobicContact CD2-CE1 4.16Å; I363-F390 HydrophobicContact CG2-CD1 3.82Å; I363-F390 HydrophobicContact CG2-CE1 4.39Å; A366-F390 HydrophobicContact CB-CE1 4.04Å; A366-F390 HydrophobicContact CB-CZ 4.47Å; R367-F390 HydrophobicContact CB-CB 4.31Å; R367-F390 HydrophobicContact CB-CD1 3.75Å; R367-F390 HydrophobicContact CB-CD2 4.06Å; R367-F390 HydrophobicContact CB-CE1 3.95Å; R367-F390 HydrophobicContact CB-CE2 4.24Å; R367-F390 HydrophobicContact CB-CG 3.81Å; R367-F390 HydrophobicContact CB-CZ 4.18Å; R367-F390 HydrophobicContact CG-CB 4.08Å; R367-F390 HydrophobicContact CG-CD1 4.35Å; R367-F390 HydrophobicContact CG-CD2 3.89Å; R367-F390 HydrophobicContact CG-CE2 4.35Å; R367-F390 HydrophobicContact CG-CG 3.88Å; W370-F390 HydrophobicContact CB-CE2 3.96Å; W370-F390 HydrophobicContact CB-CZ 4.08Å; W370-F390 AromaticContact CG-CE2 3.88Å; W370-F390 HydrophobicContact CG-CE2 3.88Å; W370-F390 HydrophobicContact CG-CZ 4.37Å; I386-F390 HydrophobicContact CG2-CD2 3.78Å; I386-F390 HydrophobicContact CG2-CE2 3.59Å; I386-F390 VanDerWaalsContact O-CD2 3.31Å; I386-F390 WeakPolarHBondContact O-CD2 3.41Å; I386-F390 PolarHBondContact O-N 3.25Å; F390-L392 VanDerWaalsContact C-N 3.33Å; F390-L392 PolarHBondContact O-N 3.31Å; F390-V393 PolarHBondContact O-N 2.9Å; F390-I394 VanDerWaalsContact O-CG1 3.31Å; F390-I394 WeakPolarHBondContact O-CG1 3.16Å; F390-I394 PolarHBondContact O-N 3.21Å
391	A	91.6	Very high	90.2	Very high	8 Å²	8	26.3 Å²	26.3	7%	0.066	15%	0.148	C	C	.	.	H	α-helix	trans	-60.8	-39.5	178.6	0	0	0	0	0	113	Q387 C388 D389 C395 V428 L1255	Q387-A391 WeakPolarHBondContact O-CB 3.36Å; Q387-A391 PolarHBondContact O-N 3.01Å; C388-A391 WeakPolarHBondContact O-CB 3.29Å; C388-A391 PolarHBondContact O-N 3.47Å; D389-A391 VanDerWaalsContact C-N 3.34Å; D389-A391 PolarHBondContact O-N 3.21Å; A391-C395 WeakPolarHBondContact O-CB 3.24Å; A391-C395 PolarHBondContact O-N 2.9Å; A391-V428 HydrophobicContact CB-CG2 3.57Å; A391-L1255 HydrophobicContact CB-CD1 3.58Å
392	L	92.4	Very high	90.5	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-65.9	-46	175.2	-73	163.4	0	0	0	111.8	P337 C388 D389 F390 C395 L396 V428 Q431 L432 L435	P337-L392 HydrophobicContact CB-CB 4.12Å; P337-L392 HydrophobicContact CB-CD1 4.49Å; P337-L392 HydrophobicContact CG-CB 4.39Å; C388-L392 WeakPolarHBondContact O-CG 3.28Å; C388-L392 PolarHBondContact O-N 3.47Å; D389-L392 PolarHBondContact O-N 2.8Å; F390-L392 VanDerWaalsContact C-N 3.33Å; F390-L392 PolarHBondContact O-N 3.31Å; L392-C395 PolarHBondContact O-N 3.39Å; L392-L396 WeakPolarHBondContact O-CB 3.27Å; L392-L396 VanDerWaalsContact O-CG 3.29Å; L392-L396 WeakPolarHBondContact O-CG 3.2Å; L392-L396 PolarHBondContact O-N 2.83Å; L392-V428 HydrophobicContact CD2-CG1 4.06Å; L392-Q431 HydrophobicContact CD1-CB 3.73Å; L392-Q431 HydrophobicContact CD2-CB 4.28Å; L392-Q431 HydrophobicContact CG-CB 4.5Å; L392-L432 HydrophobicContact CD2-CB 4.15Å; L392-L432 HydrophobicContact CD2-CD1 4.26Å; L392-L435 HydrophobicContact CD2-CD1 4.36Å
393	V	93.4	Very high	91	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-62.7	-45.6	178.3	174.8	0	0	0	0	110.9	I334 P337 L338 L341 I363 D389 F390 C395 L396 L397	I334-V393 HydrophobicContact CG2-CG1 4.48Å; P337-V393 HydrophobicContact CB-CG2 3.87Å; P337-V393 HydrophobicContact CG-CG2 3.94Å; L338-V393 HydrophobicContact CB-CG2 4.23Å; L338-V393 HydrophobicContact CD1-CG1 4.04Å; L338-V393 HydrophobicContact CD1-CG2 4.32Å; L341-V393 HydrophobicContact CD1-CB 4.46Å; L341-V393 HydrophobicContact CD1-CG2 3.89Å; I363-V393 HydrophobicContact CB-CG1 4.46Å; I363-V393 HydrophobicContact CD1-CG1 4.33Å; I363-V393 HydrophobicContact CG1-CG1 3.93Å; I363-V393 HydrophobicContact CG2-CB 4.26Å; I363-V393 HydrophobicContact CG2-CG1 3.89Å; D389-V393 WeakPolarHBondContact O-CG2 3.5Å; D389-V393 PolarHBondContact O-N 2.75Å; F390-V393 PolarHBondContact O-N 2.9Å; V393-C395 PolarHBondContact O-N 3.42Å; V393-L396 PolarHBondContact O-N 3.33Å; V393-L397 HydrophobicContact CG1-CD1 3.62Å; V393-L397 HydrophobicContact CG1-CG 4.05Å; V393-L397 VanDerWaalsContact O-CB 3.28Å; V393-L397 WeakPolarHBondContact O-CB 3.31Å; V393-L397 VanDerWaalsContact O-CG 3.29Å; V393-L397 WeakPolarHBondContact O-CG 3.44Å; V393-L397 PolarHBondContact O-N 3.46Å
394	I	91.9	Very high	91.3	Very high	34 Å²	34	15.5 Å²	15.5	17%	0.174	9%	0.09	C	C	.	.	H	α-helix	trans	-61.6	-44.5	177.7	-66.7	164.3	0	0	0	111	K360 I363 I364 F390 H398	K360-I394 HydrophobicContact CG-CG2 4.44Å; I363-I394 HydrophobicContact CB-CG1 4.27Å; I363-I394 HydrophobicContact CG2-CD1 4.29Å; I363-I394 HydrophobicContact CG2-CG1 3.77Å; I364-I394 HydrophobicContact CG1-CD1 3.84Å; I364-I394 HydrophobicContact CG1-CG1 4.24Å; F390-I394 VanDerWaalsContact O-CG1 3.31Å; F390-I394 WeakPolarHBondContact O-CG1 3.16Å; F390-I394 PolarHBondContact O-N 3.21Å; I394-H398 PolarHBondContact O-N 3.16Å; I394-H398 VanDerWaalsContact O-N 3.13Å
395	C	92.4	Very high	91.4	Very high	9 Å²	9	14.5 Å²	14.5	6%	0.061	8%	0.078	C	C	.	.	H	α-helix	trans	-60.3	-46.9	177	179.9	0	0	0	0	112.5	A391 L392 V393 G399 Y414	A391-C395 WeakPolarHBondContact O-CB 3.24Å; A391-C395 PolarHBondContact O-N 2.9Å; L392-C395 PolarHBondContact O-N 3.39Å; V393-C395 PolarHBondContact O-N 3.42Å; C395-G399 PolarHBondContact O-N 3.45Å; C395-G399 VanDerWaalsContact O-N 3.13Å; C395-Y414 WeakPolarHBondContact CA-OH 3.46Å; C395-Y414 WeakPolarHBondContact O-CE1 3.24Å; C395-Y414 PolarHBondContact O-OH 3.14Å; C395-Y414 PolarHBondContact SG-OH 3.18Å
396	L	93.4	Very high	91.3	Very high	2 Å²	2	12.9 Å²	12.9	1%	0.01	7%	0.067	C	C	.	.	H	α-helix	trans	-76.7	-35.1	-176.6	-68	168.8	0	0	0	112.6	L330 I334 P337 L392 V393 G399 L400 L432 L435 M438	L330-L396 HydrophobicContact CD1-CD2 3.77Å; I334-L396 HydrophobicContact CD1-CB 4.14Å; I334-L396 HydrophobicContact CG1-CB 3.44Å; I334-L396 VanDerWaalsContact CG1-CB 3.44Å; I334-L396 HydrophobicContact CG1-CD1 4.18Å; I334-L396 HydrophobicContact CG1-CG 4.4Å; P337-L396 HydrophobicContact CG-CD1 4.34Å; L392-L396 WeakPolarHBondContact O-CB 3.27Å; L392-L396 VanDerWaalsContact O-CG 3.29Å; L392-L396 WeakPolarHBondContact O-CG 3.2Å; L392-L396 PolarHBondContact O-N 2.83Å; V393-L396 PolarHBondContact O-N 3.33Å; L396-G399 PolarHBondContact O-N 2.98Å; L396-L400 PolarHBondContact O-N 3.4Å; L396-L432 HydrophobicContact CD2-CD1 3.8Å; L396-L432 HydrophobicContact CG-CD1 4.32Å; L396-L435 HydrophobicContact CD1-CD1 3.71Å; L396-M438 HydrophobicContact CD2-CE 4.21Å; L396-M438 HydrophobicContact CD2-SD 3.72Å
397	L	92.7	Very high	91.2	Very high	10 Å²	10	12.8 Å²	12.8	5%	0.052	7%	0.066	C	C	.	.	H	α-helix	trans	-63.7	-39.5	173.2	-76.8	176	0	0	0	111.8	I334 P355 L358 I363 V393 L400 E401	I334-L397 HydrophobicContact CD1-CD2 4.23Å; I334-L397 HydrophobicContact CG2-CD2 4.38Å; P355-L397 HydrophobicContact CB-CD2 4.38Å; P355-L397 WeakPolarHBondContact O-CD2 3.35Å; L358-L397 HydrophobicContact CB-CD1 4.41Å; I363-L397 HydrophobicContact CG1-CD1 3.73Å; V393-L397 HydrophobicContact CG1-CD1 3.62Å; V393-L397 HydrophobicContact CG1-CG 4.05Å; V393-L397 VanDerWaalsContact O-CB 3.28Å; V393-L397 WeakPolarHBondContact O-CB 3.31Å; V393-L397 VanDerWaalsContact O-CG 3.29Å; V393-L397 WeakPolarHBondContact O-CG 3.44Å; V393-L397 PolarHBondContact O-N 3.46Å; L397-L400 HydrophobicContact CD2-CD2 4.44Å; L397-L400 WeakPolarHBondContact O-CB 3.3Å; L397-L400 PolarHBondContact O-N 3.26Å; L397-E401 WeakPolarHBondContact O-CB 3.37Å; L397-E401 PolarHBondContact O-N 2.96Å
398	H	91.1	Very high	91.3	Very high	31 Å²	31	12.1 Å²	12.1	14%	0.144	6%	0.063	C	C	.	.	H	α-helix	trans	-69.5	-33.7	173.8	-175.5	52.9	0	0	0	112.1	I394 L400 E401 L402 Y414	I394-H398 PolarHBondContact O-N 3.16Å; I394-H398 VanDerWaalsContact O-N 3.13Å; H398-L400 VanDerWaalsContact C-N 3.33Å; H398-L400 PolarHBondContact O-N 2.81Å; H398-E401 IonicContact CE1-OE2 2.72Å; H398-E401 IonicContact CG-OE2 2.8Å; H398-E401 IonicContact ND1-OE2 3.52Å; H398-E401 PolarHBondContact ND1-OE2 3.46Å; H398-E401 WeakPolarHBondContact O-CB 3.11Å; H398-E401 PolarHBondContact O-N 3.04Å; H398-L402 WeakPolarHBondContact O-CG 3.3Å; H398-L402 PolarHBondContact O-N 2.88Å; H398-Y414 AromaticContact CD2-CD2 3.94Å; H398-Y414 AromaticContact CD2-CE2 3.51Å; H398-Y414 AromaticContact CD2-CZ 3.93Å
399	G	92.1	Very high	91	Very high	1 Å²	1	13.7 Å²	13.7	1%	0.01	7%	0.068	C	C	.	.	H	α-helix	trans	-59	-42.4	167.1	0	0	0	0	0	112.9	C395 L396 L402 L403	C395-G399 PolarHBondContact O-N 3.45Å; C395-G399 VanDerWaalsContact O-N 3.13Å; L396-G399 PolarHBondContact O-N 2.98Å; G399-L402 PolarHBondContact O-N 2.9Å; G399-L403 WeakPolarHBondContact O-CB 3.18Å; G399-L403 PolarHBondContact O-N 2.72Å
400	L	92.9	Very high	90.7	Very high	10 Å²	10	13.8 Å²	13.8	5%	0.052	7%	0.069	C	C	.	.	H	α-helix	trans	-66.3	-39.6	177.6	-173.8	66.3	0	0	0	111.8	R327 L330 I331 I334 P355 L396 L397 H398 L403 V404	R327-L400 HydrophobicContact CG-CD1 3.79Å; L330-L400 HydrophobicContact CB-CD1 4.49Å; L330-L400 HydrophobicContact CD2-CB 3.98Å; L330-L400 HydrophobicContact CD2-CD1 4.13Å; L330-L400 HydrophobicContact CG-CB 4.49Å; L330-L400 HydrophobicContact CG-CD1 4.39Å; I331-L400 HydrophobicContact CG1-CD1 4.07Å; I331-L400 HydrophobicContact CG1-CD2 4.03Å; I334-L400 HydrophobicContact CD1-CB 4.17Å; I334-L400 HydrophobicContact CD1-CD2 3.84Å; P355-L400 HydrophobicContact CB-CD2 4.44Å; L396-L400 PolarHBondContact O-N 3.4Å; L397-L400 HydrophobicContact CD2-CD2 4.44Å; L397-L400 WeakPolarHBondContact O-CB 3.3Å; L397-L400 PolarHBondContact O-N 3.26Å; H398-L400 VanDerWaalsContact C-N 3.33Å; H398-L400 PolarHBondContact O-N 2.81Å; L400-L403 PolarHBondContact O-N 2.68Å; L400-V404 WeakPolarHBondContact O-CB 3.2Å; L400-V404 VanDerWaalsContact O-CG2 3.3Å; L400-V404 WeakPolarHBondContact O-CG2 3.32Å; L400-V404 PolarHBondContact O-N 2.93Å
401	E	89.5	Confident	90.6	Very high	64 Å²	64	13.8 Å²	13.8	30%	0.299	7%	0.069	S	C	.	.	H	α-helix	trans	-58.8	-53.4	173	-177.7	-179.9	-146	0	0	111.6	L397 H398 L403 V404 Q405	L397-E401 WeakPolarHBondContact O-CB 3.37Å; L397-E401 PolarHBondContact O-N 2.96Å; H398-E401 IonicContact CE1-OE2 2.72Å; H398-E401 IonicContact CG-OE2 2.8Å; H398-E401 IonicContact ND1-OE2 3.52Å; H398-E401 PolarHBondContact ND1-OE2 3.46Å; H398-E401 WeakPolarHBondContact O-CB 3.11Å; H398-E401 PolarHBondContact O-N 3.04Å; E401-L403 VanDerWaalsContact C-N 3.31Å; E401-L403 PolarHBondContact O-N 3.04Å; E401-V404 PolarHBondContact O-N 3.42Å; E401-Q405 VanDerWaalsContact CG-NE2 3.35Å; E401-Q405 WeakPolarHBondContact O-CB 3.2Å; E401-Q405 WeakPolarHBondContact O-CG 3.45Å; E401-Q405 PolarHBondContact O-N 3.29Å
402	L	89.8	Confident	90.4	Very high	5 Å²	5	13.8 Å²	13.8	3%	0.026	7%	0.067	C	C	.	.	H	α-helix	trans	-58	-42.5	177.7	-70.7	173	0	0	0	112.1	H398 G399 V404 H406 G407 P410 Y414 F516	H398-L402 WeakPolarHBondContact O-CG 3.3Å; H398-L402 PolarHBondContact O-N 2.88Å; G399-L402 PolarHBondContact O-N 2.9Å; L402-V404 PolarHBondContact O-N 3.34Å; L402-H406 CarbonylContact O-C 3.54Å; L402-H406 PolarHBondContact O-N 2.94Å; L402-G407 PolarHBondContact O-N 3.37Å; L402-P410 HydrophobicContact CB-CB 4.48Å; L402-P410 HydrophobicContact CD2-CB 4.43Å; L402-Y414 HydrophobicContact CD1-CD1 4.4Å; L402-Y414 HydrophobicContact CD1-CD2 3.9Å; L402-Y414 HydrophobicContact CD1-CG 3.69Å; L402-F516 HydrophobicContact CD2-CD1 3.98Å; L402-F516 HydrophobicContact CD2-CE1 3.49Å; L402-F516 VanDerWaalsContact CD2-CE1 3.49Å; L402-F516 HydrophobicContact CD2-CE2 4.42Å; L402-F516 HydrophobicContact CD2-CZ 3.74Å
403	L	92	Very high	90.1	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-63.1	-39.5	178.3	-179.3	61.2	0	0	0	112.8	L323 R327 L330 G399 L400 E401 G407 L408 L411	L323-L403 HydrophobicContact CD2-CD1 3.79Å; R327-L403 HydrophobicContact CB-CD2 4.18Å; L330-L403 HydrophobicContact CD2-CD2 4.27Å; G399-L403 WeakPolarHBondContact O-CB 3.18Å; G399-L403 PolarHBondContact O-N 2.72Å; L400-L403 PolarHBondContact O-N 2.68Å; E401-L403 VanDerWaalsContact C-N 3.31Å; E401-L403 PolarHBondContact O-N 3.04Å; L403-G407 VanDerWaalsContact O-CA 3.26Å; L403-G407 WeakPolarHBondContact O-CA 3.48Å; L403-G407 PolarHBondContact O-N 3.02Å; L403-L408 HydrophobicContact CD1-CD2 3.55Å; L403-L408 HydrophobicContact CD1-CG 3.83Å; L403-L411 HydrophobicContact CB-CD2 4.04Å; L403-L411 HydrophobicContact CD1-CD2 3.96Å; L403-L411 HydrophobicContact CD2-CD2 3.99Å; L403-L411 HydrophobicContact CG-CD2 4.22Å
404	V	91.1	Very high	89.9	Confident	32 Å²	32	18.1 Å²	18.1	19%	0.194	8%	0.084	C	C	.	.	H	α-helix	trans	-83.6	-30.3	-176	171	0	0	0	0	112.5	L319 R327 L400 E401 L402 H480 T643	L319-V404 HydrophobicContact CD2-CG1 4.46Å; L319-V404 HydrophobicContact CD2-CG2 4.5Å; R327-V404 HydrophobicContact CG-CG2 4.38Å; L400-V404 WeakPolarHBondContact O-CB 3.2Å; L400-V404 VanDerWaalsContact O-CG2 3.3Å; L400-V404 WeakPolarHBondContact O-CG2 3.32Å; L400-V404 PolarHBondContact O-N 2.93Å; E401-V404 PolarHBondContact O-N 3.42Å; L402-V404 PolarHBondContact O-N 3.34Å; V404-H480 PolarHBondContact O-NE2 3.35Å; V404-T643 HydrophobicContact CG1-CG2 3.93Å; V404-T643 VanDerWaalsContact O-CB 3.31Å; V404-T643 WeakPolarHBondContact O-CB 3.35Å; V404-T643 WeakPolarHBondContact O-CG2 3.43Å; V404-T643 PolarHBondContact O-OG1 2.78Å
405	Q	86.7	Confident	89.7	Confident	40 Å²	40	16.6 Å²	16.6	19%	0.187	8%	0.076	C	C	.	.	H	α-helix	trans	-90	-36	-179.7	-65.3	179.9	18	0	0	113.2	E401 K482	E401-Q405 VanDerWaalsContact CG-NE2 3.35Å; E401-Q405 WeakPolarHBondContact O-CB 3.2Å; E401-Q405 WeakPolarHBondContact O-CG 3.45Å; E401-Q405 PolarHBondContact O-N 3.29Å; Q405-K482 PolarHBondContact O-NZ 3.22Å
406	H	86.2	Confident	89.4	Confident	1 Å²	1	19 Å²	19	1%	0.005	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-133.6	-17.2	-170.5	-49.4	-61.4	0	0	0	115.1	L402 P410 H480 F516 F614 D615	L402-H406 CarbonylContact O-C 3.54Å; L402-H406 PolarHBondContact O-N 2.94Å; H406-P410 HydrophobicContact CB-CB 4.38Å; H406-P410 HydrophobicContact CB-CG 3.79Å; H406-H480 WeakPolarHBondContact O-CB 3.47Å; H406-F516 AromaticContact CD2-CD2 3.47Å; H406-F516 VanDerWaalsContact CD2-CD2 3.47Å; H406-F516 WeakPolarHBondContact CD2-CD2 3.5Å; H406-F516 AromaticContact CD2-CE2 3.74Å; H406-F516 AromaticContact CE1-CD2 3.71Å; H406-F516 AromaticContact NE2-CD2 3.03Å; H406-F516 WeakPolarHBondContact NE2-CD2 3.42Å; H406-F516 AromaticContact NE2-CE2 3.21Å; H406-F516 WeakPolarHBondContact NE2-CE2 3.26Å; H406-F614 AromaticContact ND1-CD1 3.91Å; H406-F614 AromaticContact ND1-CE1 3.79Å; H406-D615 IonicContact CE1-OD2 2.72Å; H406-D615 PolarHBondContact CE1-OD2 3.27Å; H406-D615 VanDerWaalsContact CE1-OD2 3.24Å; H406-D615 IonicContact ND1-OD2 3.71Å
407	G	89.9	Confident	89	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	9%	0.089	C	C	.	.			trans	97.1	-159.1	170.3	0	0	0	0	0	116.4	L402 L403 P410 L411 G479	L402-G407 PolarHBondContact O-N 3.37Å; L403-G407 VanDerWaalsContact O-CA 3.26Å; L403-G407 WeakPolarHBondContact O-CA 3.48Å; L403-G407 PolarHBondContact O-N 3.02Å; G407-P410 WeakPolarHBondContact O-CD 3.26Å; G407-L411 PolarHBondContact O-N 3.05Å; G407-G479 VanDerWaalsContact CA-O 3.25Å; G407-G479 WeakPolarHBondContact CA-O 3.46Å
408	L	89.7	Confident	88.7	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-75.6	-28.9	-162.2	-73.3	160.7	0	0	0	114.8	L323 Y326 L403 L411 Y412 L445 R448 F449 G479	L323-L408 HydrophobicContact CD2-CD1 3.68Å; L323-L408 HydrophobicContact CD2-CD2 4.43Å; L323-L408 HydrophobicContact CD2-CG 3.61Å; Y326-L408 HydrophobicContact CD1-CD2 3.82Å; Y326-L408 HydrophobicContact CD2-CD1 4.01Å; Y326-L408 HydrophobicContact CD2-CD2 3.81Å; Y326-L408 HydrophobicContact CE1-CD2 4.18Å; Y326-L408 HydrophobicContact CE2-CD1 4.04Å; Y326-L408 HydrophobicContact CE2-CD2 4.22Å; Y326-L408 HydrophobicContact CG-CD2 3.61Å; L403-L408 HydrophobicContact CD1-CD2 3.55Å; L403-L408 HydrophobicContact CD1-CG 3.83Å; L408-L411 PolarHBondContact O-N 3.43Å; L408-Y412 WeakPolarHBondContact O-CB 3.01Å; L408-Y412 PolarHBondContact O-N 2.84Å; L408-L445 HydrophobicContact CD2-CD1 3.85Å; L408-L445 HydrophobicContact CD2-CG 4.01Å; L408-R448 VanDerWaalsContact CD1-CZ 3.44Å; L408-F449 HydrophobicContact CB-CE2 4.1Å; L408-F449 HydrophobicContact CB-CZ 3.82Å; L408-F449 WeakPolarHBondContact O-CE2 3.49Å; L408-G479 PolarHBondContact N-O 2.84Å
409	R	85.9	Confident	88.4	Confident	40 Å²	40	18.4 Å²	18.4	15%	0.151	8%	0.084	C	C	.	.	H	α-helix	trans	-72.8	-42.5	-179.1	-173.3	79.1	71	165.7	-0.3	112	Y412 R413 F449 E522	R409-Y412 PolarHBondContact O-N 3.26Å; R409-R413 PolarHBondContact O-N 2.76Å; R409-R413 VanDerWaalsContact O-N 3.09Å; R409-F449 HydrophobicContact CB-CE1 4.48Å; R409-F449 HydrophobicContact CB-CZ 4.05Å; R409-F449 VanDerWaalsContact CZ-CE1 3.42Å; R409-F449 VanDerWaalsContact NH1-CD1 3.35Å; R409-E522 WeakPolarHBondContact CB-OE2 3.48Å
410	P	86.9	Confident	87.9	Confident	2 Å²	2	21.4 Å²	21.4	1%	0.013	11%	0.105	C	C	.	.	H	α-helix	trans	-61.5	-41.2	167.5	-28.5	39.4	0	0	0	113.1	L402 H406 G407 Y412 R413 Y414 D518	L402-P410 HydrophobicContact CB-CB 4.48Å; L402-P410 HydrophobicContact CD2-CB 4.43Å; H406-P410 HydrophobicContact CB-CB 4.38Å; H406-P410 HydrophobicContact CB-CG 3.79Å; G407-P410 WeakPolarHBondContact O-CD 3.26Å; P410-Y412 VanDerWaalsContact C-N 3.35Å; P410-Y412 PolarHBondContact O-N 2.78Å; P410-R413 PolarHBondContact O-N 3.36Å; P410-Y414 VanDerWaalsContact O-CB 3.32Å; P410-Y414 WeakPolarHBondContact O-CB 3.5Å; P410-Y414 PolarHBondContact O-N 2.95Å; P410-D518 HydrophobicContact CG-CB 4.31Å
411	L	90.2	Very high	87.2	Confident	0 Å²	0	22 Å²	22	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-60.7	-42.4	174.3	178.5	59.2	0	0	0	111.9	L330 L403 G407 L408 Y414 L415 L445	L330-L411 HydrophobicContact CD2-CD2 4.28Å; L403-L411 HydrophobicContact CB-CD2 4.04Å; L403-L411 HydrophobicContact CD1-CD2 3.96Å; L403-L411 HydrophobicContact CD2-CD2 3.99Å; L403-L411 HydrophobicContact CG-CD2 4.22Å; G407-L411 PolarHBondContact O-N 3.05Å; L408-L411 PolarHBondContact O-N 3.43Å; L411-Y414 PolarHBondContact O-N 3.31Å; L411-L415 HydrophobicContact CD1-CD1 3.76Å; L411-L415 HydrophobicContact CD1-CD2 4.49Å; L411-L415 HydrophobicContact CD1-CG 3.8Å; L411-L415 HydrophobicContact CG-CD1 3.99Å; L411-L415 HydrophobicContact CG-CG 4.39Å; L411-L415 WeakPolarHBondContact O-CG 3.34Å; L411-L415 PolarHBondContact O-N 3Å; L411-L445 HydrophobicContact CD2-CD1 3.5Å; L411-L445 HydrophobicContact CG-CD1 3.84Å
412	Y	88.7	Confident	86.5	Confident	9 Å²	9	25.8 Å²	25.8	4%	0.035	14%	0.136	C	C	.	.	H	α-helix	trans	-56.9	-55.9	175.2	-177.9	-94.9	0	0	0	111.5	L408 R409 P410 Y414 L415 E416 W442 L445 A446 F449 M451 Q462	L408-Y412 WeakPolarHBondContact O-CB 3.01Å; L408-Y412 PolarHBondContact O-N 2.84Å; R409-Y412 PolarHBondContact O-N 3.26Å; P410-Y412 VanDerWaalsContact C-N 3.35Å; P410-Y412 PolarHBondContact O-N 2.78Å; Y412-Y414 PolarHBondContact O-N 3.42Å; Y412-L415 PolarHBondContact O-N 2.86Å; Y412-E416 HydrophobicContact CE1-CB 4.22Å; Y412-E416 HydrophobicContact CE1-CG 4.44Å; Y412-E416 WeakPolarHBondContact CE1-OE2 3.36Å; Y412-E416 VanDerWaalsContact O-CB 3.25Å; Y412-E416 WeakPolarHBondContact O-CB 3.17Å; Y412-E416 PolarHBondContact O-N 2.94Å; Y412-E416 PolarHBondContact OH-OE1 3.15Å; Y412-W442 HydrophobicContact CD2-CH2 4.15Å; Y412-W442 AromaticContact CD2-CZ3 3.85Å; Y412-W442 HydrophobicContact CD2-CZ3 3.85Å; Y412-W442 AromaticContact CE2-CH2 3.57Å; Y412-W442 HydrophobicContact CE2-CH2 3.57Å; Y412-W442 HydrophobicContact CE2-CZ2 4.41Å; Y412-W442 AromaticContact CE2-CZ3 3.73Å; Y412-W442 HydrophobicContact CE2-CZ3 3.73Å; Y412-W442 AromaticContact CZ-CH2 3.92Å; Y412-L445 HydrophobicContact CD2-CD2 3.62Å; Y412-L445 HydrophobicContact CG-CD2 4.08Å; Y412-A446 HydrophobicContact CE2-CB 3.79Å; Y412-F449 AromaticContact CD2-CD2 3.88Å; Y412-F449 HydrophobicContact CD2-CD2 3.88Å; Y412-F449 AromaticContact CG-CD2 3.81Å; Y412-F449 HydrophobicContact CG-CD2 3.81Å; Y412-F449 HydrophobicContact CG-CE2 4.3Å; Y412-M451 HydrophobicContact CE1-SD 4.41Å; Y412-M451 WeakPolarHBondContact OH-CE 3.47Å; Y412-M451 PolarHBondContact OH-SD 3.14Å; Y412-Q462 PolarHBondContact OH-NE2 3.15Å
413	R	85.5	Confident	85.9	Confident	77 Å²	77	30 Å²	30	29%	0.291	15%	0.151	S	C	.	.	H	α-helix	trans	-63.5	-30.9	-178.3	-71.5	-178.1	174.3	169.2	2.6	112.5	R409 P410 G417 D518	R409-R413 PolarHBondContact O-N 2.76Å; R409-R413 VanDerWaalsContact O-N 3.09Å; P410-R413 PolarHBondContact O-N 3.36Å; R413-G417 PolarHBondContact O-N 2.86Å; R413-G417 VanDerWaalsContact O-N 3.08Å; R413-D518 WeakPolarHBondContact CD-OD1 3.4Å; R413-D518 IonicContact CZ-OD1 2.92Å; R413-D518 IonicContact NE-OD1 3.06Å; R413-D518 IonicContact NH1-OD1 3.58Å; R413-D518 PolarHBondContact NH1-OD1 2.92Å
414	Y	88.9	Confident	85.3	Confident	14 Å²	14	30.7 Å²	30.7	6%	0.055	16%	0.158	C	C	.	.	H	α-helix	trans	-66.3	-54.7	172.1	178.5	-99.9	0	0	0	111.6	C395 H398 L402 P410 L411 Y412 E416 G417 V418	C395-Y414 WeakPolarHBondContact CA-OH 3.46Å; C395-Y414 WeakPolarHBondContact O-CE1 3.24Å; C395-Y414 PolarHBondContact O-OH 3.14Å; C395-Y414 PolarHBondContact SG-OH 3.18Å; H398-Y414 AromaticContact CD2-CD2 3.94Å; H398-Y414 AromaticContact CD2-CE2 3.51Å; H398-Y414 AromaticContact CD2-CZ 3.93Å; L402-Y414 HydrophobicContact CD1-CD1 4.4Å; L402-Y414 HydrophobicContact CD1-CD2 3.9Å; L402-Y414 HydrophobicContact CD1-CG 3.69Å; P410-Y414 VanDerWaalsContact O-CB 3.32Å; P410-Y414 WeakPolarHBondContact O-CB 3.5Å; P410-Y414 PolarHBondContact O-N 2.95Å; L411-Y414 PolarHBondContact O-N 3.31Å; Y412-Y414 PolarHBondContact O-N 3.42Å; Y414-E416 VanDerWaalsContact C-N 3.34Å; Y414-E416 PolarHBondContact O-N 3.2Å; Y414-G417 CarbonylContact O-C 3.52Å; Y414-G417 WeakPolarHBondContact O-CA 3.38Å; Y414-G417 PolarHBondContact O-N 3.4Å; Y414-G417 VanDerWaalsContact O-N 3.12Å; Y414-V418 HydrophobicContact CD1-CG2 4.24Å; Y414-V418 HydrophobicContact CE1-CG2 3.75Å; Y414-V418 HydrophobicContact CE2-CG2 4.25Å; Y414-V418 WeakPolarHBondContact O-CG2 3.29Å; Y414-V418 PolarHBondContact O-N 2.86Å
415	L	89	Confident	84.9	Confident	2 Å²	2	31.9 Å²	31.9	1%	0.01	17%	0.168	C	C	.	.	H	α-helix	trans	-65.3	-35.2	-179.6	-69.5	177.7	0	0	0	112.4	L411 Y412 V418 Y419 L441 W442	L411-L415 HydrophobicContact CD1-CD1 3.76Å; L411-L415 HydrophobicContact CD1-CD2 4.49Å; L411-L415 HydrophobicContact CD1-CG 3.8Å; L411-L415 HydrophobicContact CG-CD1 3.99Å; L411-L415 HydrophobicContact CG-CG 4.39Å; L411-L415 WeakPolarHBondContact O-CG 3.34Å; L411-L415 PolarHBondContact O-N 3Å; Y412-L415 PolarHBondContact O-N 2.86Å; L415-V418 CarbonylContact O-C 3.16Å; L415-V418 WeakPolarHBondContact O-CB 3.46Å; L415-V418 PolarHBondContact O-N 2.96Å; L415-Y419 HydrophobicContact CB-CD2 4.42Å; L415-Y419 HydrophobicContact CB-CE2 4.39Å; L415-Y419 WeakPolarHBondContact O-CD2 3.39Å; L415-Y419 PolarHBondContact O-N 2.75Å; L415-L441 HydrophobicContact CD1-CD2 4.28Å; L415-W442 HydrophobicContact CB-CE3 3.81Å; L415-W442 HydrophobicContact CB-CZ3 3.65Å; L415-W442 HydrophobicContact CD1-CE3 4.26Å
416	E	85.9	Confident	84.6	Confident	60 Å²	60	34.3 Å²	34.3	28%	0.28	19%	0.189	S	C	.	.	H	α-helix	trans	-60.2	-45.4	170.4	-177.7	171.2	-126.6	0	0	111.5	Y412 Y414 V418 Y419 S420 W442 Q462	Y412-E416 HydrophobicContact CE1-CB 4.22Å; Y412-E416 HydrophobicContact CE1-CG 4.44Å; Y412-E416 WeakPolarHBondContact CE1-OE2 3.36Å; Y412-E416 VanDerWaalsContact O-CB 3.25Å; Y412-E416 WeakPolarHBondContact O-CB 3.17Å; Y412-E416 PolarHBondContact O-N 2.94Å; Y412-E416 PolarHBondContact OH-OE1 3.15Å; Y414-E416 VanDerWaalsContact C-N 3.34Å; Y414-E416 PolarHBondContact O-N 3.2Å; E416-V418 VanDerWaalsContact C-N 3.31Å; E416-V418 PolarHBondContact O-N 3.39Å; E416-Y419 PolarHBondContact O-N 3.01Å; E416-S420 VanDerWaalsContact O-CB 3.26Å; E416-S420 WeakPolarHBondContact O-CB 3.39Å; E416-S420 PolarHBondContact O-N 3.03Å; E416-S420 PolarHBondContact O-OG 3.05Å; E416-W442 HydrophobicContact CB-CH2 3.96Å; E416-Q462 PolarHBondContact OE1-NE2 3Å
417	G	84.7	Confident	84.4	Confident	7 Å²	7	37.9 Å²	37.9	7%	0.072	21%	0.207	C	C	.	.	H	α-helix	trans	-61.7	-35.8	172.3	0	0	0	0	0	113.3	R413 Y414 S420 G421 N422 R423	R413-G417 PolarHBondContact O-N 2.86Å; R413-G417 VanDerWaalsContact O-N 3.08Å; Y414-G417 CarbonylContact O-C 3.52Å; Y414-G417 WeakPolarHBondContact O-CA 3.38Å; Y414-G417 PolarHBondContact O-N 3.4Å; Y414-G417 VanDerWaalsContact O-N 3.12Å; G417-S420 WeakPolarHBondContact CA-OG 3.23Å; G417-S420 PolarHBondContact O-OG 2.88Å; G417-S420 VanDerWaalsContact O-OG 3.13Å; G417-G421 PolarHBondContact O-N 3.35Å; G417-N422 PolarHBondContact O-N 2.88Å; G417-R423 PolarHBondContact O-N 2.89Å
418	V	86.9	Confident	84.1	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-68.4	-51.6	174.8	165.9	0	0	0	0	110.9	Y414 L415 E416 G421 R423 A424 R429 L432	Y414-V418 HydrophobicContact CD1-CG2 4.24Å; Y414-V418 HydrophobicContact CE1-CG2 3.75Å; Y414-V418 HydrophobicContact CE2-CG2 4.25Å; Y414-V418 WeakPolarHBondContact O-CG2 3.29Å; Y414-V418 PolarHBondContact O-N 2.86Å; L415-V418 CarbonylContact O-C 3.16Å; L415-V418 WeakPolarHBondContact O-CB 3.46Å; L415-V418 PolarHBondContact O-N 2.96Å; E416-V418 VanDerWaalsContact C-N 3.31Å; E416-V418 PolarHBondContact O-N 3.39Å; V418-G421 PolarHBondContact O-N 3.21Å; V418-R423 HydrophobicContact CG2-CB 4.18Å; V418-A424 HydrophobicContact CB-CB 4.22Å; V418-A424 HydrophobicContact CG1-CB 3.77Å; V418-A424 HydrophobicContact CG2-CB 4.27Å; V418-R429 WeakPolarHBondContact O-CD 3.38Å; V418-R429 VanDerWaalsContact O-CG 3.22Å; V418-R429 WeakPolarHBondContact O-CG 3.41Å; V418-L432 HydrophobicContact CG1-CD2 3.53Å
419	Y	84.4	Confident	83.9	Confident	22 Å²	22	41.7 Å²	41.7	9%	0.086	22%	0.223	C	C	.	.	H	α-helix	trans	-69.8	-41	-176.6	-75.5	-58.4	0	0	0	113.7	L415 E416 G421 R429 L432 N433 M438 W442 W460	L415-Y419 HydrophobicContact CB-CD2 4.42Å; L415-Y419 HydrophobicContact CB-CE2 4.39Å; L415-Y419 WeakPolarHBondContact O-CD2 3.39Å; L415-Y419 PolarHBondContact O-N 2.75Å; E416-Y419 PolarHBondContact O-N 3.01Å; Y419-G421 PolarHBondContact O-N 2.93Å; Y419-R429 WeakPolarHBondContact O-CD 3.47Å; Y419-R429 PolarHBondContact O-NH1 2.89Å; Y419-L432 HydrophobicContact CD1-CD2 4.28Å; Y419-L432 HydrophobicContact CE1-CD2 3.61Å; Y419-L432 HydrophobicContact CE1-CG 4.12Å; Y419-L432 HydrophobicContact CE2-CD2 4.45Å; Y419-N433 WeakPolarHBondContact CE1-OD1 3.45Å; Y419-M438 WeakPolarHBondContact OH-CE 3.43Å; Y419-W442 AromaticContact CD2-CD2 3.76Å; Y419-W442 HydrophobicContact CD2-CD2 3.76Å; Y419-W442 AromaticContact CD2-CE2 3.74Å; Y419-W442 HydrophobicContact CD2-CE3 4.03Å; Y419-W442 HydrophobicContact CD2-CG 4.24Å; Y419-W442 HydrophobicContact CD2-CH2 4.32Å; Y419-W442 HydrophobicContact CD2-CZ2 4.04Å; Y419-W442 HydrophobicContact CD2-CZ3 4.31Å; Y419-W442 HydrophobicContact CE2-CB 4.1Å; Y419-W442 AromaticContact CE2-CD2 3.52Å; Y419-W442 HydrophobicContact CE2-CD2 3.52Å; Y419-W442 AromaticContact CE2-CE2 3.95Å; Y419-W442 AromaticContact CE2-CE3 3.86Å; Y419-W442 HydrophobicContact CE2-CE3 3.86Å; Y419-W442 AromaticContact CE2-CG 3.61Å; Y419-W442 HydrophobicContact CE2-CG 3.61Å; Y419-W460 AromaticContact CD1-CD1 3.56Å; Y419-W460 AromaticContact CD1-NE1 3.56Å; Y419-W460 AromaticContact CE1-CD1 3.95Å; Y419-W460 AromaticContact CE1-NE1 3.42Å; Y419-W460 AromaticContact CG-CD1 3.88Å; Y419-W460 AromaticContact CZ-NE1 3.89Å
420	S	81.1	Confident	83.8	Confident	64 Å²	64	42.2 Å²	42.2	45%	0.448	23%	0.232	S	C	.	.	H	α-helix	trans	-58	-32.2	171	55.4	0	0	0	0	111.9	E416 G417 R429	E416-S420 VanDerWaalsContact O-CB 3.26Å; E416-S420 WeakPolarHBondContact O-CB 3.39Å; E416-S420 PolarHBondContact O-N 3.03Å; E416-S420 PolarHBondContact O-OG 3.05Å; G417-S420 WeakPolarHBondContact CA-OG 3.23Å; G417-S420 PolarHBondContact O-OG 2.88Å; G417-S420 VanDerWaalsContact O-OG 3.13Å; S420-R429 PolarHBondContact O-NH1 3.47Å
421	G	78.6	Confident	83.7	Confident	23 Å²	23	44.7 Å²	44.7	24%	0.237	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	100.9	4.7	-179.4	0	0	0	0	0	114.8	G417 V418 Y419 R423 R429	G417-G421 PolarHBondContact O-N 3.35Å; V418-G421 PolarHBondContact O-N 3.21Å; Y419-G421 PolarHBondContact O-N 2.93Å; G421-R423 PolarHBondContact O-N 3.15Å; G421-R429 VanDerWaalsContact CA-NH1 3.27Å
422	N	75	Confident	83.6	Confident	144 Å²	144	44.7 Å²	44.7	77%	0.77	24%	0.244	S	C	*	.	S	Bend	trans	-71.9	-19.8	176.8	-63.8	-16.9	0	0	0	112.4	G417	G417-N422 PolarHBondContact O-N 2.88Å
423	R	77.4	Confident	83.3	Confident	92 Å²	92	45.7 Å²	45.7	35%	0.347	25%	0.25	S	C	.	.	S	Bend	trans	-126.5	2	-178	-55.4	-173.3	-173.4	-164.5	6.2	114.7	G417 V418 G421	G417-R423 PolarHBondContact O-N 2.89Å; V418-R423 HydrophobicContact CG2-CB 4.18Å; G421-R423 PolarHBondContact O-N 3.15Å
424	A	79	Confident	83.2	Confident	16 Å²	16	48.8 Å²	48.8	13%	0.132	27%	0.265	C	S	.	.	S	Bend	trans	-152.7	144.8	-176.9	0	0	0	0	0	114	V418 V428 R429	V418-A424 HydrophobicContact CB-CB 4.22Å; V418-A424 HydrophobicContact CG1-CB 3.77Å; V418-A424 HydrophobicContact CG2-CB 4.27Å; A424-V428 HydrophobicContact CB-CB 4.45Å; A424-V428 HydrophobicContact CB-CG1 4.19Å; A424-R429 HydrophobicContact CB-CG 4.36Å; A424-R429 PolarHBondContact O-NE 2.96Å
425	S	81.5	Confident	83.2	Confident	57 Å²	57	48.7 Å²	48.7	40%	0.399	27%	0.266	S	S	.	.			trans	-61.7	159.6	177	75.6	0	0	0	0	112.2	L427 V428 R429	S425-L427 PolarHBondContact O-N 2.84Å; S425-V428 PolarHBondContact O-N 2.84Å; S425-V428 WeakPolarHBondContact OG-CG2 3.35Å; S425-V428 PolarHBondContact OG-N 3.22Å; S425-R429 PolarHBondContact O-N 2.72Å; S425-R429 VanDerWaalsContact O-N 3.12Å; S425-R429 PolarHBondContact O-NE 3.47Å
426	S	80.9	Confident	82.8	Confident	90 Å²	90	51.4 Å²	51.4	63%	0.629	28%	0.284	S	S	*	.	H	α-helix	trans	-58.3	-37.5	173.4	48	0	0	0	0	112	S430	S426-S430 WeakPolarHBondContact O-CB 3.29Å; S426-S430 PolarHBondContact O-N 3.08Å
427	L	82.3	Confident	82.7	Confident	76 Å²	76	52.9 Å²	52.9	40%	0.398	29%	0.294	S	S	.	.	H	α-helix	trans	-65	-50.7	178.7	-171.2	67.6	0	0	0	111.3	C388 S425 R429 S430 Q431	C388-L427 HydrophobicContact CB-CD2 3.88Å; C388-L427 HydrophobicContact CB-CG 4.38Å; S425-L427 PolarHBondContact O-N 2.84Å; L427-R429 PolarHBondContact O-N 3.07Å; L427-S430 PolarHBondContact O-N 3.28Å; L427-S430 VanDerWaalsContact O-N 3.08Å; L427-S430 PolarHBondContact O-OG 3.43Å; L427-Q431 WeakPolarHBondContact O-CG 3.34Å; L427-Q431 PolarHBondContact O-N 3.38Å; L427-Q431 VanDerWaalsContact O-N 3.12Å
428	V	84.2	Confident	82.9	Confident	8 Å²	8	52.6 Å²	52.6	5%	0.048	29%	0.29	C	S	.	.	H	α-helix	trans	-57.8	-49.1	178.5	170.3	0	0	0	0	110.6	A391 L392 A424 S425 S430 Q431 L432	A391-V428 HydrophobicContact CB-CG2 3.57Å; L392-V428 HydrophobicContact CD2-CG1 4.06Å; A424-V428 HydrophobicContact CB-CB 4.45Å; A424-V428 HydrophobicContact CB-CG1 4.19Å; S425-V428 PolarHBondContact O-N 2.84Å; S425-V428 WeakPolarHBondContact OG-CG2 3.35Å; S425-V428 PolarHBondContact OG-N 3.22Å; V428-S430 VanDerWaalsContact C-N 3.3Å; V428-S430 PolarHBondContact O-N 3.29Å; V428-Q431 PolarHBondContact O-N 2.97Å; V428-L432 WeakPolarHBondContact O-CB 3.45Å; V428-L432 PolarHBondContact O-N 2.93Å
429	R	85	Confident	82.8	Confident	72 Å²	72	55.6 Å²	55.6	27%	0.272	31%	0.306	S	S	.	.	H	α-helix	trans	-55	-43.5	174	-76.9	-176.8	-81.9	-178.4	-9.8	113.1	V418 Y419 S420 G421 A424 S425 L427 Q431 L432 N433	V418-R429 WeakPolarHBondContact O-CD 3.38Å; V418-R429 VanDerWaalsContact O-CG 3.22Å; V418-R429 WeakPolarHBondContact O-CG 3.41Å; Y419-R429 WeakPolarHBondContact O-CD 3.47Å; Y419-R429 PolarHBondContact O-NH1 2.89Å; S420-R429 PolarHBondContact O-NH1 3.47Å; G421-R429 VanDerWaalsContact CA-NH1 3.27Å; A424-R429 HydrophobicContact CB-CG 4.36Å; A424-R429 PolarHBondContact O-NE 2.96Å; S425-R429 PolarHBondContact O-N 2.72Å; S425-R429 VanDerWaalsContact O-N 3.12Å; S425-R429 PolarHBondContact O-NE 3.47Å; L427-R429 PolarHBondContact O-N 3.07Å; R429-Q431 VanDerWaalsContact C-N 3.27Å; R429-Q431 PolarHBondContact O-N 3.14Å; R429-L432 PolarHBondContact O-N 3.42Å; R429-N433 PolarHBondContact O-N 3.12Å
430	S	83.1	Confident	82.9	Confident	51 Å²	51	59.6 Å²	59.6	36%	0.357	33%	0.326	S	S	.	.	H	α-helix	trans	-67	-27	-177.6	79.2	0	0	0	0	113.4	S426 L427 V428 K434	S426-S430 WeakPolarHBondContact O-CB 3.29Å; S426-S430 PolarHBondContact O-N 3.08Å; L427-S430 PolarHBondContact O-N 3.28Å; L427-S430 VanDerWaalsContact O-N 3.08Å; L427-S430 PolarHBondContact O-OG 3.43Å; V428-S430 VanDerWaalsContact C-N 3.3Å; V428-S430 PolarHBondContact O-N 3.29Å; S430-K434 VanDerWaalsContact O-CE 3.26Å; S430-K434 WeakPolarHBondContact O-CE 3.37Å; S430-K434 WeakPolarHBondContact O-CG 3.2Å
431	Q	85.9	Confident	83.3	Confident	55 Å²	55	56.6 Å²	56.6	26%	0.257	31%	0.305	S	S	.	.	H	α-helix	trans	-90.6	-33	175.9	-57.5	-68.7	16.7	0	0	111.9	L392 L427 V428 R429 N433 K434 L435	L392-Q431 HydrophobicContact CD1-CB 3.73Å; L392-Q431 HydrophobicContact CD2-CB 4.28Å; L392-Q431 HydrophobicContact CG-CB 4.5Å; L427-Q431 WeakPolarHBondContact O-CG 3.34Å; L427-Q431 PolarHBondContact O-N 3.38Å; L427-Q431 VanDerWaalsContact O-N 3.12Å; V428-Q431 PolarHBondContact O-N 2.97Å; R429-Q431 VanDerWaalsContact C-N 3.27Å; R429-Q431 PolarHBondContact O-N 3.14Å; Q431-N433 VanDerWaalsContact C-N 3.28Å; Q431-N433 PolarHBondContact O-N 3.03Å; Q431-K434 WeakPolarHBondContact O-CA 3.21Å; Q431-K434 WeakPolarHBondContact O-CB 3.46Å; Q431-K434 PolarHBondContact O-N 3.2Å; Q431-L435 PolarHBondContact O-N 3.36Å
432	L	87.9	Confident	83.7	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-56.6	-40.9	175	-170.3	67.8	0	0	0	111.9	L392 L396 V418 Y419 V428 R429 K434 L435 M438	L392-L432 HydrophobicContact CD2-CB 4.15Å; L392-L432 HydrophobicContact CD2-CD1 4.26Å; L396-L432 HydrophobicContact CD2-CD1 3.8Å; L396-L432 HydrophobicContact CG-CD1 4.32Å; V418-L432 HydrophobicContact CG1-CD2 3.53Å; Y419-L432 HydrophobicContact CD1-CD2 4.28Å; Y419-L432 HydrophobicContact CE1-CD2 3.61Å; Y419-L432 HydrophobicContact CE1-CG 4.12Å; Y419-L432 HydrophobicContact CE2-CD2 4.45Å; V428-L432 WeakPolarHBondContact O-CB 3.45Å; V428-L432 PolarHBondContact O-N 2.93Å; R429-L432 PolarHBondContact O-N 3.42Å; L432-K434 PolarHBondContact O-N 3.26Å; L432-L435 HydrophobicContact CD1-CD1 4.33Å; L432-L435 PolarHBondContact O-N 3.09Å; L432-M438 HydrophobicContact CD1-CE 3.79Å; L432-M438 HydrophobicContact CD1-CG 4.25Å; L432-M438 HydrophobicContact CD1-SD 4.19Å; L432-M438 HydrophobicContact CG-CE 4.11Å; L432-M438 WeakPolarHBondContact O-CB 3.43Å
433	N	82	Confident	84.2	Confident	29 Å²	29	50.6 Å²	50.6	16%	0.155	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-15.7	173.7	-77.5	-8.3	0	0	0	114.5	Y419 R429 Q431 N439 G458 W460	Y419-N433 WeakPolarHBondContact CE1-OD1 3.45Å; R429-N433 PolarHBondContact O-N 3.12Å; Q431-N433 VanDerWaalsContact C-N 3.28Å; Q431-N433 PolarHBondContact O-N 3.03Å; N433-N439 PolarHBondContact O-ND2 3Å; N433-N439 PolarHBondContact O-OD1 3.46Å; N433-G458 PolarHBondContact ND2-O 2.74Å; N433-W460 PolarHBondContact OD1-NE1 2.89Å
434	K	84.4	Confident	84.6	Confident	142 Å²	142	47.6 Å²	47.6	62%	0.617	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	-13.6	179.2	-60.1	179	-159.3	160.9	0	113.4	S430 Q431 L432	S430-K434 VanDerWaalsContact O-CE 3.26Å; S430-K434 WeakPolarHBondContact O-CE 3.37Å; S430-K434 WeakPolarHBondContact O-CG 3.2Å; Q431-K434 WeakPolarHBondContact O-CA 3.21Å; Q431-K434 WeakPolarHBondContact O-CB 3.46Å; Q431-K434 PolarHBondContact O-N 3.2Å; L432-K434 PolarHBondContact O-N 3.26Å
435	L	87.1	Confident	84.9	Confident	12 Å²	12	46.8 Å²	46.8	6%	0.063	25%	0.252	C	S	.	.	S	Bend	trans	-66	137.8	175.1	-67.6	179.6	0	0	0	109.3	M336 P337 L392 L396 Q431 L432 M438	M336-L435 HydrophobicContact CB-CD2 4.22Å; P337-L435 HydrophobicContact CG-CD1 4.38Å; P337-L435 HydrophobicContact CG-CD2 4.48Å; L392-L435 HydrophobicContact CD2-CD1 4.36Å; L396-L435 HydrophobicContact CD1-CD1 3.71Å; Q431-L435 PolarHBondContact O-N 3.36Å; L432-L435 HydrophobicContact CD1-CD1 4.33Å; L432-L435 PolarHBondContact O-N 3.09Å; L435-M438 HydrophobicContact CB-CB 4.32Å; L435-M438 HydrophobicContact CB-CG 3.69Å; L435-M438 HydrophobicContact CD1-CG 4.26Å
436	P	82	Confident	85	Confident	60 Å²	60	44.1 Å²	44.1	39%	0.39	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	151.9	175	27.3	-34.3	0	0	0	109.9	C333 M336 M438	C333-P436 PolarHBondContact SG-O 3.43Å; C333-P436 VanDerWaalsContact SG-O 3.35Å; M336-P436 HydrophobicContact CG-CG 3.76Å; P436-M438 PolarHBondContact O-N 2.86Å
437	N	84.2	Confident	85.1	Confident	91 Å²	91	44.6 Å²	44.6	49%	0.487	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	63	-21	179.4	-51.8	-30.1	0	0	0	116.9	N439 H440 L441	N437-N439 VanDerWaalsContact C-N 3.31Å; N437-N439 PolarHBondContact O-N 3.21Å; N437-H440 WeakPolarHBondContact O-CA 3.28Å; N437-H440 WeakPolarHBondContact O-CB 3.2Å; N437-H440 PolarHBondContact O-N 3.3Å; N437-L441 PolarHBondContact O-N 2.75Å
438	M	88.6	Confident	85.1	Confident	0 Å²	0	43 Å²	43	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-55.2	-42.9	-180	-82.7	-57	-49.8	0	0	113.3	C333 L396 Y419 L432 L435 P436 H440 L441 W442	C333-M438 HydrophobicContact CB-CG 3.92Å; C333-M438 HydrophobicContact CB-SD 3.57Å; C333-M438 VanDerWaalsContact CB-SD 3.57Å; L396-M438 HydrophobicContact CD2-CE 4.21Å; L396-M438 HydrophobicContact CD2-SD 3.72Å; Y419-M438 WeakPolarHBondContact OH-CE 3.43Å; L432-M438 HydrophobicContact CD1-CE 3.79Å; L432-M438 HydrophobicContact CD1-CG 4.25Å; L432-M438 HydrophobicContact CD1-SD 4.19Å; L432-M438 HydrophobicContact CG-CE 4.11Å; L432-M438 WeakPolarHBondContact O-CB 3.43Å; L435-M438 HydrophobicContact CB-CB 4.32Å; L435-M438 HydrophobicContact CB-CG 3.69Å; L435-M438 HydrophobicContact CD1-CG 4.26Å; P436-M438 PolarHBondContact O-N 2.86Å; M438-H440 VanDerWaalsContact C-N 3.29Å; M438-H440 PolarHBondContact O-N 3.19Å; M438-L441 HydrophobicContact CE-CD2 3.84Å; M438-L441 PolarHBondContact O-N 3.26Å; M438-L441 HydrophobicContact SD-CD2 3.96Å; M438-W442 WeakPolarHBondContact O-CB 3.21Å; M438-W442 PolarHBondContact O-N 2.87Å
439	N	84	Confident	84.6	Confident	63 Å²	63	43.6 Å²	43.6	34%	0.337	22%	0.216	S	C	.	.	H	α-helix	trans	-65.7	-33.1	179	-60.1	-25.3	0	0	0	111.8	N433 N437 T443 W460	N433-N439 PolarHBondContact O-ND2 3Å; N433-N439 PolarHBondContact O-OD1 3.46Å; N437-N439 VanDerWaalsContact C-N 3.31Å; N437-N439 PolarHBondContact O-N 3.21Å; N439-T443 WeakPolarHBondContact O-CB 3.28Å; N439-T443 PolarHBondContact O-N 3.32Å; N439-T443 PolarHBondContact O-OG1 3.18Å; N439-W460 HydrophobicContact CB-CH2 3.99Å; N439-W460 HydrophobicContact CB-CZ2 4.2Å; N439-W460 WeakPolarHBondContact OD1-CZ2 3.19Å
440	H	87.3	Confident	83.8	Confident	107 Å²	107	40.6 Å²	40.6	50%	0.495	21%	0.207	S	C	.	.	H	α-helix	trans	-73.2	-49.9	174.6	-178.7	-67.3	0	0	0	111.2	N437 M438 W442 T443 E444	N437-H440 WeakPolarHBondContact O-CA 3.28Å; N437-H440 WeakPolarHBondContact O-CB 3.2Å; N437-H440 PolarHBondContact O-N 3.3Å; M438-H440 VanDerWaalsContact C-N 3.29Å; M438-H440 PolarHBondContact O-N 3.19Å; H440-W442 VanDerWaalsContact C-N 3.33Å; H440-W442 PolarHBondContact O-N 3.4Å; H440-T443 PolarHBondContact O-N 3.02Å; H440-E444 IonicContact CE1-OE2 3.93Å; H440-E444 PolarHBondContact CE1-OE2 3.17Å; H440-E444 VanDerWaalsContact CE1-OE2 3.23Å; H440-E444 IonicContact ND1-OE2 3.98Å; H440-E444 WeakPolarHBondContact O-CB 3.28Å; H440-E444 PolarHBondContact O-N 3.05Å
441	L	88.9	Confident	83	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-51.4	-51.9	175.9	175.9	102.3	0	0	0	110.6	Y326 Q329 L330 L415 N437 M438 E444 L445	Y326-L441 HydrophobicContact CD1-CD1 4.29Å; Q329-L441 HydrophobicContact CB-CD1 3.63Å; L330-L441 HydrophobicContact CB-CD1 4.23Å; L330-L441 HydrophobicContact CD1-CD2 4.12Å; L415-L441 HydrophobicContact CD1-CD2 4.28Å; N437-L441 PolarHBondContact O-N 2.75Å; M438-L441 HydrophobicContact CE-CD2 3.84Å; M438-L441 PolarHBondContact O-N 3.26Å; M438-L441 HydrophobicContact SD-CD2 3.96Å; L441-E444 PolarHBondContact O-N 3.16Å; L441-L445 WeakPolarHBondContact O-CB 3.39Å; L441-L445 PolarHBondContact O-N 3.24Å
442	W	87.5	Confident	81.8	Confident	3 Å²	3	40.5 Å²	40.5	1%	0.011	20%	0.204	C	C	.	.	H	α-helix	trans	-63.5	-42	-179.7	174	-114.9	0	0	0	112.7	Y412 L415 E416 Y419 M438 H440 L445 A446 W460	Y412-W442 HydrophobicContact CD2-CH2 4.15Å; Y412-W442 AromaticContact CD2-CZ3 3.85Å; Y412-W442 HydrophobicContact CD2-CZ3 3.85Å; Y412-W442 AromaticContact CE2-CH2 3.57Å; Y412-W442 HydrophobicContact CE2-CH2 3.57Å; Y412-W442 HydrophobicContact CE2-CZ2 4.41Å; Y412-W442 AromaticContact CE2-CZ3 3.73Å; Y412-W442 HydrophobicContact CE2-CZ3 3.73Å; Y412-W442 AromaticContact CZ-CH2 3.92Å; L415-W442 HydrophobicContact CB-CE3 3.81Å; L415-W442 HydrophobicContact CB-CZ3 3.65Å; L415-W442 HydrophobicContact CD1-CE3 4.26Å; E416-W442 HydrophobicContact CB-CH2 3.96Å; Y419-W442 AromaticContact CD2-CD2 3.76Å; Y419-W442 HydrophobicContact CD2-CD2 3.76Å; Y419-W442 AromaticContact CD2-CE2 3.74Å; Y419-W442 HydrophobicContact CD2-CE3 4.03Å; Y419-W442 HydrophobicContact CD2-CG 4.24Å; Y419-W442 HydrophobicContact CD2-CH2 4.32Å; Y419-W442 HydrophobicContact CD2-CZ2 4.04Å; Y419-W442 HydrophobicContact CD2-CZ3 4.31Å; Y419-W442 HydrophobicContact CE2-CB 4.1Å; Y419-W442 AromaticContact CE2-CD2 3.52Å; Y419-W442 HydrophobicContact CE2-CD2 3.52Å; Y419-W442 AromaticContact CE2-CE2 3.95Å; Y419-W442 AromaticContact CE2-CE3 3.86Å; Y419-W442 HydrophobicContact CE2-CE3 3.86Å; Y419-W442 AromaticContact CE2-CG 3.61Å; Y419-W442 HydrophobicContact CE2-CG 3.61Å; M438-W442 WeakPolarHBondContact O-CB 3.21Å; M438-W442 PolarHBondContact O-N 2.87Å; H440-W442 VanDerWaalsContact C-N 3.33Å; H440-W442 PolarHBondContact O-N 3.4Å; W442-L445 PolarHBondContact O-N 3.05Å; W442-A446 VanDerWaalsContact O-CB 3.26Å; W442-A446 WeakPolarHBondContact O-CB 3.49Å; W442-A446 PolarHBondContact O-N 2.86Å; W442-W460 AromaticContact CD1-CD2 3.6Å; W442-W460 AromaticContact CD1-CE2 3.56Å; W442-W460 AromaticContact CD1-CE3 3.66Å; W442-W460 AromaticContact CD1-CH2 3.62Å; W442-W460 AromaticContact CD1-CZ2 3.59Å; W442-W460 AromaticContact CD1-CZ3 3.65Å; W442-W460 HydrophobicContact CG-CZ2 4.47Å; W442-W460 AromaticContact NE1-CD2 3.53Å; W442-W460 AromaticContact NE1-CE2 3.89Å; W442-W460 AromaticContact NE1-CE3 3.69Å; W442-W460 AromaticContact NE1-CG 3.84Å
443	T	85.1	Confident	80.7	Confident	37 Å²	37	41 Å²	41	23%	0.227	21%	0.206	C	C	.	.	H	α-helix	trans	-64.6	-47.3	177.6	-55	0	0	0	0	111.5	N439 H440 L445 A446 Q447	N439-T443 WeakPolarHBondContact O-CB 3.28Å; N439-T443 PolarHBondContact O-N 3.32Å; N439-T443 PolarHBondContact O-OG1 3.18Å; H440-T443 PolarHBondContact O-N 3.02Å; T443-L445 VanDerWaalsContact C-N 3.34Å; T443-L445 PolarHBondContact O-N 3.48Å; T443-A446 PolarHBondContact O-N 3.23Å; T443-Q447 HydrophobicContact CG2-CG 4.4Å; T443-Q447 WeakPolarHBondContact O-CB 3.21Å; T443-Q447 VanDerWaalsContact O-CG 3.28Å; T443-Q447 WeakPolarHBondContact O-CG 2.78Å; T443-Q447 PolarHBondContact O-N 3.43Å
444	E	86.4	Confident	79.7	Confident	29 Å²	29	46 Å²	46	14%	0.136	23%	0.229	C	C	.	.	H	α-helix	trans	-59.9	-44.7	178.3	-161.9	-168.8	142.5	0	0	111.3	R325 Y326 Q329 H440 L441 R448	R325-E444 IonicContact CZ-OE1 3Å; R325-E444 IonicContact CZ-OE2 2.84Å; R325-E444 IonicContact NE-OE1 3.18Å; R325-E444 PolarHBondContact NE-OE1 3.42Å; R325-E444 IonicContact NE-OE2 2.75Å; R325-E444 PolarHBondContact NE-OE2 3.26Å; R325-E444 IonicContact NH1-OE1 2.72Å; R325-E444 IonicContact NH2-OE1 3.01Å; R325-E444 PolarHBondContact NH2-OE1 2.71Å; R325-E444 IonicContact NH2-OE2 2.74Å; R325-E444 PolarHBondContact NH2-OE2 3.24Å; Y326-E444 HydrophobicContact CE1-CB 4.32Å; Y326-E444 HydrophobicContact CE1-CG 4.27Å; Y326-E444 WeakPolarHBondContact OH-CG 3.28Å; Y326-E444 PolarHBondContact OH-OE1 3.49Å; Q329-E444 PolarHBondContact NE2-OE2 2.74Å; H440-E444 IonicContact CE1-OE2 3.93Å; H440-E444 PolarHBondContact CE1-OE2 3.17Å; H440-E444 VanDerWaalsContact CE1-OE2 3.23Å; H440-E444 IonicContact ND1-OE2 3.98Å; H440-E444 WeakPolarHBondContact O-CB 3.28Å; H440-E444 PolarHBondContact O-N 3.05Å; L441-E444 PolarHBondContact O-N 3.16Å; E444-R448 WeakPolarHBondContact O-CB 3.47Å; E444-R448 PolarHBondContact O-N 2.68Å; E444-R448 VanDerWaalsContact O-N 3.15Å
445	L	85.4	Confident	78.7	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-70.6	-35.7	-177.5	-157.3	158.8	0	0	0	112.1	Y326 L408 L411 Y412 L441 W442 T443 F449	Y326-L445 HydrophobicContact CD1-CB 4.48Å; Y326-L445 HydrophobicContact CD1-CD1 4.1Å; Y326-L445 HydrophobicContact CD1-CG 4.41Å; Y326-L445 HydrophobicContact CE1-CB 3.84Å; Y326-L445 HydrophobicContact CE1-CD1 4.24Å; Y326-L445 HydrophobicContact CE1-CG 4.05Å; L408-L445 HydrophobicContact CD2-CD1 3.85Å; L408-L445 HydrophobicContact CD2-CG 4.01Å; L411-L445 HydrophobicContact CD2-CD1 3.5Å; L411-L445 HydrophobicContact CG-CD1 3.84Å; Y412-L445 HydrophobicContact CD2-CD2 3.62Å; Y412-L445 HydrophobicContact CG-CD2 4.08Å; L441-L445 WeakPolarHBondContact O-CB 3.39Å; L441-L445 PolarHBondContact O-N 3.24Å; W442-L445 PolarHBondContact O-N 3.05Å; T443-L445 VanDerWaalsContact C-N 3.34Å; T443-L445 PolarHBondContact O-N 3.48Å; L445-F449 HydrophobicContact CD2-CD2 4.17Å; L445-F449 HydrophobicContact CD2-CE2 3.92Å; L445-F449 VanDerWaalsContact O-CD2 3.27Å; L445-F449 WeakPolarHBondContact O-CD2 3.38Å
446	A	82.7	Confident	77.2	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-75.4	-41.6	176	0	0	0	0	0	113.1	Y412 W442 T443 R448 F449 G450 M451 V453	Y412-A446 HydrophobicContact CE2-CB 3.79Å; W442-A446 VanDerWaalsContact O-CB 3.26Å; W442-A446 WeakPolarHBondContact O-CB 3.49Å; W442-A446 PolarHBondContact O-N 2.86Å; T443-A446 PolarHBondContact O-N 3.23Å; A446-R448 PolarHBondContact O-N 2.72Å; A446-F449 CarbonylContact O-C 3.6Å; A446-F449 PolarHBondContact O-N 3.02Å; A446-G450 PolarHBondContact O-N 3.03Å; A446-M451 CarbonylContact C-O 3.59Å; A446-M451 PolarHBondContact O-N 3.05Å; A446-M451 VanDerWaalsContact O-N 3.15Å; A446-V453 HydrophobicContact CB-CB 4.48Å; A446-V453 HydrophobicContact CB-CG2 3.31Å
447	Q	83.4	Confident	75.9	Confident	100 Å²	100	47.9 Å²	47.9	47%	0.467	25%	0.248	S	C	.	.	H	α-helix	trans	-57	-41.5	174.4	-78.4	176.1	-13.7	0	0	111	T443 F449 G450 M451	T443-Q447 HydrophobicContact CG2-CG 4.4Å; T443-Q447 WeakPolarHBondContact O-CB 3.21Å; T443-Q447 VanDerWaalsContact O-CG 3.28Å; T443-Q447 WeakPolarHBondContact O-CG 2.78Å; T443-Q447 PolarHBondContact O-N 3.43Å; Q447-F449 PolarHBondContact O-N 2.85Å; Q447-F449 VanDerWaalsContact O-N 3.15Å; Q447-G450 PolarHBondContact O-N 2.85Å; Q447-M451 WeakPolarHBondContact CA-O 3.28Å; Q447-M451 PolarHBondContact N-O 3.23Å
448	R	81.8	Confident	74.6	Confident	44 Å²	44	45.7 Å²	45.7	17%	0.166	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-26.8	174.7	-179.3	176.3	179.1	146.3	8.7	114	E322 L408 E444 A446 L477	E322-R448 IonicContact OE1-CZ 3.18Å; E322-R448 IonicContact OE1-NH1 2.77Å; E322-R448 PolarHBondContact OE1-NH1 2.97Å; E322-R448 IonicContact OE1-NH2 2.74Å; E322-R448 IonicContact OE2-CZ 2.86Å; E322-R448 IonicContact OE2-NH1 3.72Å; E322-R448 PolarHBondContact OE2-NH1 3.23Å; E322-R448 IonicContact OE2-NH2 3.6Å; E322-R448 PolarHBondContact OE2-NH2 2.97Å; L408-R448 VanDerWaalsContact CD1-CZ 3.44Å; E444-R448 WeakPolarHBondContact O-CB 3.47Å; E444-R448 PolarHBondContact O-N 2.68Å; E444-R448 VanDerWaalsContact O-N 3.15Å; A446-R448 PolarHBondContact O-N 2.72Å; R448-L477 HydrophobicContact CG-CD2 3.76Å
449	F	74.4	Confident	73.2	Confident	20 Å²	20	49.6 Å²	49.6	9%	0.088	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	17.6	176.1	-64.4	-53.6	0	0	0	113.9	L408 R409 Y412 L445 A446 Q447	L408-F449 HydrophobicContact CB-CE2 4.1Å; L408-F449 HydrophobicContact CB-CZ 3.82Å; L408-F449 WeakPolarHBondContact O-CE2 3.49Å; R409-F449 HydrophobicContact CB-CE1 4.48Å; R409-F449 HydrophobicContact CB-CZ 4.05Å; R409-F449 VanDerWaalsContact CZ-CE1 3.42Å; R409-F449 VanDerWaalsContact NH1-CD1 3.35Å; Y412-F449 AromaticContact CD2-CD2 3.88Å; Y412-F449 HydrophobicContact CD2-CD2 3.88Å; Y412-F449 AromaticContact CG-CD2 3.81Å; Y412-F449 HydrophobicContact CG-CD2 3.81Å; Y412-F449 HydrophobicContact CG-CE2 4.3Å; L445-F449 HydrophobicContact CD2-CD2 4.17Å; L445-F449 HydrophobicContact CD2-CE2 3.92Å; L445-F449 VanDerWaalsContact O-CD2 3.27Å; L445-F449 WeakPolarHBondContact O-CD2 3.38Å; A446-F449 CarbonylContact O-C 3.6Å; A446-F449 PolarHBondContact O-N 3.02Å; Q447-F449 PolarHBondContact O-N 2.85Å; Q447-F449 VanDerWaalsContact O-N 3.15Å
450	G	67.1	Low	72.2	Confident	9 Å²	9	48.9 Å²	48.9	9%	0.093	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.4	16.9	171.7	0	0	0	0	0	114.7	A446 Q447 I465	A446-G450 PolarHBondContact O-N 3.03Å; Q447-G450 PolarHBondContact O-N 2.85Å; G450-I465 WeakPolarHBondContact O-CB 3.45Å; G450-I465 WeakPolarHBondContact O-CG1 3.38Å; G450-I465 PolarHBondContact O-N 2.78Å
451	M	66.7	Low	70.8	Confident	29 Å²	29	49 Å²	49	14%	0.143	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	118	-173.7	-64.1	172.7	69	0	0	110.6	Y412 A446 Q447 Q462 E463 L464	Y412-M451 HydrophobicContact CE1-SD 4.41Å; Y412-M451 WeakPolarHBondContact OH-CE 3.47Å; Y412-M451 PolarHBondContact OH-SD 3.14Å; A446-M451 CarbonylContact C-O 3.59Å; A446-M451 PolarHBondContact O-N 3.05Å; A446-M451 VanDerWaalsContact O-N 3.15Å; Q447-M451 WeakPolarHBondContact CA-O 3.28Å; Q447-M451 PolarHBondContact N-O 3.23Å; M451-Q462 HydrophobicContact CE-CB 3.82Å; M451-Q462 VanDerWaalsContact CE-CD 3.48Å; M451-Q462 HydrophobicContact CE-CG 3.86Å; M451-E463 CarbonylContact C-O 3.58Å; M451-E463 WeakPolarHBondContact CA-O 3.36Å; M451-L464 HydrophobicContact CG-CD2 4.38Å
452	N	61.9	Low	69.3	Low	75 Å²	75	53.1 Å²	53.1	40%	0.401	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	137.3	164.1	-83	-19.1	0	0	0	107.7	Q462 E463 I465	N452-Q462 WeakPolarHBondContact O-CA 3.33Å; N452-E463 PolarHBondContact N-O 3.45Å; N452-E463 PolarHBondContact O-N 3.06Å; N452-I465 HydrophobicContact CB-CG1 4.21Å; N452-I465 WeakPolarHBondContact OD1-CD1 3.4Å
453	V	63.4	Low	67.5	Low	9 Å²	9	59.7 Å²	59.7	6%	0.055	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	120.2	174.9	-152.9	0	0	0	0	110	A446 W460 K461 Q462	A446-V453 HydrophobicContact CB-CB 4.48Å; A446-V453 HydrophobicContact CB-CG2 3.31Å; V453-W460 HydrophobicContact CB-CE3 4.19Å; V453-W460 HydrophobicContact CG1-CB 3.86Å; V453-W460 HydrophobicContact CG1-CD2 4.29Å; V453-W460 HydrophobicContact CG1-CE3 3.7Å; V453-W460 HydrophobicContact CG1-CG 4.42Å; V453-K461 VanDerWaalsContact CA-O 3.26Å; V453-K461 WeakPolarHBondContact CA-O 3.32Å; V453-K461 VanDerWaalsContact CG1-O 3.23Å; V453-K461 WeakPolarHBondContact CG1-O 3.49Å; V453-Q462 HydrophobicContact CG1-CG 3.87Å; V453-Q462 HydrophobicContact CG2-CG 4.18Å
454	E	61	Low	66.1	Low	136 Å²	136	61.8 Å²	61.8	64%	0.636	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.5	137.6	177.9	-64.9	-169.5	162.7	0	0	110.3	W460 K461	E454-W460 CarbonylContact O-C 3.11Å; E454-W460 WeakPolarHBondContact O-CA 3.42Å; E454-K461 PolarHBondContact N-O 3.38Å; E454-K461 PolarHBondContact O-N 2.77Å
455	C	63.4	Low	64.8	Low	55 Å²	55	63.5 Å²	63.5	37%	0.372	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	101	174.3	-167.1	0	0	0	0	109.7	W460	C455-W460 HydrophobicContact CB-CD2 3.86Å; C455-W460 HydrophobicContact CB-CE3 3.63Å; C455-W460 HydrophobicContact CB-CH2 3.85Å; C455-W460 HydrophobicContact CB-CZ2 4.02Å; C455-W460 HydrophobicContact CB-CZ3 3.65Å
456	T	56.4	Low	63.1	Low	35 Å²	35	68.9 Å²	68.9	22%	0.215	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	128.2	171.9	60.4	0	0	0	0	109.5	G458 T459 K461	T456-G458 PolarHBondContact O-N 3.26Å; T456-G458 VanDerWaalsContact O-N 3.17Å; T456-T459 PolarHBondContact N-O 3.34Å; T456-T459 WeakPolarHBondContact O-CA 3.16Å; T456-T459 PolarHBondContact O-N 2.98Å; T456-T459 PolarHBondContact O-OG1 3.09Å; T456-K461 HydrophobicContact CG2-CD 4.39Å; T456-K461 WeakPolarHBondContact OG1-CE 3.31Å; T456-K461 PolarHBondContact OG1-NZ 2.82Å
457	D	54.6	Low	61.4	Low	163 Å²	163	72.4 Å²	72.4	87%	0.872	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.6	29.1	178.5	-45.3	-40.8	0	0	0	114.2	T459	D457-T459 PolarHBondContact O-N 3.26Å
458	G	57	Low	59.5	Low	45 Å²	45	74.3 Å²	74.3	46%	0.464	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.3	3.8	-174	0	0	0	0	0	114.6	N433 T456	N433-G458 PolarHBondContact ND2-O 2.74Å; T456-G458 PolarHBondContact O-N 3.26Å; T456-G458 VanDerWaalsContact O-N 3.17Å
459	T	58	Low	58	Low	82 Å²	82	76.3 Å²	76.3	50%	0.503	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	124.6	172.1	56.5	0	0	0	0	111	T456 D457 K461	T456-T459 PolarHBondContact N-O 3.34Å; T456-T459 WeakPolarHBondContact O-CA 3.16Å; T456-T459 PolarHBondContact O-N 2.98Å; T456-T459 PolarHBondContact O-OG1 3.09Å; D457-T459 PolarHBondContact O-N 3.26Å; T459-K461 PolarHBondContact O-N 3.06Å
460	W	63.1	Low	56.6	Low	48 Å²	48	80 Å²	80	18%	0.182	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	121.1	173.7	-67.6	103.5	0	0	0	110.2	Y419 N433 N439 W442 V453 E454 C455	Y419-W460 AromaticContact CD1-CD1 3.56Å; Y419-W460 AromaticContact CD1-NE1 3.56Å; Y419-W460 AromaticContact CE1-CD1 3.95Å; Y419-W460 AromaticContact CE1-NE1 3.42Å; Y419-W460 AromaticContact CG-CD1 3.88Å; Y419-W460 AromaticContact CZ-NE1 3.89Å; N433-W460 PolarHBondContact OD1-NE1 2.89Å; N439-W460 HydrophobicContact CB-CH2 3.99Å; N439-W460 HydrophobicContact CB-CZ2 4.2Å; N439-W460 WeakPolarHBondContact OD1-CZ2 3.19Å; W442-W460 AromaticContact CD1-CD2 3.6Å; W442-W460 AromaticContact CD1-CE2 3.56Å; W442-W460 AromaticContact CD1-CE3 3.66Å; W442-W460 AromaticContact CD1-CH2 3.62Å; W442-W460 AromaticContact CD1-CZ2 3.59Å; W442-W460 AromaticContact CD1-CZ3 3.65Å; W442-W460 HydrophobicContact CG-CZ2 4.47Å; W442-W460 AromaticContact NE1-CD2 3.53Å; W442-W460 AromaticContact NE1-CE2 3.89Å; W442-W460 AromaticContact NE1-CE3 3.69Å; W442-W460 AromaticContact NE1-CG 3.84Å; V453-W460 HydrophobicContact CB-CE3 4.19Å; V453-W460 HydrophobicContact CG1-CB 3.86Å; V453-W460 HydrophobicContact CG1-CD2 4.29Å; V453-W460 HydrophobicContact CG1-CE3 3.7Å; V453-W460 HydrophobicContact CG1-CG 4.42Å; E454-W460 CarbonylContact O-C 3.11Å; E454-W460 WeakPolarHBondContact O-CA 3.42Å; C455-W460 HydrophobicContact CB-CD2 3.86Å; C455-W460 HydrophobicContact CB-CE3 3.63Å; C455-W460 HydrophobicContact CB-CH2 3.85Å; C455-W460 HydrophobicContact CB-CZ2 4.02Å; C455-W460 HydrophobicContact CB-CZ3 3.65Å
461	K	57.7	Low	55.6	Low	109 Å²	109	85.8 Å²	85.8	47%	0.474	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	124.2	167.6	-69.9	168.6	179.7	149.8	0	108.2	V453 E454 T456 T459	V453-K461 VanDerWaalsContact CA-O 3.26Å; V453-K461 WeakPolarHBondContact CA-O 3.32Å; V453-K461 VanDerWaalsContact CG1-O 3.23Å; V453-K461 WeakPolarHBondContact CG1-O 3.49Å; E454-K461 PolarHBondContact N-O 3.38Å; E454-K461 PolarHBondContact O-N 2.77Å; T456-K461 HydrophobicContact CG2-CD 4.39Å; T456-K461 WeakPolarHBondContact OG1-CE 3.31Å; T456-K461 PolarHBondContact OG1-NZ 2.82Å; T459-K461 PolarHBondContact O-N 3.06Å
462	Q	59.1	Low	54.6	Low	87 Å²	87	86.9 Å²	86.9	41%	0.407	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	129.7	172.1	-66.3	166.7	-39.4	0	0	109.2	Y412 E416 M451 N452 V453	Y412-Q462 PolarHBondContact OH-NE2 3.15Å; E416-Q462 PolarHBondContact OE1-NE2 3Å; M451-Q462 HydrophobicContact CE-CB 3.82Å; M451-Q462 VanDerWaalsContact CE-CD 3.48Å; M451-Q462 HydrophobicContact CE-CG 3.86Å; N452-Q462 WeakPolarHBondContact O-CA 3.33Å; V453-Q462 HydrophobicContact CG1-CG 3.87Å; V453-Q462 HydrophobicContact CG2-CG 4.18Å
463	E	49.8	Very low	54	Low	142 Å²	142	85 Å²	85	66%	0.664	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.1	146.6	169	-65	-163.9	167.9	0	0	110.4	M451 N452	M451-E463 CarbonylContact C-O 3.58Å; M451-E463 WeakPolarHBondContact CA-O 3.36Å; N452-E463 PolarHBondContact N-O 3.45Å; N452-E463 PolarHBondContact O-N 3.06Å
464	L	55.6	Low	53.4	Low	80 Å²	80	88 Å²	88	42%	0.419	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	125.7	-178.6	-83.5	158.1	0	0	0	110.6	M451 H466 L470	M451-L464 HydrophobicContact CG-CD2 4.38Å; L464-H466 VanDerWaalsContact C-N 3.31Å; L464-L470 HydrophobicContact CD1-CB 4.37Å; L464-L470 HydrophobicContact CD1-CD1 4.26Å; L464-L470 HydrophobicContact CD1-CD2 3.96Å; L464-L470 HydrophobicContact CD1-CG 4.42Å; L464-L470 HydrophobicContact CD2-CB 4.1Å; L464-L470 HydrophobicContact CD2-CD1 4.04Å
465	I	57.9	Low	53.3	Low	65 Å²	65	87.4 Å²	87.4	33%	0.333	49%	0.49	S	S	.	.	S	Bend	trans	-66.5	-40.3	173.9	-55.1	176.5	0	0	0	109.4	G450 N452	G450-I465 WeakPolarHBondContact O-CB 3.45Å; G450-I465 WeakPolarHBondContact O-CG1 3.38Å; G450-I465 PolarHBondContact O-N 2.78Å; N452-I465 HydrophobicContact CB-CG1 4.21Å; N452-I465 WeakPolarHBondContact OD1-CD1 3.4Å
466	H	49.7	Very low	53.7	Low	113 Å²	113	87.2 Å²	87.2	52%	0.523	48%	0.483	S	S	.	.			trans	-143.9	137.4	171.8	-61.1	-65.6	0	0	0	110.9	L464 D468 L469	L464-H466 VanDerWaalsContact C-N 3.31Å; H466-D468 VanDerWaalsContact C-N 3.32Å; H466-D468 PolarHBondContact O-N 3.37Å; H466-L469 HydrophobicContact CB-CD1 4.2Å; H466-L469 PolarHBondContact O-N 3.33Å
467	A	47.3	Very low	54.5	Low	75 Å²	75	89.2 Å²	89.2	62%	0.62	49%	0.491	S	S	*	.	G	3₁₀ helix	trans	-64.8	-33.8	179.8	0	0	0	0	0	113.2	L469 L470	A467-L469 VanDerWaalsContact C-N 3.3Å; A467-L469 PolarHBondContact O-N 2.85Å; A467-L470 WeakPolarHBondContact O-CB 3.44Å; A467-L470 PolarHBondContact O-N 3.39Å
468	D	44.6	Very low	55.6	Low	140 Å²	140	82.3 Å²	82.3	75%	0.749	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-68.2	-27.3	-176.5	-58.4	-50	0	0	0	113.4	H466 L470 S472	H466-D468 VanDerWaalsContact C-N 3.32Å; H466-D468 PolarHBondContact O-N 3.37Å; D468-L470 VanDerWaalsContact C-N 3.3Å; D468-L470 PolarHBondContact O-N 2.82Å; D468-S472 WeakPolarHBondContact O-CB 3.38Å
469	L	49.1	Very low	56.8	Low	85 Å²	85	80.2 Å²	80.2	45%	0.445	44%	0.436	S	S	.	.	G	3₁₀ helix	trans	-73.6	-17.8	-179.7	-92.8	157.9	0	0	0	113.4	H466 A467 H471	H466-L469 HydrophobicContact CB-CD1 4.2Å; H466-L469 PolarHBondContact O-N 3.33Å; A467-L469 VanDerWaalsContact C-N 3.3Å; A467-L469 PolarHBondContact O-N 2.85Å; L469-H471 PolarHBondContact O-N 2.89Å
470	L	44.8	Very low	58.5	Low	97 Å²	97	76.4 Å²	76.4	51%	0.508	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-63.9	-25.9	-177.7	-174.7	67.1	0	0	0	113.1	L464 A467 D468	L464-L470 HydrophobicContact CD1-CB 4.37Å; L464-L470 HydrophobicContact CD1-CD1 4.26Å; L464-L470 HydrophobicContact CD1-CD2 3.96Å; L464-L470 HydrophobicContact CD1-CG 4.42Å; L464-L470 HydrophobicContact CD2-CB 4.1Å; L464-L470 HydrophobicContact CD2-CD1 4.04Å; A467-L470 WeakPolarHBondContact O-CB 3.44Å; A467-L470 PolarHBondContact O-N 3.39Å; D468-L470 VanDerWaalsContact C-N 3.3Å; D468-L470 PolarHBondContact O-N 2.82Å
471	H	46.4	Very low	59.9	Low	131 Å²	131	76 Å²	76	61%	0.606	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.1	-0.5	-175.6	-63.7	101.2	0	0	0	114.4	L469	L469-H471 PolarHBondContact O-N 2.89Å
472	S	44.8	Very low	61.6	Low	53 Å²	53	70.9 Å²	70.9	37%	0.371	39%	0.394	S	S	.	.			trans	-133.1	110.4	-171	-172.2	0	0	0	0	111.3	D468 A474	D468-S472 WeakPolarHBondContact O-CB 3.38Å; S472-A474 PolarHBondContact O-N 2.89Å; S472-A474 WeakPolarHBondContact OG-CB 3.47Å
473	Q	51.2	Low	63.2	Low	36 Å²	36	66.8 Å²	66.8	17%	0.168	37%	0.374	C	S	.	.			trans	-89.9	62.6	165.5	-48.7	176.2	0.4	0	0	108.2	P475 F476 H525	Q473-P475 VanDerWaalsContact C-C 3.47Å; Q473-P475 CarbonylContact C-O 3.23Å; Q473-P475 VanDerWaalsContact C-O 3.23Å; Q473-P475 CarbonylContact O-C 3.56Å; Q473-F476 HydrophobicContact CB-CD2 4.35Å; Q473-F476 WeakPolarHBondContact O-CA 3.5Å; Q473-F476 PolarHBondContact O-N 3.47Å; Q473-F476 VanDerWaalsContact OE1-CE2 3.31Å; Q473-H525 WeakPolarHBondContact CB-NE2 3.39Å; Q473-H525 PolarHBondContact N-NE2 2.87Å
474	A	50.7	Low	65.2	Low	71 Å²	71	62.8 Å²	62.8	59%	0.587	36%	0.358	S	S	*	.	S	Bend	trans	-120.9	109.7	176.6	0	0	0	0	0	109.2	S472	S472-A474 PolarHBondContact O-N 2.89Å; S472-A474 WeakPolarHBondContact OG-CB 3.47Å
475	P	58.9	Low	67.1	Low	124 Å²	124	63 Å²	63	81%	0.805	36%	0.355	S	S	*	.	S	Bend	cis	-66.9	155.8	-2.5	30.6	-36.5	0	0	0	113.2	Q473 L477	Q473-P475 VanDerWaalsContact C-C 3.47Å; Q473-P475 CarbonylContact C-O 3.23Å; Q473-P475 VanDerWaalsContact C-O 3.23Å; Q473-P475 CarbonylContact O-C 3.56Å; P475-L477 PolarHBondContact O-N 2.83Å
476	F	70.7	Confident	68.9	Low	51 Å²	51	60 Å²	60	22%	0.224	34%	0.34	C	S	.	.			trans	-72.4	109.2	177.7	174.2	-100.3	0	0	0	110.1	Q473 A478 L483 E522 H525 M526	Q473-F476 HydrophobicContact CB-CD2 4.35Å; Q473-F476 WeakPolarHBondContact O-CA 3.5Å; Q473-F476 PolarHBondContact O-N 3.47Å; Q473-F476 VanDerWaalsContact OE1-CE2 3.31Å; F476-A478 HydrophobicContact CD1-CB 4.41Å; F476-A478 HydrophobicContact CE1-CB 3.77Å; F476-A478 HydrophobicContact CZ-CB 4.48Å; F476-A478 PolarHBondContact O-N 2.88Å; F476-L483 HydrophobicContact CZ-CD1 4.21Å; F476-E522 HydrophobicContact CE2-CG 4.03Å; F476-E522 HydrophobicContact CZ-CG 3.97Å; F476-H525 HydrophobicContact CD2-CB 4.47Å; F476-H525 HydrophobicContact CE2-CB 4.33Å; F476-M526 HydrophobicContact CD1-CB 4.24Å; F476-M526 HydrophobicContact CD1-CG 3.95Å; F476-M526 HydrophobicContact CD2-CB 4.36Å; F476-M526 HydrophobicContact CE1-CB 3.75Å; F476-M526 HydrophobicContact CE1-CG 3.57Å; F476-M526 HydrophobicContact CE1-SD 3.88Å; F476-M526 HydrophobicContact CE2-CB 3.89Å; F476-M526 HydrophobicContact CZ-CB 3.56Å; F476-M526 HydrophobicContact CZ-CG 3.94Å; F476-M526 HydrophobicContact CZ-SD 4.3Å
477	L	73.3	Confident	71	Confident	76 Å²	76	57.5 Å²	57.5	40%	0.398	33%	0.326	S	S	.	.			trans	-89.8	98.7	175	-174.5	64.3	0	0	0	109.5	R448 P475 G479	R448-L477 HydrophobicContact CG-CD2 3.76Å; P475-L477 PolarHBondContact O-N 2.83Å; L477-G479 PolarHBondContact O-N 3.39Å
478	A	78.4	Confident	73.2	Confident	18 Å²	18	57.9 Å²	57.9	15%	0.149	32%	0.317	C	S	.	.			trans	-57.9	125.1	178.4	0	0	0	0	0	111.5	F476 H480 L483 D484	F476-A478 HydrophobicContact CD1-CB 4.41Å; F476-A478 HydrophobicContact CE1-CB 3.77Å; F476-A478 HydrophobicContact CZ-CB 4.48Å; F476-A478 PolarHBondContact O-N 2.88Å; A478-H480 VanDerWaalsContact C-N 3.29Å; A478-H480 PolarHBondContact O-N 3.32Å; A478-L483 HydrophobicContact CB-CB 4.16Å; A478-L483 HydrophobicContact CB-CD1 4.18Å; A478-D484 WeakPolarHBondContact CB-OD2 3.38Å
479	G	82.4	Confident	75.6	Confident	2 Å²	2	51.8 Å²	51.8	2%	0.021	29%	0.285	C	S	.	.	S	Bend	trans	-73.2	-15.4	174.5	0	0	0	0	0	114.8	G407 L408 L477 E522	G407-G479 VanDerWaalsContact CA-O 3.25Å; G407-G479 WeakPolarHBondContact CA-O 3.46Å; L408-G479 PolarHBondContact N-O 2.84Å; L477-G479 PolarHBondContact O-N 3.39Å; G479-E522 WeakPolarHBondContact CA-OE1 3.45Å; G479-E522 PolarHBondContact N-OE1 2.84Å
480	H	91.9	Very high	77.7	Confident	2 Å²	2	47.8 Å²	47.8	1%	0.009	26%	0.264	C	S	.	.	S	Bend	trans	-155	140.1	-179.2	-160	-90.7	0	0	0	111.9	L323 V404 H406 A478 K482 L483 T643	L323-H480 HydrophobicContact CD1-CB 4.43Å; L323-H480 WeakPolarHBondContact CD1-CD2 3.38Å; V404-H480 PolarHBondContact O-NE2 3.35Å; H406-H480 WeakPolarHBondContact O-CB 3.47Å; A478-H480 VanDerWaalsContact C-N 3.29Å; A478-H480 PolarHBondContact O-N 3.32Å; H480-K482 VanDerWaalsContact ND1-CB 3.35Å; H480-K482 WeakPolarHBondContact ND1-CB 3.48Å; H480-K482 VanDerWaalsContact ND1-CG 3.32Å; H480-K482 WeakPolarHBondContact ND1-CG 3.41Å; H480-K482 PolarHBondContact ND1-N 2.77Å; H480-K482 PolarHBondContact O-N 3.26Å; H480-L483 HydrophobicContact CB-CD1 4.48Å; H480-L483 VanDerWaalsContact O-CB 3.28Å; H480-L483 WeakPolarHBondContact O-CB 3.42Å; H480-L483 PolarHBondContact O-N 2.98Å; H480-T643 PolarHBondContact CE1-OG1 3.13Å
481	P	93.3	Very high	80	Confident	40 Å²	40	45.2 Å²	45.2	26%	0.26	25%	0.25	S	S	.	.	H	α-helix	trans	-60	-18.2	177.9	-25.7	35.1	0	0	0	115.3	V317 L319 L483 D484 K485	V317-P481 HydrophobicContact CG1-CB 3.88Å; L319-P481 WeakPolarHBondContact O-CG 3.43Å; P481-L483 PolarHBondContact O-N 3.36Å; P481-D484 PolarHBondContact O-N 2.91Å; P481-K485 PolarHBondContact O-N 2.93Å
482	K	93.8	Very high	82.2	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-57.6	-30.6	168.8	-78.6	177.7	170.1	-174.4	0	112	V317 Q405 H480 K485 L486 F614 L641 T643 E647	V317-K482 HydrophobicContact CB-CG 4.14Å; V317-K482 HydrophobicContact CG1-CG 4.26Å; V317-K482 HydrophobicContact CG2-CG 4.19Å; Q405-K482 PolarHBondContact O-NZ 3.22Å; H480-K482 VanDerWaalsContact ND1-CB 3.35Å; H480-K482 WeakPolarHBondContact ND1-CB 3.48Å; H480-K482 VanDerWaalsContact ND1-CG 3.32Å; H480-K482 WeakPolarHBondContact ND1-CG 3.41Å; H480-K482 PolarHBondContact ND1-N 2.77Å; H480-K482 PolarHBondContact O-N 3.26Å; K482-K485 PolarHBondContact O-N 2.85Å; K482-L486 WeakPolarHBondContact O-CB 3.05Å; K482-L486 PolarHBondContact O-N 3.34Å; K482-F614 HydrophobicContact CB-CD2 4.16Å; K482-F614 HydrophobicContact CB-CE2 3.5Å; K482-F614 VanDerWaalsContact CB-CE2 3.5Å; K482-F614 HydrophobicContact CB-CZ 3.81Å; K482-F614 HydrophobicContact CD-CE1 4.47Å; K482-F614 HydrophobicContact CD-CE2 4.47Å; K482-F614 HydrophobicContact CD-CZ 4.35Å; K482-F614 WeakPolarHBondContact CD-O 3.19Å; K482-F614 WeakPolarHBondContact CE-O 3.18Å; K482-F614 PolarHBondContact NZ-O 2.87Å; K482-L641 HydrophobicContact CB-CD1 4.43Å; K482-L641 HydrophobicContact CD-CB 4.31Å; K482-L641 VanDerWaalsContact CE-O 3.25Å; K482-L641 WeakPolarHBondContact CE-O 3.41Å; K482-L641 HydrophobicContact CG-CB 4.21Å; K482-L641 PolarHBondContact NZ-O 3.43Å; K482-T643 VanDerWaalsContact CE-N 3.35Å; K482-T643 VanDerWaalsContact CE-OG1 3.26Å; K482-T643 WeakPolarHBondContact CE-OG1 3.39Å; K482-E647 WeakPolarHBondContact CE-OE2 3.33Å; K482-E647 VanDerWaalsContact NZ-CD 3.29Å; K482-E647 IonicContact NZ-OE1 3.46Å; K482-E647 PolarHBondContact NZ-OE1 2.83Å; K482-E647 IonicContact NZ-OE2 3.88Å; K482-E647 PolarHBondContact NZ-OE2 3.2Å
483	L	92.9	Very high	84.3	Confident	1 Å²	1	38.9 Å²	38.9	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-68.6	-49.1	179.1	-66.7	163	0	0	0	110.6	F476 A478 H480 P481 K485 L486 R487 E522 I523 M526 F614	F476-L483 HydrophobicContact CZ-CD1 4.21Å; A478-L483 HydrophobicContact CB-CB 4.16Å; A478-L483 HydrophobicContact CB-CD1 4.18Å; H480-L483 HydrophobicContact CB-CD1 4.48Å; H480-L483 VanDerWaalsContact O-CB 3.28Å; H480-L483 WeakPolarHBondContact O-CB 3.42Å; H480-L483 PolarHBondContact O-N 2.98Å; P481-L483 PolarHBondContact O-N 3.36Å; L483-K485 VanDerWaalsContact C-N 3.32Å; L483-K485 PolarHBondContact O-N 3.33Å; L483-L486 WeakPolarHBondContact O-CB 3.36Å; L483-L486 PolarHBondContact O-N 3.25Å; L483-R487 PolarHBondContact O-N 2.83Å; L483-E522 HydrophobicContact CD1-CG 3.86Å; L483-E522 WeakPolarHBondContact CD1-OE1 3.22Å; L483-E522 HydrophobicContact CD2-CG 4.37Å; L483-I523 HydrophobicContact CD2-CG1 3.61Å; L483-M526 VanDerWaalsContact C-SD 3.55Å; L483-M526 HydrophobicContact CB-SD 3.75Å; L483-M526 HydrophobicContact CD2-SD 4.41Å; L483-M526 WeakPolarHBondContact O-CE 3.11Å; L483-F614 HydrophobicContact CD2-CE2 3.68Å; L483-F614 HydrophobicContact CD2-CZ 3.77Å; L483-F614 HydrophobicContact CG-CE2 3.97Å; L483-F614 HydrophobicContact CG-CZ 3.93Å
484	D	92.2	Very high	86.2	Confident	58 Å²	58	37.5 Å²	37.5	31%	0.31	22%	0.217	S	C	.	.	H	α-helix	trans	-55.4	-48.1	171.4	-69.8	-80.7	0	0	0	111.4	A478 P481 L486 R487 D488	A478-D484 WeakPolarHBondContact CB-OD2 3.38Å; P481-D484 PolarHBondContact O-N 2.91Å; D484-L486 PolarHBondContact O-N 3.12Å; D484-R487 WeakPolarHBondContact O-CB 3.24Å; D484-R487 PolarHBondContact O-N 3.25Å; D484-R487 IonicContact OD1-CZ 3.19Å; D484-R487 IonicContact OD1-NH1 2.68Å; D484-R487 PolarHBondContact OD1-NH1 3.07Å; D484-R487 IonicContact OD1-NH2 3.26Å; D484-R487 PolarHBondContact OD1-NH2 2.96Å; D484-D488 WeakPolarHBondContact O-CB 3.5Å; D484-D488 PolarHBondContact O-N 2.72Å
485	K	94.4	Very high	87.9	Confident	86 Å²	86	37.6 Å²	37.6	37%	0.374	21%	0.207	S	C	.	.	H	α-helix	trans	-63	-39.8	178.9	-168.5	58.8	172.7	-179.4	0	112.7	V315 V317 P481 K482 L483 D488 I489 L641	V315-K485 HydrophobicContact CG1-CD 4.29Å; V315-K485 VanDerWaalsContact CG1-CE 3.44Å; V315-K485 HydrophobicContact CG1-CG 3.9Å; V317-K485 HydrophobicContact CG2-CB 4.24Å; V317-K485 HydrophobicContact CG2-CG 4.11Å; P481-K485 PolarHBondContact O-N 2.93Å; K482-K485 PolarHBondContact O-N 2.85Å; L483-K485 VanDerWaalsContact C-N 3.32Å; L483-K485 PolarHBondContact O-N 3.33Å; K485-D488 PolarHBondContact O-N 3.36Å; K485-I489 HydrophobicContact CD-CD1 4.47Å; K485-I489 HydrophobicContact CG-CD1 4Å; K485-I489 WeakPolarHBondContact O-CD1 3.46Å; K485-I489 VanDerWaalsContact O-CG1 3.25Å; K485-I489 WeakPolarHBondContact O-CG1 3.47Å; K485-I489 PolarHBondContact O-N 2.64Å; K485-L641 HydrophobicContact CB-CD2 4.42Å; K485-L641 HydrophobicContact CG-CD2 3.88Å
486	L	95.2	Very high	88.6	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-61.4	-47.5	174.2	172.3	64.8	0	0	0	111.6	K482 L483 D484 D488 I489 L490 V512 I523 M526 V612 F614 L641	K482-L486 WeakPolarHBondContact O-CB 3.05Å; K482-L486 PolarHBondContact O-N 3.34Å; L483-L486 WeakPolarHBondContact O-CB 3.36Å; L483-L486 PolarHBondContact O-N 3.25Å; D484-L486 PolarHBondContact O-N 3.12Å; L486-D488 VanDerWaalsContact C-N 3.31Å; L486-D488 PolarHBondContact O-N 3.15Å; L486-I489 PolarHBondContact O-N 3.33Å; L486-L490 HydrophobicContact CD1-CD1 3.77Å; L486-L490 HydrophobicContact CD1-CG 4.16Å; L486-L490 HydrophobicContact CG-CD1 3.95Å; L486-L490 WeakPolarHBondContact O-CB 3.46Å; L486-L490 WeakPolarHBondContact O-CG 3.46Å; L486-L490 PolarHBondContact O-N 2.98Å; L486-V512 HydrophobicContact CD1-CG1 3.89Å; L486-V512 HydrophobicContact CD1-CG2 3.93Å; L486-V512 HydrophobicContact CD2-CG1 3.92Å; L486-I523 HydrophobicContact CD2-CB 4.37Å; L486-I523 HydrophobicContact CD2-CD1 3.93Å; L486-I523 HydrophobicContact CD2-CG1 3.78Å; L486-I523 HydrophobicContact CD2-CG2 3.69Å; L486-M526 HydrophobicContact CB-CE 4.27Å; L486-M526 HydrophobicContact CD2-CE 3.88Å; L486-M526 HydrophobicContact CG-CE 4.02Å; L486-V612 HydrophobicContact CD1-CB 3.87Å; L486-V612 HydrophobicContact CD1-CG1 3.58Å; L486-V612 HydrophobicContact CD1-CG2 4.21Å; L486-F614 HydrophobicContact CD2-CD2 3.97Å; L486-F614 HydrophobicContact CD2-CE2 4.38Å; L486-L641 HydrophobicContact CB-CD1 3.8Å; L486-L641 HydrophobicContact CD1-CD1 4.44Å
487	R	94.1	Very high	88.2	Confident	62 Å²	62	38 Å²	38	23%	0.234	20%	0.197	C	C	.	.	H	α-helix	trans	-56.2	-48.9	174.9	176.2	-165.4	63.9	-129.2	-12.4	110.2	L483 D484 I489 L490 L491 M526 L530	L483-R487 PolarHBondContact O-N 2.83Å; D484-R487 WeakPolarHBondContact O-CB 3.24Å; D484-R487 PolarHBondContact O-N 3.25Å; D484-R487 IonicContact OD1-CZ 3.19Å; D484-R487 IonicContact OD1-NH1 2.68Å; D484-R487 PolarHBondContact OD1-NH1 3.07Å; D484-R487 IonicContact OD1-NH2 3.26Å; D484-R487 PolarHBondContact OD1-NH2 2.96Å; R487-I489 PolarHBondContact O-N 2.94Å; R487-L490 PolarHBondContact O-N 3.36Å; R487-L491 HydrophobicContact CG-CD1 3.76Å; R487-L491 HydrophobicContact CG-CG 4.22Å; R487-L491 WeakPolarHBondContact O-CB 3.29Å; R487-L491 WeakPolarHBondContact O-CG 3.46Å; R487-L491 PolarHBondContact O-N 2.98Å; R487-M526 HydrophobicContact CB-CE 3.87Å; R487-M526 HydrophobicContact CB-SD 3.87Å; R487-L530 HydrophobicContact CG-CD1 4.04Å
488	D	94.2	Very high	87.4	Confident	83 Å²	83	40 Å²	40	44%	0.444	21%	0.208	S	C	.	.	H	α-helix	trans	-68.5	-35.1	-174.4	-60.4	-9	0	0	0	111.7	D484 K485 L486 G492	D484-D488 WeakPolarHBondContact O-CB 3.5Å; D484-D488 PolarHBondContact O-N 2.72Å; K485-D488 PolarHBondContact O-N 3.36Å; L486-D488 VanDerWaalsContact C-N 3.31Å; L486-D488 PolarHBondContact O-N 3.15Å; D488-G492 PolarHBondContact O-N 3.36Å
489	I	94	Very high	86.3	Confident	12 Å²	12	49 Å²	49	6%	0.062	24%	0.238	C	C	.	.	H	α-helix	trans	-64.2	-48.7	171.5	-71.7	158.3	0	0	0	111.3	K485 L486 R487 G492 H493 L610 V612 V639 L641	K485-I489 HydrophobicContact CD-CD1 4.47Å; K485-I489 HydrophobicContact CG-CD1 4Å; K485-I489 WeakPolarHBondContact O-CD1 3.46Å; K485-I489 VanDerWaalsContact O-CG1 3.25Å; K485-I489 WeakPolarHBondContact O-CG1 3.47Å; K485-I489 PolarHBondContact O-N 2.64Å; L486-I489 PolarHBondContact O-N 3.33Å; R487-I489 PolarHBondContact O-N 2.94Å; I489-G492 PolarHBondContact O-N 3.15Å; I489-H493 WeakPolarHBondContact O-CB 3.48Å; I489-H493 PolarHBondContact O-N 2.96Å; I489-L610 HydrophobicContact CG2-CD2 4.14Å; I489-V612 HydrophobicContact CG2-CG2 3.96Å; I489-V639 HydrophobicContact CD1-CG1 3.82Å; I489-V639 HydrophobicContact CG2-CG2 4.27Å; I489-L641 HydrophobicContact CD1-CD2 3.71Å
490	L	94	Very high	85.1	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-66.1	-45.4	-179.2	-70.5	167.7	0	0	0	111.4	L486 R487 G492 H493 F494 A510 V512 L527 I534 L610 V612	L486-L490 HydrophobicContact CD1-CD1 3.77Å; L486-L490 HydrophobicContact CD1-CG 4.16Å; L486-L490 HydrophobicContact CG-CD1 3.95Å; L486-L490 WeakPolarHBondContact O-CB 3.46Å; L486-L490 WeakPolarHBondContact O-CG 3.46Å; L486-L490 PolarHBondContact O-N 2.98Å; R487-L490 PolarHBondContact O-N 3.36Å; L490-G492 VanDerWaalsContact C-N 3.32Å; L490-G492 PolarHBondContact O-N 2.72Å; L490-H493 PolarHBondContact O-N 2.76Å; L490-F494 HydrophobicContact CD2-CE2 4.31Å; L490-F494 WeakPolarHBondContact O-CD2 3.37Å; L490-F494 PolarHBondContact O-N 3.22Å; L490-A510 HydrophobicContact CD2-CB 3.83Å; L490-V512 HydrophobicContact CD1-CG2 4.02Å; L490-V512 HydrophobicContact CD2-CG2 4.35Å; L490-L527 HydrophobicContact CD1-CD1 3.78Å; L490-L527 HydrophobicContact CD1-CD2 3.76Å; L490-L527 HydrophobicContact CD1-CG 4.42Å; L490-I534 HydrophobicContact CB-CD1 3.89Å; L490-L610 HydrophobicContact CD2-CD2 3.97Å; L490-V612 HydrophobicContact CD2-CG2 4.47Å
491	L	93.3	Very high	83.1	Confident	44 Å²	44	59.5 Å²	59.5	23%	0.23	29%	0.286	C	S	.	.	H	α-helix	trans	-59.4	-43.4	172.9	-73.5	178.4	0	0	0	110.9	R487 H493 N495 L530 L533 I534	R487-L491 HydrophobicContact CG-CD1 3.76Å; R487-L491 HydrophobicContact CG-CG 4.22Å; R487-L491 WeakPolarHBondContact O-CB 3.29Å; R487-L491 WeakPolarHBondContact O-CG 3.46Å; R487-L491 PolarHBondContact O-N 2.98Å; L491-H493 PolarHBondContact O-N 2.99Å; L491-N495 VanDerWaalsContact O-CB 3.23Å; L491-N495 WeakPolarHBondContact O-CB 3.28Å; L491-N495 PolarHBondContact O-N 3.48Å; L491-N495 PolarHBondContact O-ND2 3.47Å; L491-L530 HydrophobicContact CD2-CD1 4.23Å; L491-L530 HydrophobicContact CD2-CD2 4.49Å; L491-L530 HydrophobicContact CG-CD1 4.45Å; L491-L533 HydrophobicContact CD2-CD2 3.91Å; L491-I534 HydrophobicContact CD2-CD1 4.11Å
492	G	91.6	Very high	80.8	Confident	30 Å²	30	63 Å²	63	31%	0.309	31%	0.307	S	S	.	.	H	α-helix	trans	-57.1	-49.1	175.1	0	0	0	0	0	112.3	D488 I489 L490 F496	D488-G492 PolarHBondContact O-N 3.36Å; I489-G492 PolarHBondContact O-N 3.15Å; L490-G492 VanDerWaalsContact C-N 3.32Å; L490-G492 PolarHBondContact O-N 2.72Å; G492-F496 WeakPolarHBondContact O-CB 3.27Å; G492-F496 WeakPolarHBondContact O-CD2 3.4Å; G492-F496 PolarHBondContact O-N 2.92Å; G492-F496 VanDerWaalsContact O-N 3.11Å
493	H	90.1	Very high	78.3	Confident	21 Å²	21	71.6 Å²	71.6	10%	0.097	35%	0.347	C	S	.	.	H	α-helix	trans	-59.8	-55.8	179.1	170.3	54.3	0	0	0	112.8	I489 L490 L491 N495 F496 E497 T508 L610	I489-H493 WeakPolarHBondContact O-CB 3.48Å; I489-H493 PolarHBondContact O-N 2.96Å; L490-H493 PolarHBondContact O-N 2.76Å; L491-H493 PolarHBondContact O-N 2.99Å; H493-N495 PolarHBondContact O-N 3.03Å; H493-F496 PolarHBondContact O-N 3.42Å; H493-E497 IonicContact CE1-OE1 2.68Å; H493-E497 PolarHBondContact CE1-OE1 3.41Å; H493-E497 IonicContact ND1-OE1 3.18Å; H493-E497 PolarHBondContact O-N 2.92Å; H493-T508 PolarHBondContact CE1-OG1 3.09Å; H493-T508 PolarHBondContact NE2-OG1 3.02Å; H493-L610 HydrophobicContact CB-CD2 3.76Å; H493-L610 VanDerWaalsContact CD2-CD2 3.48Å; H493-L610 WeakPolarHBondContact CD2-CD2 3.27Å; H493-L610 WeakPolarHBondContact NE2-CB 3.49Å
494	F	90.1	Very high	76	Confident	7 Å²	7	78.3 Å²	78.3	3%	0.031	38%	0.378	C	S	.	.	H	α-helix	trans	-66	-38.9	-177.8	-70	-68	0	0	0	112.6	L490 F496 D498 T508 A510 L533 I534 N591 T592	L490-F494 HydrophobicContact CD2-CE2 4.31Å; L490-F494 WeakPolarHBondContact O-CD2 3.37Å; L490-F494 PolarHBondContact O-N 3.22Å; F494-F496 VanDerWaalsContact C-N 3.3Å; F494-F496 PolarHBondContact O-N 3.07Å; F494-D498 PolarHBondContact O-N 3.14Å; F494-T508 HydrophobicContact CD1-CG2 3.52Å; F494-T508 HydrophobicContact CE1-CG2 3.6Å; F494-A510 HydrophobicContact CE2-CB 4.25Å; F494-A510 HydrophobicContact CZ-CB 3.94Å; F494-L533 HydrophobicContact CB-CD1 3.82Å; F494-L533 HydrophobicContact CB-CD2 4.27Å; F494-L533 HydrophobicContact CB-CG 3.9Å; F494-I534 HydrophobicContact CD2-CD1 3.99Å; F494-I534 HydrophobicContact CD2-CG1 3.71Å; F494-I534 HydrophobicContact CE2-CD1 4.36Å; F494-I534 HydrophobicContact CE2-CG1 4.09Å; F494-I534 HydrophobicContact CG-CG1 4.49Å; F494-N591 HydrophobicContact CE1-CB 4.1Å; F494-N591 VanDerWaalsContact CE1-ND2 3.29Å; F494-N591 WeakPolarHBondContact CE1-ND2 3.45Å; F494-N591 HydrophobicContact CZ-CB 4.33Å; F494-T592 WeakPolarHBondContact CE2-OG1 3.49Å; F494-T592 WeakPolarHBondContact CZ-OG1 3.35Å
495	N	86.7	Confident	73.8	Confident	72 Å²	72	85.4 Å²	85.4	39%	0.385	41%	0.409	S	S	.	.	H	α-helix	trans	-70	-20.7	176.7	-75.3	-68.4	0	0	0	114.2	L491 H493	L491-N495 VanDerWaalsContact O-CB 3.23Å; L491-N495 WeakPolarHBondContact O-CB 3.28Å; L491-N495 PolarHBondContact O-N 3.48Å; L491-N495 PolarHBondContact O-ND2 3.47Å; H493-N495 PolarHBondContact O-N 3.03Å
496	F	73.4	Confident	71.9	Confident	147 Å²	147	83 Å²	83	65%	0.645	40%	0.403	S	S	*	.	H	α-helix	trans	-80.5	-35.6	177.7	-107.9	-84.6	0	0	0	112.7	G492 H493 F494 R499	G492-F496 WeakPolarHBondContact O-CB 3.27Å; G492-F496 WeakPolarHBondContact O-CD2 3.4Å; G492-F496 PolarHBondContact O-N 2.92Å; G492-F496 VanDerWaalsContact O-N 3.11Å; H493-F496 PolarHBondContact O-N 3.42Å; F494-F496 VanDerWaalsContact C-N 3.3Å; F494-F496 PolarHBondContact O-N 3.07Å; F496-R499 PolarHBondContact O-N 3.05Å
497	E	62.5	Low	70.9	Confident	38 Å²	38	86 Å²	86	18%	0.178	42%	0.424	C	S	.	.	H	α-helix	trans	-80.7	-32.5	-178.4	-76.2	-157.9	-124.2	0	0	113.7	H493 R499 K500 N501 T508	H493-E497 IonicContact CE1-OE1 2.68Å; H493-E497 PolarHBondContact CE1-OE1 3.41Å; H493-E497 IonicContact ND1-OE1 3.18Å; H493-E497 PolarHBondContact O-N 2.92Å; E497-R499 PolarHBondContact O-N 3.3Å; E497-K500 PolarHBondContact O-N 3.08Å; E497-N501 PolarHBondContact O-N 3.32Å; E497-N501 PolarHBondContact OE2-ND2 2.9Å; E497-T508 HydrophobicContact CB-CG2 4.22Å; E497-T508 VanDerWaalsContact CD-CB 3.42Å; E497-T508 HydrophobicContact CG-CG2 4.47Å; E497-T508 WeakPolarHBondContact OE1-CB 3.38Å; E497-T508 PolarHBondContact OE1-OG1 3.35Å; E497-T508 WeakPolarHBondContact OE2-CB 3.38Å
498	D	57.1	Low	70.5	Confident	116 Å²	116	83.6 Å²	83.6	62%	0.62	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-20.1	169.3	-80.4	-5.7	0	0	0	112.6	F494 L533	F494-D498 PolarHBondContact O-N 3.14Å; D498-L533 WeakPolarHBondContact OD2-CD1 3.43Å
499	R	54.4	Low	70.2	Confident	209 Å²	209	81.8 Å²	81.8	79%	0.789	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-11.4	175.4	-62.9	-179.1	-176.7	-154.3	-0.1	114.8	F496 E497	F496-R499 PolarHBondContact O-N 3.05Å; E497-R499 PolarHBondContact O-N 3.3Å
500	K	57.5	Low	70.1	Confident	161 Å²	161	81.2 Å²	81.2	70%	0.7	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.6	-36.1	179.7	-74.9	-172.8	175.3	-178.2	0	113	E497 T502	E497-K500 PolarHBondContact O-N 3.08Å; K500-T502 VanDerWaalsContact C-N 3.26Å; K500-T502 PolarHBondContact O-N 2.64Å; K500-T502 VanDerWaalsContact O-N 3.12Å
501	N	50.1	Low	70	Confident	62 Å²	62	81.2 Å²	81.2	33%	0.332	40%	0.401	S	S	.	.			trans	-90.3	37.7	-167.6	-62	-12.8	0	0	0	113	E497 H503	E497-N501 PolarHBondContact O-N 3.32Å; E497-N501 PolarHBondContact OE2-ND2 2.9Å; N501-H503 PolarHBondContact O-N 2.9Å; N501-H503 VanDerWaalsContact O-N 3.15Å
502	T	46.3	Very low	69.9	Low	113 Å²	113	79.1 Å²	79.1	69%	0.693	39%	0.39	S	S	*	.	S	Bend	trans	-69.2	-4.1	176.1	42.8	0	0	0	0	114.3	K500	K500-T502 VanDerWaalsContact C-N 3.26Å; K500-T502 PolarHBondContact O-N 2.64Å; K500-T502 VanDerWaalsContact O-N 3.12Å
503	H	41.1	Very low	69.9	Low	182 Å²	182	77.8 Å²	77.8	84%	0.843	38%	0.375	S	S	*	.	S	Bend	trans	-129.3	-9.5	-177.9	-87.9	-75.7	0	0	0	117.2	N501	N501-H503 PolarHBondContact O-N 2.9Å; N501-H503 VanDerWaalsContact O-N 3.15Å
504	E	44.3	Very low	69.8	Low	141 Å²	141	76.8 Å²	76.8	66%	0.659	37%	0.37	S	S	*	.			trans	-136.6	129.7	173	-71.5	-164.5	160.4	0	0	112.1	S506	E504-S506 PolarHBondContact O-N 2.95Å
505	Q	44.7	Very low	69.5	Low	208 Å²	208	78.5 Å²	78.5	97%	0.972	38%	0.379	S	S	*	.			trans	-77.8	30.4	-169	-64.8	-176.4	-26.5	0	0	115.1	S507	Q505-S507 PolarHBondContact O-N 3.39Å
506	S	55.4	Low	69.2	Low	35 Å²	35	77.4 Å²	77.4	25%	0.245	37%	0.37	C	S	.	.			trans	-82.2	101.7	175.6	61.4	0	0	0	0	111.1	E504 T508 R634	E504-S506 PolarHBondContact O-N 2.95Å; S506-T508 PolarHBondContact O-N 3.49Å; S506-R634 PolarHBondContact OG-NH1 2.77Å; S506-R634 PolarHBondContact OG-NH2 2.81Å
507	S	74.2	Confident	69.7	Low	64 Å²	64	75.5 Å²	75.5	45%	0.448	36%	0.359	S	S	.	.			trans	-67.3	120.4	171.4	61.2	0	0	0	0	110.7	Q505	Q505-S507 PolarHBondContact O-N 3.39Å
508	T	85.3	Confident	70.5	Confident	10 Å²	10	75.5 Å²	75.5	6%	0.061	36%	0.36	C	S	.	.			trans	-63.2	151.9	176.4	-162.5	0	0	0	0	112.5	H493 F494 E497 S506 D609	H493-T508 PolarHBondContact CE1-OG1 3.09Å; H493-T508 PolarHBondContact NE2-OG1 3.02Å; F494-T508 HydrophobicContact CD1-CG2 3.52Å; F494-T508 HydrophobicContact CE1-CG2 3.6Å; E497-T508 HydrophobicContact CB-CG2 4.22Å; E497-T508 VanDerWaalsContact CD-CB 3.42Å; E497-T508 HydrophobicContact CG-CG2 4.47Å; E497-T508 WeakPolarHBondContact OE1-CB 3.38Å; E497-T508 PolarHBondContact OE1-OG1 3.35Å; E497-T508 WeakPolarHBondContact OE2-CB 3.38Å; S506-T508 PolarHBondContact O-N 3.49Å; T508-D609 WeakPolarHBondContact OG1-CB 3.48Å; T508-D609 PolarHBondContact OG1-OD2 3.26Å
509	R	88.5	Confident	72	Confident	45 Å²	45	70.1 Å²	70.1	17%	0.17	33%	0.332	C	S	.	.			trans	-134.4	137.9	-174.7	-71.7	-170.4	-64.9	-135.8	-8.8	113.4	F585 R586 Q607 V608 D609 L610	R509-F585 HydrophobicContact CB-CE1 4.3Å; R509-F585 HydrophobicContact CB-CE2 4.44Å; R509-F585 HydrophobicContact CB-CZ 3.79Å; R509-F585 HydrophobicContact CG-CE1 4.5Å; R509-F585 HydrophobicContact CG-CZ 4.2Å; R509-R586 PolarHBondContact NH1-O 3.1Å; R509-Q607 PolarHBondContact NE-O 2.98Å; R509-Q607 PolarHBondContact NH2-O 3.4Å; R509-V608 WeakPolarHBondContact O-CG1 3.48Å; R509-D609 PolarHBondContact N-OD2 3.22Å; R509-D609 PolarHBondContact O-N 3.16Å; R509-L610 PolarHBondContact O-N 3.22Å
510	A	91.4	Very high	73.7	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	148.5	177.6	0	0	0	0	0	113.1	L490 F494 F585 N591 T592 L593 L610	L490-A510 HydrophobicContact CD2-CB 3.83Å; F494-A510 HydrophobicContact CE2-CB 4.25Å; F494-A510 HydrophobicContact CZ-CB 3.94Å; A510-F585 WeakPolarHBondContact O-CE2 3.2Å; A510-F585 WeakPolarHBondContact O-CZ 3.2Å; A510-N591 PolarHBondContact N-O 2.75Å; A510-T592 WeakPolarHBondContact O-CA 3.33Å; A510-L593 PolarHBondContact O-N 3.17Å; A510-L610 CarbonylContact C-O 3.46Å; A510-L610 WeakPolarHBondContact CA-O 3.19Å; A510-L610 HydrophobicContact CB-CB 4.17Å; A510-L610 HydrophobicContact CB-CD2 4.3Å; A510-L610 HydrophobicContact CB-CG 4.44Å
511	I	91.1	Very high	75	Confident	1 Å²	1	55 Å²	55	1%	0.005	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	134.5	163	-56.9	179.9	0	0	0	109.3	F513 F585 L593 V605 V608 L610 I611 V612	I511-F513 HydrophobicContact CB-CE2 4.27Å; I511-F513 HydrophobicContact CG2-CD2 3.89Å; I511-F513 HydrophobicContact CG2-CE1 4.23Å; I511-F513 HydrophobicContact CG2-CE2 3.54Å; I511-F513 HydrophobicContact CG2-CG 4.37Å; I511-F513 HydrophobicContact CG2-CZ 3.74Å; I511-F585 HydrophobicContact CG1-CZ 4.1Å; I511-L593 CarbonylContact C-O 3.57Å; I511-L593 WeakPolarHBondContact CA-O 3.42Å; I511-L593 HydrophobicContact CG1-CB 4.19Å; I511-L593 HydrophobicContact CG2-CB 4.42Å; I511-V605 HydrophobicContact CD1-CB 4.23Å; I511-V605 HydrophobicContact CD1-CG1 3.67Å; I511-V605 HydrophobicContact CD1-CG2 4.46Å; I511-V608 HydrophobicContact CD1-CG1 4.39Å; I511-V608 HydrophobicContact CD1-CG2 3.75Å; I511-V608 HydrophobicContact CG1-CG1 3.98Å; I511-V608 HydrophobicContact CG1-CG2 4.03Å; I511-L610 PolarHBondContact N-O 2.84Å; I511-I611 HydrophobicContact CB-CG1 4.47Å; I511-I611 CarbonylContact O-C 3.59Å; I511-I611 WeakPolarHBondContact O-CA 3.35Å; I511-V612 PolarHBondContact O-N 3.47Å
512	V	92.5	Very high	76.7	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	121.8	168.5	-172.6	0	0	0	0	108.5	L486 L490 I523 T592 L593 V594 S595 V612	L486-V512 HydrophobicContact CD1-CG1 3.89Å; L486-V512 HydrophobicContact CD1-CG2 3.93Å; L486-V512 HydrophobicContact CD2-CG1 3.92Å; L490-V512 HydrophobicContact CD1-CG2 4.02Å; L490-V512 HydrophobicContact CD2-CG2 4.35Å; V512-I523 HydrophobicContact CG1-CD1 4.18Å; V512-T592 HydrophobicContact CG2-CG2 4.11Å; V512-L593 PolarHBondContact N-O 2.97Å; V512-V594 HydrophobicContact CB-CG1 4.39Å; V512-V594 HydrophobicContact CB-CG2 4.5Å; V512-V594 CarbonylContact O-C 3.55Å; V512-V594 WeakPolarHBondContact O-CA 3.3Å; V512-S595 PolarHBondContact O-N 3.4Å; V512-V612 CarbonylContact C-O 3.57Å; V512-V612 VanDerWaalsContact CA-O 3.26Å; V512-V612 WeakPolarHBondContact CA-O 3.39Å
513	F	90.6	Very high	78.9	Confident	1 Å²	1	46.9 Å²	46.9	0%	0.004	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	139.9	172.7	-73.7	-75.7	0	0	0	110.9	I511 S595 E600 I611 V612 F614 R626	I511-F513 HydrophobicContact CB-CE2 4.27Å; I511-F513 HydrophobicContact CG2-CD2 3.89Å; I511-F513 HydrophobicContact CG2-CE1 4.23Å; I511-F513 HydrophobicContact CG2-CE2 3.54Å; I511-F513 HydrophobicContact CG2-CG 4.37Å; I511-F513 HydrophobicContact CG2-CZ 3.74Å; F513-S595 WeakPolarHBondContact CA-O 3.31Å; F513-E600 HydrophobicContact CD1-CG 3.99Å; F513-E600 HydrophobicContact CE1-CG 3.57Å; F513-E600 HydrophobicContact CZ-CG 4.02Å; F513-I611 HydrophobicContact CD2-CG2 3.78Å; F513-I611 HydrophobicContact CE2-CD1 4.43Å; F513-I611 HydrophobicContact CE2-CG2 4.02Å; F513-V612 PolarHBondContact N-O 3Å; F513-F614 WeakPolarHBondContact O-CB 3.48Å; F513-F614 PolarHBondContact O-N 2.92Å; F513-R626 HydrophobicContact CD2-CG 4.12Å; F513-R626 HydrophobicContact CE2-CG 3.89Å; F513-R626 HydrophobicContact CZ-CG 4.37Å
514	T	88.9	Confident	81.3	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.187	C	C	.	.			trans	-147.5	145.5	166.2	-178.9	0	0	0	0	111.1	F516 S519 V520 I523 S595 T596 D615	T514-F516 VanDerWaalsContact C-N 3.31Å; T514-F516 PolarHBondContact O-N 3.36Å; T514-S519 WeakPolarHBondContact OG1-CB 3.45Å; T514-V520 HydrophobicContact CG2-CG2 3.51Å; T514-I523 HydrophobicContact CG2-CD1 4.19Å; T514-S595 PolarHBondContact N-O 3.43Å; T514-T596 VanDerWaalsContact O-CA 3.28Å; T514-T596 WeakPolarHBondContact O-CA 3.4Å; T514-D615 WeakPolarHBondContact CA-OD1 3.45Å; T514-D615 WeakPolarHBondContact CA-OD2 3.09Å; T514-D615 VanDerWaalsContact CB-OD2 3.29Å; T514-D615 WeakPolarHBondContact CB-OD2 3.34Å; T514-D615 PolarHBondContact OG1-OD2 2.96Å
515	Q	83.4	Confident	83.4	Confident	44 Å²	44	34.1 Å²	34.1	21%	0.206	17%	0.165	C	C	.	.	S	Bend	trans	-64.8	-33.2	179.2	-64.9	-176.6	43.3	0	0	112.8	D615 A616	Q515-D615 PolarHBondContact N-OD1 2.75Å; Q515-D615 PolarHBondContact N-OD2 3.39Å; Q515-A616 PolarHBondContact NE2-O 3.37Å
516	F	80.3	Confident	85.6	Confident	48 Å²	48	24.6 Å²	24.6	21%	0.211	12%	0.121	C	C	.	.			trans	-104.1	132.9	-168.3	-72.1	-98.9	0	0	0	114.2	L402 H406 T514 D518 S519 V520	L402-F516 HydrophobicContact CD2-CD1 3.98Å; L402-F516 HydrophobicContact CD2-CE1 3.49Å; L402-F516 VanDerWaalsContact CD2-CE1 3.49Å; L402-F516 HydrophobicContact CD2-CE2 4.42Å; L402-F516 HydrophobicContact CD2-CZ 3.74Å; H406-F516 AromaticContact CD2-CD2 3.47Å; H406-F516 VanDerWaalsContact CD2-CD2 3.47Å; H406-F516 WeakPolarHBondContact CD2-CD2 3.5Å; H406-F516 AromaticContact CD2-CE2 3.74Å; H406-F516 AromaticContact CE1-CD2 3.71Å; H406-F516 AromaticContact NE2-CD2 3.03Å; H406-F516 WeakPolarHBondContact NE2-CD2 3.42Å; H406-F516 AromaticContact NE2-CE2 3.21Å; H406-F516 WeakPolarHBondContact NE2-CE2 3.26Å; T514-F516 VanDerWaalsContact C-N 3.31Å; T514-F516 PolarHBondContact O-N 3.36Å; F516-D518 VanDerWaalsContact C-N 3.29Å; F516-D518 PolarHBondContact O-N 2.84Å; F516-S519 WeakPolarHBondContact O-CB 3.43Å; F516-S519 PolarHBondContact O-N 2.85Å; F516-V520 PolarHBondContact O-N 2.85Å
517	R	83.4	Confident	87.3	Confident	107 Å²	107	22.9 Å²	22.9	40%	0.404	11%	0.109	S	C	.	.	H	α-helix	trans	-63.6	-32.5	177.7	-59.6	-175.5	-177.1	168	4.9	113	S519 V520 E521 I540 T596	R517-S519 VanDerWaalsContact C-N 3.34Å; R517-V520 WeakPolarHBondContact O-CB 3.07Å; R517-V520 PolarHBondContact O-N 2.83Å; R517-E521 PolarHBondContact O-N 2.89Å; R517-I540 HydrophobicContact CG-CG2 3.83Å; R517-T596 HydrophobicContact CG-CG2 3.98Å
518	D	81	Confident	88.1	Confident	39 Å²	39	23.3 Å²	23.3	21%	0.209	10%	0.103	C	C	.	.	H	α-helix	trans	-63.2	-41.8	175.3	-72.1	-53.4	0	0	0	111.5	P410 R413 F516 V520 E521 E522	P410-D518 HydrophobicContact CG-CB 4.31Å; R413-D518 WeakPolarHBondContact CD-OD1 3.4Å; R413-D518 IonicContact CZ-OD1 2.92Å; R413-D518 IonicContact NE-OD1 3.06Å; R413-D518 IonicContact NH1-OD1 3.58Å; R413-D518 PolarHBondContact NH1-OD1 2.92Å; F516-D518 VanDerWaalsContact C-N 3.29Å; F516-D518 PolarHBondContact O-N 2.84Å; D518-V520 VanDerWaalsContact C-N 3.35Å; D518-V520 PolarHBondContact O-N 2.68Å; D518-E521 PolarHBondContact O-N 3.44Å; D518-E522 PolarHBondContact O-N 3.42Å; D518-E522 VanDerWaalsContact O-N 3.16Å
519	S	87.7	Confident	88.2	Confident	2 Å²	2	27.2 Å²	27.2	1%	0.014	13%	0.128	C	C	.	.	H	α-helix	trans	-63.6	-37.1	174.4	-50	0	0	0	0	112.1	T514 F516 R517 E521 E522 I523	T514-S519 WeakPolarHBondContact OG1-CB 3.45Å; F516-S519 WeakPolarHBondContact O-CB 3.43Å; F516-S519 PolarHBondContact O-N 2.85Å; R517-S519 VanDerWaalsContact C-N 3.34Å; S519-E521 VanDerWaalsContact C-N 3.35Å; S519-E521 PolarHBondContact O-N 3.1Å; S519-E522 PolarHBondContact O-N 2.91Å; S519-I523 WeakPolarHBondContact O-CB 3.37Å; S519-I523 WeakPolarHBondContact O-CD1 3.44Å; S519-I523 WeakPolarHBondContact O-CG1 3.27Å; S519-I523 PolarHBondContact O-N 2.73Å
520	V	89.2	Confident	88.3	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-58.1	-45.5	173.5	176	0	0	0	0	111.1	T514 F516 R517 D518 M524 I540 V594 T596	T514-V520 HydrophobicContact CG2-CG2 3.51Å; F516-V520 PolarHBondContact O-N 2.85Å; R517-V520 WeakPolarHBondContact O-CB 3.07Å; R517-V520 PolarHBondContact O-N 2.83Å; D518-V520 VanDerWaalsContact C-N 3.35Å; D518-V520 PolarHBondContact O-N 2.68Å; V520-M524 HydrophobicContact CG1-CG 4.19Å; V520-M524 WeakPolarHBondContact O-CB 3.48Å; V520-M524 WeakPolarHBondContact O-CG 3.46Å; V520-M524 PolarHBondContact O-N 3.33Å; V520-I540 HydrophobicContact CB-CD1 4.22Å; V520-I540 HydrophobicContact CG1-CD1 3.84Å; V520-I540 HydrophobicContact CG1-CG1 4.09Å; V520-V594 HydrophobicContact CB-CG1 4.32Å; V520-V594 HydrophobicContact CG1-CB 4.29Å; V520-V594 HydrophobicContact CG1-CG1 3.89Å; V520-V594 HydrophobicContact CG2-CG1 4.37Å; V520-T596 HydrophobicContact CG2-CG2 3.85Å
521	E	84.9	Confident	88.1	Confident	54 Å²	54	32.9 Å²	32.9	25%	0.252	16%	0.156	S	C	.	.	H	α-helix	trans	-69.7	-33.6	179.1	-79.8	-56.4	140.8	0	0	113.5	R517 D518 S519 M524 H525 K528	R517-E521 PolarHBondContact O-N 2.89Å; D518-E521 PolarHBondContact O-N 3.44Å; S519-E521 VanDerWaalsContact C-N 3.35Å; S519-E521 PolarHBondContact O-N 3.1Å; E521-M524 PolarHBondContact O-N 3.48Å; E521-H525 WeakPolarHBondContact O-CB 3.45Å; E521-H525 PolarHBondContact O-N 2.71Å; E521-K528 IonicContact OE2-NZ 3.03Å; E521-K528 PolarHBondContact OE2-NZ 2.88Å
522	E	87.6	Confident	87.9	Confident	4 Å²	4	38.1 Å²	38.1	2%	0.019	19%	0.19	C	C	.	.	H	α-helix	trans	-69.1	-46.3	175.2	-172.6	165.1	-165.9	0	0	111.9	R409 F476 G479 L483 D518 S519 M524 H525 M526	R409-E522 WeakPolarHBondContact CB-OE2 3.48Å; F476-E522 HydrophobicContact CE2-CG 4.03Å; F476-E522 HydrophobicContact CZ-CG 3.97Å; G479-E522 WeakPolarHBondContact CA-OE1 3.45Å; G479-E522 PolarHBondContact N-OE1 2.84Å; L483-E522 HydrophobicContact CD1-CG 3.86Å; L483-E522 WeakPolarHBondContact CD1-OE1 3.22Å; L483-E522 HydrophobicContact CD2-CG 4.37Å; D518-E522 PolarHBondContact O-N 3.42Å; D518-E522 VanDerWaalsContact O-N 3.16Å; S519-E522 PolarHBondContact O-N 2.91Å; E522-M524 VanDerWaalsContact C-N 3.31Å; E522-M524 PolarHBondContact O-N 2.69Å; E522-H525 PolarHBondContact O-N 3.49Å; E522-H525 VanDerWaalsContact O-N 3.1Å; E522-M526 PolarHBondContact O-N 2.86Å
523	I	92.2	Very high	87.8	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-60	-42.9	172.3	-65.6	164.8	0	0	0	110.3	L483 L486 V512 T514 S519 H525 M526 L527 V594 F614	L483-I523 HydrophobicContact CD2-CG1 3.61Å; L486-I523 HydrophobicContact CD2-CB 4.37Å; L486-I523 HydrophobicContact CD2-CD1 3.93Å; L486-I523 HydrophobicContact CD2-CG1 3.78Å; L486-I523 HydrophobicContact CD2-CG2 3.69Å; V512-I523 HydrophobicContact CG1-CD1 4.18Å; T514-I523 HydrophobicContact CG2-CD1 4.19Å; S519-I523 WeakPolarHBondContact O-CB 3.37Å; S519-I523 WeakPolarHBondContact O-CD1 3.44Å; S519-I523 WeakPolarHBondContact O-CG1 3.27Å; S519-I523 PolarHBondContact O-N 2.73Å; I523-H525 VanDerWaalsContact C-N 3.32Å; I523-H525 PolarHBondContact O-N 3.13Å; I523-M526 WeakPolarHBondContact O-CB 3.43Å; I523-M526 PolarHBondContact O-N 3.3Å; I523-L527 HydrophobicContact CG2-CD1 3.78Å; I523-L527 HydrophobicContact CG2-CG 4.24Å; I523-L527 WeakPolarHBondContact O-CB 3.44Å; I523-L527 VanDerWaalsContact O-CG 3.31Å; I523-L527 WeakPolarHBondContact O-CG 3.18Å; I523-L527 PolarHBondContact O-N 2.89Å; I523-V594 HydrophobicContact CB-CG1 3.97Å; I523-V594 HydrophobicContact CD1-CG1 4.37Å; I523-V594 HydrophobicContact CG2-CB 4.48Å; I523-V594 HydrophobicContact CG2-CG1 3.65Å; I523-V594 HydrophobicContact CG2-CG2 3.93Å; I523-F614 HydrophobicContact CD1-CB 4.35Å; I523-F614 HydrophobicContact CD1-CD1 4.34Å; I523-F614 HydrophobicContact CD1-CD2 3.98Å; I523-F614 HydrophobicContact CD1-CE2 4.32Å; I523-F614 HydrophobicContact CD1-CG 3.97Å
524	M	91.4	Very high	87.8	Confident	12 Å²	12	40.1 Å²	40.1	6%	0.059	20%	0.201	C	C	.	.	H	α-helix	trans	-63.5	-35.5	175	-76.9	-69	-66.8	0	0	112.2	V520 E521 E522 K528 P536 A537 V594	V520-M524 HydrophobicContact CG1-CG 4.19Å; V520-M524 WeakPolarHBondContact O-CB 3.48Å; V520-M524 WeakPolarHBondContact O-CG 3.46Å; V520-M524 PolarHBondContact O-N 3.33Å; E521-M524 PolarHBondContact O-N 3.48Å; E522-M524 VanDerWaalsContact C-N 3.31Å; E522-M524 PolarHBondContact O-N 2.69Å; M524-K528 WeakPolarHBondContact O-CB 3.48Å; M524-K528 WeakPolarHBondContact O-CD 3.26Å; M524-K528 WeakPolarHBondContact O-CE 3.37Å; M524-K528 WeakPolarHBondContact O-CG 3.3Å; M524-K528 PolarHBondContact O-N 3Å; M524-P536 HydrophobicContact CE-CB 4.37Å; M524-P536 HydrophobicContact SD-CB 3.78Å; M524-P536 HydrophobicContact SD-CG 4.38Å; M524-A537 VanDerWaalsContact SD-C 3.57Å; M524-V594 HydrophobicContact CG-CB 4.18Å; M524-V594 HydrophobicContact CG-CG1 4.49Å; M524-V594 HydrophobicContact CG-CG2 4.27Å; M524-V594 HydrophobicContact SD-CB 4Å; M524-V594 HydrophobicContact SD-CG2 3.72Å
525	H	86.9	Confident	88.1	Confident	42 Å²	42	43.7 Å²	43.7	19%	0.194	21%	0.214	C	C	.	.	H	α-helix	trans	-67	-43.2	173.7	-152.1	111.4	0	0	0	111.4	Q473 F476 E521 E522 I523 L527 P529	Q473-H525 WeakPolarHBondContact CB-NE2 3.39Å; Q473-H525 PolarHBondContact N-NE2 2.87Å; F476-H525 HydrophobicContact CD2-CB 4.47Å; F476-H525 HydrophobicContact CE2-CB 4.33Å; E521-H525 WeakPolarHBondContact O-CB 3.45Å; E521-H525 PolarHBondContact O-N 2.71Å; E522-H525 PolarHBondContact O-N 3.49Å; E522-H525 VanDerWaalsContact O-N 3.1Å; I523-H525 VanDerWaalsContact C-N 3.32Å; I523-H525 PolarHBondContact O-N 3.13Å; H525-L527 PolarHBondContact O-N 3.2Å; H525-P529 WeakPolarHBondContact O-CD 3.36Å
526	M	91.2	Very high	88.6	Confident	8 Å²	8	41.9 Å²	41.9	4%	0.039	21%	0.206	C	C	.	.	H	α-helix	trans	-60.7	-40.1	176.5	-170.9	-178.7	70	0	0	113.4	F476 L483 L486 R487 E522 I523	F476-M526 HydrophobicContact CD1-CB 4.24Å; F476-M526 HydrophobicContact CD1-CG 3.95Å; F476-M526 HydrophobicContact CD2-CB 4.36Å; F476-M526 HydrophobicContact CE1-CB 3.75Å; F476-M526 HydrophobicContact CE1-CG 3.57Å; F476-M526 HydrophobicContact CE1-SD 3.88Å; F476-M526 HydrophobicContact CE2-CB 3.89Å; F476-M526 HydrophobicContact CZ-CB 3.56Å; F476-M526 HydrophobicContact CZ-CG 3.94Å; F476-M526 HydrophobicContact CZ-SD 4.3Å; L483-M526 VanDerWaalsContact C-SD 3.55Å; L483-M526 HydrophobicContact CB-SD 3.75Å; L483-M526 HydrophobicContact CD2-SD 4.41Å; L483-M526 WeakPolarHBondContact O-CE 3.11Å; L486-M526 HydrophobicContact CB-CE 4.27Å; L486-M526 HydrophobicContact CD2-CE 3.88Å; L486-M526 HydrophobicContact CG-CE 4.02Å; R487-M526 HydrophobicContact CB-CE 3.87Å; R487-M526 HydrophobicContact CB-SD 3.87Å; E522-M526 PolarHBondContact O-N 2.86Å; I523-M526 WeakPolarHBondContact O-CB 3.43Å; I523-M526 PolarHBondContact O-N 3.3Å
527	L	92.7	Very high	89.1	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-88.8	-22.7	-174.8	-62.1	-179.2	0	0	0	113.8	L490 I523 H525 L530 I534 P536 T592 V594	L490-L527 HydrophobicContact CD1-CD1 3.78Å; L490-L527 HydrophobicContact CD1-CD2 3.76Å; L490-L527 HydrophobicContact CD1-CG 4.42Å; I523-L527 HydrophobicContact CG2-CD1 3.78Å; I523-L527 HydrophobicContact CG2-CG 4.24Å; I523-L527 WeakPolarHBondContact O-CB 3.44Å; I523-L527 VanDerWaalsContact O-CG 3.31Å; I523-L527 WeakPolarHBondContact O-CG 3.18Å; I523-L527 PolarHBondContact O-N 2.89Å; H525-L527 PolarHBondContact O-N 3.2Å; L527-L530 HydrophobicContact CD2-CD1 3.82Å; L527-L530 PolarHBondContact O-N 2.85Å; L527-L530 VanDerWaalsContact O-N 3.09Å; L527-I534 HydrophobicContact CB-CG2 4.35Å; L527-I534 HydrophobicContact CD2-CD1 4.26Å; L527-I534 HydrophobicContact CD2-CG2 4.47Å; L527-P536 HydrophobicContact CB-CB 3.91Å; L527-P536 HydrophobicContact CB-CG 3.74Å; L527-P536 HydrophobicContact CD1-CB 4.29Å; L527-T592 HydrophobicContact CD1-CG2 4.13Å; L527-V594 HydrophobicContact CD1-CG2 4.12Å
528	K	89.3	Confident	89.5	Confident	72 Å²	72	36 Å²	36	31%	0.313	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-54.8	-41.2	178.6	-85.1	157.8	-162.9	158.4	0	113.5	E521 M524 L530	E521-K528 IonicContact OE2-NZ 3.03Å; E521-K528 PolarHBondContact OE2-NZ 2.88Å; M524-K528 WeakPolarHBondContact O-CB 3.48Å; M524-K528 WeakPolarHBondContact O-CD 3.26Å; M524-K528 WeakPolarHBondContact O-CE 3.37Å; M524-K528 WeakPolarHBondContact O-CG 3.3Å; M524-K528 PolarHBondContact O-N 3Å; K528-L530 VanDerWaalsContact C-N 3.29Å; K528-L530 PolarHBondContact O-N 2.72Å
529	P	89.1	Confident	89.8	Confident	92 Å²	92	34.3 Å²	34.3	60%	0.597	18%	0.179	S	C	*	.	G	3₁₀ helix	trans	-66.9	-19.5	175.5	-25.2	35.3	0	0	0	115.6	H525 K531	H525-P529 WeakPolarHBondContact O-CD 3.36Å; P529-K531 PolarHBondContact O-N 3.41Å; P529-K531 VanDerWaalsContact O-N 3.16Å
530	L	89.1	Confident	89.6	Confident	43 Å²	43	35 Å²	35	23%	0.225	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-84.5	17.6	-172.3	-56.2	176.7	0	0	0	113.4	R487 L491 L527 K528 L533 I534	R487-L530 HydrophobicContact CG-CD1 4.04Å; L491-L530 HydrophobicContact CD2-CD1 4.23Å; L491-L530 HydrophobicContact CD2-CD2 4.49Å; L491-L530 HydrophobicContact CG-CD1 4.45Å; L527-L530 HydrophobicContact CD2-CD1 3.82Å; L527-L530 PolarHBondContact O-N 2.85Å; L527-L530 VanDerWaalsContact O-N 3.09Å; K528-L530 VanDerWaalsContact C-N 3.29Å; K528-L530 PolarHBondContact O-N 2.72Å; L530-L533 PolarHBondContact O-N 3.34Å; L530-I534 HydrophobicContact CB-CB 4.02Å; L530-I534 HydrophobicContact CB-CD1 4.28Å; L530-I534 HydrophobicContact CB-CG1 4.25Å; L530-I534 HydrophobicContact CD1-CD1 3.95Å; L530-I534 PolarHBondContact O-N 3.3Å
531	K	87.2	Confident	88.8	Confident	122 Å²	122	35.1 Å²	35.1	53%	0.53	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	143.9	172.1	-72.2	178	179	-175.2	0	110.1	P529 I534	P529-K531 PolarHBondContact O-N 3.41Å; P529-K531 VanDerWaalsContact O-N 3.16Å; K531-I534 WeakPolarHBondContact CG-O 3.44Å
532	P	87	Confident	87.9	Confident	111 Å²	111	36.9 Å²	36.9	72%	0.721	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	cis	-86	-11.6	9.4	33.8	-36.8	0	0	0	115.5	R535	P532-R535 WeakPolarHBondContact O-CG 3.45Å; P532-R535 PolarHBondContact O-NH1 2.83Å
533	L	90	Very high	86.4	Confident	43 Å²	43	37.4 Å²	37.4	23%	0.225	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-52.7	-174.2	-176.3	68.4	0	0	0	111.8	L491 F494 D498 L530 N591	L491-L533 HydrophobicContact CD2-CD2 3.91Å; F494-L533 HydrophobicContact CB-CD1 3.82Å; F494-L533 HydrophobicContact CB-CD2 4.27Å; F494-L533 HydrophobicContact CB-CG 3.9Å; D498-L533 WeakPolarHBondContact OD2-CD1 3.43Å; L530-L533 PolarHBondContact O-N 3.34Å; L533-N591 PolarHBondContact O-ND2 2.98Å
534	I	92.1	Very high	84.2	Confident	0 Å²	0	42 Å²	42	0%	0	23%	0.226	C	C	.	.			trans	-106.2	123.6	175.7	-53.3	-174.2	0	0	0	108.7	L490 L491 F494 L527 L530 K531 P536	L490-I534 HydrophobicContact CB-CD1 3.89Å; L491-I534 HydrophobicContact CD2-CD1 4.11Å; F494-I534 HydrophobicContact CD2-CD1 3.99Å; F494-I534 HydrophobicContact CD2-CG1 3.71Å; F494-I534 HydrophobicContact CE2-CD1 4.36Å; F494-I534 HydrophobicContact CE2-CG1 4.09Å; F494-I534 HydrophobicContact CG-CG1 4.49Å; L527-I534 HydrophobicContact CB-CG2 4.35Å; L527-I534 HydrophobicContact CD2-CD1 4.26Å; L527-I534 HydrophobicContact CD2-CG2 4.47Å; L530-I534 HydrophobicContact CB-CB 4.02Å; L530-I534 HydrophobicContact CB-CD1 4.28Å; L530-I534 HydrophobicContact CB-CG1 4.25Å; L530-I534 HydrophobicContact CD1-CD1 3.95Å; L530-I534 PolarHBondContact O-N 3.3Å; K531-I534 WeakPolarHBondContact CG-O 3.44Å; I534-P536 WeakPolarHBondContact O-CD 2.85Å
535	R	93.7	Very high	81.7	Confident	74 Å²	74	50.8 Å²	50.8	28%	0.279	26%	0.258	S	S	.	.			trans	-117.9	82.2	178.8	-59.8	-173.8	-59	-76	5.3	108.3	P532 G588 V589 Y590 N591 T592	P532-R535 WeakPolarHBondContact O-CG 3.45Å; P532-R535 PolarHBondContact O-NH1 2.83Å; R535-G588 PolarHBondContact NH2-O 2.88Å; R535-V589 WeakPolarHBondContact CD-O 3.38Å; R535-V589 PolarHBondContact NE-O 3.42Å; R535-Y590 WeakPolarHBondContact O-CA 3.5Å; R535-Y590 WeakPolarHBondContact O-CB 3.49Å; R535-N591 PolarHBondContact N-OD1 2.81Å; R535-N591 PolarHBondContact O-N 3.49Å; R535-T592 PolarHBondContact O-N 3.5Å
536	P	93.9	Very high	79.4	Confident	6 Å²	6	53.6 Å²	53.6	4%	0.039	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	145.9	-172.7	36	-38.3	0	0	0	112	M524 L527 I534 T592 V594	M524-P536 HydrophobicContact CE-CB 4.37Å; M524-P536 HydrophobicContact SD-CB 3.78Å; M524-P536 HydrophobicContact SD-CG 4.38Å; L527-P536 HydrophobicContact CB-CB 3.91Å; L527-P536 HydrophobicContact CB-CG 3.74Å; L527-P536 HydrophobicContact CD1-CB 4.29Å; I534-P536 WeakPolarHBondContact O-CD 2.85Å; P536-T592 CarbonylContact C-O 3.36Å; P536-T592 VanDerWaalsContact CA-O 3.29Å; P536-T592 WeakPolarHBondContact CA-O 3.29Å; P536-V594 HydrophobicContact CB-CG2 4.48Å
537	A	92.7	Very high	76.5	Confident	7 Å²	7	60.9 Å²	60.9	6%	0.058	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	141.7	167.7	0	0	0	0	0	110.6	M524 V581 Y590 T592 L593 V594	M524-A537 VanDerWaalsContact SD-C 3.57Å; A537-V581 HydrophobicContact CB-CG1 3.93Å; A537-Y590 HydrophobicContact CB-CD1 3.76Å; A537-Y590 HydrophobicContact CB-CD2 3.68Å; A537-Y590 HydrophobicContact CB-CE1 4.05Å; A537-Y590 HydrophobicContact CB-CE2 3.98Å; A537-Y590 HydrophobicContact CB-CG 3.57Å; A537-T592 PolarHBondContact N-O 3.26Å; A537-L593 HydrophobicContact CB-CD1 4.45Å; A537-V594 PolarHBondContact O-N 2.95Å
538	S	91.5	Very high	73.5	Confident	25 Å²	25	64 Å²	64	18%	0.175	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	142.6	176.2	38.1	0	0	0	0	111.8	I573 V594	S538-I573 VanDerWaalsContact O-CD1 3.31Å; S538-I573 WeakPolarHBondContact O-CD1 3.32Å; S538-V594 CarbonylContact C-O 3.58Å; S538-V594 WeakPolarHBondContact CA-O 3.45Å
539	F	87.4	Confident	70.5	Confident	3 Å²	3	65.1 Å²	65.1	1%	0.013	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	105	176.6	-163	-93.8	0	0	0	110	Q578 V581 M582 L593 V594 S595 T596 I598 I603	F539-Q578 HydrophobicContact CE2-CB 3.74Å; F539-Q578 HydrophobicContact CE2-CG 4.07Å; F539-Q578 HydrophobicContact CZ-CB 3.97Å; F539-Q578 HydrophobicContact CZ-CG 4.14Å; F539-V581 HydrophobicContact CD2-CG1 4.11Å; F539-M582 HydrophobicContact CD2-CE 3.92Å; F539-M582 HydrophobicContact CE2-CE 3.65Å; F539-M582 HydrophobicContact CZ-CE 4.07Å; F539-L593 HydrophobicContact CB-CD1 3.94Å; F539-L593 HydrophobicContact CB-CD2 4.1Å; F539-L593 HydrophobicContact CB-CG 3.93Å; F539-L593 HydrophobicContact CD2-CD1 4.5Å; F539-L593 HydrophobicContact CG-CD2 4.3Å; F539-V594 PolarHBondContact N-O 3.41Å; F539-S595 VanDerWaalsContact O-CA 3.28Å; F539-S595 WeakPolarHBondContact O-CA 3.25Å; F539-T596 PolarHBondContact O-N 3.27Å; F539-T596 VanDerWaalsContact O-N 3.07Å; F539-I598 HydrophobicContact CE1-CG2 4.36Å; F539-I603 HydrophobicContact CE1-CD1 3.65Å; F539-I603 HydrophobicContact CZ-CD1 3.55Å
540	I	83.5	Confident	67.6	Low	17 Å²	17	66.3 Å²	66.3	9%	0.087	37%	0.374	C	S	.	.			trans	-133.2	145.1	-170.5	-53.8	178.2	0	0	0	108.3	R517 V520 I573 Q578	R517-I540 HydrophobicContact CG-CG2 3.83Å; V520-I540 HydrophobicContact CB-CD1 4.22Å; V520-I540 HydrophobicContact CG1-CD1 3.84Å; V520-I540 HydrophobicContact CG1-CG1 4.09Å; I540-I573 HydrophobicContact CB-CD1 4.1Å; I540-I573 HydrophobicContact CB-CG1 4.18Å; I540-I573 HydrophobicContact CG1-CD1 4.3Å; I540-Q578 PolarHBondContact O-NE2 3.1Å
541	G	70.6	Confident	64.6	Low	2 Å²	2	72.7 Å²	72.7	2%	0.021	40%	0.403	C	S	.	.			trans	-58.3	165.7	175.3	0	0	0	0	0	115.2	G543 G572 I573 I598	G541-G543 PolarHBondContact O-N 3.34Å; G541-G572 WeakPolarHBondContact O-CA 3.4Å; G541-I573 PolarHBondContact O-N 3.36Å; G541-I598 VanDerWaalsContact CA-CD1 3.41Å
542	Q	66.8	Low	61.8	Low	92 Å²	92	74.5 Å²	74.5	43%	0.43	42%	0.417	S	S	.	.			trans	-77.9	67.2	174.1	-73.5	175.4	93.8	0	0	110.9	I573 Q575	Q542-I573 WeakPolarHBondContact CG-O 3.47Å; Q542-Q575 VanDerWaalsContact OE1-N 3.16Å
543	G	55.8	Low	58.8	Low	14 Å²	14	74.3 Å²	74.3	14%	0.144	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-60.3	137.6	173.9	0	0	0	0	0	113.2	G541 G572	G541-G543 PolarHBondContact O-N 3.34Å; G543-G572 PolarHBondContact O-N 3.12Å
544	T	47	Very low	55.9	Low	96 Å²	96	79.7 Å²	79.7	59%	0.589	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-46.1	134.9	176.5	-26.4	0	0	0	0	111.8	V546	T544-V546 PolarHBondContact O-N 3.03Å
545	R	38.7	Very low	52.8	Low	198 Å²	198	86.9 Å²	86.9	75%	0.747	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-71.5	125	170.5	-70.7	-177.8	176	-174.2	-0.9	108.9	N547	R545-N547 PolarHBondContact O-N 3.14Å
546	V	39	Very low	49.8	Very low	101 Å²	101	94.4 Å²	94.4	61%	0.612	51%	0.507	S	S	*	.			trans	-70.5	96.5	171.8	-177.6	0	0	0	0	108.9	T544 G548	T544-V546 PolarHBondContact O-N 3.03Å; V546-G548 VanDerWaalsContact C-N 3.32Å; V546-G548 PolarHBondContact O-N 3.03Å
547	N	28.7	Very low	46.5	Very low	161 Å²	161	102.3 Å²	102.3	86%	0.861	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	87.9	171.9	-71.8	-19	0	0	0	109.3	R545	R545-N547 PolarHBondContact O-N 3.14Å
548	G	29.6	Very low	43.3	Very low	65 Å²	65	107.7 Å²	107.7	67%	0.67	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	162.8	-4.5	178.4	0	0	0	0	0	117.6	V546 P550	V546-G548 VanDerWaalsContact C-N 3.32Å; V546-G548 PolarHBondContact O-N 3.03Å; G548-P550 VanDerWaalsContact O-CD 3.25Å; G548-P550 WeakPolarHBondContact O-CD 3.32Å
549	S	27.8	Very low	40.2	Very low	96 Å²	96	111.9 Å²	111.9	67%	0.671	61%	0.607	S	S	*	*			trans	-72	117.4	174.3	45.1	0	0	0	0	111.3	Q551	S549-Q551 PolarHBondContact O-N 2.86Å
550	P	27.1	Very low	37.3	Very low	116 Å²	116	119.4 Å²	119.4	75%	0.753	65%	0.648	S	S	*	*			trans	-70.2	132.9	177.1	-15.8	31.5	0	0	0	110.1	G548 L552	G548-P550 VanDerWaalsContact O-CD 3.25Å; G548-P550 WeakPolarHBondContact O-CD 3.32Å; P550-L552 PolarHBondContact O-N 3.42Å
551	Q	26.5	Very low	34.6	Very low	177 Å²	177	125.9 Å²	125.9	83%	0.827	68%	0.682	S	S	*	*			trans	-69.4	101.3	171	-67.7	-177.6	2	0	0	109.3	S549 T553	S549-Q551 PolarHBondContact O-N 2.86Å; Q551-T553 VanDerWaalsContact C-N 3.3Å; Q551-T553 HydrophobicContact CB-CG2 4.46Å; Q551-T553 PolarHBondContact O-N 3.05Å
552	L	28.7	Very low	32.5	Very low	161 Å²	161	133.8 Å²	133.8	84%	0.843	72%	0.715	S	S	*	*			trans	-72.9	87.3	169.5	-83.7	168.7	0	0	0	109.6	P550 N554	P550-L552 PolarHBondContact O-N 3.42Å; L552-N554 VanDerWaalsContact C-N 3.29Å; L552-N554 PolarHBondContact O-N 3.01Å
553	T	24	Very low	30.5	Very low	106 Å²	106	136.1 Å²	136.1	65%	0.65	73%	0.731	S	S	*	*			trans	-71.5	78.5	176.6	53.5	0	0	0	0	111.3	Q551 Q555	Q551-T553 VanDerWaalsContact C-N 3.3Å; Q551-T553 HydrophobicContact CB-CG2 4.46Å; Q551-T553 PolarHBondContact O-N 3.05Å; T553-Q555 VanDerWaalsContact C-N 3.27Å; T553-Q555 PolarHBondContact O-N 3.42Å
554	N	29.7	Very low	29.2	Very low	156 Å²	156	139 Å²	139	83%	0.834	75%	0.749	S	S	*	*			trans	-74.1	86.1	162.7	-82.7	-4.3	0	0	0	109.3	L552 Y556	L552-N554 VanDerWaalsContact C-N 3.29Å; L552-N554 PolarHBondContact O-N 3.01Å; N554-Y556 PolarHBondContact O-N 2.88Å
555	Q	25.7	Very low	28.3	Very low	152 Å²	152	146.3 Å²	146.3	71%	0.71	77%	0.766	S	S	*	*			trans	-63.6	107.8	158.8	-67.5	171.2	-34.1	0	0	108.3	T553	T553-Q555 VanDerWaalsContact C-N 3.27Å; T553-Q555 PolarHBondContact O-N 3.42Å
556	Y	30.3	Very low	28.1	Very low	232 Å²	232	141.4 Å²	141.4	91%	0.91	75%	0.754	S	S	*	*			trans	-164.1	154.6	141.2	-93.3	-59.5	0	0	0	108.9	N554	N554-Y556 PolarHBondContact O-N 2.88Å
557	E	26.3	Very low	27.7	Very low	171 Å²	171	141.2 Å²	141.2	80%	0.799	76%	0.757	S	S	*	*			trans	-104.4	144.6	-150.3	-58.1	175.3	115.9	0	0	114.4
558	S	25.4	Very low	28	Very low	121 Å²	121	139 Å²	139	85%	0.846	75%	0.745	S	S	*	*			trans	-162.4	83.8	155.5	-84.9	0	0	0	0	110.5	N560	S558-N560 PolarHBondContact O-N 2.81Å; S558-N560 VanDerWaalsContact O-N 3.14Å
559	P	26.1	Very low	28.5	Very low	112 Å²	112	139.3 Å²	139.3	73%	0.727	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	94	-176.3	31.9	-33.6	0	0	0	111.5
560	N	25	Very low	29.5	Very low	162 Å²	162	141.8 Å²	141.8	87%	0.866	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-167.5	-4.9	150.9	-102.2	-35.7	0	0	0	118.5	S558	S558-N560 PolarHBondContact O-N 2.81Å; S558-N560 VanDerWaalsContact O-N 3.14Å
561	L	28.1	Very low	30.8	Very low	153 Å²	153	138.4 Å²	138.4	80%	0.801	72%	0.721	S	S	*	*			trans	-101.9	110.2	-179.6	-128	73.1	0	0	0	113.6	N563	L561-N563 PolarHBondContact O-N 3.44Å
562	K	26	Very low	32.4	Very low	168 Å²	168	131 Å²	131	73%	0.73	69%	0.692	S	S	*	*			trans	-78	45.8	179.1	-66.8	-179.6	179.6	169.4	0	114
563	N	25	Very low	34.4	Very low	140 Å²	140	124.9 Å²	124.9	75%	0.749	66%	0.66	S	S	*	*			trans	-122.9	62.9	-173	-80.1	-21.4	0	0	0	113.7	L561	L561-N563 PolarHBondContact O-N 3.44Å
564	S	28.4	Very low	36.8	Very low	76 Å²	76	122 Å²	122	53%	0.531	64%	0.644	S	S	.	*			trans	-151.5	126.1	155.2	-169	0	0	0	0	113.6
565	R	28.8	Very low	38.9	Very low	248 Å²	248	119.4 Å²	119.4	94%	0.936	63%	0.626	S	S	*	*			trans	-138.7	27	155.5	-72.5	-168.4	177.5	-177.4	-0.4	110.3
566	L	33.4	Very low	41.4	Very low	96 Å²	96	122.1 Å²	122.1	50%	0.503	63%	0.63	S	S	.	*			trans	-96.1	-1.7	-172.7	-81.8	155	0	0	0	113.5
567	S	31.1	Very low	43.9	Very low	96 Å²	96	113.9 Å²	113.9	67%	0.671	60%	0.602	S	S	*	*	S	Bend	trans	-90.9	3.6	-172.5	57.2	0	0	0	0	115.7
568	N	34	Very low	46.5	Very low	115 Å²	115	106.8 Å²	106.8	62%	0.615	57%	0.569	S	S	*	*			trans	-108.2	26.1	-177.7	-80.5	29.9	0	0	0	113.2	H570 S571	N568-H570 PolarHBondContact O-N 3.12Å; N568-S571 PolarHBondContact O-N 2.94Å; N568-S571 PolarHBondContact O-OG 3.37Å; N568-S571 VanDerWaalsContact O-OG 3.07Å
569	A	41	Very low	49.2	Very low	71 Å²	71	105.5 Å²	105.5	59%	0.587	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61	-7.1	-170.2	0	0	0	0	0	116.5
570	H	48.6	Very low	52.1	Low	148 Å²	148	107.6 Å²	107.6	69%	0.685	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.7	-6.2	176	-60.1	-39.5	0	0	0	114.4	N568	N568-H570 PolarHBondContact O-N 3.12Å
571	S	55	Low	55.1	Low	46 Å²	46	100.8 Å²	100.8	32%	0.322	51%	0.509	S	S	.	.	S	Bend	trans	-99.1	138.1	172.9	62.5	0	0	0	0	111.3	N568	N568-S571 PolarHBondContact O-N 2.94Å; N568-S571 PolarHBondContact O-OG 3.37Å; N568-S571 VanDerWaalsContact O-OG 3.07Å
572	G	60.4	Low	57.7	Low	20 Å²	20	93.8 Å²	93.8	21%	0.206	47%	0.473	C	S	.	.	P	Polyproline II helix	trans	-64.3	165	173.7	0	0	0	0	0	115	G541 G543	G541-G572 WeakPolarHBondContact O-CA 3.4Å; G543-G572 PolarHBondContact O-N 3.12Å
573	I	70.6	Confident	60.6	Low	34 Å²	34	89.2 Å²	89.2	17%	0.174	46%	0.456	C	S	.	.	P	Polyproline II helix	trans	-74.6	127.7	171.8	-57.9	-179.6	0	0	0	108.1	S538 I540 G541 Q542 D577 Q578	S538-I573 VanDerWaalsContact O-CD1 3.31Å; S538-I573 WeakPolarHBondContact O-CD1 3.32Å; I540-I573 HydrophobicContact CB-CD1 4.1Å; I540-I573 HydrophobicContact CB-CG1 4.18Å; I540-I573 HydrophobicContact CG1-CD1 4.3Å; G541-I573 PolarHBondContact O-N 3.36Å; Q542-I573 WeakPolarHBondContact CG-O 3.47Å; I573-D577 HydrophobicContact CG2-CB 3.48Å; I573-D577 VanDerWaalsContact CG2-CB 3.48Å; I573-Q578 HydrophobicContact CB-CG 4.15Å; I573-Q578 HydrophobicContact CG2-CG 3.89Å
574	S	74.5	Confident	63.6	Low	45 Å²	45	83 Å²	83	32%	0.315	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-62.4	153.3	-178.2	87.2	0	0	0	0	111.9	R576 D577 Q578	S574-R576 PolarHBondContact O-N 2.91Å; S574-R576 VanDerWaalsContact O-N 3.1Å; S574-R576 PolarHBondContact OG-N 3.36Å; S574-D577 CarbonylContact O-C 3.57Å; S574-D577 WeakPolarHBondContact O-CA 3.46Å; S574-D577 PolarHBondContact O-N 3.15Å; S574-D577 PolarHBondContact OG-N 3.33Å; S574-D577 PolarHBondContact OG-OD2 3.03Å; S574-Q578 WeakPolarHBondContact O-CG 3.38Å; S574-Q578 PolarHBondContact O-N 3.42Å
575	Q	73.6	Confident	66.4	Low	101 Å²	101	79.4 Å²	79.4	47%	0.472	40%	0.4	S	S	.	.	H	α-helix	trans	-54.3	-35.4	178.3	-157	-178.7	8.4	0	0	113.1	Q542 Q578 I579	Q542-Q575 VanDerWaalsContact OE1-N 3.16Å; Q575-Q578 PolarHBondContact O-N 3.1Å; Q575-I579 HydrophobicContact CG-CD1 4.48Å; Q575-I579 WeakPolarHBondContact O-CD1 3.47Å; Q575-I579 VanDerWaalsContact O-CG1 3.3Å; Q575-I579 WeakPolarHBondContact O-CG1 3.24Å; Q575-I579 PolarHBondContact O-N 3.24Å
576	R	77.6	Confident	69	Low	210 Å²	210	72.9 Å²	72.9	79%	0.792	38%	0.375	S	S	*	.	H	α-helix	trans	-68.7	-37.2	177.2	-63.3	-179.2	-177.5	169.4	1.1	111.9	S574 R580	S574-R576 PolarHBondContact O-N 2.91Å; S574-R576 VanDerWaalsContact O-N 3.1Å; S574-R576 PolarHBondContact OG-N 3.36Å; R576-R580 VanDerWaalsContact O-CB 3.32Å; R576-R580 WeakPolarHBondContact O-CB 3.46Å; R576-R580 PolarHBondContact O-N 3.37Å
577	D	82.8	Confident	71.5	Confident	59 Å²	59	72.4 Å²	72.4	32%	0.316	38%	0.38	S	S	.	.	H	α-helix	trans	-76.6	-32.8	176.1	-66.3	-62	0	0	0	112.1	I573 S574 R580 V581	I573-D577 HydrophobicContact CG2-CB 3.48Å; I573-D577 VanDerWaalsContact CG2-CB 3.48Å; S574-D577 CarbonylContact O-C 3.57Å; S574-D577 WeakPolarHBondContact O-CA 3.46Å; S574-D577 PolarHBondContact O-N 3.15Å; S574-D577 PolarHBondContact OG-N 3.33Å; S574-D577 PolarHBondContact OG-OD2 3.03Å; D577-R580 PolarHBondContact O-N 3.05Å; D577-R580 IonicContact OD1-CZ 3.44Å; D577-R580 IonicContact OD1-NH1 3.45Å; D577-R580 PolarHBondContact OD1-NH1 2.97Å; D577-V581 WeakPolarHBondContact O-CB 3.29Å; D577-V581 VanDerWaalsContact O-CG2 3.31Å; D577-V581 WeakPolarHBondContact O-CG2 3.2Å; D577-V581 PolarHBondContact O-N 3.11Å
578	Q	81.6	Confident	74.1	Confident	22 Å²	22	68.5 Å²	68.5	10%	0.103	36%	0.355	C	S	.	.	H	α-helix	trans	-59.3	-50.2	170	-71.6	176.4	-27.4	0	0	110.8	F539 I540 I573 S574 Q575 V581 M582	F539-Q578 HydrophobicContact CE2-CB 3.74Å; F539-Q578 HydrophobicContact CE2-CG 4.07Å; F539-Q578 HydrophobicContact CZ-CB 3.97Å; F539-Q578 HydrophobicContact CZ-CG 4.14Å; I540-Q578 PolarHBondContact O-NE2 3.1Å; I573-Q578 HydrophobicContact CB-CG 4.15Å; I573-Q578 HydrophobicContact CG2-CG 3.89Å; S574-Q578 WeakPolarHBondContact O-CG 3.38Å; S574-Q578 PolarHBondContact O-N 3.42Å; Q575-Q578 PolarHBondContact O-N 3.1Å; Q578-V581 PolarHBondContact O-N 2.82Å; Q578-M582 WeakPolarHBondContact O-CB 3.37Å; Q578-M582 PolarHBondContact O-N 3.47Å
579	I	81.6	Confident	76.7	Confident	93 Å²	93	67 Å²	67	48%	0.477	35%	0.35	S	S	.	.	H	α-helix	trans	-58.9	-48.8	175	-67.2	163.5	0	0	0	110.6	Q575 V581 M582 D583	Q575-I579 HydrophobicContact CG-CD1 4.48Å; Q575-I579 WeakPolarHBondContact O-CD1 3.47Å; Q575-I579 VanDerWaalsContact O-CG1 3.3Å; Q575-I579 WeakPolarHBondContact O-CG1 3.24Å; Q575-I579 PolarHBondContact O-N 3.24Å; I579-V581 VanDerWaalsContact C-N 3.35Å; I579-V581 PolarHBondContact O-N 3.03Å; I579-M582 WeakPolarHBondContact O-CB 3.33Å; I579-M582 PolarHBondContact O-N 3.34Å; I579-M582 VanDerWaalsContact O-N 3.08Å; I579-D583 WeakPolarHBondContact CG2-OD2 3.49Å; I579-D583 PolarHBondContact O-N 3.38Å
580	R	86.6	Confident	79.1	Confident	156 Å²	156	67.1 Å²	67.1	59%	0.589	34%	0.335	S	S	*	.	H	α-helix	trans	-57.7	-40.7	177.4	177.1	-174.8	-74.5	154.3	-10.2	113.5	R576 D577 G584	R576-R580 VanDerWaalsContact O-CB 3.32Å; R576-R580 WeakPolarHBondContact O-CB 3.46Å; R576-R580 PolarHBondContact O-N 3.37Å; D577-R580 PolarHBondContact O-N 3.05Å; D577-R580 IonicContact OD1-CZ 3.44Å; D577-R580 IonicContact OD1-NH1 3.45Å; D577-R580 PolarHBondContact OD1-NH1 2.97Å; R580-G584 PolarHBondContact O-N 2.81Å
581	V	88	Confident	81.2	Confident	20 Å²	20	60.4 Å²	60.4	12%	0.121	31%	0.305	C	S	.	.	H	α-helix	trans	-67.5	-41.4	175.2	167.1	0	0	0	0	110.5	A537 F539 D577 Q578 I579 G584 F585 L593	A537-V581 HydrophobicContact CB-CG1 3.93Å; F539-V581 HydrophobicContact CD2-CG1 4.11Å; D577-V581 WeakPolarHBondContact O-CB 3.29Å; D577-V581 VanDerWaalsContact O-CG2 3.31Å; D577-V581 WeakPolarHBondContact O-CG2 3.2Å; D577-V581 PolarHBondContact O-N 3.11Å; Q578-V581 PolarHBondContact O-N 2.82Å; I579-V581 VanDerWaalsContact C-N 3.35Å; I579-V581 PolarHBondContact O-N 3.03Å; V581-G584 PolarHBondContact O-N 3.32Å; V581-F585 PolarHBondContact O-N 3.48Å; V581-L593 HydrophobicContact CG1-CD1 3.64Å
582	M	83.7	Confident	83	Confident	6 Å²	6	58.2 Å²	58.2	3%	0.03	29%	0.289	C	S	.	.	H	α-helix	trans	-63	-46.7	178.7	-165.4	52.7	48.4	0	0	112.3	F539 Q578 I579 G584 F585 R586 L593 I603 V605	F539-M582 HydrophobicContact CD2-CE 3.92Å; F539-M582 HydrophobicContact CE2-CE 3.65Å; F539-M582 HydrophobicContact CZ-CE 4.07Å; Q578-M582 WeakPolarHBondContact O-CB 3.37Å; Q578-M582 PolarHBondContact O-N 3.47Å; I579-M582 WeakPolarHBondContact O-CB 3.33Å; I579-M582 PolarHBondContact O-N 3.34Å; I579-M582 VanDerWaalsContact O-N 3.08Å; M582-G584 VanDerWaalsContact C-N 3.33Å; M582-G584 PolarHBondContact O-N 3.47Å; M582-F585 PolarHBondContact O-N 3.15Å; M582-F585 VanDerWaalsContact O-N 3.14Å; M582-R586 VanDerWaalsContact O-CG 3.31Å; M582-R586 WeakPolarHBondContact O-CG 3.36Å; M582-R586 PolarHBondContact O-N 3.19Å; M582-L593 HydrophobicContact CE-CD2 3.9Å; M582-I603 HydrophobicContact CE-CG2 3.96Å; M582-I603 HydrophobicContact CG-CG2 4.07Å; M582-I603 HydrophobicContact SD-CG2 4Å; M582-V605 HydrophobicContact CE-CG1 4.44Å; M582-V605 HydrophobicContact CE-CG2 3.88Å; M582-V605 HydrophobicContact SD-CB 3.91Å; M582-V605 HydrophobicContact SD-CG1 3.77Å; M582-V605 HydrophobicContact SD-CG2 3.66Å
583	D	85.8	Confident	84.5	Confident	72 Å²	72	57.3 Å²	57.3	39%	0.385	28%	0.28	S	S	.	.	H	α-helix	trans	-68.9	-32.3	177.1	-64.9	-31.6	0	0	0	112	I579 F585 R586 S587	I579-D583 WeakPolarHBondContact CG2-OD2 3.49Å; I579-D583 PolarHBondContact O-N 3.38Å; D583-F585 VanDerWaalsContact C-N 3.34Å; D583-R586 PolarHBondContact O-N 3.17Å; D583-R586 IonicContact OD1-CZ 3.89Å; D583-R586 IonicContact OD1-NH1 2.86Å; D583-R586 PolarHBondContact OD1-NH1 3.06Å; D583-S587 VanDerWaalsContact O-CB 3.31Å; D583-S587 WeakPolarHBondContact O-CB 3.15Å; D583-S587 PolarHBondContact O-N 3.43Å; D583-S587 PolarHBondContact O-OG 2.97Å
584	G	88.1	Confident	85.6	Confident	10 Å²	10	55.7 Å²	55.7	10%	0.103	27%	0.271	C	S	.	.	H	α-helix	trans	-63.5	-34.1	168.6	0	0	0	0	0	114	R580 V581 M582 S587 G588 V589 Y590	R580-G584 PolarHBondContact O-N 2.81Å; V581-G584 PolarHBondContact O-N 3.32Å; M582-G584 VanDerWaalsContact C-N 3.33Å; M582-G584 PolarHBondContact O-N 3.47Å; G584-S587 WeakPolarHBondContact CA-OG 3.1Å; G584-S587 PolarHBondContact O-OG 3.01Å; G584-G588 PolarHBondContact O-N 3.03Å; G584-V589 WeakPolarHBondContact O-CA 3.38Å; G584-V589 VanDerWaalsContact O-CB 3.31Å; G584-V589 WeakPolarHBondContact O-CB 3.48Å; G584-V589 PolarHBondContact O-N 3.19Å; G584-Y590 PolarHBondContact O-N 2.87Å; G584-Y590 VanDerWaalsContact O-N 3.15Å
585	F	88.2	Confident	86.3	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-77.1	-41.6	175	-174.7	-94.3	0	0	0	112	R509 A510 I511 V581 M582 D583 S587 G588 L593 V605 V608	R509-F585 HydrophobicContact CB-CE1 4.3Å; R509-F585 HydrophobicContact CB-CE2 4.44Å; R509-F585 HydrophobicContact CB-CZ 3.79Å; R509-F585 HydrophobicContact CG-CE1 4.5Å; R509-F585 HydrophobicContact CG-CZ 4.2Å; A510-F585 WeakPolarHBondContact O-CE2 3.2Å; A510-F585 WeakPolarHBondContact O-CZ 3.2Å; I511-F585 HydrophobicContact CG1-CZ 4.1Å; V581-F585 PolarHBondContact O-N 3.48Å; M582-F585 PolarHBondContact O-N 3.15Å; M582-F585 VanDerWaalsContact O-N 3.14Å; D583-F585 VanDerWaalsContact C-N 3.34Å; F585-S587 VanDerWaalsContact C-N 3.31Å; F585-S587 PolarHBondContact O-N 2.71Å; F585-G588 PolarHBondContact O-N 3.2Å; F585-L593 HydrophobicContact CD2-CB 3.93Å; F585-L593 HydrophobicContact CD2-CD1 4.49Å; F585-L593 HydrophobicContact CE2-CB 3.8Å; F585-L593 HydrophobicContact CZ-CB 4.34Å; F585-V605 HydrophobicContact CD1-CG1 3.56Å; F585-V605 HydrophobicContact CE1-CG1 3.46Å; F585-V605 VanDerWaalsContact CE1-CG1 3.46Å; F585-V605 HydrophobicContact CZ-CG1 4.43Å; F585-V608 HydrophobicContact CE1-CG2 4.28Å
586	R	84.2	Confident	86.9	Confident	111 Å²	111	49.1 Å²	49.1	42%	0.419	24%	0.236	S	C	.	.	H	α-helix	trans	-58.8	-41.8	173.9	-71.2	165.5	175.2	169.6	-7.4	111.9	R509 M582 D583 D604	R509-R586 PolarHBondContact NH1-O 3.1Å; M582-R586 VanDerWaalsContact O-CG 3.31Å; M582-R586 WeakPolarHBondContact O-CG 3.36Å; M582-R586 PolarHBondContact O-N 3.19Å; D583-R586 PolarHBondContact O-N 3.17Å; D583-R586 IonicContact OD1-CZ 3.89Å; D583-R586 IonicContact OD1-NH1 2.86Å; D583-R586 PolarHBondContact OD1-NH1 3.06Å; R586-D604 PolarHBondContact NE-O 3.21Å; R586-D604 PolarHBondContact NH2-O 2.79Å
587	S	85.4	Confident	86.7	Confident	85 Å²	85	40.9 Å²	40.9	59%	0.594	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.5	0.9	178.1	58.5	0	0	0	0	115.2	D583 G584 F585 V589	D583-S587 VanDerWaalsContact O-CB 3.31Å; D583-S587 WeakPolarHBondContact O-CB 3.15Å; D583-S587 PolarHBondContact O-N 3.43Å; D583-S587 PolarHBondContact O-OG 2.97Å; G584-S587 WeakPolarHBondContact CA-OG 3.1Å; G584-S587 PolarHBondContact O-OG 3.01Å; F585-S587 VanDerWaalsContact C-N 3.31Å; F585-S587 PolarHBondContact O-N 2.71Å; S587-V589 VanDerWaalsContact C-N 3.33Å; S587-V589 PolarHBondContact O-N 3.4Å
588	G	85.8	Confident	86.1	Confident	14 Å²	14	40.6 Å²	40.6	14%	0.144	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.4	4.2	174.3	0	0	0	0	0	116.1	R535 G584 F585 Y590	R535-G588 PolarHBondContact NH2-O 2.88Å; G584-G588 PolarHBondContact O-N 3.03Å; F585-G588 PolarHBondContact O-N 3.2Å; G588-Y590 PolarHBondContact O-N 2.86Å
589	V	88.7	Confident	85.1	Confident	84 Å²	84	39.7 Å²	39.7	51%	0.509	21%	0.205	S	C	.	.	S	Bend	trans	-55.5	-43.7	169.1	-178.8	0	0	0	0	109.6	R535 G584 S587	R535-V589 WeakPolarHBondContact CD-O 3.38Å; R535-V589 PolarHBondContact NE-O 3.42Å; G584-V589 WeakPolarHBondContact O-CA 3.38Å; G584-V589 VanDerWaalsContact O-CB 3.31Å; G584-V589 WeakPolarHBondContact O-CB 3.48Å; G584-V589 PolarHBondContact O-N 3.19Å; S587-V589 VanDerWaalsContact C-N 3.33Å; S587-V589 PolarHBondContact O-N 3.4Å
590	Y	91.4	Very high	84.3	Confident	73 Å²	73	35.6 Å²	35.6	29%	0.286	18%	0.183	S	C	.	.			trans	-107.7	136.4	168.9	-48	-58.4	0	0	0	109.8	R535 A537 G584 G588	R535-Y590 WeakPolarHBondContact O-CA 3.5Å; R535-Y590 WeakPolarHBondContact O-CB 3.49Å; A537-Y590 HydrophobicContact CB-CD1 3.76Å; A537-Y590 HydrophobicContact CB-CD2 3.68Å; A537-Y590 HydrophobicContact CB-CE1 4.05Å; A537-Y590 HydrophobicContact CB-CE2 3.98Å; A537-Y590 HydrophobicContact CB-CG 3.57Å; G584-Y590 PolarHBondContact O-N 2.87Å; G584-Y590 VanDerWaalsContact O-N 3.15Å; G588-Y590 PolarHBondContact O-N 2.86Å
591	N	91.7	Very high	83.1	Confident	7 Å²	7	31.4 Å²	31.4	4%	0.037	17%	0.171	C	C	.	.	S	Bend	trans	-112.3	-3.6	172.2	66.1	-13.2	0	0	0	112.8	F494 A510 L533 R535	F494-N591 HydrophobicContact CE1-CB 4.1Å; F494-N591 VanDerWaalsContact CE1-ND2 3.29Å; F494-N591 WeakPolarHBondContact CE1-ND2 3.45Å; F494-N591 HydrophobicContact CZ-CB 4.33Å; A510-N591 PolarHBondContact N-O 2.75Å; L533-N591 PolarHBondContact O-ND2 2.98Å; R535-N591 PolarHBondContact N-OD1 2.81Å; R535-N591 PolarHBondContact O-N 3.49Å
592	T	93.2	Very high	81.6	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	126.4	170.9	-58.9	0	0	0	0	110.1	F494 A510 V512 L527 R535 P536 A537 V594	F494-T592 WeakPolarHBondContact CE2-OG1 3.49Å; F494-T592 WeakPolarHBondContact CZ-OG1 3.35Å; A510-T592 WeakPolarHBondContact O-CA 3.33Å; V512-T592 HydrophobicContact CG2-CG2 4.11Å; L527-T592 HydrophobicContact CD1-CG2 4.13Å; R535-T592 PolarHBondContact O-N 3.5Å; P536-T592 CarbonylContact C-O 3.36Å; P536-T592 VanDerWaalsContact CA-O 3.29Å; P536-T592 WeakPolarHBondContact CA-O 3.29Å; A537-T592 PolarHBondContact N-O 3.26Å; T592-V594 HydrophobicContact CG2-CG2 4.35Å
593	L	92.4	Very high	80.6	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	126.1	172.3	-163.4	72	0	0	0	108.9	A510 I511 V512 A537 F539 V581 M582 F585 V605	A510-L593 PolarHBondContact O-N 3.17Å; I511-L593 CarbonylContact C-O 3.57Å; I511-L593 WeakPolarHBondContact CA-O 3.42Å; I511-L593 HydrophobicContact CG1-CB 4.19Å; I511-L593 HydrophobicContact CG2-CB 4.42Å; V512-L593 PolarHBondContact N-O 2.97Å; A537-L593 HydrophobicContact CB-CD1 4.45Å; F539-L593 HydrophobicContact CB-CD1 3.94Å; F539-L593 HydrophobicContact CB-CD2 4.1Å; F539-L593 HydrophobicContact CB-CG 3.93Å; F539-L593 HydrophobicContact CD2-CD1 4.5Å; F539-L593 HydrophobicContact CG-CD2 4.3Å; V581-L593 HydrophobicContact CG1-CD1 3.64Å; M582-L593 HydrophobicContact CE-CD2 3.9Å; F585-L593 HydrophobicContact CD2-CB 3.93Å; F585-L593 HydrophobicContact CD2-CD1 4.49Å; F585-L593 HydrophobicContact CE2-CB 3.8Å; F585-L593 HydrophobicContact CZ-CB 4.34Å; L593-V605 HydrophobicContact CD2-CG1 4.3Å
594	V	93.1	Very high	79.6	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	106.3	176.1	-170.5	0	0	0	0	107.9	V512 V520 I523 M524 L527 P536 A537 S538 F539 T592	V512-V594 HydrophobicContact CB-CG1 4.39Å; V512-V594 HydrophobicContact CB-CG2 4.5Å; V512-V594 CarbonylContact O-C 3.55Å; V512-V594 WeakPolarHBondContact O-CA 3.3Å; V520-V594 HydrophobicContact CB-CG1 4.32Å; V520-V594 HydrophobicContact CG1-CB 4.29Å; V520-V594 HydrophobicContact CG1-CG1 3.89Å; V520-V594 HydrophobicContact CG2-CG1 4.37Å; I523-V594 HydrophobicContact CB-CG1 3.97Å; I523-V594 HydrophobicContact CD1-CG1 4.37Å; I523-V594 HydrophobicContact CG2-CB 4.48Å; I523-V594 HydrophobicContact CG2-CG1 3.65Å; I523-V594 HydrophobicContact CG2-CG2 3.93Å; M524-V594 HydrophobicContact CG-CB 4.18Å; M524-V594 HydrophobicContact CG-CG1 4.49Å; M524-V594 HydrophobicContact CG-CG2 4.27Å; M524-V594 HydrophobicContact SD-CB 4Å; M524-V594 HydrophobicContact SD-CG2 3.72Å; L527-V594 HydrophobicContact CD1-CG2 4.12Å; P536-V594 HydrophobicContact CB-CG2 4.48Å; A537-V594 PolarHBondContact O-N 2.95Å; S538-V594 CarbonylContact C-O 3.58Å; S538-V594 WeakPolarHBondContact CA-O 3.45Å; F539-V594 PolarHBondContact N-O 3.41Å; T592-V594 HydrophobicContact CG2-CG2 4.35Å
595	S	89.2	Confident	78.6	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	147.2	-163.3	-168.6	0	0	0	0	112.8	V512 F513 T514 F539 G599	V512-S595 PolarHBondContact O-N 3.4Å; F513-S595 WeakPolarHBondContact CA-O 3.31Å; T514-S595 PolarHBondContact N-O 3.43Å; F539-S595 VanDerWaalsContact O-CA 3.28Å; F539-S595 WeakPolarHBondContact O-CA 3.25Å; S595-G599 WeakPolarHBondContact OG-CA 3.44Å; S595-G599 PolarHBondContact OG-N 3.33Å
596	T	85.7	Confident	77.6	Confident	8 Å²	8	32.9 Å²	32.9	5%	0.049	18%	0.183	C	C	.	.			trans	-79.6	178.2	155	69.4	0	0	0	0	111.2	T514 R517 V520 F539 I598 G599	T514-T596 VanDerWaalsContact O-CA 3.28Å; T514-T596 WeakPolarHBondContact O-CA 3.4Å; R517-T596 HydrophobicContact CG-CG2 3.98Å; V520-T596 HydrophobicContact CG2-CG2 3.85Å; F539-T596 PolarHBondContact O-N 3.27Å; F539-T596 VanDerWaalsContact O-N 3.07Å; T596-I598 PolarHBondContact O-N 3.19Å; T596-G599 PolarHBondContact O-N 2.99Å
597	C	73.5	Confident	76.9	Confident	37 Å²	37	31.5 Å²	31.5	25%	0.25	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-56.3	-15.3	-179	-43.7	0	0	0	0	114.2	G599 E600	C597-G599 PolarHBondContact O-N 3.42Å; C597-G599 VanDerWaalsContact O-N 3.16Å; C597-E600 WeakPolarHBondContact CA-OE1 3.47Å; C597-E600 WeakPolarHBondContact O-CB 3.27Å; C597-E600 VanDerWaalsContact O-CG 3.29Å; C597-E600 WeakPolarHBondContact O-CG 3.37Å; C597-E600 PolarHBondContact O-N 2.83Å
598	I	70.1	Confident	76.7	Confident	54 Å²	54	27.7 Å²	27.7	28%	0.277	16%	0.155	S	C	.	.	G	3₁₀ helix	trans	-66.8	-11.8	175.2	-68.1	169.5	0	0	0	112.6	F539 G541 T596 E600	F539-I598 HydrophobicContact CE1-CG2 4.36Å; G541-I598 VanDerWaalsContact CA-CD1 3.41Å; T596-I598 PolarHBondContact O-N 3.19Å; I598-E600 VanDerWaalsContact C-N 3.32Å
599	G	61.7	Low	76.7	Confident	2 Å²	2	27.9 Å²	27.9	2%	0.021	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-81.9	-1.9	166.2	0	0	0	0	0	115	S595 T596 C597 R629	S595-G599 WeakPolarHBondContact OG-CA 3.44Å; S595-G599 PolarHBondContact OG-N 3.33Å; T596-G599 PolarHBondContact O-N 2.99Å; C597-G599 PolarHBondContact O-N 3.42Å; C597-G599 VanDerWaalsContact O-N 3.16Å; G599-R629 PolarHBondContact O-NH1 3.37Å; G599-R629 PolarHBondContact O-NH2 2.97Å
600	E	62.9	Low	76.8	Confident	7 Å²	7	24 Å²	24	3%	0.033	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-39.9	-176.3	-59.9	165.7	-168.9	0	0	112.4	F513 C597 I598 Q622 R626 R629	F513-E600 HydrophobicContact CD1-CG 3.99Å; F513-E600 HydrophobicContact CE1-CG 3.57Å; F513-E600 HydrophobicContact CZ-CG 4.02Å; C597-E600 WeakPolarHBondContact CA-OE1 3.47Å; C597-E600 WeakPolarHBondContact O-CB 3.27Å; C597-E600 VanDerWaalsContact O-CG 3.29Å; C597-E600 WeakPolarHBondContact O-CG 3.37Å; C597-E600 PolarHBondContact O-N 2.83Å; I598-E600 VanDerWaalsContact C-N 3.32Å; E600-Q622 WeakPolarHBondContact OE2-CB 3.44Å; E600-Q622 VanDerWaalsContact OE2-CD 3.32Å; E600-Q622 WeakPolarHBondContact OE2-CG 3.23Å; E600-R626 HydrophobicContact CG-CG 4.14Å; E600-R626 IonicContact OE1-CZ 2.7Å; E600-R626 IonicContact OE1-NE 2.7Å; E600-R626 PolarHBondContact OE1-NE 3.25Å; E600-R626 IonicContact OE1-NH2 3.84Å; E600-R626 PolarHBondContact OE1-NH2 3.39Å; E600-R629 VanDerWaalsContact C-NH2 3.34Å; E600-R629 PolarHBondContact O-NH2 2.82Å
601	E	62.6	Low	76.7	Confident	69 Å²	69	20.5 Å²	20.5	32%	0.322	12%	0.115	S	C	.	.	S	Bend	trans	-91.9	152.6	178.2	-67.7	-160.6	-162.6	0	0	112.9	K241 I603	K241-E601 WeakPolarHBondContact CE-OE1 3.48Å; K241-E601 IonicContact NZ-OE1 2.71Å; K241-E601 PolarHBondContact NZ-OE1 2.98Å; K241-E601 IonicContact NZ-OE2 3.71Å; K241-E601 PolarHBondContact NZ-OE2 2.76Å; E601-I603 PolarHBondContact O-N 2.8Å
602	G	56.4	Low	76.7	Confident	13 Å²	13	20.1 Å²	20.1	13%	0.134	11%	0.113	C	C	.	.	S	Bend	trans	61.7	2.9	157.2	0	0	0	0	0	119.6
603	I	62	Low	76.6	Confident	37 Å²	37	20.2 Å²	20.2	19%	0.19	11%	0.113	C	C	.	.			trans	-133.3	115.4	-174.4	-56.6	162.3	0	0	0	111	F539 M582 E601 V605 R629	F539-I603 HydrophobicContact CE1-CD1 3.65Å; F539-I603 HydrophobicContact CZ-CD1 3.55Å; M582-I603 HydrophobicContact CE-CG2 3.96Å; M582-I603 HydrophobicContact CG-CG2 4.07Å; M582-I603 HydrophobicContact SD-CG2 4Å; E601-I603 PolarHBondContact O-N 2.8Å; I603-V605 HydrophobicContact CG2-CG2 4.11Å; I603-V605 PolarHBondContact O-N 3.31Å; I603-R629 PolarHBondContact O-NH1 3.26Å; I603-R629 PolarHBondContact O-NH2 2.89Å
604	D	65.4	Low	76.6	Confident	67 Å²	67	20.2 Å²	20.2	36%	0.358	11%	0.113	S	C	.	.			trans	-73.3	104.4	166.2	-173.6	20	0	0	0	111.7	R586 G606	R586-D604 PolarHBondContact NE-O 3.21Å; R586-D604 PolarHBondContact NH2-O 2.79Å; D604-G606 VanDerWaalsContact C-N 3.25Å; D604-G606 PolarHBondContact OD1-N 2.91Å
605	V	67.8	Low	76.3	Confident	2 Å²	2	20.2 Å²	20.2	1%	0.012	11%	0.113	C	C	.	.			trans	-84.3	-3.8	177.8	-174.8	0	0	0	0	111.4	I511 M582 F585 L593 I603 V608	I511-V605 HydrophobicContact CD1-CB 4.23Å; I511-V605 HydrophobicContact CD1-CG1 3.67Å; I511-V605 HydrophobicContact CD1-CG2 4.46Å; M582-V605 HydrophobicContact CE-CG1 4.44Å; M582-V605 HydrophobicContact CE-CG2 3.88Å; M582-V605 HydrophobicContact SD-CB 3.91Å; M582-V605 HydrophobicContact SD-CG1 3.77Å; M582-V605 HydrophobicContact SD-CG2 3.66Å; F585-V605 HydrophobicContact CD1-CG1 3.56Å; F585-V605 HydrophobicContact CE1-CG1 3.46Å; F585-V605 VanDerWaalsContact CE1-CG1 3.46Å; F585-V605 HydrophobicContact CZ-CG1 4.43Å; L593-V605 HydrophobicContact CD2-CG1 4.3Å; I603-V605 HydrophobicContact CG2-CG2 4.11Å; I603-V605 PolarHBondContact O-N 3.31Å; V605-V608 HydrophobicContact CG1-CG2 4.49Å
606	G	66.1	Low	75.7	Confident	20 Å²	20	20.9 Å²	20.9	21%	0.206	12%	0.119	C	C	.	.			trans	81.6	-162.3	-174.9	0	0	0	0	0	112.9	D604	D604-G606 VanDerWaalsContact C-N 3.25Å; D604-G606 PolarHBondContact OD1-N 2.91Å
607	Q	70.9	Confident	74.9	Confident	82 Å²	82	21.1 Å²	21.1	38%	0.383	12%	0.121	S	C	.	.			trans	-80.6	127.9	-179	-66.7	174.1	34.3	0	0	111	R509	R509-Q607 PolarHBondContact NE-O 2.98Å; R509-Q607 PolarHBondContact NH2-O 3.4Å
608	V	81.2	Confident	74.5	Confident	5 Å²	5	25.5 Å²	25.5	3%	0.03	14%	0.136	C	C	.	.			trans	-124.8	136.4	-178.3	179.9	0	0	0	0	108.2	R509 I511 F585 V605 L610 I611 T630	R509-V608 WeakPolarHBondContact O-CG1 3.48Å; I511-V608 HydrophobicContact CD1-CG1 4.39Å; I511-V608 HydrophobicContact CD1-CG2 3.75Å; I511-V608 HydrophobicContact CG1-CG1 3.98Å; I511-V608 HydrophobicContact CG1-CG2 4.03Å; F585-V608 HydrophobicContact CE1-CG2 4.28Å; V605-V608 HydrophobicContact CG1-CG2 4.49Å; V608-L610 WeakPolarHBondContact CG1-O 3.46Å; V608-I611 HydrophobicContact CG1-CG1 4.01Å; V608-T630 HydrophobicContact CB-CG2 4.34Å; V608-T630 HydrophobicContact CG1-CG2 4.44Å; V608-T630 WeakPolarHBondContact O-CA 3.26Å; V608-T630 WeakPolarHBondContact O-CB 3.34Å; V608-T630 WeakPolarHBondContact O-CG2 3.41Å
609	D	85.7	Confident	74.4	Confident	18 Å²	18	24.6 Å²	24.6	10%	0.096	13%	0.134	C	C	.	.	S	Bend	trans	-96.2	-36.7	-173.6	-49.6	-83.6	0	0	0	110.8	T508 R509 R634 R637	T508-D609 WeakPolarHBondContact OG1-CB 3.48Å; T508-D609 PolarHBondContact OG1-OD2 3.26Å; R509-D609 PolarHBondContact N-OD2 3.22Å; R509-D609 PolarHBondContact O-N 3.16Å; D609-R634 WeakPolarHBondContact OD1-CD 3.35Å; D609-R637 PolarHBondContact O-N 3.04Å
610	L	89.3	Confident	74.6	Confident	1 Å²	1	25.4 Å²	25.4	1%	0.005	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	131	174.7	176.2	64.7	0	0	0	112.6	I489 L490 H493 R509 A510 I511 V608 V612 R637 V639	I489-L610 HydrophobicContact CG2-CD2 4.14Å; L490-L610 HydrophobicContact CD2-CD2 3.97Å; H493-L610 HydrophobicContact CB-CD2 3.76Å; H493-L610 VanDerWaalsContact CD2-CD2 3.48Å; H493-L610 WeakPolarHBondContact CD2-CD2 3.27Å; H493-L610 WeakPolarHBondContact NE2-CB 3.49Å; R509-L610 PolarHBondContact O-N 3.22Å; A510-L610 CarbonylContact C-O 3.46Å; A510-L610 WeakPolarHBondContact CA-O 3.19Å; A510-L610 HydrophobicContact CB-CB 4.17Å; A510-L610 HydrophobicContact CB-CD2 4.3Å; A510-L610 HydrophobicContact CB-CG 4.44Å; I511-L610 PolarHBondContact N-O 2.84Å; V608-L610 WeakPolarHBondContact CG1-O 3.46Å; L610-V612 HydrophobicContact CD1-CG2 4.04Å; L610-V612 HydrophobicContact CD2-CG2 3.89Å; L610-V612 HydrophobicContact CG-CG2 3.9Å; L610-R637 WeakPolarHBondContact CA-O 3.18Å; L610-R637 HydrophobicContact CD1-CB 4.23Å; L610-R637 HydrophobicContact CD1-CG 4.2Å; L610-V639 HydrophobicContact CD1-CG2 4.05Å
611	I	89.7	Confident	74.7	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	134.2	160.1	-66.2	178	0	0	0	109.2	I511 F513 V608 R626 R629 T630 R637 I638 V639	I511-I611 HydrophobicContact CB-CG1 4.47Å; I511-I611 CarbonylContact O-C 3.59Å; I511-I611 WeakPolarHBondContact O-CA 3.35Å; F513-I611 HydrophobicContact CD2-CG2 3.78Å; F513-I611 HydrophobicContact CE2-CD1 4.43Å; F513-I611 HydrophobicContact CE2-CG2 4.02Å; V608-I611 HydrophobicContact CG1-CG1 4.01Å; I611-R626 HydrophobicContact CD1-CB 4.39Å; I611-R626 WeakPolarHBondContact CD1-O 3.43Å; I611-R629 HydrophobicContact CD1-CB 4.28Å; I611-T630 HydrophobicContact CD1-CG2 3.58Å; I611-T630 HydrophobicContact CG1-CG2 3.68Å; I611-R637 PolarHBondContact N-O 3.03Å; I611-I638 HydrophobicContact CB-CG1 4.4Å; I611-I638 HydrophobicContact CB-CG2 4.38Å; I611-I638 HydrophobicContact CG2-CG2 4.47Å; I611-I638 CarbonylContact O-C 3.53Å; I611-I638 VanDerWaalsContact O-CA 3.31Å; I611-I638 WeakPolarHBondContact O-CA 3.39Å; I611-V639 PolarHBondContact O-N 2.9Å
612	V	92.5	Very high	75.1	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	118.1	168.3	-168.6	0	0	0	0	109.5	L486 I489 L490 I511 V512 F513 L610 V639 L641	L486-V612 HydrophobicContact CD1-CB 3.87Å; L486-V612 HydrophobicContact CD1-CG1 3.58Å; L486-V612 HydrophobicContact CD1-CG2 4.21Å; I489-V612 HydrophobicContact CG2-CG2 3.96Å; L490-V612 HydrophobicContact CD2-CG2 4.47Å; I511-V612 PolarHBondContact O-N 3.47Å; V512-V612 CarbonylContact C-O 3.57Å; V512-V612 VanDerWaalsContact CA-O 3.26Å; V512-V612 WeakPolarHBondContact CA-O 3.39Å; F513-V612 PolarHBondContact N-O 3Å; L610-V612 HydrophobicContact CD1-CG2 4.04Å; L610-V612 HydrophobicContact CD2-CG2 3.89Å; L610-V612 HydrophobicContact CG-CG2 3.9Å; V612-V639 CarbonylContact C-O 3.49Å; V612-V639 VanDerWaalsContact CA-O 3.32Å; V612-V639 WeakPolarHBondContact CA-O 3.29Å; V612-V639 HydrophobicContact CG1-CB 4.4Å; V612-L641 HydrophobicContact CG1-CD1 3.96Å; V612-L641 HydrophobicContact CG1-CG 4Å
613	C	91.5	Very high	75.8	Confident	1 Å²	1	24.6 Å²	24.6	1%	0.007	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	112.9	169.4	-51	0	0	0	0	106.9	D615 R626 V639 V640 L641	C613-D615 WeakPolarHBondContact CB-O 3.24Å; C613-D615 PolarHBondContact O-N 2.85Å; C613-R626 PolarHBondContact SG-NH1 3.34Å; C613-V639 PolarHBondContact N-O 2.67Å; C613-V640 HydrophobicContact CB-CB 4.34Å; C613-V640 HydrophobicContact CB-CG1 4.04Å; C613-V640 HydrophobicContact CB-CG2 4.18Å; C613-L641 WeakPolarHBondContact O-CB 3.46Å; C613-L641 PolarHBondContact O-N 2.94Å
614	F	91.9	Very high	76.1	Confident	1 Å²	1	24.8 Å²	24.8	0%	0.004	13%	0.133	C	C	.	.	S	Bend	trans	-71.2	-19.2	176.6	-173	-103.4	0	0	0	112.3	H406 K482 L483 L486 F513 I523 L641	H406-F614 AromaticContact ND1-CD1 3.91Å; H406-F614 AromaticContact ND1-CE1 3.79Å; K482-F614 HydrophobicContact CB-CD2 4.16Å; K482-F614 HydrophobicContact CB-CE2 3.5Å; K482-F614 VanDerWaalsContact CB-CE2 3.5Å; K482-F614 HydrophobicContact CB-CZ 3.81Å; K482-F614 HydrophobicContact CD-CE1 4.47Å; K482-F614 HydrophobicContact CD-CE2 4.47Å; K482-F614 HydrophobicContact CD-CZ 4.35Å; K482-F614 WeakPolarHBondContact CD-O 3.19Å; K482-F614 WeakPolarHBondContact CE-O 3.18Å; K482-F614 PolarHBondContact NZ-O 2.87Å; L483-F614 HydrophobicContact CD2-CE2 3.68Å; L483-F614 HydrophobicContact CD2-CZ 3.77Å; L483-F614 HydrophobicContact CG-CE2 3.97Å; L483-F614 HydrophobicContact CG-CZ 3.93Å; L486-F614 HydrophobicContact CD2-CD2 3.97Å; L486-F614 HydrophobicContact CD2-CE2 4.38Å; F513-F614 WeakPolarHBondContact O-CB 3.48Å; F513-F614 PolarHBondContact O-N 2.92Å; I523-F614 HydrophobicContact CD1-CB 4.35Å; I523-F614 HydrophobicContact CD1-CD1 4.34Å; I523-F614 HydrophobicContact CD1-CD2 3.98Å; I523-F614 HydrophobicContact CD1-CE2 4.32Å; I523-F614 HydrophobicContact CD1-CG 3.97Å; F614-L641 HydrophobicContact CD2-CD1 4.09Å
615	D	85.8	Confident	76.3	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.119	C	C	.	.	S	Bend	trans	-139.9	156.9	177.6	37.1	57.9	0	0	0	110.2	H406 T514 Q515 C613 S617 E647	H406-D615 IonicContact CE1-OD2 2.72Å; H406-D615 PolarHBondContact CE1-OD2 3.27Å; H406-D615 VanDerWaalsContact CE1-OD2 3.24Å; H406-D615 IonicContact ND1-OD2 3.71Å; T514-D615 WeakPolarHBondContact CA-OD1 3.45Å; T514-D615 WeakPolarHBondContact CA-OD2 3.09Å; T514-D615 VanDerWaalsContact CB-OD2 3.29Å; T514-D615 WeakPolarHBondContact CB-OD2 3.34Å; T514-D615 PolarHBondContact OG1-OD2 2.96Å; Q515-D615 PolarHBondContact N-OD1 2.75Å; Q515-D615 PolarHBondContact N-OD2 3.39Å; C613-D615 WeakPolarHBondContact CB-O 3.24Å; C613-D615 PolarHBondContact O-N 2.85Å; D615-S617 PolarHBondContact O-N 2.71Å; D615-E647 VanDerWaalsContact CA-OE1 3.23Å; D615-E647 WeakPolarHBondContact CA-OE1 3.35Å
616	A	77.9	Confident	76.5	Confident	15 Å²	15	22.2 Å²	22.2	12%	0.124	12%	0.119	C	C	.	.			trans	-59.6	134.3	167.2	0	0	0	0	0	110	Q515 L642 E647 H651	Q515-A616 PolarHBondContact NE2-O 3.37Å; A616-L642 HydrophobicContact CB-CD2 3.91Å; A616-E647 HydrophobicContact CB-CG 3.87Å; A616-E647 PolarHBondContact N-OE1 2.8Å; A616-H651 HydrophobicContact CB-CB 4.19Å
617	S	68.2	Low	76.7	Confident	12 Å²	12	22.9 Å²	22.9	8%	0.084	12%	0.117	C	C	.	.			trans	-70.8	134.4	171.3	47.9	0	0	0	0	110.4	D615 S619	D615-S617 PolarHBondContact O-N 2.71Å; S617-S619 WeakPolarHBondContact CB-O 2.82Å; S617-S619 PolarHBondContact O-N 3.49Å; S617-S619 PolarHBondContact OG-O 3.09Å; S617-S619 VanDerWaalsContact OG-O 3.12Å
618	K	65.6	Low	76.3	Confident	129 Å²	129	19 Å²	19	56%	0.561	10%	0.099	S	C	*	.	S	Bend	trans	-55.8	-36.7	177.5	-67.7	-168.7	178.8	-174.4	0	112.1
619	S	66.6	Low	75.8	Confident	36 Å²	36	19.9 Å²	19.9	25%	0.252	10%	0.101	S	C	.	.	S	Bend	trans	-110	136.2	175.3	177.3	0	0	0	0	112	S617 I621 Q622	S617-S619 WeakPolarHBondContact CB-O 2.82Å; S617-S619 PolarHBondContact O-N 3.49Å; S617-S619 PolarHBondContact OG-O 3.09Å; S617-S619 VanDerWaalsContact OG-O 3.12Å; S619-I621 PolarHBondContact O-N 3.43Å; S619-I621 WeakPolarHBondContact OG-CB 3.12Å; S619-I621 PolarHBondContact OG-N 3.29Å; S619-Q622 WeakPolarHBondContact O-CB 3.46Å; S619-Q622 PolarHBondContact O-N 3.05Å
620	P	66.2	Low	75	Confident	19 Å²	19	19.1 Å²	19.1	12%	0.123	10%	0.097	C	C	.	.	H	α-helix	trans	-70	-19.6	171.2	27.4	-31.6	0	0	0	112.6	Q622 L623 M624 S654 T658	P620-Q622 VanDerWaalsContact C-N 3.29Å; P620-Q622 PolarHBondContact O-N 2.86Å; P620-L623 WeakPolarHBondContact O-CB 3.49Å; P620-L623 PolarHBondContact O-N 2.63Å; P620-L623 VanDerWaalsContact O-N 3.14Å; P620-M624 PolarHBondContact O-N 2.91Å; P620-S654 WeakPolarHBondContact CB-OG 3.35Å; P620-S654 WeakPolarHBondContact CD-OG 3.28Å; P620-S654 WeakPolarHBondContact CG-OG 3.42Å; P620-T658 VanDerWaalsContact CB-OG1 3.24Å; P620-T658 WeakPolarHBondContact CB-OG1 3.33Å; P620-T658 WeakPolarHBondContact CG-OG1 3.41Å
621	I	66.6	Low	73.6	Confident	17 Å²	17	19.2 Å²	19.2	9%	0.087	10%	0.099	C	C	.	.	H	α-helix	trans	-61	-42.1	172.2	-56.8	179.9	0	0	0	109.9	T273 S619 L623 M624 Q625	T273-I621 HydrophobicContact CG2-CG1 4.42Å; T273-I621 WeakPolarHBondContact OG1-CG1 3.45Å; T273-I621 WeakPolarHBondContact OG1-CG2 3.33Å; S619-I621 PolarHBondContact O-N 3.43Å; S619-I621 WeakPolarHBondContact OG-CB 3.12Å; S619-I621 PolarHBondContact OG-N 3.29Å; I621-L623 VanDerWaalsContact C-N 3.32Å; I621-L623 PolarHBondContact O-N 2.89Å; I621-M624 PolarHBondContact O-N 2.93Å; I621-Q625 HydrophobicContact CG2-CG 4.43Å; I621-Q625 WeakPolarHBondContact O-CG 3.33Å; I621-Q625 PolarHBondContact O-N 3.04Å
622	Q	70.6	Confident	72.2	Confident	46 Å²	46	23.6 Å²	23.6	22%	0.215	12%	0.115	C	C	.	.	H	α-helix	trans	-60.5	-41.8	174.3	-67.2	166.9	-25.5	0	0	111	E600 S619 P620 M624 Q625 R626	E600-Q622 WeakPolarHBondContact OE2-CB 3.44Å; E600-Q622 VanDerWaalsContact OE2-CD 3.32Å; E600-Q622 WeakPolarHBondContact OE2-CG 3.23Å; S619-Q622 WeakPolarHBondContact O-CB 3.46Å; S619-Q622 PolarHBondContact O-N 3.05Å; P620-Q622 VanDerWaalsContact C-N 3.29Å; P620-Q622 PolarHBondContact O-N 2.86Å; Q622-M624 PolarHBondContact O-N 3.27Å; Q622-Q625 PolarHBondContact O-N 3.46Å; Q622-R626 VanDerWaalsContact O-CB 3.32Å; Q622-R626 WeakPolarHBondContact O-CB 3.29Å; Q622-R626 WeakPolarHBondContact O-CG 3.37Å; Q622-R626 PolarHBondContact O-N 3.42Å
623	L	70.3	Confident	70.6	Confident	8 Å²	8	30.7 Å²	30.7	4%	0.042	15%	0.146	C	C	.	.	H	α-helix	trans	-62.8	-41.4	176.1	-173	61.2	0	0	0	111.9	L312 P620 I621 R626 Q627 V640 I655	L312-L623 HydrophobicContact CD1-CD1 4.49Å; P620-L623 WeakPolarHBondContact O-CB 3.49Å; P620-L623 PolarHBondContact O-N 2.63Å; P620-L623 VanDerWaalsContact O-N 3.14Å; I621-L623 VanDerWaalsContact C-N 3.32Å; I621-L623 PolarHBondContact O-N 2.89Å; L623-R626 PolarHBondContact O-N 3.45Å; L623-Q627 WeakPolarHBondContact O-CB 3.33Å; L623-Q627 WeakPolarHBondContact O-CG 3.3Å; L623-Q627 PolarHBondContact O-N 2.93Å; L623-V640 HydrophobicContact CD1-CG2 4.31Å; L623-I655 HydrophobicContact CD2-CD1 4.15Å; L623-I655 HydrophobicContact CD2-CG1 4.21Å
624	M	67.7	Low	69.3	Low	42 Å²	42	34.9 Å²	34.9	21%	0.207	16%	0.162	C	C	.	.	H	α-helix	trans	-69.4	-35	175.6	-72	-175.8	64.4	0	0	113.3	T273 P620 I621 Q622 Q627 G628 T658	T273-M624 HydrophobicContact CG2-CB 4.32Å; T273-M624 HydrophobicContact CG2-CE 3.73Å; T273-M624 HydrophobicContact CG2-CG 4.5Å; T273-M624 HydrophobicContact CG2-SD 3.47Å; T273-M624 WeakPolarHBondContact CG2-SD 3.42Å; P620-M624 PolarHBondContact O-N 2.91Å; I621-M624 PolarHBondContact O-N 2.93Å; Q622-M624 PolarHBondContact O-N 3.27Å; M624-Q627 WeakPolarHBondContact O-CB 3.34Å; M624-Q627 PolarHBondContact O-N 3.26Å; M624-G628 PolarHBondContact O-N 2.88Å; M624-T658 HydrophobicContact SD-CG2 3.52Å; M624-T658 VanDerWaalsContact SD-CG2 3.52Å
625	Q	70.3	Confident	68.2	Low	14 Å²	14	41 Å²	41	7%	0.065	19%	0.194	C	C	.	.	H	α-helix	trans	-68.8	-41.7	172.1	-73.4	171.7	-20.6	0	0	111.7	E238 A272 I621 Q622 G628	E238-Q625 PolarHBondContact OE2-NE2 2.83Å; E238-Q625 VanDerWaalsContact OE2-NE2 3.13Å; A272-Q625 HydrophobicContact CB-CG 4.17Å; I621-Q625 HydrophobicContact CG2-CG 4.43Å; I621-Q625 WeakPolarHBondContact O-CG 3.33Å; I621-Q625 PolarHBondContact O-N 3.04Å; Q622-Q625 PolarHBondContact O-N 3.46Å; Q625-G628 PolarHBondContact O-N 3.43Å
626	R	72	Confident	67.7	Low	1 Å²	1	41.2 Å²	41.2	0%	0.004	20%	0.196	C	C	.	.	H	α-helix	trans	-56.6	-48.9	169.7	-72.3	172.2	-175.9	-179.1	5.2	109.8	F513 E600 I611 C613 Q622 L623 G628 R629	F513-R626 HydrophobicContact CD2-CG 4.12Å; F513-R626 HydrophobicContact CE2-CG 3.89Å; F513-R626 HydrophobicContact CZ-CG 4.37Å; E600-R626 HydrophobicContact CG-CG 4.14Å; E600-R626 IonicContact OE1-CZ 2.7Å; E600-R626 IonicContact OE1-NE 2.7Å; E600-R626 PolarHBondContact OE1-NE 3.25Å; E600-R626 IonicContact OE1-NH2 3.84Å; E600-R626 PolarHBondContact OE1-NH2 3.39Å; I611-R626 HydrophobicContact CD1-CB 4.39Å; I611-R626 WeakPolarHBondContact CD1-O 3.43Å; C613-R626 PolarHBondContact SG-NH1 3.34Å; Q622-R626 VanDerWaalsContact O-CB 3.32Å; Q622-R626 WeakPolarHBondContact O-CB 3.29Å; Q622-R626 WeakPolarHBondContact O-CG 3.37Å; Q622-R626 PolarHBondContact O-N 3.42Å; L623-R626 PolarHBondContact O-N 3.45Å; R626-G628 VanDerWaalsContact C-N 3.31Å; R626-G628 PolarHBondContact O-N 3.18Å; R626-R629 WeakPolarHBondContact O-CB 3.48Å; R626-R629 PolarHBondContact O-N 3.49Å; R626-R629 VanDerWaalsContact O-N 3.08Å
627	Q	69.7	Low	68.2	Low	34 Å²	34	44.4 Å²	44.4	16%	0.159	20%	0.204	C	C	.	.	H	α-helix	trans	-55.7	-42.1	174.9	-73.8	163.6	4	0	0	112.7	R310 L623 M624 R629 T630 I638	R310-Q627 VanDerWaalsContact CZ-O 3.23Å; R310-Q627 PolarHBondContact NE-O 3.31Å; R310-Q627 PolarHBondContact NH2-O 3.02Å; L623-Q627 WeakPolarHBondContact O-CB 3.33Å; L623-Q627 WeakPolarHBondContact O-CG 3.3Å; L623-Q627 PolarHBondContact O-N 2.93Å; M624-Q627 WeakPolarHBondContact O-CB 3.34Å; M624-Q627 PolarHBondContact O-N 3.26Å; Q627-R629 PolarHBondContact O-N 3.4Å; Q627-T630 PolarHBondContact O-N 3.08Å; Q627-T630 VanDerWaalsContact O-N 3.1Å; Q627-T630 PolarHBondContact O-OG1 3.04Å; Q627-I638 HydrophobicContact CB-CD1 3.89Å; Q627-I638 HydrophobicContact CG-CD1 3.42Å; Q627-I638 VanDerWaalsContact CG-CD1 3.42Å
628	G	64.2	Low	69.1	Low	1 Å²	1	43.8 Å²	43.8	1%	0.01	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-8.7	176.8	0	0	0	0	0	116.1	T136 M624 Q625 R626 R632	T136-G628 VanDerWaalsContact O-CA 3.3Å; T136-G628 WeakPolarHBondContact O-CA 3.39Å; M624-G628 PolarHBondContact O-N 2.88Å; Q625-G628 PolarHBondContact O-N 3.43Å; R626-G628 VanDerWaalsContact C-N 3.31Å; R626-G628 PolarHBondContact O-N 3.18Å; G628-R632 VanDerWaalsContact O-CZ 3.3Å; G628-R632 PolarHBondContact O-NE 3.49Å; G628-R632 PolarHBondContact O-NH2 3.13Å
629	R	68.8	Low	70.3	Confident	22 Å²	22	37.7 Å²	37.7	8%	0.083	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-18.9	176	-63.2	165.7	173	-90.1	-5.3	113	G599 E600 I603 I611 R626 Q627	G599-R629 PolarHBondContact O-NH1 3.37Å; G599-R629 PolarHBondContact O-NH2 2.97Å; E600-R629 VanDerWaalsContact C-NH2 3.34Å; E600-R629 PolarHBondContact O-NH2 2.82Å; I603-R629 PolarHBondContact O-NH1 3.26Å; I603-R629 PolarHBondContact O-NH2 2.89Å; I611-R629 HydrophobicContact CD1-CB 4.28Å; R626-R629 WeakPolarHBondContact O-CB 3.48Å; R626-R629 PolarHBondContact O-N 3.49Å; R626-R629 VanDerWaalsContact O-N 3.08Å; Q627-R629 PolarHBondContact O-N 3.4Å
630	T	69.6	Low	71.5	Confident	2 Å²	2	36 Å²	36	1%	0.012	16%	0.162	C	C	.	.	S	Bend	trans	-110.3	176.4	174.4	77.8	0	0	0	0	111.4	R310 V608 I611 Q627 R632 I638	R310-T630 PolarHBondContact NE-O 2.81Å; R310-T630 VanDerWaalsContact NE-O 3.14Å; R310-T630 PolarHBondContact NH2-O 3.16Å; V608-T630 HydrophobicContact CB-CG2 4.34Å; V608-T630 HydrophobicContact CG1-CG2 4.44Å; V608-T630 WeakPolarHBondContact O-CA 3.26Å; V608-T630 WeakPolarHBondContact O-CB 3.34Å; V608-T630 WeakPolarHBondContact O-CG2 3.41Å; I611-T630 HydrophobicContact CD1-CG2 3.58Å; I611-T630 HydrophobicContact CG1-CG2 3.68Å; Q627-T630 PolarHBondContact O-N 3.08Å; Q627-T630 VanDerWaalsContact O-N 3.1Å; Q627-T630 PolarHBondContact O-OG1 3.04Å; T630-R632 VanDerWaalsContact C-N 3.32Å; T630-R632 PolarHBondContact O-N 3.39Å; T630-I638 HydrophobicContact CG2-CG1 4.42Å
631	G	59	Low	72.8	Confident	3 Å²	3	35.1 Å²	35.1	3%	0.031	16%	0.156	C	C	.	.	S	Bend	trans	75.3	9.8	170.4	0	0	0	0	0	116.3	Q308 R634	Q308-G631 PolarHBondContact N-O 3Å; G631-R634 WeakPolarHBondContact CA-O 3.27Å
632	R	60.9	Low	74.1	Confident	92 Å²	92	34.4 Å²	34.4	35%	0.347	15%	0.153	S	C	.	.	S	Bend	trans	-84.4	-34.9	-173.9	-63.4	-170.8	-172.4	170.3	6.2	114.8	G628 T630	G628-R632 VanDerWaalsContact O-CZ 3.3Å; G628-R632 PolarHBondContact O-NE 3.49Å; G628-R632 PolarHBondContact O-NH2 3.13Å; T630-R632 VanDerWaalsContact C-N 3.32Å; T630-R632 PolarHBondContact O-N 3.39Å
633	K	59.8	Low	75.1	Confident	150 Å²	150	32.3 Å²	32.3	65%	0.652	14%	0.143	S	C	*	.	S	Bend	trans	-139.1	-11.4	177	-70.8	-162	176	-165.6	0	113.5	Q308	Q308-K633 VanDerWaalsContact NE2-C 3.27Å; Q308-K633 PolarHBondContact NE2-O 3.44Å; Q308-K633 VanDerWaalsContact OE1-C 3.25Å; Q308-K633 PolarHBondContact OE1-O 2.94Å
634	R	64.6	Low	76.1	Confident	89 Å²	89	37.6 Å²	37.6	34%	0.336	17%	0.167	S	C	.	.	S	Bend	trans	-139.8	152	-178	-65.3	179.8	171.7	-158.7	-10.3	108.1	Q308 S506 D609 G631 G636	Q308-R634 PolarHBondContact OE1-O 3.01Å; S506-R634 PolarHBondContact OG-NH1 2.77Å; S506-R634 PolarHBondContact OG-NH2 2.81Å; D609-R634 WeakPolarHBondContact OD1-CD 3.35Å; G631-R634 WeakPolarHBondContact CA-O 3.27Å; R634-G636 PolarHBondContact O-N 3.42Å
635	L	67.2	Low	76.9	Confident	130 Å²	130	36.3 Å²	36.3	68%	0.681	17%	0.165	S	C	*	.	P	Polyproline II helix	trans	-56.2	119.6	174.6	-66.1	172.4	0	0	0	109.4	H309	H309-L635 HydrophobicContact CB-CD2 4.36Å; H309-L635 WeakPolarHBondContact O-CD2 3.3Å
636	G	76.9	Confident	77.6	Confident	3 Å²	3	40.4 Å²	40.4	3%	0.031	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	123.4	178.2	0	0	0	0	0	110.9	R310 E311 R634	R310-G636 WeakPolarHBondContact CA-O 3.46Å; E311-G636 PolarHBondContact N-O 3.42Å; R634-G636 PolarHBondContact O-N 3.42Å
637	R	86.8	Confident	78.2	Confident	82 Å²	82	41.2 Å²	41.2	31%	0.309	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	137.5	170.9	-175.6	169.7	167	-147.8	4.7	110.2	E311 E313 D609 L610 I611 V639	E311-R637 HydrophobicContact CB-CG 4.44Å; E313-R637 IonicContact OE1-NH2 3.61Å; E313-R637 PolarHBondContact OE1-NH2 2.97Å; E313-R637 IonicContact OE2-CZ 3.95Å; E313-R637 IonicContact OE2-NE 3.37Å; E313-R637 PolarHBondContact OE2-NE 3.31Å; E313-R637 IonicContact OE2-NH2 3.23Å; E313-R637 PolarHBondContact OE2-NH2 2.63Å; D609-R637 PolarHBondContact O-N 3.04Å; L610-R637 WeakPolarHBondContact CA-O 3.18Å; L610-R637 HydrophobicContact CD1-CB 4.23Å; L610-R637 HydrophobicContact CD1-CG 4.2Å; I611-R637 PolarHBondContact N-O 3.03Å; R637-V639 HydrophobicContact CG-CG2 4.11Å
638	I	87.1	Confident	79.1	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	111.5	-175.8	-56.8	169.8	0	0	0	107.2	E311 L312 E313 I611 Q627 T630	E311-I638 PolarHBondContact O-N 3.36Å; L312-I638 WeakPolarHBondContact CA-O 3.44Å; L312-I638 HydrophobicContact CD1-CB 4.07Å; L312-I638 HydrophobicContact CD1-CG2 3.78Å; E313-I638 PolarHBondContact N-O 2.72Å; I611-I638 HydrophobicContact CB-CG1 4.4Å; I611-I638 HydrophobicContact CB-CG2 4.38Å; I611-I638 HydrophobicContact CG2-CG2 4.47Å; I611-I638 CarbonylContact O-C 3.53Å; I611-I638 VanDerWaalsContact O-CA 3.31Å; I611-I638 WeakPolarHBondContact O-CA 3.39Å; Q627-I638 HydrophobicContact CB-CD1 3.89Å; Q627-I638 HydrophobicContact CG-CD1 3.42Å; Q627-I638 VanDerWaalsContact CG-CD1 3.42Å; T630-I638 HydrophobicContact CG2-CG1 4.42Å
639	V	91.7	Very high	80.2	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	127.5	-177.5	-169.3	0	0	0	0	109.3	E313 V315 I489 L610 I611 V612 C613 R637 L641	E313-V639 HydrophobicContact CB-CG1 4.42Å; E313-V639 HydrophobicContact CB-CG2 4.35Å; E313-V639 CarbonylContact O-C 3.59Å; E313-V639 WeakPolarHBondContact O-CA 3.5Å; V315-V639 HydrophobicContact CB-CG1 4.14Å; V315-V639 HydrophobicContact CG2-CG1 3.48Å; V315-V639 VanDerWaalsContact CG2-CG1 3.48Å; I489-V639 HydrophobicContact CD1-CG1 3.82Å; I489-V639 HydrophobicContact CG2-CG2 4.27Å; L610-V639 HydrophobicContact CD1-CG2 4.05Å; I611-V639 PolarHBondContact O-N 2.9Å; V612-V639 CarbonylContact C-O 3.49Å; V612-V639 VanDerWaalsContact CA-O 3.32Å; V612-V639 WeakPolarHBondContact CA-O 3.29Å; V612-V639 HydrophobicContact CG1-CB 4.4Å; C613-V639 PolarHBondContact N-O 2.67Å; R637-V639 HydrophobicContact CG-CG2 4.11Å; V639-L641 HydrophobicContact CG1-CD2 4.44Å
640	V	91.6	Very high	80.8	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.006	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	116.8	174	-170.7	0	0	0	0	108.9	L312 E313 V315 C613 L623 L642	L312-V640 HydrophobicContact CD1-CG2 4.09Å; E313-V640 PolarHBondContact O-N 3.37Å; V315-V640 PolarHBondContact N-O 3.07Å; C613-V640 HydrophobicContact CB-CB 4.34Å; C613-V640 HydrophobicContact CB-CG1 4.04Å; C613-V640 HydrophobicContact CB-CG2 4.18Å; L623-V640 HydrophobicContact CD1-CG2 4.31Å; V640-L642 HydrophobicContact CG1-CD2 3.68Å; V640-L642 HydrophobicContact CG1-CG 4.02Å
641	L	94	Very high	81.5	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	113	175.7	-62.2	-179.2	0	0	0	109.3	V315 V317 K482 K485 L486 I489 V612 C613 F614 V639	V315-L641 HydrophobicContact CB-CD2 3.99Å; V315-L641 HydrophobicContact CG1-CD2 3.92Å; V317-L641 HydrophobicContact CG2-CD2 4.32Å; K482-L641 HydrophobicContact CB-CD1 4.43Å; K482-L641 HydrophobicContact CD-CB 4.31Å; K482-L641 VanDerWaalsContact CE-O 3.25Å; K482-L641 WeakPolarHBondContact CE-O 3.41Å; K482-L641 HydrophobicContact CG-CB 4.21Å; K482-L641 PolarHBondContact NZ-O 3.43Å; K485-L641 HydrophobicContact CB-CD2 4.42Å; K485-L641 HydrophobicContact CG-CD2 3.88Å; L486-L641 HydrophobicContact CB-CD1 3.8Å; L486-L641 HydrophobicContact CD1-CD1 4.44Å; I489-L641 HydrophobicContact CD1-CD2 3.71Å; V612-L641 HydrophobicContact CG1-CD1 3.96Å; V612-L641 HydrophobicContact CG1-CG 4Å; C613-L641 WeakPolarHBondContact O-CB 3.46Å; C613-L641 PolarHBondContact O-N 2.94Å; F614-L641 HydrophobicContact CD2-CD1 4.09Å; V639-L641 HydrophobicContact CG1-CD2 4.44Å
642	L	92.9	Very high	82.7	Confident	3 Å²	3	56 Å²	56	2%	0.016	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	132.9	-177.5	-58.1	166.8	0	0	0	108.6	A314 V315 V316 V317 A616 V640 E647 E648 H651	A314-L642 HydrophobicContact CB-CD1 4.02Å; V315-L642 PolarHBondContact O-N 2.83Å; V316-L642 CarbonylContact C-O 3.55Å; V316-L642 WeakPolarHBondContact CA-O 3.48Å; V317-L642 PolarHBondContact N-O 3.47Å; A616-L642 HydrophobicContact CB-CD2 3.91Å; V640-L642 HydrophobicContact CG1-CD2 3.68Å; V640-L642 HydrophobicContact CG1-CG 4.02Å; L642-E647 HydrophobicContact CD2-CG 4.02Å; L642-E648 HydrophobicContact CB-CB 4.49Å; L642-H651 HydrophobicContact CD1-CB 4.15Å; L642-H651 WeakPolarHBondContact CD1-ND1 3.38Å; L642-H651 HydrophobicContact CD2-CB 3.66Å
643	T	92.3	Very high	83.6	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.006	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	134.9	165	-60.4	0	0	0	0	108.9	V317 L319 V404 H480 K482 G645 E647	V317-T643 WeakPolarHBondContact O-CA 3.42Å; L319-T643 HydrophobicContact CD2-CG2 3.66Å; L319-T643 HydrophobicContact CG-CG2 3.78Å; V404-T643 HydrophobicContact CG1-CG2 3.93Å; V404-T643 VanDerWaalsContact O-CB 3.31Å; V404-T643 WeakPolarHBondContact O-CB 3.35Å; V404-T643 WeakPolarHBondContact O-CG2 3.43Å; V404-T643 PolarHBondContact O-OG1 2.78Å; H480-T643 PolarHBondContact CE1-OG1 3.13Å; K482-T643 VanDerWaalsContact CE-N 3.35Å; K482-T643 VanDerWaalsContact CE-OG1 3.26Å; K482-T643 WeakPolarHBondContact CE-OG1 3.39Å; T643-G645 PolarHBondContact O-N 3.47Å; T643-E647 PolarHBondContact N-OE2 3.03Å
644	E	90.7	Very high	84.3	Confident	119 Å²	119	48 Å²	48	56%	0.556	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-46.6	131.2	175.9	-171.9	-171.7	164	0	0	112.3	V316 V317	V316-E644 HydrophobicContact CG1-CB 3.88Å; V316-E644 HydrophobicContact CG1-CG 4.29Å; V317-E644 PolarHBondContact O-N 2.77Å; V317-E644 VanDerWaalsContact O-N 3.12Å
645	G	85.9	Confident	84.9	Confident	15 Å²	15	46.4 Å²	46.4	16%	0.155	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	105.2	-105.4	174.7	0	0	0	0	0	115	T643 E648 R649	T643-G645 PolarHBondContact O-N 3.47Å; G645-E648 PolarHBondContact N-OE2 3.49Å; G645-R649 VanDerWaalsContact O-CG 3.31Å; G645-R649 WeakPolarHBondContact O-CG 3.42Å; G645-R649 PolarHBondContact O-N 3.05Å; G645-R649 PolarHBondContact O-NH1 3.02Å
646	R	83.5	Confident	85.4	Confident	100 Å²	100	42.6 Å²	42.6	38%	0.377	22%	0.217	S	C	.	.	H	α-helix	trans	-74.1	-47	-167.7	-170.1	177.5	-173.9	162.1	7.3	112.8	K357 L358 A359 E648 R649 N650	K357-R646 PolarHBondContact O-NH1 3.25Å; K357-R646 VanDerWaalsContact O-NH1 3.08Å; L358-R646 PolarHBondContact O-NH1 2.96Å; A359-R646 VanDerWaalsContact CB-NH2 3.34Å; R646-E648 VanDerWaalsContact C-N 3.32Å; R646-E648 PolarHBondContact O-N 2.72Å; R646-R649 PolarHBondContact O-N 3.37Å; R646-N650 WeakPolarHBondContact O-CB 3.43Å; R646-N650 PolarHBondContact O-N 3.11Å; R646-N650 PolarHBondContact O-OD1 3.09Å
647	E	85.2	Confident	85.1	Confident	19 Å²	19	46.8 Å²	46.8	9%	0.089	23%	0.232	C	C	.	.	H	α-helix	trans	-61.3	-43.7	179.3	-170.7	-176.3	-172	0	0	111	K482 D615 A616 L642 T643 N650 H651	K482-E647 WeakPolarHBondContact CE-OE2 3.33Å; K482-E647 VanDerWaalsContact NZ-CD 3.29Å; K482-E647 IonicContact NZ-OE1 3.46Å; K482-E647 PolarHBondContact NZ-OE1 2.83Å; K482-E647 IonicContact NZ-OE2 3.88Å; K482-E647 PolarHBondContact NZ-OE2 3.2Å; D615-E647 VanDerWaalsContact CA-OE1 3.23Å; D615-E647 WeakPolarHBondContact CA-OE1 3.35Å; A616-E647 HydrophobicContact CB-CG 3.87Å; A616-E647 PolarHBondContact N-OE1 2.8Å; L642-E647 HydrophobicContact CD2-CG 4.02Å; T643-E647 PolarHBondContact N-OE2 3.03Å; E647-N650 PolarHBondContact O-N 3.2Å; E647-H651 WeakPolarHBondContact O-CB 3.39Å; E647-H651 PolarHBondContact O-N 3.06Å
648	E	89.3	Confident	84.2	Confident	68 Å²	68	43.4 Å²	43.4	32%	0.318	22%	0.22	S	C	.	.	H	α-helix	trans	-53.6	-52.8	172.5	179.7	-172.3	-175.3	0	0	113.3	V316 L642 G645 R646 H651 A652	V316-E648 HydrophobicContact CG2-CG 3.94Å; L642-E648 HydrophobicContact CB-CB 4.49Å; G645-E648 PolarHBondContact N-OE2 3.49Å; R646-E648 VanDerWaalsContact C-N 3.32Å; R646-E648 PolarHBondContact O-N 2.72Å; E648-H651 PolarHBondContact O-N 2.8Å; E648-A652 WeakPolarHBondContact O-CB 3.45Å; E648-A652 PolarHBondContact O-N 3.35Å
649	R	85.6	Confident	83.3	Confident	165 Å²	165	46.7 Å²	46.7	62%	0.623	24%	0.243	S	C	*	.	H	α-helix	trans	-63.9	-45.6	179.3	-71.9	180	-163	96.9	1.6	112.2	G645 R646 H651 A652 V653	G645-R649 VanDerWaalsContact O-CG 3.31Å; G645-R649 WeakPolarHBondContact O-CG 3.42Å; G645-R649 PolarHBondContact O-N 3.05Å; G645-R649 PolarHBondContact O-NH1 3.02Å; R646-R649 PolarHBondContact O-N 3.37Å; R649-H651 VanDerWaalsContact C-N 3.31Å; R649-H651 PolarHBondContact O-N 3.33Å; R649-A652 PolarHBondContact O-N 3.09Å; R649-V653 WeakPolarHBondContact O-CG2 3.22Å; R649-V653 PolarHBondContact O-N 3.17Å
650	N	82.4	Confident	82.3	Confident	66 Å²	66	50 Å²	50	35%	0.353	27%	0.266	S	S	.	.	H	α-helix	trans	-58.5	-44.7	177.9	-75.4	29.5	0	0	0	111	R646 E647 V653 S654	R646-N650 WeakPolarHBondContact O-CB 3.43Å; R646-N650 PolarHBondContact O-N 3.11Å; R646-N650 PolarHBondContact O-OD1 3.09Å; E647-N650 PolarHBondContact O-N 3.2Å; N650-V653 PolarHBondContact O-N 3.19Å; N650-S654 VanDerWaalsContact O-CB 3.26Å; N650-S654 WeakPolarHBondContact O-CB 3.32Å; N650-S654 PolarHBondContact O-N 3.3Å
651	H	84.1	Confident	81.4	Confident	15 Å²	15	50.3 Å²	50.3	7%	0.069	27%	0.268	C	S	.	.	H	α-helix	trans	-63.3	-43.2	176.5	177.8	-99.3	0	0	0	112.7	A616 L642 E647 E648 R649 S654 I655	A616-H651 HydrophobicContact CB-CB 4.19Å; L642-H651 HydrophobicContact CD1-CB 4.15Å; L642-H651 WeakPolarHBondContact CD1-ND1 3.38Å; L642-H651 HydrophobicContact CD2-CB 3.66Å; E647-H651 WeakPolarHBondContact O-CB 3.39Å; E647-H651 PolarHBondContact O-N 3.06Å; E648-H651 PolarHBondContact O-N 2.8Å; R649-H651 VanDerWaalsContact C-N 3.31Å; R649-H651 PolarHBondContact O-N 3.33Å; H651-S654 PolarHBondContact O-N 2.89Å; H651-I655 WeakPolarHBondContact CE1-CD1 3.41Å; H651-I655 PolarHBondContact O-N 3.09Å
652	A	83.9	Confident	80.5	Confident	59 Å²	59	51 Å²	51	49%	0.488	27%	0.272	S	S	.	.	H	α-helix	trans	-61.7	-45.1	177.3	0	0	0	0	0	112.3	E648 R649 A656	E648-A652 WeakPolarHBondContact O-CB 3.45Å; E648-A652 PolarHBondContact O-N 3.35Å; R649-A652 PolarHBondContact O-N 3.09Å; A652-A656 WeakPolarHBondContact O-CB 3.29Å; A652-A656 PolarHBondContact O-N 3.18Å
653	V	80.8	Confident	79.6	Confident	53 Å²	53	56.6 Å²	56.6	32%	0.321	30%	0.296	S	S	.	.	H	α-helix	trans	-66.9	-38.9	176.1	176	0	0	0	0	111.4	R649 N650 A656 R657 I1282	R649-V653 WeakPolarHBondContact O-CG2 3.22Å; R649-V653 PolarHBondContact O-N 3.17Å; N650-V653 PolarHBondContact O-N 3.19Å; V653-A656 PolarHBondContact O-N 3.25Å; V653-R657 HydrophobicContact CG1-CG 4.25Å; V653-R657 WeakPolarHBondContact O-CG 3.44Å; V653-R657 PolarHBondContact O-N 3.28Å; V653-I1282 HydrophobicContact CB-CD1 3.95Å; V653-I1282 HydrophobicContact CG1-CD1 3.73Å; V653-I1282 HydrophobicContact CG2-CD1 4.19Å
654	S	74.4	Confident	78.8	Confident	21 Å²	21	57.9 Å²	57.9	15%	0.147	31%	0.307	C	S	.	.	H	α-helix	trans	-59.4	-48.1	177.1	-168.3	0	0	0	0	112.1	P620 N650 H651 A656 R657 T658	P620-S654 WeakPolarHBondContact CB-OG 3.35Å; P620-S654 WeakPolarHBondContact CD-OG 3.28Å; P620-S654 WeakPolarHBondContact CG-OG 3.42Å; N650-S654 VanDerWaalsContact O-CB 3.26Å; N650-S654 WeakPolarHBondContact O-CB 3.32Å; N650-S654 PolarHBondContact O-N 3.3Å; H651-S654 PolarHBondContact O-N 2.89Å; S654-A656 PolarHBondContact O-N 3.33Å; S654-R657 PolarHBondContact O-N 2.83Å; S654-T658 PolarHBondContact O-N 3.18Å
655	I	77.7	Confident	78.3	Confident	54 Å²	54	52.6 Å²	52.6	28%	0.277	28%	0.282	S	S	.	.	H	α-helix	trans	-63.4	-41.2	174.4	-70.8	-179.6	0	0	0	111.5	L312 L623 H651 S659	L312-I655 HydrophobicContact CD2-CD1 3.99Å; L623-I655 HydrophobicContact CD2-CD1 4.15Å; L623-I655 HydrophobicContact CD2-CG1 4.21Å; H651-I655 WeakPolarHBondContact CE1-CD1 3.41Å; H651-I655 PolarHBondContact O-N 3.09Å; I655-S659 VanDerWaalsContact O-CB 3.28Å; I655-S659 WeakPolarHBondContact O-CB 3.15Å; I655-S659 PolarHBondContact O-N 3.44Å; I655-S659 PolarHBondContact O-OG 2.64Å
656	A	76	Confident	77.9	Confident	50 Å²	50	55.7 Å²	55.7	41%	0.413	30%	0.295	S	S	.	.	H	α-helix	trans	-63.3	-42.8	178.5	0	0	0	0	0	112.3	A652 V653 S654 S660	A652-A656 WeakPolarHBondContact O-CB 3.29Å; A652-A656 PolarHBondContact O-N 3.18Å; V653-A656 PolarHBondContact O-N 3.25Å; S654-A656 PolarHBondContact O-N 3.33Å; A656-S660 VanDerWaalsContact O-CB 3.27Å; A656-S660 WeakPolarHBondContact O-CB 3.38Å; A656-S660 PolarHBondContact O-N 3.13Å; A656-S660 PolarHBondContact O-OG 3.25Å
657	R	70.9	Confident	77.3	Confident	92 Å²	92	56.5 Å²	56.5	35%	0.347	30%	0.303	S	S	.	.	H	α-helix	trans	-56.9	-57.5	175.9	-75.9	177.1	178.1	179.8	-1.6	110.9	V653 S654 S659 S660 V661 D1279 F1281	V653-R657 HydrophobicContact CG1-CG 4.25Å; V653-R657 WeakPolarHBondContact O-CG 3.44Å; V653-R657 PolarHBondContact O-N 3.28Å; S654-R657 PolarHBondContact O-N 2.83Å; R657-S659 PolarHBondContact O-N 2.82Å; R657-S660 WeakPolarHBondContact O-CB 3.43Å; R657-S660 PolarHBondContact O-N 3.21Å; R657-S660 VanDerWaalsContact O-N 3.1Å; R657-V661 PolarHBondContact O-N 3.24Å; R657-D1279 IonicContact CZ-OD1 2.81Å; R657-D1279 IonicContact CZ-OD2 2.78Å; R657-D1279 IonicContact NH1-OD1 2.8Å; R657-D1279 PolarHBondContact NH1-OD1 2.93Å; R657-D1279 IonicContact NH1-OD2 3.77Å; R657-D1279 PolarHBondContact NH1-OD2 3.28Å; R657-D1279 IonicContact NH2-OD1 3.14Å; R657-F1281 PolarHBondContact NH2-O 3.32Å
658	T	67.7	Low	76.3	Confident	10 Å²	10	56.9 Å²	56.9	6%	0.061	31%	0.311	C	S	.	.	H	α-helix	trans	-66.2	-38.2	-176.5	-56.4	0	0	0	0	113.4	P620 M624 S654 S660 V661 H662	P620-T658 VanDerWaalsContact CB-OG1 3.24Å; P620-T658 WeakPolarHBondContact CB-OG1 3.33Å; P620-T658 WeakPolarHBondContact CG-OG1 3.41Å; M624-T658 HydrophobicContact SD-CG2 3.52Å; M624-T658 VanDerWaalsContact SD-CG2 3.52Å; S654-T658 PolarHBondContact O-N 3.18Å; T658-S660 VanDerWaalsContact C-N 3.28Å; T658-S660 PolarHBondContact O-N 3.3Å; T658-V661 PolarHBondContact O-N 3.08Å; T658-H662 PolarHBondContact O-N 3.16Å; T658-H662 VanDerWaalsContact O-N 3.15Å
659	S	69.6	Low	75.2	Confident	69 Å²	69	59.9 Å²	59.9	48%	0.483	33%	0.33	S	S	.	.	H	α-helix	trans	-61.2	-39.4	173.4	-55.9	0	0	0	0	111.3	I655 R657 K663	I655-S659 VanDerWaalsContact O-CB 3.28Å; I655-S659 WeakPolarHBondContact O-CB 3.15Å; I655-S659 PolarHBondContact O-N 3.44Å; I655-S659 PolarHBondContact O-OG 2.64Å; R657-S659 PolarHBondContact O-N 2.82Å; S659-K663 WeakPolarHBondContact O-CB 3.35Å; S659-K663 PolarHBondContact O-N 3.43Å
660	S	70.9	Confident	74.4	Confident	69 Å²	69	52.3 Å²	52.3	48%	0.483	30%	0.303	S	S	.	.	H	α-helix	trans	-69	-35.7	178.5	-58.6	0	0	0	0	112.8	A656 R657 T658 A664	A656-S660 VanDerWaalsContact O-CB 3.27Å; A656-S660 WeakPolarHBondContact O-CB 3.38Å; A656-S660 PolarHBondContact O-N 3.13Å; A656-S660 PolarHBondContact O-OG 3.25Å; R657-S660 WeakPolarHBondContact O-CB 3.43Å; R657-S660 PolarHBondContact O-N 3.21Å; R657-S660 VanDerWaalsContact O-N 3.1Å; T658-S660 VanDerWaalsContact C-N 3.28Å; T658-S660 PolarHBondContact O-N 3.3Å; S660-A664 WeakPolarHBondContact O-CB 3.3Å; S660-A664 PolarHBondContact O-N 2.8Å
661	V	72.6	Confident	74.2	Confident	9 Å²	9	53 Å²	53	6%	0.055	30%	0.301	C	S	.	.	H	α-helix	trans	-65.6	-51.1	174.9	174.6	0	0	0	0	111.3	P274 A276 R657 T658 K663 A664 L665	P274-V661 HydrophobicContact CG-CG1 4.4Å; A276-V661 WeakPolarHBondContact O-CG2 3.46Å; R657-V661 PolarHBondContact O-N 3.24Å; T658-V661 PolarHBondContact O-N 3.08Å; V661-K663 VanDerWaalsContact C-N 3.28Å; V661-K663 PolarHBondContact O-N 3.46Å; V661-A664 PolarHBondContact O-N 3.4Å; V661-L665 HydrophobicContact CG1-CD1 3.81Å; V661-L665 HydrophobicContact CG1-CG 4.46Å; V661-L665 WeakPolarHBondContact O-CB 3.46Å; V661-L665 VanDerWaalsContact O-CG 3.3Å; V661-L665 WeakPolarHBondContact O-CG 3.32Å; V661-L665 PolarHBondContact O-N 2.69Å
662	H	74.3	Confident	73.6	Confident	15 Å²	15	57.6 Å²	57.6	7%	0.069	33%	0.333	C	S	.	.	H	α-helix	trans	-59.5	-41.8	177	-84.6	-111.4	0	0	0	111.3	T658 L666	T658-H662 PolarHBondContact O-N 3.16Å; T658-H662 VanDerWaalsContact O-N 3.15Å; H662-L666 WeakPolarHBondContact O-CB 3.41Å; H662-L666 VanDerWaalsContact O-CG 3.24Å; H662-L666 WeakPolarHBondContact O-CG 3.42Å; H662-L666 PolarHBondContact O-N 2.86Å; H662-L666 VanDerWaalsContact O-N 3.11Å
663	K	74.7	Confident	73.4	Confident	119 Å²	119	62.9 Å²	62.9	52%	0.517	35%	0.345	S	S	.	.	H	α-helix	trans	-62.6	-52	175.8	-174.2	179.2	179.5	-171.7	0	112.3	S659 V661 L665 L666 E667	S659-K663 WeakPolarHBondContact O-CB 3.35Å; S659-K663 PolarHBondContact O-N 3.43Å; V661-K663 VanDerWaalsContact C-N 3.28Å; V661-K663 PolarHBondContact O-N 3.46Å; K663-L665 VanDerWaalsContact C-N 3.3Å; K663-L665 PolarHBondContact O-N 3.37Å; K663-L666 PolarHBondContact O-N 3.47Å; K663-E667 WeakPolarHBondContact CE-OE1 3.4Å; K663-E667 WeakPolarHBondContact CE-OE2 3.19Å; K663-E667 VanDerWaalsContact CG-CD 3.46Å; K663-E667 HydrophobicContact CG-CG 4.18Å; K663-E667 WeakPolarHBondContact CG-OE1 3.27Å; K663-E667 WeakPolarHBondContact CG-OE2 3.42Å; K663-E667 IonicContact NZ-OE1 2.7Å; K663-E667 WeakPolarHBondContact O-CB 3.42Å; K663-E667 WeakPolarHBondContact O-CG 3.48Å; K663-E667 PolarHBondContact O-N 2.81Å
664	A	75.2	Confident	73.5	Confident	29 Å²	29	61.1 Å²	61.1	24%	0.24	33%	0.334	C	S	.	.	H	α-helix	trans	-65.2	-31	-176	0	0	0	0	0	113.6	I278 S660 V661 A670	I278-A664 HydrophobicContact CD1-CB 4.4Å; S660-A664 WeakPolarHBondContact O-CB 3.3Å; S660-A664 PolarHBondContact O-N 2.8Å; V661-A664 PolarHBondContact O-N 3.4Å; A664-A670 HydrophobicContact CB-CB 3.97Å; A664-A670 VanDerWaalsContact O-CB 3.29Å; A664-A670 WeakPolarHBondContact O-CB 3.15Å; A664-A670 PolarHBondContact O-N 3.11Å
665	L	78.9	Confident	74.1	Confident	7 Å²	7	63.3 Å²	63.3	4%	0.037	35%	0.353	C	S	.	.	H	α-helix	trans	-73.6	-40.5	173.2	-68.2	172	0	0	0	112.1	P274 V281 L295 V661 K663 A670 L674	P274-L665 HydrophobicContact CG-CD1 3.82Å; V281-L665 HydrophobicContact CG2-CD1 4.34Å; L295-L665 HydrophobicContact CD2-CB 3.65Å; L295-L665 HydrophobicContact CD2-CD1 4.1Å; V661-L665 HydrophobicContact CG1-CD1 3.81Å; V661-L665 HydrophobicContact CG1-CG 4.46Å; V661-L665 WeakPolarHBondContact O-CB 3.46Å; V661-L665 VanDerWaalsContact O-CG 3.3Å; V661-L665 WeakPolarHBondContact O-CG 3.32Å; V661-L665 PolarHBondContact O-N 2.69Å; K663-L665 VanDerWaalsContact C-N 3.3Å; K663-L665 PolarHBondContact O-N 3.37Å; L665-A670 HydrophobicContact CD2-CB 4.27Å; L665-L674 HydrophobicContact CD2-CD1 3.85Å
666	L	78.4	Confident	74.6	Confident	81 Å²	81	63.2 Å²	63.2	42%	0.424	35%	0.351	S	S	.	.	H	α-helix	trans	-74.9	-32.4	178.3	-70.4	172.5	0	0	0	113.2	L295 T297 H662 K663 G668	L295-L666 HydrophobicContact CD2-CD2 4.02Å; L295-L666 HydrophobicContact CD2-CG 3.97Å; L295-L666 HydrophobicContact CG-CD2 4.18Å; T297-L666 HydrophobicContact CG2-CD1 3.83Å; H662-L666 WeakPolarHBondContact O-CB 3.41Å; H662-L666 VanDerWaalsContact O-CG 3.24Å; H662-L666 WeakPolarHBondContact O-CG 3.42Å; H662-L666 PolarHBondContact O-N 2.86Å; H662-L666 VanDerWaalsContact O-N 3.11Å; K663-L666 PolarHBondContact O-N 3.47Å; L666-G668 PolarHBondContact O-N 3.28Å
667	E	70.7	Confident	75.1	Confident	117 Å²	117	62.6 Å²	62.6	55%	0.547	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	16.4	176.8	-66.9	179.7	169.1	0	0	113	K663 N669	K663-E667 WeakPolarHBondContact CE-OE1 3.4Å; K663-E667 WeakPolarHBondContact CE-OE2 3.19Å; K663-E667 VanDerWaalsContact CG-CD 3.46Å; K663-E667 HydrophobicContact CG-CG 4.18Å; K663-E667 WeakPolarHBondContact CG-OE1 3.27Å; K663-E667 WeakPolarHBondContact CG-OE2 3.42Å; K663-E667 IonicContact NZ-OE1 2.7Å; K663-E667 WeakPolarHBondContact O-CB 3.42Å; K663-E667 WeakPolarHBondContact O-CG 3.48Å; K663-E667 PolarHBondContact O-N 2.81Å; E667-N669 PolarHBondContact O-N 2.85Å
668	G	63.3	Low	75.5	Confident	26 Å²	26	62.9 Å²	62.9	27%	0.268	35%	0.352	S	S	.	.	S	Bend	trans	72.7	-36.4	169.2	0	0	0	0	0	116.4	L666 A670 Y671 C672	L666-G668 PolarHBondContact O-N 3.28Å; G668-A670 PolarHBondContact O-N 3.43Å; G668-A670 VanDerWaalsContact O-N 3.13Å; G668-Y671 WeakPolarHBondContact O-CB 3.17Å; G668-Y671 PolarHBondContact O-N 2.99Å; G668-C672 PolarHBondContact O-N 2.98Å; G668-C672 PolarHBondContact O-SG 3.42Å
669	N	67.7	Low	75.8	Confident	132 Å²	132	65.7 Å²	65.7	71%	0.706	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-22.2	-172	-78.5	-34.9	0	0	0	115	E667 K673	E667-N669 PolarHBondContact O-N 2.85Å; N669-K673 WeakPolarHBondContact O-CD 3.46Å; N669-K673 VanDerWaalsContact O-CE 3.22Å; N669-K673 WeakPolarHBondContact O-CE 3.38Å
670	A	69.1	Low	76.2	Confident	6 Å²	6	62.9 Å²	62.9	5%	0.05	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-35.3	167.3	0	0	0	0	0	112.7	I278 A664 L665 G668 C672 K673	I278-A670 HydrophobicContact CD1-CB 3.78Å; I278-A670 HydrophobicContact CG1-CB 4.39Å; A664-A670 HydrophobicContact CB-CB 3.97Å; A664-A670 VanDerWaalsContact O-CB 3.29Å; A664-A670 WeakPolarHBondContact O-CB 3.15Å; A664-A670 PolarHBondContact O-N 3.11Å; L665-A670 HydrophobicContact CD2-CB 4.27Å; G668-A670 PolarHBondContact O-N 3.43Å; G668-A670 VanDerWaalsContact O-N 3.13Å; A670-C672 VanDerWaalsContact C-N 3.33Å; A670-C672 PolarHBondContact O-N 3.49Å; A670-K673 WeakPolarHBondContact O-CB 3.46Å; A670-K673 PolarHBondContact O-N 3.5Å
671	Y	76.7	Confident	76.6	Confident	79 Å²	79	60 Å²	60	31%	0.31	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-55.9	-46.5	178.2	-175.1	-82.1	0	0	0	111.8	L293 G668 K673 L674 F676	L293-Y671 HydrophobicContact CB-CE2 4.19Å; L293-Y671 HydrophobicContact CD2-CD2 4.35Å; L293-Y671 HydrophobicContact CD2-CE2 4.35Å; G668-Y671 WeakPolarHBondContact O-CB 3.17Å; G668-Y671 PolarHBondContact O-N 2.99Å; Y671-K673 PolarHBondContact O-N 2.92Å; Y671-L674 PolarHBondContact O-N 2.95Å; Y671-L674 VanDerWaalsContact O-N 3.08Å; Y671-F676 HydrophobicContact CD2-CZ 4.44Å; Y671-F676 HydrophobicContact CE1-CE2 4.12Å; Y671-F676 HydrophobicContact CE1-CZ 4.41Å; Y671-F676 HydrophobicContact CE2-CE2 4.35Å; Y671-F676 AromaticContact CE2-CZ 3.84Å; Y671-F676 HydrophobicContact CE2-CZ 3.84Å; Y671-F676 AromaticContact CZ-CE2 3.95Å; Y671-F676 AromaticContact CZ-CZ 3.8Å
672	C	71.9	Confident	77.2	Confident	112 Å²	112	60.1 Å²	60.1	76%	0.757	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-68.1	-0.9	178.2	-60.1	0	0	0	0	114.6	G668 A670	G668-C672 PolarHBondContact O-N 2.98Å; G668-C672 PolarHBondContact O-SG 3.42Å; A670-C672 VanDerWaalsContact C-N 3.33Å; A670-C672 PolarHBondContact O-N 3.49Å
673	K	79.2	Confident	78	Confident	170 Å²	170	59.5 Å²	59.5	74%	0.739	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-106.1	-7	174.7	-60.5	178	-177.8	174.1	0	113	N669 A670 Y671	N669-K673 WeakPolarHBondContact O-CD 3.46Å; N669-K673 VanDerWaalsContact O-CE 3.22Å; N669-K673 WeakPolarHBondContact O-CE 3.38Å; A670-K673 WeakPolarHBondContact O-CB 3.46Å; A670-K673 PolarHBondContact O-N 3.5Å; Y671-K673 PolarHBondContact O-N 2.92Å
674	L	84.1	Confident	78.8	Confident	16 Å²	16	53.9 Å²	53.9	8%	0.084	30%	0.296	C	S	.	.			trans	-78.4	124.5	178.5	-64.5	173.7	0	0	0	110.6	I278 V281 Q282 I285 L293 L665 Y671 F676	I278-L674 HydrophobicContact CG2-CD2 4.35Å; V281-L674 HydrophobicContact CG1-CD1 4.16Å; V281-L674 HydrophobicContact CG1-CD2 4.24Å; Q282-L674 HydrophobicContact CB-CD2 4.34Å; I285-L674 HydrophobicContact CD1-CB 4.23Å; I285-L674 HydrophobicContact CD1-CD1 3.88Å; I285-L674 HydrophobicContact CD1-CD2 4.25Å; I285-L674 HydrophobicContact CD1-CG 4.35Å; L293-L674 HydrophobicContact CD2-CD1 4.24Å; L665-L674 HydrophobicContact CD2-CD1 3.85Å; Y671-L674 PolarHBondContact O-N 2.95Å; Y671-L674 VanDerWaalsContact O-N 3.08Å; L674-F676 HydrophobicContact CB-CD2 4.27Å; L674-F676 HydrophobicContact CB-CE2 3.76Å; L674-F676 HydrophobicContact CB-CZ 4.11Å; L674-F676 HydrophobicContact CD1-CZ 4.11Å; L674-F676 WeakPolarHBondContact O-CD2 3.41Å; L674-F676 PolarHBondContact O-N 3.25Å
675	A	87.3	Confident	79.4	Confident	67 Å²	67	52.9 Å²	52.9	55%	0.554	29%	0.287	S	S	*	.			trans	-81.4	96.7	169.8	0	0	0	0	0	109.4	Q282 I285	Q282-A675 PolarHBondContact NE2-O 3.4Å; I285-A675 WeakPolarHBondContact CG2-O 3.24Å
676	F	88.4	Confident	79.7	Confident	52 Å²	52	56.3 Å²	56.3	23%	0.228	30%	0.304	C	S	.	.			trans	-73.5	153.3	173.1	-69.3	-83.5	0	0	0	112.1	I285 L293 Y671 L674 P678	I285-F676 HydrophobicContact CD1-CD1 4.25Å; I285-F676 HydrophobicContact CD1-CE1 3.86Å; I285-F676 HydrophobicContact CD1-CZ 4.34Å; I285-F676 HydrophobicContact CG2-CD1 4.35Å; L293-F676 HydrophobicContact CB-CE1 3.85Å; L293-F676 HydrophobicContact CB-CZ 4.08Å; Y671-F676 HydrophobicContact CD2-CZ 4.44Å; Y671-F676 HydrophobicContact CE1-CE2 4.12Å; Y671-F676 HydrophobicContact CE1-CZ 4.41Å; Y671-F676 HydrophobicContact CE2-CE2 4.35Å; Y671-F676 AromaticContact CE2-CZ 3.84Å; Y671-F676 HydrophobicContact CE2-CZ 3.84Å; Y671-F676 AromaticContact CZ-CE2 3.95Å; Y671-F676 AromaticContact CZ-CZ 3.8Å; L674-F676 HydrophobicContact CB-CD2 4.27Å; L674-F676 HydrophobicContact CB-CE2 3.76Å; L674-F676 HydrophobicContact CB-CZ 4.11Å; L674-F676 HydrophobicContact CD1-CZ 4.11Å; L674-F676 WeakPolarHBondContact O-CD2 3.41Å; L674-F676 PolarHBondContact O-N 3.25Å; F676-P678 WeakPolarHBondContact O-CD 3.42Å
677	Y	85.7	Confident	79.9	Confident	37 Å²	37	55.4 Å²	55.4	15%	0.145	32%	0.315	C	S	.	.			trans	-71.1	118.3	178.3	-171.4	-114.7	0	0	0	110.8	L289 I290 S291 H679	L289-Y677 HydrophobicContact CB-CD1 3.71Å; L289-Y677 HydrophobicContact CB-CD2 4.46Å; L289-Y677 HydrophobicContact CB-CE1 3.87Å; L289-Y677 HydrophobicContact CB-CG 4.01Å; L289-Y677 HydrophobicContact CD1-CE1 4.47Å; L289-Y677 HydrophobicContact CD2-CD2 4Å; L289-Y677 HydrophobicContact CD2-CE1 4.28Å; L289-Y677 HydrophobicContact CD2-CE2 3.73Å; L289-Y677 HydrophobicContact CD2-CG 4.41Å; L289-Y677 HydrophobicContact CG-CE1 4.43Å; I290-Y677 WeakPolarHBondContact O-CB 3.38Å; I290-Y677 PolarHBondContact O-N 2.88Å; S291-Y677 WeakPolarHBondContact CB-O 3.3Å; Y677-H679 HydrophobicContact CD1-CB 4.15Å; Y677-H679 HydrophobicContact CE1-CB 3.49Å; Y677-H679 VanDerWaalsContact CE1-CB 3.49Å; Y677-H679 VanDerWaalsContact CE1-O 3.25Å; Y677-H679 WeakPolarHBondContact CE1-O 3.39Å; Y677-H679 HydrophobicContact CE2-CB 4.5Å; Y677-H679 PolarHBondContact O-N 3.44Å
678	P	79.7	Confident	80.5	Confident	98 Å²	98	51 Å²	51	64%	0.636	30%	0.296	S	S	*	.	S	Bend	trans	-78	-19.7	-171	31	-36.5	0	0	0	113.6	F676 N680	F676-P678 WeakPolarHBondContact O-CD 3.42Å; P678-N680 PolarHBondContact O-N 3.16Å; P678-N680 VanDerWaalsContact O-N 3.13Å
679	H	73.6	Confident	81.6	Confident	70 Å²	70	56 Å²	56	32%	0.324	31%	0.312	S	S	.	.			trans	-90	69	-175.1	-76	-61.5	0	0	0	111.3	N90 Y677 P681	N90-H679 VanDerWaalsContact ND2-CB 3.33Å; N90-H679 WeakPolarHBondContact ND2-CB 3.46Å; N90-H679 PolarHBondContact ND2-ND1 2.92Å; N90-H679 PolarHBondContact OD1-ND1 3.34Å; N90-H679 VanDerWaalsContact OD1-ND1 3.14Å; Y677-H679 HydrophobicContact CD1-CB 4.15Å; Y677-H679 HydrophobicContact CE1-CB 3.49Å; Y677-H679 VanDerWaalsContact CE1-CB 3.49Å; Y677-H679 VanDerWaalsContact CE1-O 3.25Å; Y677-H679 WeakPolarHBondContact CE1-O 3.39Å; Y677-H679 HydrophobicContact CE2-CB 4.5Å; Y677-H679 PolarHBondContact O-N 3.44Å; H679-P681 VanDerWaalsContact O-CD 3.27Å; H679-P681 WeakPolarHBondContact O-CD 3.38Å
680	N	78.3	Confident	82.7	Confident	10 Å²	10	50.1 Å²	50.1	5%	0.053	28%	0.281	C	S	.	.			trans	-93.1	105.4	178.1	-179.9	73.3	0	0	0	111.9	Y85 T88 Y127 K128 N129 R266 S291 P678	Y85-N680 PolarHBondContact OH-O 3.15Å; T88-N680 PolarHBondContact OG1-O 2.87Å; Y127-N680 PolarHBondContact O-ND2 3.14Å; K128-N680 VanDerWaalsContact CA-OD1 3.27Å; K128-N680 WeakPolarHBondContact CA-OD1 3.32Å; N129-N680 PolarHBondContact N-OD1 3.39Å; R266-N680 PolarHBondContact NH1-OD1 3.47Å; S291-N680 PolarHBondContact OG-OD1 3.23Å; P678-N680 PolarHBondContact O-N 3.16Å; P678-N680 VanDerWaalsContact O-N 3.13Å
681	P	79.8	Confident	83.7	Confident	9 Å²	9	57.3 Å²	57.3	6%	0.058	31%	0.311	C	S	.	.			trans	-69.4	133.8	172.7	30	-34.3	0	0	0	110.1	R266 H679 M683	R266-P681 VanDerWaalsContact CZ-O 3.29Å; R266-P681 PolarHBondContact NH1-O 3.29Å; R266-P681 PolarHBondContact NH2-O 2.88Å; H679-P681 VanDerWaalsContact O-CD 3.27Å; H679-P681 WeakPolarHBondContact O-CD 3.38Å; P681-M683 VanDerWaalsContact C-N 3.26Å; P681-M683 HydrophobicContact CB-CG 4.41Å; P681-M683 HydrophobicContact CB-SD 4.01Å; P681-M683 HydrophobicContact CG-CG 4.39Å; P681-M683 HydrophobicContact CG-SD 4.15Å; P681-M683 PolarHBondContact O-N 3.44Å
682	R	84.9	Confident	84.3	Confident	10 Å²	10	54.8 Å²	54.8	4%	0.038	30%	0.303	C	S	.	.			trans	-63	-30.3	179.4	-168.3	173.4	-177	-107.8	2.3	113.6	Y85 D91 Y127 R266 V684 P685 V688 H689	Y85-R682 HydrophobicContact CD1-CG 4Å; Y85-R682 HydrophobicContact CD2-CG 4.4Å; Y85-R682 HydrophobicContact CE1-CB 3.83Å; Y85-R682 VanDerWaalsContact CE1-CD 3.43Å; Y85-R682 HydrophobicContact CE1-CG 3.65Å; Y85-R682 HydrophobicContact CE2-CB 4.24Å; Y85-R682 HydrophobicContact CE2-CG 4.06Å; Y85-R682 HydrophobicContact CG-CG 4.37Å; Y85-R682 WeakPolarHBondContact OH-CB 3.13Å; Y85-R682 PolarHBondContact OH-N 3.05Å; D91-R682 WeakPolarHBondContact OD1-CB 3.4Å; D91-R682 PolarHBondContact OD1-N 3.38Å; Y127-R682 HydrophobicContact CD1-CG 4.32Å; R266-R682 PolarHBondContact NH2-O 3.43Å; R682-V684 WeakPolarHBondContact CD-O 3.49Å; R682-V684 HydrophobicContact CG-CB 4.3Å; R682-V684 PolarHBondContact NH1-O 3.44Å; R682-V684 PolarHBondContact O-N 3Å; R682-V684 VanDerWaalsContact O-N 3.15Å; R682-P685 PolarHBondContact NH1-O 2.7Å; R682-V688 PolarHBondContact NH1-O 3.03Å; R682-V688 PolarHBondContact NH2-O 2.91Å; R682-H689 PolarHBondContact NH2-CE1 3.15Å; R682-H689 PolarHBondContact NH2-ND1 2.82Å
683	M	91	Very high	85.2	Confident	2 Å²	2	52.8 Å²	52.8	1%	0.01	28%	0.283	C	S	.	.	S	Bend	trans	56.3	20	-174.1	-56.2	-59	-69	0	0	114.5	F151 Y155 R232 Q264 R266 P681	F151-M683 HydrophobicContact CE1-CB 3.88Å; F151-M683 HydrophobicContact CE1-CE 4.2Å; F151-M683 HydrophobicContact CE1-CG 4.23Å; F151-M683 HydrophobicContact CZ-CB 3.88Å; F151-M683 HydrophobicContact CZ-CG 4.34Å; Y155-M683 HydrophobicContact CE2-CE 3.98Å; Y155-M683 WeakPolarHBondContact OH-CE 3.37Å; Y155-M683 PolarHBondContact OH-O 2.94Å; R232-M683 HydrophobicContact CB-CE 4.23Å; Q264-M683 WeakPolarHBondContact O-CE 3.29Å; R266-M683 HydrophobicContact CB-CG 4.19Å; P681-M683 VanDerWaalsContact C-N 3.26Å; P681-M683 HydrophobicContact CB-CG 4.41Å; P681-M683 HydrophobicContact CB-SD 4.01Å; P681-M683 HydrophobicContact CG-CG 4.39Å; P681-M683 HydrophobicContact CG-SD 4.15Å; P681-M683 PolarHBondContact O-N 3.44Å
684	V	90.6	Very high	85.6	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.006	26%	0.256	C	S	.	.	S	Bend	trans	-143	128.3	172.7	179.1	0	0	0	0	107	F98 Y127 W154 R682 V688 P690	F98-V684 HydrophobicContact CE2-CG2 4.41Å; F98-V684 HydrophobicContact CZ-CG1 4.1Å; Y127-V684 HydrophobicContact CD1-CG2 4.41Å; Y127-V684 HydrophobicContact CE1-CG2 4.08Å; W154-V684 HydrophobicContact CE3-CG2 4.15Å; W154-V684 HydrophobicContact CH2-CG2 3.92Å; W154-V684 HydrophobicContact CZ3-CG2 3.6Å; R682-V684 WeakPolarHBondContact CD-O 3.49Å; R682-V684 HydrophobicContact CG-CB 4.3Å; R682-V684 PolarHBondContact NH1-O 3.44Å; R682-V684 PolarHBondContact O-N 3Å; R682-V684 VanDerWaalsContact O-N 3.15Å; V684-V688 HydrophobicContact CG1-CB 3.91Å; V684-V688 HydrophobicContact CG1-CG1 3.94Å; V684-P690 HydrophobicContact CG1-CG 3.9Å; V684-P690 HydrophobicContact CG2-CG 4.15Å
685	P	88.8	Confident	85.6	Confident	8 Å²	8	49.1 Å²	49.1	5%	0.052	27%	0.266	C	S	.	.			trans	-59.4	144.4	-175.4	-24.8	34.5	0	0	0	113.4	S92 L95 F98 R682 G687 V688	S92-P685 WeakPolarHBondContact O-CA 3.38Å; L95-P685 HydrophobicContact CB-CG 4.37Å; L95-P685 HydrophobicContact CD1-CG 4.18Å; L95-P685 HydrophobicContact CG-CG 4.29Å; F98-P685 HydrophobicContact CB-CG 4.37Å; F98-P685 VanDerWaalsContact CD1-CD 3.44Å; F98-P685 HydrophobicContact CD1-CG 3.47Å; F98-P685 VanDerWaalsContact CD1-CG 3.47Å; F98-P685 HydrophobicContact CD2-CG 4.41Å; F98-P685 HydrophobicContact CE1-CG 3.76Å; F98-P685 HydrophobicContact CG-CG 3.84Å; F98-P685 HydrophobicContact CZ-CG 4.35Å; R682-P685 PolarHBondContact NH1-O 2.7Å; P685-G687 PolarHBondContact O-N 3.09Å; P685-V688 HydrophobicContact CB-CG2 4.15Å; P685-V688 WeakPolarHBondContact O-CB 3.45Å; P685-V688 PolarHBondContact O-N 2.88Å
686	I	83.8	Confident	85.2	Confident	79 Å²	79	49.8 Å²	49.8	41%	0.405	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	135.5	177.8	-61.8	172.3	0	0	0	109.7	D91 S92 E93 V688	D91-I686 HydrophobicContact CB-CD1 4.07Å; D91-I686 HydrophobicContact CB-CG1 4.2Å; S92-I686 PolarHBondContact O-N 3.21Å; S92-I686 VanDerWaalsContact O-N 3.13Å; E93-I686 HydrophobicContact CG-CB 4.22Å; I686-V688 VanDerWaalsContact C-N 3.29Å; I686-V688 PolarHBondContact O-N 3.21Å
687	G	82.6	Confident	84.6	Confident	62 Å²	62	47.8 Å²	47.8	64%	0.639	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.7	-20.9	-174.6	0	0	0	0	0	115.3	P685 H689	P685-G687 PolarHBondContact O-N 3.09Å; G687-H689 PolarHBondContact O-CD2 2.83Å
688	V	85.1	Confident	83.6	Confident	26 Å²	26	51.7 Å²	51.7	16%	0.158	27%	0.272	C	S	.	.			trans	-82.8	127.3	170	-175.8	0	0	0	0	109.1	V100 G103 R682 V684 P685 I686	V100-V688 HydrophobicContact CG1-CG2 4.42Å; G103-V688 WeakPolarHBondContact O-CG1 3.13Å; R682-V688 PolarHBondContact NH1-O 3.03Å; R682-V688 PolarHBondContact NH2-O 2.91Å; V684-V688 HydrophobicContact CG1-CB 3.91Å; V684-V688 HydrophobicContact CG1-CG1 3.94Å; P685-V688 HydrophobicContact CB-CG2 4.15Å; P685-V688 WeakPolarHBondContact O-CB 3.45Å; P685-V688 PolarHBondContact O-N 2.88Å; I686-V688 VanDerWaalsContact C-N 3.29Å; I686-V688 PolarHBondContact O-N 3.21Å
689	H	86	Confident	82.5	Confident	130 Å²	130	53.1 Å²	53.1	60%	0.602	27%	0.273	S	S	*	.			trans	-128.5	92.3	178.3	-70.8	-94.2	0	0	0	110	R682 G687 K691	R682-H689 PolarHBondContact NH2-CE1 3.15Å; R682-H689 PolarHBondContact NH2-ND1 2.82Å; G687-H689 PolarHBondContact O-CD2 2.83Å; H689-K691 PolarHBondContact O-N 2.87Å
690	P	90.2	Very high	81	Confident	9 Å²	9	57.3 Å²	57.3	6%	0.058	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-54.2	119.1	-177.7	-20.9	21.9	0	0	0	112.7	G103 W106 Y127 W154 V684	G103-P690 WeakPolarHBondContact O-CB 3.44Å; G103-P690 VanDerWaalsContact O-CG 3.3Å; G103-P690 WeakPolarHBondContact O-CG 3.04Å; W106-P690 HydrophobicContact CB-CB 4.25Å; Y127-P690 HydrophobicContact CE1-CG 4.48Å; Y127-P690 WeakPolarHBondContact OH-CD 3.49Å; W154-P690 HydrophobicContact CH2-CB 4.21Å; W154-P690 HydrophobicContact CH2-CG 3.81Å; W154-P690 HydrophobicContact CZ2-CB 3.68Å; W154-P690 HydrophobicContact CZ2-CG 3.6Å; V684-P690 HydrophobicContact CG1-CG 3.9Å; V684-P690 HydrophobicContact CG2-CG 4.15Å
691	K	89.5	Confident	79.1	Confident	157 Å²	157	66 Å²	66	68%	0.683	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81	136.2	175.3	-65.5	-177.7	179.3	-179.3	0	110.9	A104 E105 W106 H689 Q693	A104-K691 PolarHBondContact O-N 3.15Å; E105-K691 CarbonylContact C-O 3.53Å; E105-K691 VanDerWaalsContact CA-O 3.27Å; E105-K691 WeakPolarHBondContact CA-O 3.41Å; W106-K691 PolarHBondContact N-O 2.86Å; H689-K691 PolarHBondContact O-N 2.87Å; K691-Q693 PolarHBondContact O-N 2.98Å
692	L	90.7	Very high	76.7	Confident	25 Å²	25	70.6 Å²	70.6	13%	0.131	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	131.5	172.9	170.4	60	0	0	0	110.5	A77 L78 W106 L119 F694	A77-L692 HydrophobicContact CB-CD2 4.07Å; L78-L692 HydrophobicContact CD2-CD2 4.45Å; L78-L692 HydrophobicContact CD2-CG 4.38Å; W106-L692 HydrophobicContact CD2-CD1 4.03Å; W106-L692 HydrophobicContact CE3-CD1 4.15Å; W106-L692 HydrophobicContact CH2-CD1 3.93Å; W106-L692 HydrophobicContact CZ2-CB 4.3Å; W106-L692 HydrophobicContact CZ2-CD1 3.77Å; W106-L692 HydrophobicContact CZ2-CD2 4.46Å; W106-L692 HydrophobicContact CZ2-CG 4.39Å; W106-L692 HydrophobicContact CZ3-CD1 4.09Å; W106-L692 CarbonylContact O-C 3.56Å; L119-L692 HydrophobicContact CD1-CD2 4.2Å; L119-L692 HydrophobicContact CD2-CD2 4.42Å; L692-F694 HydrophobicContact CD1-CE2 4.42Å; L692-F694 HydrophobicContact CD1-CZ 4.42Å; L692-F694 HydrophobicContact CD2-CE2 3.82Å; L692-F694 HydrophobicContact CD2-CZ 3.92Å; L692-F694 HydrophobicContact CG-CE2 4.07Å; L692-F694 HydrophobicContact CG-CZ 4.42Å
693	Q	89.8	Confident	74.1	Confident	71 Å²	71	78.4 Å²	78.4	33%	0.332	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	141.8	167	-65	-174	30.4	0	0	111.1	E105 W106 I107 Y108 K691	E105-Q693 HydrophobicContact CB-CG 4.38Å; E105-Q693 PolarHBondContact OE2-NE2 3.46Å; E105-Q693 PolarHBondContact OE2-OE1 3Å; E105-Q693 VanDerWaalsContact OE2-OE1 3.1Å; W106-Q693 PolarHBondContact O-N 3.4Å; I107-Q693 CarbonylContact C-O 3.52Å; I107-Q693 WeakPolarHBondContact CA-O 3.03Å; Y108-Q693 PolarHBondContact N-O 3.02Å; K691-Q693 PolarHBondContact O-N 2.98Å
694	F	87.6	Confident	71.1	Confident	41 Å²	41	84 Å²	84	18%	0.18	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	120.1	174.1	-67.9	-84.8	0	0	0	109.6	I74 A77 L78 Y108 I114 L119 L692	I74-F694 HydrophobicContact CB-CD2 4.49Å; I74-F694 HydrophobicContact CB-CE2 4.18Å; I74-F694 HydrophobicContact CG1-CD1 4.28Å; I74-F694 HydrophobicContact CG1-CD2 4.08Å; I74-F694 HydrophobicContact CG1-CE1 4.17Å; I74-F694 HydrophobicContact CG1-CE2 3.95Å; I74-F694 HydrophobicContact CG1-CG 4.24Å; I74-F694 HydrophobicContact CG1-CZ 3.99Å; I74-F694 HydrophobicContact CG2-CD2 3.89Å; I74-F694 HydrophobicContact CG2-CE2 3.87Å; A77-F694 HydrophobicContact CB-CE2 4.34Å; A77-F694 HydrophobicContact CB-CZ 3.99Å; L78-F694 HydrophobicContact CD2-CE2 4.39Å; L78-F694 HydrophobicContact CG-CE2 4.31Å; Y108-F694 AromaticContact CD1-CD1 3.77Å; Y108-F694 HydrophobicContact CD1-CD1 3.77Å; Y108-F694 AromaticContact CD1-CE1 3.65Å; Y108-F694 HydrophobicContact CD1-CE1 3.65Å; Y108-F694 HydrophobicContact CE1-CE1 4.34Å; Y108-F694 HydrophobicContact CG-CD1 4.2Å; Y108-F694 AromaticContact CG-CE1 3.96Å; Y108-F694 HydrophobicContact CG-CE1 3.96Å; Y108-F694 WeakPolarHBondContact O-CA 3.46Å; I114-F694 HydrophobicContact CD1-CD1 4.07Å; I114-F694 HydrophobicContact CD1-CE1 3.93Å; I114-F694 HydrophobicContact CG2-CE1 4.27Å; L119-F694 HydrophobicContact CD1-CE1 4.16Å; L119-F694 HydrophobicContact CD1-CZ 3.81Å; L692-F694 HydrophobicContact CD1-CE2 4.42Å; L692-F694 HydrophobicContact CD1-CZ 4.42Å; L692-F694 HydrophobicContact CD2-CE2 3.82Å; L692-F694 HydrophobicContact CD2-CZ 3.92Å; L692-F694 HydrophobicContact CG-CE2 4.07Å; L692-F694 HydrophobicContact CG-CZ 4.42Å
695	K	84.7	Confident	68.2	Low	68 Å²	68	90.2 Å²	90.2	30%	0.296	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	146.6	178.7	-57.9	-177.2	-174.2	168.9	0	110.5	E105 I107 Y108 P109 S110 L697	E105-K695 IonicContact OE1-NZ 3.16Å; E105-K695 PolarHBondContact OE1-NZ 3.37Å; E105-K695 IonicContact OE2-NZ 2.9Å; E105-K695 PolarHBondContact OE2-NZ 2.93Å; I107-K695 HydrophobicContact CD1-CD 3.83Å; I107-K695 HydrophobicContact CG1-CD 3.98Å; I107-K695 HydrophobicContact CG2-CB 3.83Å; I107-K695 HydrophobicContact CG2-CD 4.45Å; I107-K695 HydrophobicContact CG2-CG 4.23Å; Y108-K695 PolarHBondContact O-N 3.01Å; Y108-K695 VanDerWaalsContact O-N 3.07Å; P109-K695 WeakPolarHBondContact CA-O 3.48Å; S110-K695 PolarHBondContact N-O 2.89Å; S110-K695 PolarHBondContact OG-O 3.02Å; K695-L697 PolarHBondContact O-N 3Å
696	C	78.4	Confident	65.6	Low	81 Å²	81	98.2 Å²	98.2	55%	0.547	50%	0.496	S	S	.	.			trans	-74.8	123.9	173.7	-179.1	0	0	0	0	108.9	S110	S110-C696 PolarHBondContact OG-N 2.98Å; S110-C696 VanDerWaalsContact OG-N 3.13Å
697	L	75.6	Confident	63.3	Low	10 Å²	10	102.2 Å²	102.2	5%	0.052	52%	0.517	C	S	.	.			trans	-99	-12.1	179.8	-61.8	-168.8	0	0	0	113.4	I107 P109 D111 Y149 P183 K695 I699	I107-L697 HydrophobicContact CG2-CD2 3.98Å; P109-L697 HydrophobicContact CB-CD1 4.2Å; P109-L697 HydrophobicContact CB-CG 4.21Å; P109-L697 HydrophobicContact CG-CD1 3.88Å; P109-L697 HydrophobicContact CG-CG 4.43Å; D111-L697 PolarHBondContact OD1-N 3.49Å; Y149-L697 HydrophobicContact CD1-CD1 3.56Å; Y149-L697 HydrophobicContact CD1-CD2 4.29Å; Y149-L697 HydrophobicContact CE1-CD1 3.67Å; Y149-L697 HydrophobicContact CE1-CD2 3.5Å; Y149-L697 HydrophobicContact CE1-CG 4.27Å; Y149-L697 HydrophobicContact CE2-CD2 4.49Å; Y149-L697 HydrophobicContact CG-CD1 4.02Å; P183-L697 WeakPolarHBondContact CD-O 3.5Å; K695-L697 PolarHBondContact O-N 3Å; L697-I699 PolarHBondContact O-N 2.92Å
698	R	65.5	Low	60.9	Low	119 Å²	119	105 Å²	105	45%	0.449	53%	0.527	S	S	.	.			trans	-78	113.5	176.1	-66.8	-176.9	-154.4	171.6	20.3	110.4	D111 E700	D111-R698 HydrophobicContact CB-CG 4.22Å; D111-R698 PolarHBondContact O-NH2 3.24Å; D111-R698 IonicContact OD2-CZ 2.75Å; D111-R698 IonicContact OD2-NE 2.73Å; D111-R698 PolarHBondContact OD2-NE 2.89Å; D111-R698 IonicContact OD2-NH2 3.73Å; D111-R698 PolarHBondContact OD2-NH2 2.88Å; R698-E700 PolarHBondContact O-N 3.03Å; R698-E700 VanDerWaalsContact O-N 3.09Å
699	I	56.9	Low	58.4	Low	128 Å²	128	107 Å²	107	66%	0.656	55%	0.553	S	S	*	*			trans	-62.8	109.5	159.2	-56.2	172.9	0	0	0	106.8	P183 L697 K701	P183-I699 HydrophobicContact CG-CD1 4.42Å; P183-I699 HydrophobicContact CG-CG1 4.46Å; L697-I699 PolarHBondContact O-N 2.92Å; I699-K701 PolarHBondContact O-N 2.9Å
700	E	41.1	Very low	55.9	Low	158 Å²	158	110.3 Å²	110.3	74%	0.738	57%	0.569	S	S	*	*			trans	-55.6	140.2	169.7	-71.3	-166.4	151.8	0	0	109.6	R698 V702	R698-E700 PolarHBondContact O-N 3.03Å; R698-E700 VanDerWaalsContact O-N 3.09Å; E700-V702 PolarHBondContact O-N 3.1Å
701	K	38.5	Very low	53.2	Low	191 Å²	191	119.9 Å²	119.9	83%	0.83	61%	0.609	S	S	*	*			trans	-70.9	82.7	165.3	-73	177.4	-179.7	171.3	0	107.9	I699 F703	I699-K701 PolarHBondContact O-N 2.9Å; K701-F703 WeakPolarHBondContact O-CD2 3.47Å; K701-F703 PolarHBondContact O-N 3.07Å
702	V	29.2	Very low	50.3	Low	107 Å²	107	121.5 Å²	121.5	65%	0.648	62%	0.619	S	S	*	*			trans	-58.2	100.5	173.3	179.7	0	0	0	0	107.8	E700 T704	E700-V702 PolarHBondContact O-N 3.1Å; V702-T704 VanDerWaalsContact C-N 3.34Å; V702-T704 HydrophobicContact CG1-CG2 4.25Å; V702-T704 PolarHBondContact O-N 2.84Å
703	F	30	Very low	47.3	Very low	173 Å²	173	126.8 Å²	126.8	76%	0.759	66%	0.655	S	S	*	*			trans	-67.2	96.8	170.8	-84.9	-90.4	0	0	0	107.6	K701 N705	K701-F703 WeakPolarHBondContact O-CD2 3.47Å; K701-F703 PolarHBondContact O-N 3.07Å; F703-N705 PolarHBondContact O-N 2.87Å
704	T	29.3	Very low	44.4	Very low	120 Å²	120	126.9 Å²	126.9	74%	0.736	68%	0.675	S	S	*	*			trans	-69.7	66.2	175.2	38.9	0	0	0	0	111.3	V702 Q706	V702-T704 VanDerWaalsContact C-N 3.34Å; V702-T704 HydrophobicContact CG1-CG2 4.25Å; V702-T704 PolarHBondContact O-N 2.84Å; T704-Q706 PolarHBondContact O-N 2.98Å
705	N	28.8	Very low	41.6	Very low	132 Å²	132	131.7 Å²	131.7	71%	0.706	71%	0.707	S	S	*	*			trans	-64	122.3	160	-76	-48	0	0	0	107.8	F703	F703-N705 PolarHBondContact O-N 2.87Å
706	Q	34	Very low	39	Very low	175 Å²	175	136.9 Å²	136.9	82%	0.818	73%	0.733	S	S	*	*			trans	75	127.4	-162.9	-45.8	163.4	65.6	0	0	110.7	T704	T704-Q706 PolarHBondContact O-N 2.98Å
707	I	34.8	Very low	36.8	Very low	163 Å²	163	142.9 Å²	142.9	84%	0.836	75%	0.75	S	S	*	*			cis	-126.3	138.6	19.9	-65.3	167.4	0	0	0	111.4
708	S	32.8	Very low	34.8	Very low	121 Å²	121	147.2 Å²	147.2	85%	0.846	77%	0.768	S	S	*	*			trans	-80.2	116.8	171.9	57.5	0	0	0	0	111.9
709	G	32.2	Very low	33.3	Very low	69 Å²	69	144.7 Å²	144.7	71%	0.711	77%	0.769	S	S	*	*			trans	-165.1	67.6	-175.5	0	0	0	0	0	116.2	K711	G709-K711 PolarHBondContact O-N 2.86Å
710	Q	33.4	Very low	32.5	Very low	198 Å²	198	141 Å²	141	93%	0.925	75%	0.754	S	S	*	*			trans	9.2	95.7	163.3	-66.7	177.9	-33	0	0	118.7
711	K	33.4	Very low	32.3	Very low	211 Å²	211	139.3 Å²	139.3	92%	0.917	74%	0.742	S	S	*	*			trans	-128.2	156.8	135.7	-78.2	-161.1	174.9	-173.1	0	109.1	G709	G709-K711 PolarHBondContact O-N 2.86Å
712	Q	30	Very low	32.4	Very low	191 Å²	191	136.6 Å²	136.6	89%	0.893	73%	0.732	S	S	*	*			trans	-85.1	157.4	-156.4	-69	177.6	-7.8	0	0	114
713	P	27.1	Very low	33.1	Very low	135 Å²	135	135 Å²	135	88%	0.877	72%	0.72	S	S	*	*			trans	-96.4	129.3	-167.1	35.6	-33.3	0	0	0	115.1
714	G	28.1	Very low	33.6	Very low	73 Å²	73	130.6 Å²	130.6	75%	0.753	70%	0.704	S	S	*	*			trans	-171.3	143.5	163.2	0	0	0	0	0	108
715	V	29.1	Very low	34	Very low	142 Å²	142	131.8 Å²	131.8	86%	0.861	70%	0.696	S	S	*	*			cis	-111	141.9	10	175.2	0	0	0	0	110.8
716	Q	31	Very low	34.7	Very low	178 Å²	178	132.2 Å²	132.2	83%	0.832	69%	0.687	S	S	*	*			trans	-71.6	127.3	174.1	-65.4	177.5	-2.2	0	0	110.6	K718	Q716-K718 PolarHBondContact O-N 3.34Å; Q716-K718 VanDerWaalsContact O-N 3.14Å
717	K	32.8	Very low	35.4	Very low	207 Å²	207	129.4 Å²	129.4	90%	0.9	68%	0.677	S	S	*	*			trans	-63.9	114.8	164.4	-78.8	-172.6	174.1	-177.1	0	108.2	S719	K717-S719 PolarHBondContact O-N 3.06Å
718	K	32.9	Very low	35.5	Very low	100 Å²	100	126.9 Å²	126.9	44%	0.435	66%	0.662	S	S	.	*			trans	-61.8	99.3	-179.6	-66.8	-171.8	176.5	-170.3	0	110.6	Q716 V792 P793 G794 S795	Q716-K718 PolarHBondContact O-N 3.34Å; Q716-K718 VanDerWaalsContact O-N 3.14Å; K718-V792 PolarHBondContact NZ-O 2.68Å; K718-P793 WeakPolarHBondContact CE-O 3.46Å; K718-P793 PolarHBondContact NZ-O 3.38Å; K718-G794 WeakPolarHBondContact CE-O 3.17Å; K718-G794 PolarHBondContact NZ-O 3.31Å; K718-S795 PolarHBondContact NZ-OG 2.86Å
719	S	33.2	Very low	35.8	Very low	66 Å²	66	123.3 Å²	123.3	46%	0.462	64%	0.639	S	S	.	*			trans	-57.6	148	158.1	47.2	0	0	0	0	109.5	K717 Y721 I724	K717-S719 PolarHBondContact O-N 3.06Å; S719-Y721 PolarHBondContact O-N 2.98Å; S719-I724 WeakPolarHBondContact OG-CD1 3.42Å
720	S	40.5	Very low	36.4	Very low	51 Å²	51	125.8 Å²	125.8	36%	0.357	63%	0.633	S	S	.	*			trans	-59.7	142.6	176	-172.2	0	0	0	0	110	E722 D723 I724	S720-E722 PolarHBondContact O-N 3.39Å; S720-E722 PolarHBondContact OG-N 3.46Å; S720-D723 WeakPolarHBondContact CB-OD2 3.34Å; S720-D723 PolarHBondContact N-OD2 3.11Å; S720-D723 WeakPolarHBondContact O-CB 3.26Å; S720-D723 PolarHBondContact O-N 3.47Å; S720-I724 PolarHBondContact O-N 2.97Å; S720-I724 VanDerWaalsContact O-N 3.07Å
721	Y	36.6	Very low	36.9	Very low	122 Å²	122	120.4 Å²	120.4	48%	0.478	62%	0.617	S	S	.	*	H	α-helix	trans	-61.6	-29.9	169.8	-86.6	-107.2	0	0	0	110.8	S719 D723 I724 Y725 V792	S719-Y721 PolarHBondContact O-N 2.98Å; Y721-D723 VanDerWaalsContact C-N 3.31Å; Y721-D723 PolarHBondContact O-N 2.88Å; Y721-I724 PolarHBondContact O-N 2.91Å; Y721-Y725 HydrophobicContact CD1-CE2 4.11Å; Y721-Y725 WeakPolarHBondContact O-CB 3.49Å; Y721-Y725 WeakPolarHBondContact O-CD2 3.47Å; Y721-Y725 PolarHBondContact O-N 2.85Å; Y721-V792 HydrophobicContact CD2-CG2 4.25Å; Y721-V792 HydrophobicContact CE2-CB 4.45Å; Y721-V792 HydrophobicContact CE2-CG1 4.1Å; Y721-V792 HydrophobicContact CE2-CG2 3.61Å
722	E	40.2	Very low	37.1	Very low	134 Å²	134	113.7 Å²	113.7	63%	0.626	59%	0.593	S	S	*	*	H	α-helix	trans	-62.4	-36	170.4	-72.8	-168.5	107.3	0	0	112.6	S720 R726	S720-E722 PolarHBondContact O-N 3.39Å; S720-E722 PolarHBondContact OG-N 3.46Å; E722-R726 WeakPolarHBondContact O-CB 3.38Å; E722-R726 PolarHBondContact O-N 3.49Å
723	D	45.4	Very low	37.2	Very low	75 Å²	75	112.6 Å²	112.6	40%	0.401	59%	0.586	S	S	.	*	H	α-helix	trans	-73.7	-40.2	179.3	-60.5	-39.3	0	0	0	111.1	S720 Y721 R726 L727	S720-D723 WeakPolarHBondContact CB-OD2 3.34Å; S720-D723 PolarHBondContact N-OD2 3.11Å; S720-D723 WeakPolarHBondContact O-CB 3.26Å; S720-D723 PolarHBondContact O-N 3.47Å; Y721-D723 VanDerWaalsContact C-N 3.31Å; Y721-D723 PolarHBondContact O-N 2.88Å; D723-R726 PolarHBondContact O-N 3.34Å; D723-L727 WeakPolarHBondContact O-CB 3.14Å; D723-L727 WeakPolarHBondContact O-CG 3.4Å; D723-L727 PolarHBondContact O-N 3.5Å
724	I	40.1	Very low	37.5	Very low	80 Å²	80	109.7 Å²	109.7	41%	0.41	56%	0.562	S	S	.	*	H	α-helix	trans	-61.8	-48.2	173	-64	172.8	0	0	0	110.1	S719 S720 Y721 R726 H728	S719-I724 WeakPolarHBondContact OG-CD1 3.42Å; S720-I724 PolarHBondContact O-N 2.97Å; S720-I724 VanDerWaalsContact O-N 3.07Å; Y721-I724 PolarHBondContact O-N 2.91Å; I724-R726 VanDerWaalsContact C-N 3.35Å; I724-R726 PolarHBondContact O-N 2.97Å; I724-H728 VanDerWaalsContact O-CB 3.28Å; I724-H728 WeakPolarHBondContact O-CB 2.96Å; I724-H728 PolarHBondContact O-N 2.91Å
725	Y	37.9	Very low	37.9	Very low	145 Å²	145	113 Å²	113	57%	0.569	56%	0.563	S	S	*	*	H	α-helix	trans	-67.4	-33.1	179	-75.8	-57.1	0	0	0	112.8	Y721 A729	Y721-Y725 HydrophobicContact CD1-CE2 4.11Å; Y721-Y725 WeakPolarHBondContact O-CB 3.49Å; Y721-Y725 WeakPolarHBondContact O-CD2 3.47Å; Y721-Y725 PolarHBondContact O-N 2.85Å; Y725-A729 WeakPolarHBondContact O-CB 3.39Å; Y725-A729 PolarHBondContact O-N 2.75Å
726	R	44.3	Very low	38.2	Very low	140 Å²	140	118 Å²	118	53%	0.528	57%	0.566	S	S	.	*	H	α-helix	trans	-68.1	-51.7	173.8	-177.7	175.3	-63.5	152.2	7.5	111.7	E722 D723 I724 H728 A729 E730	E722-R726 WeakPolarHBondContact O-CB 3.38Å; E722-R726 PolarHBondContact O-N 3.49Å; D723-R726 PolarHBondContact O-N 3.34Å; I724-R726 VanDerWaalsContact C-N 3.35Å; I724-R726 PolarHBondContact O-N 2.97Å; R726-H728 PolarHBondContact O-N 2.86Å; R726-A729 PolarHBondContact O-N 2.9Å; R726-A729 VanDerWaalsContact O-N 3.14Å; R726-E730 WeakPolarHBondContact CD-OE1 3.34Å; R726-E730 HydrophobicContact CG-CG 4.4Å; R726-E730 WeakPolarHBondContact CG-OE1 3.42Å; R726-E730 WeakPolarHBondContact O-CB 3.45Å; R726-E730 WeakPolarHBondContact O-CG 3.42Å; R726-E730 PolarHBondContact O-N 3.36Å
727	L	46.6	Very low	38.1	Very low	116 Å²	116	115 Å²	115	61%	0.607	56%	0.555	S	S	*	*	H	α-helix	trans	-59.5	-34.1	175.5	-75.3	166.4	0	0	0	111.8	D723 S731	D723-L727 WeakPolarHBondContact O-CB 3.14Å; D723-L727 WeakPolarHBondContact O-CG 3.4Å; D723-L727 PolarHBondContact O-N 3.5Å; L727-S731 VanDerWaalsContact O-CB 3.28Å; L727-S731 WeakPolarHBondContact O-CB 3.49Å; L727-S731 PolarHBondContact O-N 3.07Å; L727-S731 PolarHBondContact O-OG 2.89Å
728	H	37.7	Very low	37.8	Very low	111 Å²	111	113.6 Å²	113.6	51%	0.514	55%	0.551	S	S	.	*	H	α-helix	trans	-69.6	-46.8	174.2	-163.6	45.8	0	0	0	111.9	I724 R726 E730 S731 V732	I724-H728 VanDerWaalsContact O-CB 3.28Å; I724-H728 WeakPolarHBondContact O-CB 2.96Å; I724-H728 PolarHBondContact O-N 2.91Å; R726-H728 PolarHBondContact O-N 2.86Å; H728-E730 VanDerWaalsContact C-N 3.33Å; H728-E730 PolarHBondContact O-N 3.1Å; H728-S731 WeakPolarHBondContact CA-OG 3.31Å; H728-S731 PolarHBondContact O-N 2.92Å; H728-S731 PolarHBondContact O-OG 3.41Å; H728-V732 VanDerWaalsContact O-CG2 3.28Å; H728-V732 WeakPolarHBondContact O-CG2 3.38Å; H728-V732 PolarHBondContact O-N 3.44Å
729	A	38.9	Very low	37.4	Very low	45 Å²	45	114.2 Å²	114.2	37%	0.372	56%	0.558	S	S	.	*	H	α-helix	trans	-59.6	-42.1	176.6	0	0	0	0	0	112.6	Y725 R726 V732 K733	Y725-A729 WeakPolarHBondContact O-CB 3.39Å; Y725-A729 PolarHBondContact O-N 2.75Å; R726-A729 PolarHBondContact O-N 2.9Å; R726-A729 VanDerWaalsContact O-N 3.14Å; A729-V732 PolarHBondContact O-N 3.02Å; A729-K733 PolarHBondContact O-N 3.41Å
730	E	45.3	Very low	37	Very low	122 Å²	122	120.5 Å²	120.5	57%	0.57	57%	0.572	S	S	*	*	H	α-helix	trans	-66.2	-41	175.9	-71.2	169.1	-173.8	0	0	111.9	R726 H728 V732	R726-E730 WeakPolarHBondContact CD-OE1 3.34Å; R726-E730 HydrophobicContact CG-CG 4.4Å; R726-E730 WeakPolarHBondContact CG-OE1 3.42Å; R726-E730 WeakPolarHBondContact O-CB 3.45Å; R726-E730 WeakPolarHBondContact O-CG 3.42Å; R726-E730 PolarHBondContact O-N 3.36Å; H728-E730 VanDerWaalsContact C-N 3.33Å; H728-E730 PolarHBondContact O-N 3.1Å; E730-V732 PolarHBondContact O-N 3.06Å
731	S	44.6	Very low	36.4	Very low	84 Å²	84	124.7 Å²	124.7	59%	0.587	59%	0.59	S	S	*	*	H	α-helix	trans	-70.4	-27.1	177.7	62.5	0	0	0	0	114.4	L727 H728	L727-S731 VanDerWaalsContact O-CB 3.28Å; L727-S731 WeakPolarHBondContact O-CB 3.49Å; L727-S731 PolarHBondContact O-N 3.07Å; L727-S731 PolarHBondContact O-OG 2.89Å; H728-S731 WeakPolarHBondContact CA-OG 3.31Å; H728-S731 PolarHBondContact O-N 2.92Å; H728-S731 PolarHBondContact O-OG 3.41Å
732	V	37.4	Very low	35.9	Very low	70 Å²	70	124.3 Å²	124.3	42%	0.424	59%	0.592	S	S	.	*	H	α-helix	trans	-93.7	-2.1	-178	-173.8	0	0	0	0	112.7	H728 A729 E730 L734	H728-V732 VanDerWaalsContact O-CG2 3.28Å; H728-V732 WeakPolarHBondContact O-CG2 3.38Å; H728-V732 PolarHBondContact O-N 3.44Å; A729-V732 PolarHBondContact O-N 3.02Å; E730-V732 PolarHBondContact O-N 3.06Å; V732-L734 HydrophobicContact CB-CD1 4.04Å; V732-L734 HydrophobicContact CB-CG 4.06Å; V732-L734 HydrophobicContact CG1-CD1 3.89Å; V732-L734 HydrophobicContact CG1-CD2 4.18Å; V732-L734 HydrophobicContact CG1-CG 3.8Å; V732-L734 PolarHBondContact O-N 3.13Å
733	K	32.2	Very low	35.5	Very low	169 Å²	169	123.3 Å²	123.3	74%	0.735	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	54.4	45.1	178.7	-58.9	-175.3	175.5	-176	0	113.6	A729 D735	A729-K733 PolarHBondContact O-N 3.41Å; K733-D735 PolarHBondContact O-N 3.26Å
734	L	32.8	Very low	34.7	Very low	74 Å²	74	128.1 Å²	128.1	39%	0.387	62%	0.622	S	S	.	*			trans	-80.2	33	-175.7	-71.7	168.2	0	0	0	113.9	V732 R736 L737	V732-L734 HydrophobicContact CB-CD1 4.04Å; V732-L734 HydrophobicContact CB-CG 4.06Å; V732-L734 HydrophobicContact CG1-CD1 3.89Å; V732-L734 HydrophobicContact CG1-CD2 4.18Å; V732-L734 HydrophobicContact CG1-CG 3.8Å; V732-L734 PolarHBondContact O-N 3.13Å; L734-R736 PolarHBondContact O-N 2.96Å; L734-L737 HydrophobicContact CD2-CD1 3.86Å; L734-L737 PolarHBondContact O-N 3.25Å
735	D	36.4	Very low	34.1	Very low	143 Å²	143	127.1 Å²	127.1	77%	0.765	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.7	-0.1	-171.8	-46.1	-20.5	0	0	0	114.9	K733	K733-D735 PolarHBondContact O-N 3.26Å
736	R	35.6	Very low	33.7	Very low	246 Å²	246	129.6 Å²	129.6	93%	0.928	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.1	1	-174.3	-65.6	-172.4	174.5	-167	-2.7	115	L734	L734-R736 PolarHBondContact O-N 2.96Å
737	L	27.9	Very low	33	Very low	114 Å²	114	125.7 Å²	125.7	60%	0.597	65%	0.651	S	S	*	*			trans	-109	110	-177.3	-92.5	163.9	0	0	0	112.1	L734 I739	L734-L737 HydrophobicContact CD2-CD1 3.86Å; L734-L737 PolarHBondContact O-N 3.25Å; L737-I739 HydrophobicContact CB-CD1 4.44Å; L737-I739 HydrophobicContact CB-CG1 4.18Å; L737-I739 PolarHBondContact O-N 3.26Å
738	H	26.6	Very low	32.2	Very low	179 Å²	179	130.4 Å²	130.4	83%	0.829	66%	0.661	S	S	*	*			trans	-74.4	56.4	177.7	-87.5	-30.9	0	0	0	113.3	R740	H738-R740 PolarHBondContact O-N 2.94Å
739	I	26.3	Very low	31.7	Very low	113 Å²	113	130.8 Å²	130.8	58%	0.579	67%	0.665	S	S	*	*			trans	-73.2	99.8	175.3	-51.4	179	0	0	0	108.8	L737 L741	L737-I739 HydrophobicContact CB-CD1 4.44Å; L737-I739 HydrophobicContact CB-CG1 4.18Å; L737-I739 PolarHBondContact O-N 3.26Å; I739-L741 VanDerWaalsContact C-N 3.28Å; I739-L741 HydrophobicContact CG2-CD2 4.18Å; I739-L741 HydrophobicContact CG2-CG 4.02Å; I739-L741 PolarHBondContact O-N 2.84Å
740	R	24.8	Very low	31.3	Very low	198 Å²	198	136.3 Å²	136.3	75%	0.747	68%	0.683	S	S	*	*			trans	-75.3	80.7	169.9	-63.4	-168.2	-163	-172.5	8.6	109.8	H738 H742	H738-R740 PolarHBondContact O-N 2.94Å; R740-H742 PolarHBondContact O-N 3.04Å
741	L	27.2	Very low	30.5	Very low	139 Å²	139	137.6 Å²	137.6	73%	0.728	69%	0.689	S	S	*	*			trans	-65.3	100.1	162.6	-70.4	178.8	0	0	0	108.3	I739 P743	I739-L741 VanDerWaalsContact C-N 3.28Å; I739-L741 HydrophobicContact CG2-CD2 4.18Å; I739-L741 HydrophobicContact CG2-CG 4.02Å; I739-L741 PolarHBondContact O-N 2.84Å; L741-P743 WeakPolarHBondContact O-CD 3.39Å
742	H	26	Very low	29.6	Very low	114 Å²	114	142.2 Å²	142.2	53%	0.528	71%	0.705	S	S	.	*			trans	-81.8	122.1	177.3	-131.7	-73.1	0	0	0	108.2	R740 L744	R740-H742 PolarHBondContact O-N 3.04Å; H742-L744 PolarHBondContact O-N 3.04Å
743	P	31.9	Very low	29.1	Very low	113 Å²	113	143.2 Å²	143.2	73%	0.734	72%	0.716	S	S	*	*			trans	-58.7	135	149.9	28.3	-32	0	0	0	106.8	L741 A745	L741-P743 WeakPolarHBondContact O-CD 3.39Å; P743-A745 PolarHBondContact O-N 3.22Å
744	L	28.2	Very low	28.9	Very low	175 Å²	175	144 Å²	144	92%	0.916	72%	0.719	S	S	*	*			trans	-60.2	104.7	-174.8	-78.3	162.2	0	0	0	110	H742	H742-L744 PolarHBondContact O-N 3.04Å
745	A	27.7	Very low	28.8	Very low	60 Å²	60	145.6 Å²	145.6	50%	0.496	74%	0.736	S	S	.	*			trans	-77.4	135.9	168.8	0	0	0	0	0	108.2	P743 G747	P743-A745 PolarHBondContact O-N 3.22Å; A745-G747 PolarHBondContact O-N 3.31Å
746	L	28.4	Very low	28.4	Very low	196 Å²	196	145.4 Å²	145.4	100%	1.026	74%	0.735	S	S	*	*	S	Bend	trans	-73.2	36.4	-174.4	-137.2	89.4	0	0	0	113.8
747	G	30.5	Very low	28.2	Very low	58 Å²	58	141.2 Å²	141.2	60%	0.598	73%	0.731	S	S	*	*			trans	-143.3	33.7	-171.6	0	0	0	0	0	113	A745	A745-G747 PolarHBondContact O-N 3.31Å
748	R	29.4	Very low	28.4	Very low	216 Å²	216	141.7 Å²	141.7	82%	0.815	74%	0.738	S	S	*	*			trans	-132.6	53.9	172.5	-83.7	-167.7	165.5	-155.5	-7.7	112.3
749	I	27.8	Very low	28.5	Very low	118 Å²	118	139.6 Å²	139.6	61%	0.605	73%	0.734	S	S	*	*			trans	-110.2	91	153.6	-58.7	178.7	0	0	0	105.7	Y772	I749-Y772 HydrophobicContact CD1-CE2 4.19Å
750	Q	29.7	Very low	28.6	Very low	161 Å²	161	141.3 Å²	141.3	75%	0.752	74%	0.744	S	S	*	*			trans	-148.4	134.6	176.9	-88.2	-171	-28.7	0	0	109.5
751	H	28.9	Very low	28.8	Very low	150 Å²	150	141.5 Å²	141.5	69%	0.694	75%	0.751	S	S	*	*			trans	53.3	85	169.6	-64.8	-68.8	0	0	0	117.8
752	I	26.3	Very low	28.8	Very low	180 Å²	180	142.8 Å²	142.8	92%	0.923	76%	0.758	S	S	*	*			trans	-109.5	82	143.8	-59.7	174.8	0	0	0	106.7
753	S	25.9	Very low	29.2	Very low	92 Å²	92	141.8 Å²	141.8	64%	0.643	76%	0.764	S	S	*	*			trans	-172.3	47.1	175.5	49.8	0	0	0	0	113.1
754	K	28.8	Very low	29.3	Very low	185 Å²	185	143 Å²	143	80%	0.804	76%	0.764	S	S	*	*			trans	-143.8	68.3	168	-76.3	-152.1	173.3	-162.4	0	112.9
755	S	30.5	Very low	29.6	Very low	108 Å²	108	142.4 Å²	142.4	76%	0.755	76%	0.756	S	S	*	*			trans	-126.1	102.6	133	50.3	0	0	0	0	103.1
756	D	28.5	Very low	29.9	Very low	138 Å²	138	143.6 Å²	143.6	74%	0.738	76%	0.759	S	S	*	*				64.1	120	80.7	-64.6	-17.4	0	0	0	110.7
757	D	30.9	Very low	30.2	Very low	159 Å²	159	135.9 Å²	135.9	85%	0.85	72%	0.72	S	S	*	*			trans	73.7	117.4	173.2	-63.3	-23.8	0	0	0	121.3
758	V	31.9	Very low	30.3	Very low	123 Å²	123	137.1 Å²	137.1	75%	0.745	72%	0.716	S	S	*	*			trans	78.3	105.9	145.7	-177.4	0	0	0	0	120.4
759	D	29.1	Very low	30.8	Very low	136 Å²	136	128.6 Å²	128.6	73%	0.727	69%	0.688	S	S	*	*			trans	37.9	129.2	134.9	-52.2	-24.7	0	0	0	122.9
760	N	27.5	Very low	31.5	Very low	148 Å²	148	124.4 Å²	124.4	79%	0.791	67%	0.667	S	S	*	*			trans	60	115.1	162	-62.5	-50.6	0	0	0	117.6
761	F	30.5	Very low	32.1	Very low	203 Å²	203	121 Å²	121	89%	0.89	65%	0.653	S	S	*	*				-174.1	146.5	116.6	-101	-67.9	0	0	0	110.7
762	N	26.3	Very low	32.7	Very low	166 Å²	166	119.2 Å²	119.2	89%	0.888	64%	0.641	S	S	*	*			trans	-88.1	122.5	171.6	-68.1	-17.5	0	0	0	109.8
763	S	34.6	Very low	33.7	Very low	92 Å²	92	113.5 Å²	113.5	64%	0.643	61%	0.612	S	S	*	*			trans	-165.3	139.5	162.9	57	0	0	0	0	110.4
764	D	33.4	Very low	34.6	Very low	140 Å²	140	110 Å²	110	75%	0.749	59%	0.586	S	S	*	*			trans	-64.3	144.1	-173.4	-53.3	-89.6	0	0	0	113.6
765	H	34.7	Very low	35.6	Very low	161 Å²	161	105 Å²	105	75%	0.745	57%	0.571	S	S	*	*			trans	-124.7	124	170.3	-81	-4.4	0	0	0	109.3	T767	H765-T767 PolarHBondContact O-N 2.84Å
766	P	34.8	Very low	36.8	Very low	85 Å²	85	101.8 Å²	101.8	55%	0.552	55%	0.548	S	S	*	.			trans	-64.9	135.5	-173.2	26	-34.4	0	0	0	111.2	D770 I771	P766-D770 WeakPolarHBondContact CA-OD2 3.47Å; P766-D770 HydrophobicContact CB-CB 3.55Å; P766-I771 HydrophobicContact CB-CG1 4.31Å; P766-I771 HydrophobicContact CG-CG1 4.43Å
767	T	34.7	Very low	38	Very low	34 Å²	34	100.2 Å²	100.2	21%	0.209	54%	0.537	C	S	.	.			trans	-74.7	174.3	179.2	76.5	0	0	0	0	110.6	H765 T769 D770 I771 E1230 F1231	H765-T767 PolarHBondContact O-N 2.84Å; T767-T769 PolarHBondContact O-N 3.36Å; T767-T769 WeakPolarHBondContact OG1-CA 3.42Å; T767-T769 VanDerWaalsContact OG1-CB 3.24Å; T767-T769 WeakPolarHBondContact OG1-CB 3.49Å; T767-T769 PolarHBondContact OG1-N 2.97Å; T767-T769 PolarHBondContact OG1-OG1 3.02Å; T767-D770 PolarHBondContact N-OD2 3.04Å; T767-D770 PolarHBondContact O-N 2.78Å; T767-D770 VanDerWaalsContact O-N 3.14Å; T767-D770 PolarHBondContact OG1-N 3.04Å; T767-D770 PolarHBondContact OG1-OD2 3Å; T767-I771 WeakPolarHBondContact O-CB 3.38Å; T767-I771 WeakPolarHBondContact O-CD1 3.31Å; T767-I771 VanDerWaalsContact O-CG1 3.24Å; T767-I771 WeakPolarHBondContact O-CG1 3.36Å; T767-I771 PolarHBondContact O-N 3Å; T767-E1230 WeakPolarHBondContact CB-OE2 3.33Å; T767-E1230 WeakPolarHBondContact CG2-OE2 3.48Å; T767-E1230 PolarHBondContact OG1-OE2 3.46Å; T767-F1231 HydrophobicContact CG2-CD2 3.66Å; T767-F1231 HydrophobicContact CG2-CE2 3.95Å
768	V	31.4	Very low	39.3	Very low	85 Å²	85	100.2 Å²	100.2	52%	0.515	53%	0.531	S	S	.	.	H	α-helix	trans	-60.8	-24.9	168.5	-179.9	0	0	0	0	111.2	Y772	V768-Y772 HydrophobicContact CG1-CD2 3.77Å; V768-Y772 HydrophobicContact CG1-CE2 4.09Å; V768-Y772 WeakPolarHBondContact O-CD2 3.24Å; V768-Y772 PolarHBondContact O-N 2.87Å
769	T	40.8	Very low	40.1	Very low	36 Å²	36	100.4 Å²	100.4	22%	0.221	52%	0.519	C	S	.	.	H	α-helix	trans	-68.7	-49.8	170.5	-42.6	0	0	0	0	110.8	T767 I771 Y772 N773 E1230	T767-T769 PolarHBondContact O-N 3.36Å; T767-T769 WeakPolarHBondContact OG1-CA 3.42Å; T767-T769 VanDerWaalsContact OG1-CB 3.24Å; T767-T769 WeakPolarHBondContact OG1-CB 3.49Å; T767-T769 PolarHBondContact OG1-N 2.97Å; T767-T769 PolarHBondContact OG1-OG1 3.02Å; T769-I771 VanDerWaalsContact C-N 3.32Å; T769-I771 PolarHBondContact O-N 3.37Å; T769-Y772 CarbonylContact O-C 3.56Å; T769-Y772 PolarHBondContact O-N 3.13Å; T769-N773 PolarHBondContact O-N 3.44Å; T769-E1230 VanDerWaalsContact CB-OE2 3.25Å; T769-E1230 WeakPolarHBondContact CB-OE2 3.44Å; T769-E1230 PolarHBondContact OG1-OE1 3.39Å; T769-E1230 VanDerWaalsContact OG1-OE1 3.14Å; T769-E1230 PolarHBondContact OG1-OE2 3.45Å; T769-E1230 VanDerWaalsContact OG1-OE2 3.11Å
770	D	43.6	Very low	41.2	Very low	31 Å²	31	95.3 Å²	95.3	17%	0.166	49%	0.492	C	S	.	.	H	α-helix	trans	-65.7	-33.4	-177.6	-58.1	-38.6	0	0	0	113.2	P766 T767 R779 L1228	P766-D770 WeakPolarHBondContact CA-OD2 3.47Å; P766-D770 HydrophobicContact CB-CB 3.55Å; T767-D770 PolarHBondContact N-OD2 3.04Å; T767-D770 PolarHBondContact O-N 2.78Å; T767-D770 VanDerWaalsContact O-N 3.14Å; T767-D770 PolarHBondContact OG1-N 3.04Å; T767-D770 PolarHBondContact OG1-OD2 3Å; D770-R779 PolarHBondContact O-NH1 3.26Å; D770-L1228 WeakPolarHBondContact OD1-CD2 3.48Å
771	I	41.6	Very low	42.6	Very low	89 Å²	89	90.6 Å²	90.6	46%	0.456	47%	0.473	S	S	.	.	H	α-helix	trans	-69.1	-37.9	175.4	-68.2	165.5	0	0	0	110.9	P766 T767 T769	P766-I771 HydrophobicContact CB-CG1 4.31Å; P766-I771 HydrophobicContact CG-CG1 4.43Å; T767-I771 WeakPolarHBondContact O-CB 3.38Å; T767-I771 WeakPolarHBondContact O-CD1 3.31Å; T767-I771 VanDerWaalsContact O-CG1 3.24Å; T767-I771 WeakPolarHBondContact O-CG1 3.36Å; T767-I771 PolarHBondContact O-N 3Å; T769-I771 VanDerWaalsContact C-N 3.32Å; T769-I771 PolarHBondContact O-N 3.37Å
772	Y	42	Very low	44	Very low	113 Å²	113	84.9 Å²	84.9	44%	0.443	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.5	33.7	-174.1	-63.4	-64.3	0	0	0	114	I749 V768 T769 L774	I749-Y772 HydrophobicContact CD1-CE2 4.19Å; V768-Y772 HydrophobicContact CG1-CD2 3.77Å; V768-Y772 HydrophobicContact CG1-CE2 4.09Å; V768-Y772 WeakPolarHBondContact O-CD2 3.24Å; V768-Y772 PolarHBondContact O-N 2.87Å; T769-Y772 CarbonylContact O-C 3.56Å; T769-Y772 PolarHBondContact O-N 3.13Å; Y772-L774 WeakPolarHBondContact O-CG 3.48Å; Y772-L774 PolarHBondContact O-N 2.8Å
773	N	46.8	Very low	45.2	Very low	59 Å²	59	79.6 Å²	79.6	32%	0.316	42%	0.424	S	S	.	.			trans	-65.5	99.5	172.6	-179.2	-7.1	0	0	0	110.9	T769 T775	T769-N773 PolarHBondContact O-N 3.44Å; N773-T775 VanDerWaalsContact C-N 3.28Å; N773-T775 PolarHBondContact O-N 3.04Å; N773-T775 WeakPolarHBondContact OD1-CB 3.36Å; N773-T775 PolarHBondContact OD1-N 3.47Å; N773-T775 VanDerWaalsContact OD1-N 3.09Å; N773-T775 PolarHBondContact OD1-OG1 3.49Å
774	L	45.6	Very low	46	Very low	19 Å²	19	82.5 Å²	82.5	10%	0.099	42%	0.421	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	11.9	-177.3	-67.7	157.4	0	0	0	113.1	Y772 L780 F783 L810 E814	Y772-L774 WeakPolarHBondContact O-CG 3.48Å; Y772-L774 PolarHBondContact O-N 2.8Å; L774-L780 HydrophobicContact CD2-CD2 4.06Å; L774-L780 WeakPolarHBondContact O-CD1 3.33Å; L774-L780 WeakPolarHBondContact O-CG 3.45Å; L774-F783 HydrophobicContact CD2-CD1 4.11Å; L774-F783 HydrophobicContact CD2-CG 4.37Å; L774-L810 HydrophobicContact CD1-CB 4.06Å; L774-E814 HydrophobicContact CB-CG 3.99Å; L774-E814 WeakPolarHBondContact CB-OE1 3.49Å; L774-E814 PolarHBondContact N-OE1 3.48Å
775	T	48.4	Very low	47.1	Very low	81 Å²	81	81.8 Å²	81.8	50%	0.497	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-30.6	176.4	66.2	0	0	0	0	113.3	N773 E814 H818	N773-T775 VanDerWaalsContact C-N 3.28Å; N773-T775 PolarHBondContact O-N 3.04Å; N773-T775 WeakPolarHBondContact OD1-CB 3.36Å; N773-T775 PolarHBondContact OD1-N 3.47Å; N773-T775 VanDerWaalsContact OD1-N 3.09Å; N773-T775 PolarHBondContact OD1-OG1 3.49Å; T775-E814 HydrophobicContact CG2-CG 4.06Å; T775-H818 VanDerWaalsContact CG2-CD2 3.47Å; T775-H818 WeakPolarHBondContact CG2-CD2 3.31Å; T775-H818 WeakPolarHBondContact CG2-NE2 3.39Å
776	S	56.2	Low	48.1	Very low	39 Å²	39	77.9 Å²	77.9	27%	0.273	40%	0.4	S	S	.	.	S	Bend	trans	-74.1	129.9	179.2	67.2	0	0	0	0	112	E778 R779 L780	S776-E778 VanDerWaalsContact C-N 3.3Å; S776-E778 PolarHBondContact O-N 2.9Å; S776-R779 PolarHBondContact O-N 3.23Å; S776-R779 VanDerWaalsContact OG-CB 3.24Å; S776-R779 WeakPolarHBondContact OG-CB 3.22Å; S776-R779 VanDerWaalsContact OG-CG 3.29Å; S776-R779 WeakPolarHBondContact OG-CG 3.33Å; S776-R779 PolarHBondContact OG-N 3.16Å; S776-L780 WeakPolarHBondContact O-CB 3.17Å; S776-L780 PolarHBondContact O-N 3.41Å
777	Q	53.4	Low	48.6	Very low	105 Å²	105	77.1 Å²	77.1	49%	0.491	39%	0.39	S	S	.	.	H	α-helix	trans	-61.5	-38.2	-177.5	-169.1	157.2	-11.6	0	0	111.8	L780 A781 M1353	Q777-L780 PolarHBondContact O-N 2.9Å; Q777-A781 WeakPolarHBondContact O-CB 3.33Å; Q777-A781 PolarHBondContact O-N 3Å; Q777-M1353 PolarHBondContact NE2-O 3.13Å
778	E	57.5	Low	49.4	Very low	159 Å²	159	80 Å²	80	74%	0.743	40%	0.402	S	S	*	.	H	α-helix	trans	-63.5	-50.9	174.3	-63.3	-176.6	157.5	0	0	113	S776 L780 A781 V782	S776-E778 VanDerWaalsContact C-N 3.3Å; S776-E778 PolarHBondContact O-N 2.9Å; E778-L780 VanDerWaalsContact C-N 3.28Å; E778-L780 PolarHBondContact O-N 3.41Å; E778-A781 CarbonylContact O-C 3.57Å; E778-A781 WeakPolarHBondContact O-CA 3.3Å; E778-A781 WeakPolarHBondContact O-CB 3.26Å; E778-A781 PolarHBondContact O-N 2.75Å; E778-A781 VanDerWaalsContact O-N 3.09Å; E778-V782 WeakPolarHBondContact O-CG2 3.3Å; E778-V782 PolarHBondContact O-N 3.24Å
779	R	50	Low	50.1	Low	127 Å²	127	80.2 Å²	80.2	48%	0.479	41%	0.406	S	S	.	.	H	α-helix	trans	-70.5	-26.8	178.5	-59.4	-173	-172	-175.3	9.9	111.9	D770 S776 F783	D770-R779 PolarHBondContact O-NH1 3.26Å; S776-R779 PolarHBondContact O-N 3.23Å; S776-R779 VanDerWaalsContact OG-CB 3.24Å; S776-R779 WeakPolarHBondContact OG-CB 3.22Å; S776-R779 VanDerWaalsContact OG-CG 3.29Å; S776-R779 WeakPolarHBondContact OG-CG 3.33Å; S776-R779 PolarHBondContact OG-N 3.16Å; R779-F783 WeakPolarHBondContact O-CB 3.3Å; R779-F783 PolarHBondContact O-N 3.09Å
780	L	50.8	Low	50.3	Low	30 Å²	30	82.8 Å²	82.8	16%	0.157	43%	0.426	C	S	.	.	H	α-helix	trans	-63.9	-41.6	167.2	-98.3	173.7	0	0	0	111.7	L774 S776 Q777 E778 R784 M807	L774-L780 HydrophobicContact CD2-CD2 4.06Å; L774-L780 WeakPolarHBondContact O-CD1 3.33Å; L774-L780 WeakPolarHBondContact O-CG 3.45Å; S776-L780 WeakPolarHBondContact O-CB 3.17Å; S776-L780 PolarHBondContact O-N 3.41Å; Q777-L780 PolarHBondContact O-N 2.9Å; E778-L780 VanDerWaalsContact C-N 3.28Å; E778-L780 PolarHBondContact O-N 3.41Å; L780-R784 WeakPolarHBondContact O-CB 3.5Å; L780-R784 PolarHBondContact O-N 3.17Å; L780-M807 HydrophobicContact CD2-CE 3.51Å
781	A	57.6	Low	50	Low	49 Å²	49	86.2 Å²	86.2	41%	0.405	44%	0.444	S	S	.	.	H	α-helix	trans	-63.4	-50.7	173.6	0	0	0	0	0	111	Q777 E778 F783 R784 E785	Q777-A781 WeakPolarHBondContact O-CB 3.33Å; Q777-A781 PolarHBondContact O-N 3Å; E778-A781 CarbonylContact O-C 3.57Å; E778-A781 WeakPolarHBondContact O-CA 3.3Å; E778-A781 WeakPolarHBondContact O-CB 3.26Å; E778-A781 PolarHBondContact O-N 2.75Å; E778-A781 VanDerWaalsContact O-N 3.09Å; A781-F783 PolarHBondContact O-N 3.43Å; A781-R784 CarbonylContact O-C 3.6Å; A781-R784 WeakPolarHBondContact O-CB 3.44Å; A781-R784 PolarHBondContact O-N 3.41Å; A781-E785 WeakPolarHBondContact O-CB 3.44Å; A781-E785 WeakPolarHBondContact O-CG 3.22Å; A781-E785 PolarHBondContact O-N 2.87Å
782	V	60	Low	49.9	Very low	83 Å²	83	84.7 Å²	84.7	50%	0.503	44%	0.438	S	S	.	.	H	α-helix	trans	-62.6	-38.2	178.2	174.1	0	0	0	0	112.4	E778 T786	E778-V782 WeakPolarHBondContact O-CG2 3.3Å; E778-V782 PolarHBondContact O-N 3.24Å; V782-T786 WeakPolarHBondContact O-CB 3.43Å; V782-T786 PolarHBondContact O-N 3.41Å; V782-T786 PolarHBondContact O-OG1 2.96Å
783	F	51.2	Low	49.5	Very low	54 Å²	54	84.8 Å²	84.8	24%	0.237	45%	0.453	C	S	.	.	H	α-helix	trans	-70.9	-39.3	175.9	-173.8	-101.1	0	0	0	111.7	L774 R779 A781 T786 M787 M807 L810	L774-F783 HydrophobicContact CD2-CD1 4.11Å; L774-F783 HydrophobicContact CD2-CG 4.37Å; R779-F783 WeakPolarHBondContact O-CB 3.3Å; R779-F783 PolarHBondContact O-N 3.09Å; A781-F783 PolarHBondContact O-N 3.43Å; F783-T786 PolarHBondContact O-N 3.1Å; F783-M787 HydrophobicContact CD1-CG 4.21Å; F783-M787 HydrophobicContact CE1-CG 3.92Å; F783-M787 HydrophobicContact CZ-CG 4.1Å; F783-M787 HydrophobicContact CZ-SD 4.37Å; F783-M787 WeakPolarHBondContact O-CB 3.45Å; F783-M787 VanDerWaalsContact O-CG 3.23Å; F783-M787 WeakPolarHBondContact O-CG 3.45Å; F783-M787 PolarHBondContact O-N 3.15Å; F783-M807 HydrophobicContact CD1-CE 3.91Å; F783-M807 HydrophobicContact CD1-SD 3.75Å; F783-M807 HydrophobicContact CE1-CE 4.31Å; F783-M807 HydrophobicContact CE1-SD 3.68Å; F783-L810 HydrophobicContact CE1-CD1 4.16Å
784	R	52	Low	49.5	Very low	154 Å²	154	85 Å²	85	58%	0.581	47%	0.469	S	S	*	.	H	α-helix	trans	-61.6	-46.8	172.2	-179.7	-176.5	-172.9	177.2	1.7	110.9	L780 A781 M787 Q788	L780-R784 WeakPolarHBondContact O-CB 3.5Å; L780-R784 PolarHBondContact O-N 3.17Å; A781-R784 CarbonylContact O-C 3.6Å; A781-R784 WeakPolarHBondContact O-CB 3.44Å; A781-R784 PolarHBondContact O-N 3.41Å; R784-M787 CarbonylContact O-C 3.59Å; R784-M787 PolarHBondContact O-N 3.29Å; R784-Q788 VanDerWaalsContact O-CB 3.28Å; R784-Q788 WeakPolarHBondContact O-CB 3.49Å; R784-Q788 WeakPolarHBondContact O-CG 3.49Å; R784-Q788 PolarHBondContact O-N 3.44Å
785	E	56.5	Low	49.1	Very low	125 Å²	125	86.6 Å²	86.6	58%	0.584	48%	0.482	S	S	*	.	H	α-helix	trans	-61.5	-41.9	172.8	-77.7	-159.8	128.1	0	0	111.8	A781 M787 Q788 S789	A781-E785 WeakPolarHBondContact O-CB 3.44Å; A781-E785 WeakPolarHBondContact O-CG 3.22Å; A781-E785 PolarHBondContact O-N 2.87Å; E785-M787 VanDerWaalsContact C-N 3.31Å; E785-M787 PolarHBondContact O-N 3.3Å; E785-Q788 CarbonylContact O-C 3.57Å; E785-Q788 PolarHBondContact O-N 3.32Å; E785-S789 WeakPolarHBondContact O-CB 3.43Å; E785-S789 PolarHBondContact O-N 3.12Å; E785-S789 PolarHBondContact O-OG 2.99Å
786	T	54.7	Low	48.4	Very low	78 Å²	78	90.8 Å²	90.8	48%	0.479	50%	0.501	S	S	.	.	H	α-helix	trans	-63.3	-40.1	176.9	-58.5	0	0	0	0	110.9	V782 F783 Q788 S790	V782-T786 WeakPolarHBondContact O-CB 3.43Å; V782-T786 PolarHBondContact O-N 3.41Å; V782-T786 PolarHBondContact O-OG1 2.96Å; F783-T786 PolarHBondContact O-N 3.1Å; T786-Q788 VanDerWaalsContact C-N 3.26Å; T786-Q788 PolarHBondContact O-N 2.71Å; T786-S790 WeakPolarHBondContact O-CB 3.26Å; T786-S790 PolarHBondContact O-N 3.06Å; T786-S790 PolarHBondContact O-OG 3.39Å
787	M	46.3	Very low	47.8	Very low	70 Å²	70	94.9 Å²	94.9	35%	0.345	52%	0.524	S	S	.	.	H	α-helix	trans	-73.2	-12.2	173.7	-69.8	-79.1	-81.8	0	0	113.7	F783 R784 E785 L806	F783-M787 HydrophobicContact CD1-CG 4.21Å; F783-M787 HydrophobicContact CE1-CG 3.92Å; F783-M787 HydrophobicContact CZ-CG 4.1Å; F783-M787 HydrophobicContact CZ-SD 4.37Å; F783-M787 WeakPolarHBondContact O-CB 3.45Å; F783-M787 VanDerWaalsContact O-CG 3.23Å; F783-M787 WeakPolarHBondContact O-CG 3.45Å; F783-M787 PolarHBondContact O-N 3.15Å; R784-M787 CarbonylContact O-C 3.59Å; R784-M787 PolarHBondContact O-N 3.29Å; E785-M787 VanDerWaalsContact C-N 3.31Å; E785-M787 PolarHBondContact O-N 3.3Å; M787-L806 HydrophobicContact CE-CD2 3.83Å
788	Q	50.7	Low	47.1	Very low	95 Å²	95	92.8 Å²	92.8	44%	0.444	53%	0.531	S	S	.	.	H	α-helix	trans	-109	-22.6	178.7	-73.8	178.6	-34.2	0	0	113.9	R784 E785 T786 L791	R784-Q788 VanDerWaalsContact O-CB 3.28Å; R784-Q788 WeakPolarHBondContact O-CB 3.49Å; R784-Q788 WeakPolarHBondContact O-CG 3.49Å; R784-Q788 PolarHBondContact O-N 3.44Å; E785-Q788 CarbonylContact O-C 3.57Å; E785-Q788 PolarHBondContact O-N 3.32Å; T786-Q788 VanDerWaalsContact C-N 3.26Å; T786-Q788 PolarHBondContact O-N 2.71Å; Q788-L791 WeakPolarHBondContact O-CB 3.48Å
789	S	46.1	Very low	46.4	Very low	88 Å²	88	87.9 Å²	87.9	62%	0.615	51%	0.514	S	S	*	.	H	α-helix	trans	-97.4	-19.7	179.6	62.8	0	0	0	0	112.8	E785 L791	E785-S789 WeakPolarHBondContact O-CB 3.43Å; E785-S789 PolarHBondContact O-N 3.12Å; E785-S789 PolarHBondContact O-OG 2.99Å; S789-L791 PolarHBondContact O-N 3.09Å
790	S	44.9	Very low	46.4	Very low	90 Å²	90	84.5 Å²	84.5	63%	0.629	51%	0.51	S	S	*	.	S	Bend	trans	-66.7	-5.4	158.7	54	0	0	0	0	113	T786	T786-S790 WeakPolarHBondContact O-CB 3.26Å; T786-S790 PolarHBondContact O-N 3.06Å; T786-S790 PolarHBondContact O-OG 3.39Å
791	L	38.8	Very low	46	Very low	104 Å²	104	87 Å²	87	55%	0.545	53%	0.529	S	S	.	.	S	Bend	trans	-92.1	126.2	163.4	-65.4	165.1	0	0	0	110.1	Q788 S789	Q788-L791 WeakPolarHBondContact O-CB 3.48Å; S789-L791 PolarHBondContact O-N 3.09Å
792	V	38	Very low	45.3	Very low	56 Å²	56	88.7 Å²	88.7	34%	0.339	54%	0.539	S	S	.	.	P	Polyproline II helix	trans	-51.4	128.3	-174.7	-176.8	0	0	0	0	112	K718 Y721 S795	K718-V792 PolarHBondContact NZ-O 2.68Å; Y721-V792 HydrophobicContact CD2-CG2 4.25Å; Y721-V792 HydrophobicContact CE2-CB 4.45Å; Y721-V792 HydrophobicContact CE2-CG1 4.1Å; Y721-V792 HydrophobicContact CE2-CG2 3.61Å; V792-S795 PolarHBondContact O-OG 2.94Å; V792-S795 VanDerWaalsContact O-OG 3.05Å
793	P	35.1	Very low	44.9	Very low	116 Å²	116	86.8 Å²	86.8	75%	0.753	53%	0.529	S	S	*	.	S	Bend	trans	-48.3	145.8	178.2	-31.3	35.9	0	0	0	114.4	K718	K718-P793 WeakPolarHBondContact CE-O 3.46Å; K718-P793 PolarHBondContact NZ-O 3.38Å
794	G	45.3	Very low	44.8	Very low	64 Å²	64	89.5 Å²	89.5	66%	0.66	54%	0.542	S	S	*	.	S	Bend	trans	72.6	41.3	178	0	0	0	0	0	115.1	K718	K718-G794 WeakPolarHBondContact CE-O 3.17Å; K718-G794 PolarHBondContact NZ-O 3.31Å
795	S	38.2	Very low	44.6	Very low	52 Å²	52	87.8 Å²	87.8	36%	0.364	54%	0.541	S	S	.	.			trans	-128.7	108.1	162.6	28.8	0	0	0	0	110.7	K718 V792 V797	K718-S795 PolarHBondContact NZ-OG 2.86Å; V792-S795 PolarHBondContact O-OG 2.94Å; V792-S795 VanDerWaalsContact O-OG 3.05Å; S795-V797 PolarHBondContact O-N 2.84Å
796	N	34.2	Very low	44.4	Very low	169 Å²	169	85.6 Å²	85.6	90%	0.904	53%	0.533	S	S	*	.			trans	-75.9	37.2	-178.2	-59.6	8.9	0	0	0	112.5	G798	N796-G798 PolarHBondContact O-N 2.92Å
797	V	42	Very low	44.3	Very low	125 Å²	125	83.7 Å²	83.7	76%	0.758	52%	0.519	S	S	*	.			trans	-87.7	97.4	175.3	-177.5	0	0	0	0	106.9	S795	S795-V797 PolarHBondContact O-N 2.84Å
798	G	38.9	Very low	44.5	Very low	60 Å²	60	83.9 Å²	83.9	62%	0.619	53%	0.527	S	S	*	.			trans	-52.8	149.8	179.6	0	0	0	0	0	112.6	N796 S800	N796-G798 PolarHBondContact O-N 2.92Å; G798-S800 PolarHBondContact O-N 3.04Å
799	S	44.1	Very low	44.7	Very low	56 Å²	56	83.9 Å²	83.9	39%	0.392	53%	0.529	S	S	.	.			trans	-40.4	122.2	-173	55.8	0	0	0	0	112.8	Q804	S799-Q804 PolarHBondContact OG-NE2 2.67Å
800	S	49.1	Very low	45.1	Very low	56 Å²	56	82.1 Å²	82.1	39%	0.392	51%	0.513	S	S	.	.			trans	-59.3	145.1	-178.5	85	0	0	0	0	110.9	G798 S802 S803 Q804	G798-S800 PolarHBondContact O-N 3.04Å; S800-S802 PolarHBondContact O-N 2.81Å; S800-S802 VanDerWaalsContact O-N 3.12Å; S800-S803 WeakPolarHBondContact O-CA 3.23Å; S800-S803 WeakPolarHBondContact O-CB 3.32Å; S800-S803 PolarHBondContact O-N 3.21Å; S800-S803 WeakPolarHBondContact OG-CB 3.49Å; S800-S803 PolarHBondContact OG-N 3.34Å; S800-S803 PolarHBondContact OG-OG 2.87Å; S800-Q804 PolarHBondContact O-N 3.14Å
801	S	42.7	Very low	45.4	Very low	82 Å²	82	85.2 Å²	85.2	57%	0.573	51%	0.51	S	S	*	.	H	α-helix	trans	-59.7	-24.2	176.1	56.2	0	0	0	0	112.2	H805	S801-H805 VanDerWaalsContact O-CB 3.26Å; S801-H805 WeakPolarHBondContact O-CB 3.49Å; S801-H805 PolarHBondContact O-N 2.96Å; S801-H805 PolarHBondContact O-ND1 2.87Å; S801-H805 VanDerWaalsContact O-ND1 3.07Å
802	S	42.8	Very low	46	Very low	85 Å²	85	83.3 Å²	83.3	59%	0.594	50%	0.501	S	S	*	.	H	α-helix	trans	-73.3	-36.3	171.2	-48.7	0	0	0	0	113.1	S800 L806	S800-S802 PolarHBondContact O-N 2.81Å; S800-S802 VanDerWaalsContact O-N 3.12Å; S802-L806 VanDerWaalsContact O-CB 3.28Å; S802-L806 WeakPolarHBondContact O-CB 3.42Å; S802-L806 PolarHBondContact O-N 3.28Å
803	S	50.3	Low	46.8	Very low	44 Å²	44	84.3 Å²	84.3	31%	0.308	51%	0.506	S	S	.	.	H	α-helix	trans	-68.3	-43.1	173.4	-54.1	0	0	0	0	110.6	S800 L806 M807	S800-S803 WeakPolarHBondContact O-CA 3.23Å; S800-S803 WeakPolarHBondContact O-CB 3.32Å; S800-S803 PolarHBondContact O-N 3.21Å; S800-S803 WeakPolarHBondContact OG-CB 3.49Å; S800-S803 PolarHBondContact OG-N 3.34Å; S800-S803 PolarHBondContact OG-OG 2.87Å; S803-L806 PolarHBondContact O-N 3.48Å; S803-M807 WeakPolarHBondContact O-CG 3.46Å; S803-M807 PolarHBondContact O-N 3Å
804	Q	50.3	Low	47.6	Very low	110 Å²	110	79.4 Å²	79.4	51%	0.514	47%	0.474	S	S	.	.	H	α-helix	trans	-63.5	-48.4	172.8	-69	-173	-14.5	0	0	111.2	S799 S800 L806 M807 S808	S799-Q804 PolarHBondContact OG-NE2 2.67Å; S800-Q804 PolarHBondContact O-N 3.14Å; Q804-L806 VanDerWaalsContact C-N 3.31Å; Q804-L806 PolarHBondContact O-N 3.04Å; Q804-M807 PolarHBondContact O-N 3.34Å; Q804-S808 WeakPolarHBondContact O-CB 3.28Å; Q804-S808 PolarHBondContact O-N 2.85Å; Q804-S808 PolarHBondContact O-OG 2.82Å; Q804-S808 VanDerWaalsContact O-OG 3.13Å
805	H	47.4	Very low	48	Very low	118 Å²	118	78.3 Å²	78.3	55%	0.546	45%	0.451	S	S	.	.	H	α-helix	trans	-57.7	-41.4	174.5	-95.9	84.3	0	0	0	112.6	S801 S808 I809	S801-H805 VanDerWaalsContact O-CB 3.26Å; S801-H805 WeakPolarHBondContact O-CB 3.49Å; S801-H805 PolarHBondContact O-N 2.96Å; S801-H805 PolarHBondContact O-ND1 2.87Å; S801-H805 VanDerWaalsContact O-ND1 3.07Å; H805-S808 PolarHBondContact O-N 3.39Å; H805-I809 HydrophobicContact CB-CD1 4.46Å; H805-I809 VanDerWaalsContact O-CB 3.28Å; H805-I809 WeakPolarHBondContact O-CB 3.34Å; H805-I809 WeakPolarHBondContact O-CD1 3.41Å; H805-I809 WeakPolarHBondContact O-CG1 3.33Å; H805-I809 PolarHBondContact O-N 2.94Å
806	L	52.5	Low	48.6	Very low	79 Å²	79	81.9 Å²	81.9	41%	0.414	46%	0.462	S	S	.	.	H	α-helix	trans	-65.1	-43.3	178.2	-178	59.9	0	0	0	111.2	M787 S802 S803 Q804 I809 L810	M787-L806 HydrophobicContact CE-CD2 3.83Å; S802-L806 VanDerWaalsContact O-CB 3.28Å; S802-L806 WeakPolarHBondContact O-CB 3.42Å; S802-L806 PolarHBondContact O-N 3.28Å; S803-L806 PolarHBondContact O-N 3.48Å; Q804-L806 VanDerWaalsContact C-N 3.31Å; Q804-L806 PolarHBondContact O-N 3.04Å; L806-I809 PolarHBondContact O-N 3.49Å; L806-L810 HydrophobicContact CD1-CD1 4.11Å; L806-L810 HydrophobicContact CD1-CG 4.12Å; L806-L810 HydrophobicContact CG-CD1 3.97Å; L806-L810 HydrophobicContact CG-CG 4.42Å; L806-L810 VanDerWaalsContact O-CB 3.28Å; L806-L810 WeakPolarHBondContact O-CB 3.29Å; L806-L810 WeakPolarHBondContact O-CG 3.34Å; L806-L810 PolarHBondContact O-N 3.39Å
807	M	52.5	Low	49.4	Very low	39 Å²	39	80.6 Å²	80.6	19%	0.192	45%	0.445	C	S	.	.	H	α-helix	trans	-64	-40.3	173.9	-69.8	-52	-55.4	0	0	112.4	L780 F783 S803 Q804 R811	L780-M807 HydrophobicContact CD2-CE 3.51Å; F783-M807 HydrophobicContact CD1-CE 3.91Å; F783-M807 HydrophobicContact CD1-SD 3.75Å; F783-M807 HydrophobicContact CE1-CE 4.31Å; F783-M807 HydrophobicContact CE1-SD 3.68Å; S803-M807 WeakPolarHBondContact O-CG 3.46Å; S803-M807 PolarHBondContact O-N 3Å; Q804-M807 PolarHBondContact O-N 3.34Å; M807-R811 VanDerWaalsContact O-CB 3.27Å; M807-R811 WeakPolarHBondContact O-CB 3.34Å; M807-R811 PolarHBondContact O-N 2.99Å
808	S	51.2	Low	49.9	Very low	73 Å²	73	79.6 Å²	79.6	51%	0.51	43%	0.432	S	S	.	.	H	α-helix	trans	-64.6	-45.4	175	-63.2	0	0	0	0	111.8	Q804 H805 R811 L812	Q804-S808 WeakPolarHBondContact O-CB 3.28Å; Q804-S808 PolarHBondContact O-N 2.85Å; Q804-S808 PolarHBondContact O-OG 2.82Å; Q804-S808 VanDerWaalsContact O-OG 3.13Å; H805-S808 PolarHBondContact O-N 3.39Å; S808-R811 PolarHBondContact O-N 3.37Å; S808-L812 WeakPolarHBondContact O-CB 3.36Å; S808-L812 PolarHBondContact O-N 2.87Å
809	I	53.7	Low	49.8	Very low	95 Å²	95	81.5 Å²	81.5	49%	0.487	44%	0.436	S	S	.	.	H	α-helix	trans	-64.3	-44.8	177.7	-71.4	163.6	0	0	0	110.3	H805 L806 L812 V813	H805-I809 HydrophobicContact CB-CD1 4.46Å; H805-I809 VanDerWaalsContact O-CB 3.28Å; H805-I809 WeakPolarHBondContact O-CB 3.34Å; H805-I809 WeakPolarHBondContact O-CD1 3.41Å; H805-I809 WeakPolarHBondContact O-CG1 3.33Å; H805-I809 PolarHBondContact O-N 2.94Å; L806-I809 PolarHBondContact O-N 3.49Å; I809-L812 PolarHBondContact O-N 3.23Å; I809-V813 HydrophobicContact CG2-CG2 4.4Å; I809-V813 WeakPolarHBondContact O-CB 3.32Å; I809-V813 VanDerWaalsContact O-CG2 3.28Å; I809-V813 WeakPolarHBondContact O-CG2 3.49Å; I809-V813 PolarHBondContact O-N 3.18Å
810	L	54.9	Low	49.7	Very low	52 Å²	52	84.4 Å²	84.4	27%	0.272	44%	0.444	S	S	.	.	H	α-helix	trans	-61.3	-46.9	175.8	-74.1	171.3	0	0	0	111	L774 F783 L806 L812 V813 E814	L774-L810 HydrophobicContact CD1-CB 4.06Å; F783-L810 HydrophobicContact CE1-CD1 4.16Å; L806-L810 HydrophobicContact CD1-CD1 4.11Å; L806-L810 HydrophobicContact CD1-CG 4.12Å; L806-L810 HydrophobicContact CG-CD1 3.97Å; L806-L810 HydrophobicContact CG-CG 4.42Å; L806-L810 VanDerWaalsContact O-CB 3.28Å; L806-L810 WeakPolarHBondContact O-CB 3.29Å; L806-L810 WeakPolarHBondContact O-CG 3.34Å; L806-L810 PolarHBondContact O-N 3.39Å; L810-L812 VanDerWaalsContact C-N 3.33Å; L810-L812 PolarHBondContact O-N 3.43Å; L810-V813 PolarHBondContact O-N 3.33Å; L810-E814 WeakPolarHBondContact O-CB 3.3Å; L810-E814 PolarHBondContact O-N 2.93Å
811	R	52.4	Low	49.4	Very low	155 Å²	155	84.4 Å²	84.4	59%	0.585	44%	0.442	S	S	*	.	H	α-helix	trans	-64.6	-34.8	176.9	-167.4	173.5	-173.4	175.4	2.9	112.7	M807 S808 E814 M815	M807-R811 VanDerWaalsContact O-CB 3.27Å; M807-R811 WeakPolarHBondContact O-CB 3.34Å; M807-R811 PolarHBondContact O-N 2.99Å; S808-R811 PolarHBondContact O-N 3.37Å; R811-E814 PolarHBondContact O-N 2.84Å; R811-M815 HydrophobicContact CG-SD 4.44Å; R811-M815 WeakPolarHBondContact O-CB 3.4Å; R811-M815 VanDerWaalsContact O-CG 3.22Å; R811-M815 WeakPolarHBondContact O-CG 3.29Å; R811-M815 PolarHBondContact O-N 2.81Å
812	L	51.1	Low	49.3	Very low	64 Å²	64	87.2 Å²	87.2	34%	0.335	45%	0.446	S	S	.	.	H	α-helix	trans	-75	-35.8	177.7	-155.7	160.5	0	0	0	111.3	S808 I809 L810 H816 A827	S808-L812 WeakPolarHBondContact O-CB 3.36Å; S808-L812 PolarHBondContact O-N 2.87Å; I809-L812 PolarHBondContact O-N 3.23Å; L810-L812 VanDerWaalsContact C-N 3.33Å; L810-L812 PolarHBondContact O-N 3.43Å; L812-H816 VanDerWaalsContact O-CB 3.29Å; L812-H816 WeakPolarHBondContact O-CB 3.27Å; L812-H816 PolarHBondContact O-N 3.44Å; L812-A827 HydrophobicContact CD1-CB 4.25Å
813	V	53.6	Low	49	Very low	76 Å²	76	89.5 Å²	89.5	46%	0.461	45%	0.451	S	S	.	.	H	α-helix	trans	-63.8	-44	168.1	167.2	0	0	0	0	110.7	I809 L810 H816 R817	I809-V813 HydrophobicContact CG2-CG2 4.4Å; I809-V813 WeakPolarHBondContact O-CB 3.32Å; I809-V813 VanDerWaalsContact O-CG2 3.28Å; I809-V813 WeakPolarHBondContact O-CG2 3.49Å; I809-V813 PolarHBondContact O-N 3.18Å; L810-V813 PolarHBondContact O-N 3.33Å; V813-H816 CarbonylContact O-C 3.55Å; V813-H816 PolarHBondContact O-N 3.38Å; V813-H816 VanDerWaalsContact O-N 3.16Å; V813-R817 WeakPolarHBondContact O-CG 3.5Å; V813-R817 PolarHBondContact O-N 3.32Å
814	E	52.5	Low	48.4	Very low	14 Å²	14	88.2 Å²	88.2	7%	0.065	44%	0.442	C	S	.	.	H	α-helix	trans	-63.7	-46.8	177.7	-149.3	79.4	144.7	0	0	111	L774 T775 L810 R811 H816 R817 H818	L774-E814 HydrophobicContact CB-CG 3.99Å; L774-E814 WeakPolarHBondContact CB-OE1 3.49Å; L774-E814 PolarHBondContact N-OE1 3.48Å; T775-E814 HydrophobicContact CG2-CG 4.06Å; L810-E814 WeakPolarHBondContact O-CB 3.3Å; L810-E814 PolarHBondContact O-N 2.93Å; R811-E814 PolarHBondContact O-N 2.84Å; E814-H816 VanDerWaalsContact C-N 3.26Å; E814-H816 PolarHBondContact O-N 3.44Å; E814-R817 PolarHBondContact O-N 3.13Å; E814-H818 PolarHBondContact O-CD2 2.7Å; E814-H818 PolarHBondContact O-N 2.87Å
815	M	54.3	Low	47.9	Very low	40 Å²	40	88.4 Å²	88.4	20%	0.197	44%	0.439	C	S	.	.	H	α-helix	trans	-57.6	-38.1	171.7	-75.4	170.7	61.8	0	0	112.3	R811 H818 S819 M820 L823	R811-M815 HydrophobicContact CG-SD 4.44Å; R811-M815 WeakPolarHBondContact O-CB 3.4Å; R811-M815 VanDerWaalsContact O-CG 3.22Å; R811-M815 WeakPolarHBondContact O-CG 3.29Å; R811-M815 PolarHBondContact O-N 2.81Å; M815-H818 CarbonylContact O-C 3.54Å; M815-H818 PolarHBondContact O-N 2.95Å; M815-S819 PolarHBondContact O-N 2.93Å; M815-S819 VanDerWaalsContact O-N 3.15Å; M815-M820 HydrophobicContact CB-CB 4.02Å; M815-M820 WeakPolarHBondContact CE-O 3.47Å; M815-M820 HydrophobicContact CG-CB 4.15Å; M815-M820 PolarHBondContact O-N 2.91Å; M815-L823 HydrophobicContact CE-CB 3.59Å
816	H	51.2	Low	47.3	Very low	128 Å²	128	91.1 Å²	91.1	59%	0.593	45%	0.451	S	S	*	.	H	α-helix	trans	-70.9	-32.6	175.8	-165.2	-38.5	0	0	0	112.5	L812 V813 E814 T821	L812-H816 VanDerWaalsContact O-CB 3.29Å; L812-H816 WeakPolarHBondContact O-CB 3.27Å; L812-H816 PolarHBondContact O-N 3.44Å; V813-H816 CarbonylContact O-C 3.55Å; V813-H816 PolarHBondContact O-N 3.38Å; V813-H816 VanDerWaalsContact O-N 3.16Å; E814-H816 VanDerWaalsContact C-N 3.26Å; E814-H816 PolarHBondContact O-N 3.44Å; H816-T821 HydrophobicContact CB-CG2 4.13Å
817	R	50.5	Low	46.7	Very low	142 Å²	142	91 Å²	91	54%	0.536	46%	0.462	S	S	.	.	H	α-helix	trans	-70.4	-35.7	173.2	-71.8	179.9	75.4	-174.3	2.3	112.2	V813 E814 S819	V813-R817 WeakPolarHBondContact O-CG 3.5Å; V813-R817 PolarHBondContact O-N 3.32Å; E814-R817 PolarHBondContact O-N 3.13Å; R817-S819 VanDerWaalsContact C-N 3.35Å
818	H	51.5	Low	46	Very low	104 Å²	104	94.9 Å²	94.9	48%	0.481	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	13.4	176.6	-66.2	-70.9	0	0	0	114.3	T775 E814 M815 M820	T775-H818 VanDerWaalsContact CG2-CD2 3.47Å; T775-H818 WeakPolarHBondContact CG2-CD2 3.31Å; T775-H818 WeakPolarHBondContact CG2-NE2 3.39Å; E814-H818 PolarHBondContact O-CD2 2.7Å; E814-H818 PolarHBondContact O-N 2.87Å; M815-H818 CarbonylContact O-C 3.54Å; M815-H818 PolarHBondContact O-N 2.95Å; H818-M820 HydrophobicContact CB-CG 4.1Å; H818-M820 PolarHBondContact O-N 2.8Å
819	S	37.8	Very low	44.9	Very low	100 Å²	100	93.8 Å²	93.8	70%	0.699	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	17.6	-179.6	-56	0	0	0	0	115.6	M815 R817 T821	M815-S819 PolarHBondContact O-N 2.93Å; M815-S819 VanDerWaalsContact O-N 3.15Å; R817-S819 VanDerWaalsContact C-N 3.35Å; S819-T821 PolarHBondContact O-N 2.74Å
820	M	42.1	Very low	43.9	Very low	117 Å²	117	91.9 Å²	91.9	58%	0.576	47%	0.473	S	S	*	.			trans	-77.7	26.9	178.5	-66.6	-86.4	-81.4	0	0	112.5	M815 H818 Q822 L823	M815-M820 HydrophobicContact CB-CB 4.02Å; M815-M820 WeakPolarHBondContact CE-O 3.47Å; M815-M820 HydrophobicContact CG-CB 4.15Å; M815-M820 PolarHBondContact O-N 2.91Å; H818-M820 HydrophobicContact CB-CG 4.1Å; H818-M820 PolarHBondContact O-N 2.8Å; M820-Q822 PolarHBondContact O-N 2.75Å; M820-Q822 VanDerWaalsContact O-N 3.15Å; M820-L823 PolarHBondContact O-N 3.1Å
821	T	41.2	Very low	42.6	Very low	56 Å²	56	100.8 Å²	100.8	34%	0.344	50%	0.503	S	S	.	.	G	3₁₀ helix	trans	-74.1	-3.8	-166.4	48.7	0	0	0	0	115	H816 S819 S824	H816-T821 HydrophobicContact CB-CG2 4.13Å; S819-T821 PolarHBondContact O-N 2.74Å; T821-S824 WeakPolarHBondContact CA-OG 3.47Å; T821-S824 PolarHBondContact O-OG 3.11Å
822	Q	40.6	Very low	41.7	Very low	141 Å²	141	102.3 Å²	102.3	66%	0.659	51%	0.514	S	S	*	.	G	3₁₀ helix	trans	-75.4	-20.9	176	-62	-165.1	42.9	0	0	113.3	M820 Y825	M820-Q822 PolarHBondContact O-N 2.75Å; M820-Q822 VanDerWaalsContact O-N 3.15Å; Q822-Y825 WeakPolarHBondContact O-CD2 3.44Å
823	L	37.2	Very low	40.8	Very low	132 Å²	132	102.2 Å²	102.2	69%	0.691	51%	0.513	S	S	*	.	G	3₁₀ helix	trans	-82.6	-13	174.9	-97.2	71	0	0	0	114.2	M815 M820 Y825	M815-L823 HydrophobicContact CE-CB 3.59Å; M820-L823 PolarHBondContact O-N 3.1Å; L823-Y825 PolarHBondContact O-N 2.97Å; L823-Y825 VanDerWaalsContact O-N 3.11Å
824	S	38.1	Very low	40	Very low	17 Å²	17	103.7 Å²	103.7	12%	0.119	52%	0.519	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-16.5	-170.8	-8.8	0	0	0	0	115.2	T821 H826 A827 L828	T821-S824 WeakPolarHBondContact CA-OG 3.47Å; T821-S824 PolarHBondContact O-OG 3.11Å; S824-H826 VanDerWaalsContact C-N 3.35Å; S824-H826 PolarHBondContact O-N 2.81Å; S824-A827 PolarHBondContact O-N 3.29Å; S824-L828 PolarHBondContact O-N 3.23Å
825	Y	38.8	Very low	39.2	Very low	115 Å²	115	107.5 Å²	107.5	45%	0.451	54%	0.538	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-35.3	-175.8	-67.7	-86.3	0	0	0	113.2	Q822 L823 A827 L828 I830 I833	Q822-Y825 WeakPolarHBondContact O-CD2 3.44Å; L823-Y825 PolarHBondContact O-N 2.97Å; L823-Y825 VanDerWaalsContact O-N 3.11Å; Y825-A827 VanDerWaalsContact C-N 3.34Å; Y825-A827 PolarHBondContact O-N 3.16Å; Y825-L828 PolarHBondContact O-N 2.98Å; Y825-I830 HydrophobicContact CD1-CD1 3.94Å; Y825-I833 HydrophobicContact CD1-CD1 3.72Å; Y825-I833 HydrophobicContact CE1-CD1 4.13Å; Y825-I833 HydrophobicContact CG-CD1 4.46Å
826	H	35.5	Very low	38.4	Very low	174 Å²	174	111.5 Å²	111.5	81%	0.806	56%	0.561	S	S	*	*	G	3₁₀ helix	trans	-66.6	-33.3	175.6	-97.7	-95.9	0	0	0	112.9	S824 L828 G829	S824-H826 VanDerWaalsContact C-N 3.35Å; S824-H826 PolarHBondContact O-N 2.81Å; H826-L828 VanDerWaalsContact C-N 3.27Å; H826-L828 PolarHBondContact O-N 3.02Å; H826-G829 PolarHBondContact O-N 3.47Å
827	A	41	Very low	38	Very low	77 Å²	77	108 Å²	108	64%	0.636	55%	0.549	S	S	*	.	G	3₁₀ helix	trans	-73.6	-18.3	178.1	0	0	0	0	0	113.2	L812 S824 Y825	L812-A827 HydrophobicContact CD1-CB 4.25Å; S824-A827 PolarHBondContact O-N 3.29Å; Y825-A827 VanDerWaalsContact C-N 3.34Å; Y825-A827 PolarHBondContact O-N 3.16Å
828	L	35.8	Very low	37.4	Very low	120 Å²	120	106.5 Å²	106.5	63%	0.628	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-93.6	9.4	178.3	-68.6	169.9	0	0	0	113.3	S824 Y825 H826 I830	S824-L828 PolarHBondContact O-N 3.23Å; Y825-L828 PolarHBondContact O-N 2.98Å; H826-L828 VanDerWaalsContact C-N 3.27Å; H826-L828 PolarHBondContact O-N 3.02Å; L828-I830 VanDerWaalsContact C-N 3.27Å; L828-I830 HydrophobicContact CB-CD1 4.06Å; L828-I830 HydrophobicContact CB-CG1 4.19Å; L828-I830 PolarHBondContact O-N 3.15Å
829	G	29.7	Very low	36.6	Very low	51 Å²	51	104 Å²	104	53%	0.526	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.3	12.7	175.3	0	0	0	0	0	115.1	H826 R831	H826-G829 PolarHBondContact O-N 3.47Å; G829-R831 WeakPolarHBondContact O-CG 3.49Å; G829-R831 PolarHBondContact O-N 2.97Å; G829-R831 VanDerWaalsContact O-N 3.16Å
830	I	32.8	Very low	36.6	Very low	54 Å²	54	101.5 Å²	101.5	28%	0.277	52%	0.517	S	S	.	.			trans	-83.6	95	-175.8	-50.4	165.6	0	0	0	109.1	Y825 L828 K832 I833 L896	Y825-I830 HydrophobicContact CD1-CD1 3.94Å; L828-I830 VanDerWaalsContact C-N 3.27Å; L828-I830 HydrophobicContact CB-CD1 4.06Å; L828-I830 HydrophobicContact CB-CG1 4.19Å; L828-I830 PolarHBondContact O-N 3.15Å; I830-K832 PolarHBondContact O-N 3.48Å; I830-I833 HydrophobicContact CG2-CD1 3.87Å; I830-I833 HydrophobicContact CG2-CG1 3.59Å; I830-L896 HydrophobicContact CG2-CD1 4.07Å
831	R	27.8	Very low	36.5	Very low	239 Å²	239	99.9 Å²	99.9	90%	0.902	51%	0.509	S	S	*	.			trans	-81.7	-5.1	-166.5	-57.6	-170.7	-172.1	-178.9	3.5	116.2	G829	G829-R831 WeakPolarHBondContact O-CG 3.49Å; G829-R831 PolarHBondContact O-N 2.97Å; G829-R831 VanDerWaalsContact O-N 3.16Å
832	K	33.6	Very low	36.3	Very low	187 Å²	187	102.5 Å²	102.5	81%	0.813	52%	0.52	S	S	*	.			trans	-158.8	113.2	170.6	-140.8	174.5	-176.2	-178.1	0	109.8	I830	I830-K832 PolarHBondContact O-N 3.48Å
833	I	32	Very low	36	Very low	63 Å²	63	100.4 Å²	100.4	32%	0.323	51%	0.512	S	S	.	.			trans	-122.5	127.1	156.1	-54.8	179	0	0	0	104.6	Y825 I830 I835	Y825-I833 HydrophobicContact CD1-CD1 3.72Å; Y825-I833 HydrophobicContact CE1-CD1 4.13Å; Y825-I833 HydrophobicContact CG-CD1 4.46Å; I830-I833 HydrophobicContact CG2-CD1 3.87Å; I830-I833 HydrophobicContact CG2-CG1 3.59Å; I833-I835 HydrophobicContact CB-CG1 4.05Å; I833-I835 HydrophobicContact CG2-CG1 3.98Å; I833-I835 WeakPolarHBondContact O-CG1 3.45Å; I833-I835 PolarHBondContact O-N 3.46Å
834	D	35.7	Very low	35.9	Very low	107 Å²	107	101.5 Å²	101.5	57%	0.572	51%	0.511	S	S	*	.			trans	-77.6	103.1	162.2	-172.3	-13.4	0	0	0	107.8	N836 T837	D834-N836 PolarHBondContact OD1-N 2.86Å; D834-T837 VanDerWaalsContact CG-OG1 3.28Å; D834-T837 PolarHBondContact OD1-N 3.4Å; D834-T837 PolarHBondContact OD1-OG1 2.93Å; D834-T837 VanDerWaalsContact OD2-CB 3.25Å; D834-T837 WeakPolarHBondContact OD2-CB 3.1Å; D834-T837 PolarHBondContact OD2-OG1 3.02Å
835	I	35.5	Very low	35.7	Very low	93 Å²	93	107.5 Å²	107.5	48%	0.477	54%	0.54	S	S	.	.			trans	-97	-1.9	-179.4	-17.6	-179.6	0	0	0	111.4	I833 R891	I833-I835 HydrophobicContact CB-CG1 4.05Å; I833-I835 HydrophobicContact CG2-CG1 3.98Å; I833-I835 WeakPolarHBondContact O-CG1 3.45Å; I833-I835 PolarHBondContact O-N 3.46Å; I835-R891 PolarHBondContact O-NH1 3.48Å
836	N	37.3	Very low	35.2	Very low	125 Å²	125	105.7 Å²	105.7	67%	0.668	55%	0.545	S	S	*	.	S	Bend	trans	-109.8	-40.7	-167	-70.8	-15	0	0	0	112.3	D834 K838	D834-N836 PolarHBondContact OD1-N 2.86Å; N836-K838 PolarHBondContact O-N 3.33Å
837	T	42.5	Very low	35	Very low	55 Å²	55	101.9 Å²	101.9	34%	0.337	54%	0.538	S	S	.	.			trans	-60.2	122.4	-179.3	-62.2	0	0	0	0	111.2	D834 E841 L842	D834-T837 VanDerWaalsContact CG-OG1 3.28Å; D834-T837 PolarHBondContact OD1-N 3.4Å; D834-T837 PolarHBondContact OD1-OG1 2.93Å; D834-T837 VanDerWaalsContact OD2-CB 3.25Å; D834-T837 WeakPolarHBondContact OD2-CB 3.1Å; D834-T837 PolarHBondContact OD2-OG1 3.02Å; T837-E841 WeakPolarHBondContact CA-OE2 3.49Å; T837-E841 HydrophobicContact CG2-CB 3.89Å; T837-L842 HydrophobicContact CG2-CD2 4.15Å; T837-L842 HydrophobicContact CG2-CG 3.91Å
838	K	38.6	Very low	34.3	Very low	109 Å²	109	103.1 Å²	103.1	47%	0.474	54%	0.542	S	S	.	.			trans	-78.7	157.7	179.2	-62.4	178.3	178.2	-177.3	0	111.2	N836 S840 E841 L842	N836-K838 PolarHBondContact O-N 3.33Å; K838-S840 VanDerWaalsContact CB-OG 3.31Å; K838-S840 WeakPolarHBondContact CB-OG 3.34Å; K838-S840 PolarHBondContact O-N 3.23Å; K838-E841 HydrophobicContact CB-CG 4.28Å; K838-E841 PolarHBondContact N-OE2 3.24Å; K838-E841 WeakPolarHBondContact O-CB 3.25Å; K838-E841 PolarHBondContact O-N 3.44Å; K838-L842 PolarHBondContact O-N 3.48Å; K838-L842 VanDerWaalsContact O-N 3.14Å
839	M	34	Very low	34	Very low	52 Å²	52	104.7 Å²	104.7	26%	0.256	55%	0.55	S	S	.	*	H	α-helix	trans	-59.4	-33	171.2	-168.5	161.7	-75.7	0	0	111.6	E841 L842 I843 M892	M839-E841 PolarHBondContact O-N 2.86Å; M839-L842 PolarHBondContact O-N 2.88Å; M839-I843 HydrophobicContact CG-CD1 3.94Å; M839-I843 WeakPolarHBondContact O-CB 3.34Å; M839-I843 WeakPolarHBondContact O-CD1 3.2Å; M839-I843 WeakPolarHBondContact O-CG1 3.36Å; M839-I843 PolarHBondContact O-N 3.18Å; M839-M892 HydrophobicContact CE-CG 4.27Å; M839-M892 HydrophobicContact CE-SD 4.01Å
840	S	39	Very low	33.8	Very low	47 Å²	47	108.4 Å²	108.4	33%	0.329	57%	0.565	S	S	.	*	H	α-helix	trans	-65.2	-15	172	61.8	0	0	0	0	115.5	K838 K844	K838-S840 VanDerWaalsContact CB-OG 3.31Å; K838-S840 WeakPolarHBondContact CB-OG 3.34Å; K838-S840 PolarHBondContact O-N 3.23Å; S840-K844 WeakPolarHBondContact O-CD 3.31Å; S840-K844 WeakPolarHBondContact O-CG 3.35Å
841	E	40.7	Very low	33.7	Very low	84 Å²	84	111.4 Å²	111.4	39%	0.393	59%	0.591	S	S	.	*	H	α-helix	trans	-98.4	-39.1	179.1	-72.1	155.7	-179.8	0	0	110.3	T837 K838 M839 I843 K844	T837-E841 WeakPolarHBondContact CA-OE2 3.49Å; T837-E841 HydrophobicContact CG2-CB 3.89Å; K838-E841 HydrophobicContact CB-CG 4.28Å; K838-E841 PolarHBondContact N-OE2 3.24Å; K838-E841 WeakPolarHBondContact O-CB 3.25Å; K838-E841 PolarHBondContact O-N 3.44Å; M839-E841 PolarHBondContact O-N 2.86Å; E841-I843 VanDerWaalsContact C-N 3.3Å; E841-I843 PolarHBondContact O-N 3.4Å; E841-K844 PolarHBondContact O-N 2.81Å; E841-K844 VanDerWaalsContact O-N 3.16Å
842	L	35.3	Very low	33.7	Very low	111 Å²	111	105.3 Å²	105.3	58%	0.581	58%	0.584	S	S	*	*	H	α-helix	trans	-57.6	-41.6	167.3	-68.9	168.3	0	0	0	112	T837 K838 M839 K844 I845	T837-L842 HydrophobicContact CG2-CD2 4.15Å; T837-L842 HydrophobicContact CG2-CG 3.91Å; K838-L842 PolarHBondContact O-N 3.48Å; K838-L842 VanDerWaalsContact O-N 3.14Å; M839-L842 PolarHBondContact O-N 2.88Å; L842-K844 VanDerWaalsContact C-N 3.25Å; L842-K844 PolarHBondContact O-N 3.02Å; L842-I845 PolarHBondContact O-N 3.14Å
843	I	34.6	Very low	33.4	Very low	96 Å²	96	105.3 Å²	105.3	49%	0.492	59%	0.587	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.8	-22.5	178.6	-72	167.1	0	0	0	112.9	M839 E841 S846	M839-I843 HydrophobicContact CG-CD1 3.94Å; M839-I843 WeakPolarHBondContact O-CB 3.34Å; M839-I843 WeakPolarHBondContact O-CD1 3.2Å; M839-I843 WeakPolarHBondContact O-CG1 3.36Å; M839-I843 PolarHBondContact O-N 3.18Å; E841-I843 VanDerWaalsContact C-N 3.3Å; E841-I843 PolarHBondContact O-N 3.4Å; I843-S846 PolarHBondContact O-OG 2.75Å
844	K	35.9	Very low	33.1	Very low	156 Å²	156	109.3 Å²	109.3	68%	0.678	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-6.5	-177.1	-78.3	179.7	-180	-177.5	0	114.9	S840 E841 L842 S847	S840-K844 WeakPolarHBondContact O-CD 3.31Å; S840-K844 WeakPolarHBondContact O-CG 3.35Å; E841-K844 PolarHBondContact O-N 2.81Å; E841-K844 VanDerWaalsContact O-N 3.16Å; L842-K844 VanDerWaalsContact C-N 3.25Å; L842-K844 PolarHBondContact O-N 3.02Å; K844-S847 PolarHBondContact O-OG 2.85Å
845	I	33	Very low	32.6	Very low	142 Å²	142	110.7 Å²	110.7	73%	0.728	62%	0.616	S	S	*	*	S	Bend	trans	-91.3	-16.3	-177.9	-66	170.9	0	0	0	111.8	L842	L842-I845 PolarHBondContact O-N 3.14Å
846	S	29.9	Very low	32.1	Very low	77 Å²	77	113 Å²	113	54%	0.538	63%	0.629	S	S	.	*	S	Bend	trans	-100.2	-2.1	178.8	53	0	0	0	0	114.9	I843 S848	I843-S846 PolarHBondContact O-OG 2.75Å; S846-S848 VanDerWaalsContact C-N 3.28Å; S846-S848 PolarHBondContact O-N 3.09Å
847	S	29.4	Very low	31.8	Very low	95 Å²	95	114.9 Å²	114.9	66%	0.664	63%	0.633	S	S	*	*			trans	-85.3	58.1	-177.3	65.1	0	0	0	0	113.5	K844	K844-S847 PolarHBondContact O-OG 2.85Å
848	S	27.8	Very low	31	Very low	103 Å²	103	117 Å²	117	72%	0.72	65%	0.65	S	S	*	*			trans	-140.2	58.9	169.5	68.5	0	0	0	0	111.3	S846	S846-S848 VanDerWaalsContact C-N 3.28Å; S846-S848 PolarHBondContact O-N 3.09Å
849	L	28	Very low	30.5	Very low	153 Å²	153	117 Å²	117	80%	0.801	66%	0.662	S	S	*	*			trans	-64.5	137.4	170.8	-94.3	75.5	0	0	0	110.4	S851	L849-S851 PolarHBondContact O-N 2.85Å; L849-S851 VanDerWaalsContact O-N 3.12Å
850	P	26.4	Very low	30.1	Very low	128 Å²	128	119.3 Å²	119.3	83%	0.831	68%	0.683	S	S	*	*			trans	-73.8	100.7	170.1	30.2	-32.5	0	0	0	109.9	S852	P850-S852 PolarHBondContact O-N 3.1Å
851	S	30.3	Very low	29.6	Very low	118 Å²	118	125.8 Å²	125.8	83%	0.825	71%	0.708	S	S	*	*			trans	-67.8	120.9	173.8	54.2	0	0	0	0	111	L849	L849-S851 PolarHBondContact O-N 2.85Å; L849-S851 VanDerWaalsContact O-N 3.12Å
852	S	27.6	Very low	28.8	Very low	110 Å²	110	126.5 Å²	126.5	77%	0.769	72%	0.721	S	S	*	*			trans	-68.6	130.4	-173.1	54.9	0	0	0	0	115.2	P850	P850-S852 PolarHBondContact O-N 3.1Å
853	Q	27.2	Very low	28.4	Very low	187 Å²	187	129.1 Å²	129.1	87%	0.874	73%	0.73	S	S	*	*			trans	-151.8	112.1	147.1	-101.1	162.3	11.8	0	0	105.9
854	L	26.1	Very low	28	Very low	147 Å²	147	131.1 Å²	131.1	77%	0.77	74%	0.737	S	S	*	*				52.5	85.3	71.7	-81.6	166	0	0	0	113.8
855	D	24.7	Very low	27.7	Very low	137 Å²	137	129.3 Å²	129.3	73%	0.733	74%	0.735	S	S	*	*			trans	70.1	132.7	141	-72.2	-17.4	0	0	0	122.8
856	L	25.8	Very low	27.4	Very low	142 Å²	142	129.7 Å²	129.7	74%	0.743	74%	0.737	S	S	*	*			trans	75.3	105.8	149.8	-62.1	159.4	0	0	0	120.1
857	H	30.6	Very low	27.4	Very low	163 Å²	163	134 Å²	134	76%	0.755	75%	0.754	S	S	*	*			trans	61.8	98.1	143.5	-63	-65.8	0	0	0	121.4
858	S	25.1	Very low	27.2	Very low	99 Å²	99	137.3 Å²	137.3	69%	0.692	76%	0.759	S	S	*	*				30.4	148.4	117.2	63.4	0	0	0	0	122.1
859	P	29.8	Very low	27.1	Very low	111 Å²	111	138.9 Å²	138.9	72%	0.721	76%	0.759	S	S	*	*			cis	-143.1	178.9	-27.2	41.2	-23.9	0	0	0	115.5
860	S	25.4	Very low	27.1	Very low	100 Å²	100	137.5 Å²	137.5	70%	0.699	76%	0.757	S	S	*	*			trans	78.5	144.5	150.3	79.1	0	0	0	0	121.2
861	Q	28.5	Very low	27.1	Very low	182 Å²	182	136.8 Å²	136.8	85%	0.85	75%	0.75	S	S	*	*			trans	67.4	151.7	161.8	-66.4	180	8.3	0	0	118.2
862	C	22.4	Very low	27.1	Very low	100 Å²	100	138 Å²	138	68%	0.676	75%	0.748	S	S	*	*			cis	-176.7	143.1	-36.7	-122.7	0	0	0	0	109
863	H	27.3	Very low	27.1	Very low	165 Å²	165	138.5 Å²	138.5	76%	0.764	75%	0.746	S	S	*	*			trans	62.2	160.7	166.7	-74.4	-83.4	0	0	0	116.3
864	H	27.4	Very low	27.1	Very low	138 Å²	138	138 Å²	138	64%	0.639	75%	0.749	S	S	*	*			cis	-164.3	177.7	-32.9	-142.4	-110.9	0	0	0	107.8
865	D	29.4	Very low	27.2	Very low	119 Å²	119	136.7 Å²	136.7	64%	0.636	75%	0.749	S	S	*	*			trans	65.7	117.6	159.1	-56.4	-33.3	0	0	0	117.8
866	L	25.5	Very low	27.2	Very low	149 Å²	149	134.3 Å²	134.3	78%	0.78	75%	0.748	S	S	*	*				68.2	113.6	83.5	-70.7	166.4	0	0	0	114.9
867	D	30.1	Very low	27.4	Very low	167 Å²	167	133 Å²	133	89%	0.893	75%	0.748	S	S	*	*				-178.4	-175	111	-98.5	-9	0	0	0	112.9
868	E	26.3	Very low	27.1	Very low	166 Å²	166	134.8 Å²	134.8	78%	0.776	76%	0.757	S	S	*	*			trans	-122.1	167.7	-146.3	-133.9	-173.3	-175.6	0	0	115.9
869	L	26.1	Very low	27.2	Very low	135 Å²	135	136.3 Å²	136.3	71%	0.707	76%	0.756	S	S	*	*			trans	77.2	160.4	149.4	-73.3	163.5	0	0	0	123
870	T	28.2	Very low	27	Very low	125 Å²	125	136.5 Å²	136.5	77%	0.767	76%	0.76	S	S	*	*			trans	73.4	134.1	170.4	68.6	0	0	0	0	117.9
871	T	25.3	Very low	27.1	Very low	112 Å²	112	137.3 Å²	137.3	69%	0.687	76%	0.757	S	S	*	*			cis	162.9	140.3	-27.1	29.7	0	0	0	0	106.3
872	N	30.6	Very low	27.2	Very low	144 Å²	144	132.3 Å²	132.3	77%	0.77	74%	0.74	S	S	*	*			trans	148	95.2	150.7	-75.9	-17.3	0	0	0	110.6
873	T	26.7	Very low	27.5	Very low	121 Å²	121	128.8 Å²	128.8	74%	0.742	72%	0.715	S	S	*	*				69.2	102.6	78.5	64.9	0	0	0	0	116.4
874	L	27.6	Very low	27.6	Very low	176 Å²	176	125.9 Å²	125.9	92%	0.921	70%	0.704	S	S	*	*			trans	-165.8	151.2	133.6	-98.4	152.5	0	0	0	108.1
875	P	28.2	Very low	27.9	Very low	120 Å²	120	125 Å²	125	78%	0.779	71%	0.705	S	S	*	*			trans	-99.3	154.2	-153.3	37.2	-37.3	0	0	0	116.5
876	A	25.5	Very low	28.1	Very low	86 Å²	86	120 Å²	120	71%	0.711	68%	0.678	S	S	*	*			trans	-128.7	153.9	155.6	0	0	0	0	0	107.9	E878	A876-E878 PolarHBondContact O-N 2.84Å
877	P	28.9	Very low	28.6	Very low	115 Å²	115	115.3 Å²	115.3	75%	0.747	65%	0.653	S	S	*	*			trans	-71.4	126.1	-165.4	27.1	-34.7	0	0	0	113.4	I879	P877-I879 PolarHBondContact O-N 2.98Å; P877-I879 VanDerWaalsContact O-N 3.13Å
878	E	25.6	Very low	29	Very low	200 Å²	200	112.7 Å²	112.7	94%	0.935	64%	0.635	S	S	*	*			trans	-71.4	99.5	170.6	-64.1	175.8	155.4	0	0	109.6	A876	A876-E878 PolarHBondContact O-N 2.84Å
879	I	26	Very low	29.7	Very low	132 Å²	132	109.7 Å²	109.7	68%	0.677	62%	0.624	S	S	*	*			trans	-105.7	121.1	170.7	-61.2	180	0	0	0	107.9	P877 D881	P877-I879 PolarHBondContact O-N 2.98Å; P877-I879 VanDerWaalsContact O-N 3.13Å; I879-D881 PolarHBondContact O-N 3.26Å
880	S	25.3	Very low	30.7	Very low	115 Å²	115	104.6 Å²	104.6	80%	0.804	60%	0.598	S	S	*	*			trans	-82.8	91.3	-176.1	56.6	0	0	0	0	111.5
881	D	29	Very low	31.6	Very low	117 Å²	117	102.8 Å²	102.8	63%	0.626	58%	0.577	S	S	*	*			trans	-84.5	120.9	172.5	-80.2	-27.6	0	0	0	111	I879 V883	I879-D881 PolarHBondContact O-N 3.26Å; D881-V883 HydrophobicContact CB-CB 4.23Å; D881-V883 HydrophobicContact CB-CG2 3.98Å; D881-V883 PolarHBondContact O-N 3.29Å
882	P	30.1	Very low	32.8	Very low	77 Å²	77	100 Å²	100	50%	0.5	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.2	20.4	179.1	33.5	-37.3	0	0	0	113.5	I886	P882-I886 WeakPolarHBondContact O-CD1 3.48Å
883	V	28.6	Very low	33.6	Very low	26 Å²	26	96.1 Å²	96.1	16%	0.158	54%	0.538	C	S	.	.	H	α-helix	trans	-82.3	-36.5	-164.4	163.6	0	0	0	0	112.8	D881 D885 I886 I887 D912	D881-V883 HydrophobicContact CB-CB 4.23Å; D881-V883 HydrophobicContact CB-CG2 3.98Å; D881-V883 PolarHBondContact O-N 3.29Å; V883-D885 VanDerWaalsContact C-N 3.32Å; V883-D885 PolarHBondContact O-N 2.99Å; V883-I886 PolarHBondContact O-N 3.22Å; V883-I887 HydrophobicContact CG1-CD1 4.3Å; V883-D912 WeakPolarHBondContact CG1-O 3.49Å; V883-D912 HydrophobicContact CG2-CB 3.8Å
884	L	30.2	Very low	34.5	Very low	103 Å²	103	94.6 Å²	94.6	54%	0.539	52%	0.521	S	S	.	.	H	α-helix	trans	-75.4	-22.5	-169.2	-158.3	68	0	0	0	113.1	Q888	L884-Q888 WeakPolarHBondContact O-CG 3.27Å; L884-Q888 PolarHBondContact O-NE2 3.08Å
885	D	32.4	Very low	35.3	Very low	120 Å²	120	87 Å²	87	64%	0.642	49%	0.486	S	S	*	.	H	α-helix	trans	-78.9	-38.4	174.9	-68.2	-25	0	0	0	111.4	V883 I887 Q888	V883-D885 VanDerWaalsContact C-N 3.32Å; V883-D885 PolarHBondContact O-N 2.99Å; D885-I887 PolarHBondContact O-N 3.03Å; D885-Q888 PolarHBondContact O-N 3.48Å; D885-Q888 VanDerWaalsContact O-N 3.09Å
886	I	34.4	Very low	35.7	Very low	15 Å²	15	87.2 Å²	87.2	8%	0.077	48%	0.48	C	S	.	.	H	α-helix	trans	-58.3	-36.6	178.1	-67.2	170.9	0	0	0	111.7	P882 V883 L907 E909 L910	P882-I886 WeakPolarHBondContact O-CD1 3.48Å; V883-I886 PolarHBondContact O-N 3.22Å; I886-L907 HydrophobicContact CG2-CD2 4.3Å; I886-L907 WeakPolarHBondContact O-CD2 3.4Å; I886-E909 HydrophobicContact CD1-CB 4.12Å; I886-E909 WeakPolarHBondContact CG2-O 3.21Å; I886-L910 HydrophobicContact CG2-CD1 3.71Å; I886-L910 HydrophobicContact CG2-CG 4.22Å
887	I	35.3	Very low	36.1	Very low	50 Å²	50	90.1 Å²	90.1	26%	0.256	49%	0.488	S	S	.	.	H	α-helix	trans	-72.6	-29.9	179.6	-62.8	173.5	0	0	0	112	V883 D885 D889 L890 C913	V883-I887 HydrophobicContact CG1-CD1 4.3Å; D885-I887 PolarHBondContact O-N 3.03Å; I887-D889 VanDerWaalsContact C-N 3.34Å; I887-D889 PolarHBondContact O-N 3.38Å; I887-L890 PolarHBondContact O-N 2.79Å; I887-C913 VanDerWaalsContact CG1-SG 3.6Å
888	Q	37.7	Very low	36.9	Very low	111 Å²	111	86.8 Å²	86.8	52%	0.519	47%	0.468	S	S	.	.	H	α-helix	trans	-73.2	-23.4	-174.3	-74	173.9	73.3	0	0	113.9	L884 D885	L884-Q888 WeakPolarHBondContact O-CG 3.27Å; L884-Q888 PolarHBondContact O-NE2 3.08Å; D885-Q888 PolarHBondContact O-N 3.48Å; D885-Q888 VanDerWaalsContact O-N 3.09Å
889	D	41	Very low	37.8	Very low	103 Å²	103	81.1 Å²	81.1	55%	0.551	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	4.7	178.3	-90	-31.1	0	0	0	114.4	I887 R891 L907	I887-D889 VanDerWaalsContact C-N 3.34Å; I887-D889 PolarHBondContact O-N 3.38Å; D889-R891 VanDerWaalsContact C-N 3.32Å; D889-R891 PolarHBondContact O-N 3.39Å; D889-L907 HydrophobicContact CB-CD2 4.14Å
890	L	47.2	Very low	38.9	Very low	29 Å²	29	81.1 Å²	81.1	15%	0.152	44%	0.439	C	S	.	.			trans	-69.4	80.7	176.8	-93.7	168.5	0	0	0	113.1	I887 M892 F903 L907	I887-L890 PolarHBondContact O-N 2.79Å; L890-M892 PolarHBondContact O-N 3.26Å; L890-F903 HydrophobicContact CD2-CD1 4Å; L890-L907 HydrophobicContact CB-CD1 4.41Å; L890-L907 HydrophobicContact CD2-CD1 3.49Å; L890-L907 VanDerWaalsContact CD2-CD1 3.49Å; L890-L907 HydrophobicContact CG-CD1 3.67Å
891	R	47.4	Very low	40.3	Very low	86 Å²	86	76.6 Å²	76.6	33%	0.325	41%	0.406	S	S	.	.			trans	-75.4	111.8	174.4	-71.2	160	173.6	-92.3	-3.4	111	I835 D889 D904	I835-R891 PolarHBondContact O-NH1 3.48Å; D889-R891 VanDerWaalsContact C-N 3.32Å; D889-R891 PolarHBondContact O-N 3.39Å; R891-D904 HydrophobicContact CB-CB 3.69Å; R891-D904 WeakPolarHBondContact CD-OD2 3.28Å; R891-D904 PolarHBondContact O-N 3.35Å
892	M	51.7	Low	41.2	Very low	54 Å²	54	76.3 Å²	76.3	27%	0.266	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	139.1	169.1	-67.6	175.7	70.8	0	0	110.6	M839 L890 I901 F902 F903 L937	M839-M892 HydrophobicContact CE-CG 4.27Å; M839-M892 HydrophobicContact CE-SD 4.01Å; L890-M892 PolarHBondContact O-N 3.26Å; M892-I901 HydrophobicContact CE-CD1 4.29Å; M892-I901 HydrophobicContact CE-CG2 3.67Å; M892-F902 WeakPolarHBondContact CA-O 3.39Å; M892-F903 HydrophobicContact CE-CE1 4.38Å; M892-F903 HydrophobicContact CE-CZ 4.43Å; M892-F903 HydrophobicContact CG-CD1 3.86Å; M892-F903 HydrophobicContact CG-CE1 3.61Å; M892-F903 HydrophobicContact SD-CE1 4.07Å; M892-L937 HydrophobicContact CE-CD1 3.92Å
893	V	46.4	Very low	42.5	Very low	62 Å²	62	73.7 Å²	73.7	38%	0.376	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	116.8	177.4	-177.7	0	0	0	0	109.5	I901 F902	V893-I901 WeakPolarHBondContact O-CA 3.45Å; V893-F902 HydrophobicContact CB-CB 4.46Å; V893-F902 PolarHBondContact N-O 3.34Å; V893-F902 PolarHBondContact O-N 3.21Å
894	K	46.6	Very low	43.5	Very low	89 Å²	89	73.4 Å²	73.4	39%	0.387	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	109.7	165.6	-172.4	176.2	177.3	-176.5	0	108	L896 N899 K900 E930	K894-L896 PolarHBondContact O-N 2.59Å; K894-L896 VanDerWaalsContact O-N 3.15Å; K894-N899 WeakPolarHBondContact CE-OD1 3.33Å; K894-N899 PolarHBondContact NZ-OD1 3.49Å; K894-K900 WeakPolarHBondContact CA-O 3.36Å; K894-E930 IonicContact NZ-OE2 2.8Å; K894-E930 PolarHBondContact NZ-OE2 3.33Å
895	G	43.7	Very low	44.2	Very low	17 Å²	17	72.2 Å²	72.2	18%	0.175	38%	0.376	C	S	.	.			trans	-74.7	104.6	-176.4	0	0	0	0	0	111.8	V897 S898 N899 K900	G895-V897 VanDerWaalsContact C-N 3.3Å; G895-V897 PolarHBondContact O-N 3.23Å; G895-S898 WeakPolarHBondContact O-CA 3.12Å; G895-S898 PolarHBondContact O-N 3.47Å; G895-S898 PolarHBondContact O-OG 3.05Å; G895-N899 PolarHBondContact O-N 2.91Å; G895-K900 PolarHBondContact N-O 2.96Å
896	L	35.8	Very low	44.6	Very low	125 Å²	125	73.4 Å²	73.4	65%	0.654	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-40.6	-42.8	-172	-73.1	161.7	0	0	0	116.7	I830 K894	I830-L896 HydrophobicContact CG2-CD1 4.07Å; K894-L896 PolarHBondContact O-N 2.59Å; K894-L896 VanDerWaalsContact O-N 3.15Å
897	V	34.4	Very low	44.9	Very low	146 Å²	146	73.5 Å²	73.5	89%	0.885	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-12	-178.1	-176.8	0	0	0	0	112.7	G895	G895-V897 VanDerWaalsContact C-N 3.3Å; G895-V897 PolarHBondContact O-N 3.23Å
898	S	45.2	Very low	44.9	Very low	46 Å²	46	76.1 Å²	76.1	32%	0.322	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.4	-13.2	-167.9	74.4	0	0	0	0	114.8	G895 K900	G895-S898 WeakPolarHBondContact O-CA 3.12Å; G895-S898 PolarHBondContact O-N 3.47Å; G895-S898 PolarHBondContact O-OG 3.05Å; S898-K900 WeakPolarHBondContact O-CG 3.4Å; S898-K900 PolarHBondContact O-N 3.25Å; S898-K900 PolarHBondContact OG-N 3.14Å
899	N	44.8	Very low	44.9	Very low	80 Å²	80	76.9 Å²	76.9	43%	0.428	40%	0.398	S	S	.	.			trans	48.2	7.3	-165.9	-101.7	-1.1	0	0	0	116.8	K894 G895 E930	K894-N899 WeakPolarHBondContact CE-OD1 3.33Å; K894-N899 PolarHBondContact NZ-OD1 3.49Å; G895-N899 PolarHBondContact O-N 2.91Å; N899-E930 VanDerWaalsContact ND2-CD 3.26Å; N899-E930 PolarHBondContact ND2-OE1 3.2Å; N899-E930 PolarHBondContact ND2-OE2 2.77Å
900	K	49.8	Very low	44.8	Very low	132 Å²	132	74.4 Å²	74.4	57%	0.574	39%	0.385	S	S	*	.			trans	-85.1	145.4	-177.4	-74.4	151.1	-169.9	154.5	0	111.7	K894 G895 S898 F902	K894-K900 WeakPolarHBondContact CA-O 3.36Å; G895-K900 PolarHBondContact N-O 2.96Å; S898-K900 WeakPolarHBondContact O-CG 3.4Å; S898-K900 PolarHBondContact O-N 3.25Å; S898-K900 PolarHBondContact OG-N 3.14Å; K900-F902 HydrophobicContact CB-CE2 3.89Å; K900-F902 HydrophobicContact CB-CZ 3.99Å; K900-F902 WeakPolarHBondContact O-CD2 3.47Å; K900-F902 WeakPolarHBondContact O-CE2 3.31Å
901	I	53.6	Low	44.2	Very low	21 Å²	21	76.3 Å²	76.3	11%	0.108	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	133.4	169.9	-62.3	170.5	0	0	0	108.7	M892 V893 I932 L937 A940	M892-I901 HydrophobicContact CE-CD1 4.29Å; M892-I901 HydrophobicContact CE-CG2 3.67Å; V893-I901 WeakPolarHBondContact O-CA 3.45Å; I901-I932 HydrophobicContact CD1-CB 4.46Å; I901-I932 HydrophobicContact CD1-CD1 3.98Å; I901-I932 HydrophobicContact CD1-CG1 4.14Å; I901-I932 HydrophobicContact CD1-CG2 3.49Å; I901-I932 VanDerWaalsContact CD1-CG2 3.49Å; I901-L937 HydrophobicContact CD1-CD1 4.38Å; I901-A940 HydrophobicContact CB-CB 4.18Å; I901-A940 HydrophobicContact CG2-CB 4.17Å
902	F	49.3	Very low	43.5	Very low	110 Å²	110	77.9 Å²	77.9	48%	0.482	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	144	170.3	-54.8	-93.7	0	0	0	108.7	M892 V893 K900	M892-F902 WeakPolarHBondContact CA-O 3.39Å; V893-F902 HydrophobicContact CB-CB 4.46Å; V893-F902 PolarHBondContact N-O 3.34Å; V893-F902 PolarHBondContact O-N 3.21Å; K900-F902 HydrophobicContact CB-CE2 3.89Å; K900-F902 HydrophobicContact CB-CZ 3.99Å; K900-F902 WeakPolarHBondContact O-CD2 3.47Å; K900-F902 WeakPolarHBondContact O-CE2 3.31Å
903	F	57.2	Low	42.7	Very low	22 Å²	22	77.2 Å²	77.2	10%	0.096	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	139.5	168.3	-69.5	-79.7	0	0	0	108.9	L890 M892 A940 L941 W944	L890-F903 HydrophobicContact CD2-CD1 4Å; M892-F903 HydrophobicContact CE-CE1 4.38Å; M892-F903 HydrophobicContact CE-CZ 4.43Å; M892-F903 HydrophobicContact CG-CD1 3.86Å; M892-F903 HydrophobicContact CG-CE1 3.61Å; M892-F903 HydrophobicContact SD-CE1 4.07Å; F903-A940 HydrophobicContact CD2-CB 4.18Å; F903-A940 HydrophobicContact CE2-CB 3.8Å; F903-L941 HydrophobicContact CE2-CB 4.42Å; F903-W944 HydrophobicContact CB-CB 4.33Å; F903-W944 VanDerWaalsContact CB-CD1 3.48Å; F903-W944 HydrophobicContact CB-CG 3.91Å; F903-W944 HydrophobicContact CD2-CB 4.14Å; F903-W944 HydrophobicContact CD2-CG 4.44Å; F903-W944 HydrophobicContact CG-CG 4.45Å
904	D	49.8	Very low	42.1	Very low	21 Å²	21	77.9 Å²	77.9	11%	0.112	42%	0.417	C	S	.	.			trans	-64.1	124	178.3	-165.9	-37.8	0	0	0	110.9	R891 R906	R891-D904 HydrophobicContact CB-CB 3.69Å; R891-D904 WeakPolarHBondContact CD-OD2 3.28Å; R891-D904 PolarHBondContact O-N 3.35Å; D904-R906 PolarHBondContact O-N 3.01Å; D904-R906 VanDerWaalsContact O-N 3.1Å; D904-R906 WeakPolarHBondContact OD1-CB 3.25Å; D904-R906 VanDerWaalsContact OD1-CG 3.28Å; D904-R906 WeakPolarHBondContact OD1-CG 3.42Å; D904-R906 IonicContact OD1-CZ 3.73Å; D904-R906 PolarHBondContact OD1-N 3.25Å; D904-R906 IonicContact OD1-NE 3.63Å; D904-R906 PolarHBondContact OD1-NE 3.32Å; D904-R906 IonicContact OD1-NH2 3.86Å; D904-R906 IonicContact OD2-CZ 2.9Å; D904-R906 IonicContact OD2-NE 2.75Å; D904-R906 PolarHBondContact OD2-NE 3.47Å; D904-R906 VanDerWaalsContact OD2-NE 3.16Å; D904-R906 IonicContact OD2-NH2 2.73Å; D904-R906 PolarHBondContact OD2-NH2 3.43Å
905	P	44.1	Very low	41.7	Very low	77 Å²	77	83 Å²	83	50%	0.5	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	11.3	-175.1	32.3	-37.2	0	0	0	114.3	F947	P905-F947 HydrophobicContact CB-CD1 4.41Å; P905-F947 HydrophobicContact CB-CE1 3.62Å; P905-F947 HydrophobicContact CB-CZ 4.05Å
906	R	41.3	Very low	41.5	Very low	145 Å²	145	86.9 Å²	86.9	55%	0.547	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-5.2	-175.8	-73.7	-179.3	-80.6	-165.6	-2.7	115.9	D904 S908	D904-R906 PolarHBondContact O-N 3.01Å; D904-R906 VanDerWaalsContact O-N 3.1Å; D904-R906 WeakPolarHBondContact OD1-CB 3.25Å; D904-R906 VanDerWaalsContact OD1-CG 3.28Å; D904-R906 WeakPolarHBondContact OD1-CG 3.42Å; D904-R906 IonicContact OD1-CZ 3.73Å; D904-R906 PolarHBondContact OD1-N 3.25Å; D904-R906 IonicContact OD1-NE 3.63Å; D904-R906 PolarHBondContact OD1-NE 3.32Å; D904-R906 IonicContact OD1-NH2 3.86Å; D904-R906 IonicContact OD2-CZ 2.9Å; D904-R906 IonicContact OD2-NE 2.75Å; D904-R906 PolarHBondContact OD2-NE 3.47Å; D904-R906 VanDerWaalsContact OD2-NE 3.16Å; D904-R906 IonicContact OD2-NH2 2.73Å; D904-R906 PolarHBondContact OD2-NH2 3.43Å; R906-S908 PolarHBondContact O-N 2.94Å
907	L	40.5	Very low	41.7	Very low	18 Å²	18	84 Å²	84	9%	0.094	44%	0.435	C	S	.	.			trans	-79.1	115	176.6	-79.2	144.6	0	0	0	111.3	I886 D889 L890 M948	I886-L907 HydrophobicContact CG2-CD2 4.3Å; I886-L907 WeakPolarHBondContact O-CD2 3.4Å; D889-L907 HydrophobicContact CB-CD2 4.14Å; L890-L907 HydrophobicContact CB-CD1 4.41Å; L890-L907 HydrophobicContact CD2-CD1 3.49Å; L890-L907 VanDerWaalsContact CD2-CD1 3.49Å; L890-L907 HydrophobicContact CG-CD1 3.67Å; L907-M948 WeakPolarHBondContact O-CE 3.33Å
908	S	36	Very low	41.9	Very low	105 Å²	105	78.7 Å²	78.7	73%	0.734	40%	0.403	S	S	*	.			trans	-87.9	-18.6	-176.8	50.7	0	0	0	0	114.9	R906	R906-S908 PolarHBondContact O-N 2.94Å
909	E	37.8	Very low	41.7	Very low	126 Å²	126	83.4 Å²	83.4	59%	0.589	42%	0.42	S	S	*	.			trans	-132.6	134.9	-175.2	-62.8	-178.6	177.2	0	0	108.8	I886	I886-E909 HydrophobicContact CD1-CB 4.12Å; I886-E909 WeakPolarHBondContact CG2-O 3.21Å
910	L	38.4	Very low	41.5	Very low	52 Å²	52	81.5 Å²	81.5	27%	0.272	41%	0.411	S	S	.	.			trans	-152.2	73.9	175.8	-154	111.4	0	0	0	111.8	I886 W944	I886-L910 HydrophobicContact CG2-CD1 3.71Å; I886-L910 HydrophobicContact CG2-CG 4.22Å; L910-W944 HydrophobicContact CB-CH2 4.01Å; L910-W944 HydrophobicContact CD1-CH2 3.77Å; L910-W944 HydrophobicContact CD1-CZ2 4.38Å; L910-W944 HydrophobicContact CD2-CH2 3.82Å; L910-W944 HydrophobicContact CD2-CZ3 3.89Å; L910-W944 HydrophobicContact CG-CH2 4.06Å
911	T	33.7	Very low	41.1	Very low	68 Å²	68	77.9 Å²	77.9	42%	0.417	40%	0.398	S	S	.	.			trans	-100.1	138.1	165.5	41.5	0	0	0	0	109.5
912	D	33.8	Very low	40.4	Very low	119 Å²	119	83.8 Å²	83.8	64%	0.636	42%	0.424	S	S	*	.			trans	55.3	91.7	170.1	-55.6	-60.1	0	0	0	116.9	V883	V883-D912 WeakPolarHBondContact CG1-O 3.49Å; V883-D912 HydrophobicContact CG2-CB 3.8Å
913	C	34.3	Very low	40	Very low	41 Å²	41	81.5 Å²	81.5	28%	0.277	42%	0.422	S	S	.	.			trans	-143.3	68.2	178.9	-78.2	0	0	0	0	112.5	I887	I887-C913 VanDerWaalsContact CG1-SG 3.6Å
914	T	34.1	Very low	39.2	Very low	75 Å²	75	82.8 Å²	82.8	46%	0.46	43%	0.43	S	S	.	.			trans	-128.9	7.8	-169.9	49.8	0	0	0	0	116.7
915	K	38.4	Very low	38.7	Very low	197 Å²	197	86.3 Å²	86.3	86%	0.857	45%	0.449	S	S	*	.	S	Bend	trans	-124.6	1.3	-173.4	-77.9	-175.5	176.2	176.9	0	118
916	Q	39.7	Very low	38.5	Very low	98 Å²	98	87.1 Å²	87.1	46%	0.458	45%	0.452	S	S	.	.	S	Bend	trans	-128.9	-4.1	178.9	-71	177.9	-14.1	0	0	113.9	T918	Q916-T918 PolarHBondContact O-N 3.15Å
917	F	40.3	Very low	38.2	Very low	64 Å²	64	86.6 Å²	86.6	28%	0.281	46%	0.46	S	S	.	.	H	α-helix	trans	-71.5	-28.8	-171.7	-152	-108.5	0	0	0	113.4	V920 L921 L937	F917-V920 PolarHBondContact O-N 3.45Å; F917-L921 HydrophobicContact CD1-CD1 4.1Å; F917-L921 HydrophobicContact CE1-CD1 4.5Å; F917-L921 PolarHBondContact O-N 2.9Å; F917-L921 VanDerWaalsContact O-N 3.15Å; F917-L937 HydrophobicContact CE1-CD2 3.59Å; F917-L937 HydrophobicContact CZ-CD2 3.81Å
918	T	38.8	Very low	38	Very low	36 Å²	36	88.6 Å²	88.6	22%	0.221	48%	0.476	C	S	.	.	H	α-helix	trans	-71.9	-36.5	179.2	45.7	0	0	0	0	113.2	Q916 V920 L921 H922 E981	Q916-T918 PolarHBondContact O-N 3.15Å; T918-V920 VanDerWaalsContact C-N 3.26Å; T918-V920 PolarHBondContact O-N 2.71Å; T918-L921 PolarHBondContact O-N 2.94Å; T918-H922 PolarHBondContact O-N 3.16Å; T918-E981 VanDerWaalsContact CB-OE1 3.23Å; T918-E981 WeakPolarHBondContact CB-OE1 3.46Å; T918-E981 WeakPolarHBondContact CB-OE2 3.3Å; T918-E981 WeakPolarHBondContact CG2-OE1 3.37Å; T918-E981 VanDerWaalsContact CG2-OE2 3.26Å; T918-E981 WeakPolarHBondContact CG2-OE2 3.42Å; T918-E981 PolarHBondContact OG1-OE1 2.88Å
919	Q	39.8	Very low	38.3	Very low	145 Å²	145	93.5 Å²	93.5	68%	0.678	49%	0.486	S	S	*	.	H	α-helix	trans	-63.2	-32.4	173.5	-67.1	-177.9	-16.4	0	0	112.6	S923	Q919-S923 PolarHBondContact O-N 3.01Å; Q919-S923 PolarHBondContact O-OG 3.07Å
920	V	40.9	Very low	38.6	Very low	40 Å²	40	91.9 Å²	91.9	24%	0.242	48%	0.479	C	S	.	.	H	α-helix	trans	-72.5	-39.1	174.3	179.4	0	0	0	0	111.3	F917 T918 S923 I924	F917-V920 PolarHBondContact O-N 3.45Å; T918-V920 VanDerWaalsContact C-N 3.26Å; T918-V920 PolarHBondContact O-N 2.71Å; V920-S923 PolarHBondContact O-N 2.99Å; V920-S923 PolarHBondContact O-OG 3.45Å; V920-I924 HydrophobicContact CG1-CD1 3.75Å; V920-I924 VanDerWaalsContact O-CG1 3.3Å; V920-I924 WeakPolarHBondContact O-CG1 3.39Å; V920-I924 PolarHBondContact O-N 3.2Å
921	L	40.6	Very low	39	Very low	55 Å²	55	93.6 Å²	93.6	29%	0.288	49%	0.493	S	S	.	.	H	α-helix	trans	-63.2	-44	175.3	-75	165.8	0	0	0	112.4	F917 T918 S923 N925 L937	F917-L921 HydrophobicContact CD1-CD1 4.1Å; F917-L921 HydrophobicContact CE1-CD1 4.5Å; F917-L921 PolarHBondContact O-N 2.9Å; F917-L921 VanDerWaalsContact O-N 3.15Å; T918-L921 PolarHBondContact O-N 2.94Å; L921-S923 VanDerWaalsContact C-N 3.33Å; L921-S923 PolarHBondContact O-N 3.47Å; L921-N925 PolarHBondContact O-N 2.93Å; L921-L937 HydrophobicContact CD2-CD1 3.81Å; L921-L937 HydrophobicContact CD2-CD2 4.39Å
922	H	39.5	Very low	39.8	Very low	145 Å²	145	92.4 Å²	92.4	67%	0.671	48%	0.484	S	S	*	.	H	α-helix	trans	-66.6	-33.2	-178.9	-164.5	-33.5	0	0	0	112.7	T918	T918-H922 PolarHBondContact O-N 3.16Å
923	S	40.3	Very low	40.8	Very low	62 Å²	62	90.6 Å²	90.6	43%	0.434	48%	0.477	S	S	.	.	H	α-helix	trans	-84.2	-20.7	-178	48.6	0	0	0	0	114.3	Q919 V920 L921 T926	Q919-S923 PolarHBondContact O-N 3.01Å; Q919-S923 PolarHBondContact O-OG 3.07Å; V920-S923 PolarHBondContact O-N 2.99Å; V920-S923 PolarHBondContact O-OG 3.45Å; L921-S923 VanDerWaalsContact C-N 3.33Å; L921-S923 PolarHBondContact O-N 3.47Å; S923-T926 PolarHBondContact O-OG1 2.76Å
924	I	41.5	Very low	41.5	Very low	50 Å²	50	92.5 Å²	92.5	26%	0.256	49%	0.488	S	S	.	.	H	α-helix	trans	-76.9	-30.9	173.2	-73.8	171.7	0	0	0	111.8	V920 T926 I932	V920-I924 HydrophobicContact CG1-CD1 3.75Å; V920-I924 VanDerWaalsContact O-CG1 3.3Å; V920-I924 WeakPolarHBondContact O-CG1 3.39Å; V920-I924 PolarHBondContact O-N 3.2Å; I924-T926 VanDerWaalsContact C-N 3.27Å; I924-T926 PolarHBondContact O-N 2.87Å; I924-I932 HydrophobicContact CG2-CB 4.27Å; I924-I932 HydrophobicContact CG2-CD1 3.68Å; I924-I932 HydrophobicContact CG2-CG1 4.43Å
925	N	38.8	Very low	42.7	Very low	95 Å²	95	91.1 Å²	91.1	51%	0.508	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	0.4	-170.8	-154.7	42.6	0	0	0	115.1	L921 P931	L921-N925 PolarHBondContact O-N 2.93Å; N925-P931 VanDerWaalsContact OD1-CB 3.32Å; N925-P931 WeakPolarHBondContact OD1-CB 3.45Å
926	T	39.1	Very low	43.5	Very low	94 Å²	94	84 Å²	84	58%	0.577	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.7	-6	-174.3	52.4	0	0	0	0	115	S923 I924	S923-T926 PolarHBondContact O-OG1 2.76Å; I924-T926 VanDerWaalsContact C-N 3.27Å; I924-T926 PolarHBondContact O-N 2.87Å
927	N	36.2	Very low	44.2	Very low	134 Å²	134	79.8 Å²	79.8	72%	0.717	44%	0.439	S	S	*	.	S	Bend	trans	-130.5	20.3	-166.8	-81.1	-57	0	0	0	115.4
928	S	35.7	Very low	45.1	Very low	60 Å²	60	81.4 Å²	81.4	42%	0.42	45%	0.448	S	S	.	.	S	Bend	trans	-146.9	142.2	173.7	57.7	0	0	0	0	114.1	E930	S928-E930 PolarHBondContact O-N 3.5Å; S928-E930 PolarHBondContact OG-O 3.38Å
929	H	41.9	Very low	46.4	Very low	207 Å²	207	83 Å²	83	96%	0.958	46%	0.458	S	S	*	.	S	Bend	trans	-62.1	-1.3	178.3	-73.5	-81.7	0	0	0	115.6
930	E	45	Very low	47.3	Very low	92 Å²	92	76.8 Å²	76.8	43%	0.43	43%	0.431	S	S	.	.	S	Bend	trans	-130.3	125.2	168.1	-62.2	177.2	130.8	0	0	108.5	K894 N899 S928	K894-E930 IonicContact NZ-OE2 2.8Å; K894-E930 PolarHBondContact NZ-OE2 3.33Å; N899-E930 VanDerWaalsContact ND2-CD 3.26Å; N899-E930 PolarHBondContact ND2-OE1 3.2Å; N899-E930 PolarHBondContact ND2-OE2 2.77Å; S928-E930 PolarHBondContact O-N 3.5Å; S928-E930 PolarHBondContact OG-O 3.38Å
931	P	46.5	Very low	48.1	Very low	89 Å²	89	76.3 Å²	76.3	58%	0.578	43%	0.427	S	S	*	.			trans	-75	134	176	29.4	-33.6	0	0	0	111.4	N925 T933	N925-P931 VanDerWaalsContact OD1-CB 3.32Å; N925-P931 WeakPolarHBondContact OD1-CB 3.45Å; P931-T933 PolarHBondContact O-N 3.14Å; P931-T933 VanDerWaalsContact O-N 3.09Å
932	I	49.8	Very low	49.2	Very low	43 Å²	43	77 Å²	77	22%	0.221	43%	0.431	C	S	.	.			trans	-75.5	100.7	173.6	-76.3	169.3	0	0	0	108.6	I901 I924 L937	I901-I932 HydrophobicContact CD1-CB 4.46Å; I901-I932 HydrophobicContact CD1-CD1 3.98Å; I901-I932 HydrophobicContact CD1-CG1 4.14Å; I901-I932 HydrophobicContact CD1-CG2 3.49Å; I901-I932 VanDerWaalsContact CD1-CG2 3.49Å; I924-I932 HydrophobicContact CG2-CB 4.27Å; I924-I932 HydrophobicContact CG2-CD1 3.68Å; I924-I932 HydrophobicContact CG2-CG1 4.43Å; I932-L937 HydrophobicContact CG2-CB 4.38Å; I932-L937 HydrophobicContact CG2-CD1 4.02Å
933	T	54.5	Low	50.3	Low	80 Å²	80	76.2 Å²	76.2	49%	0.491	43%	0.425	S	S	.	.			trans	-66.2	140.6	-177.9	63.9	0	0	0	0	111.4	P931 A935 S936 L937	P931-T933 PolarHBondContact O-N 3.14Å; P931-T933 VanDerWaalsContact O-N 3.09Å; T933-A935 PolarHBondContact O-N 3.05Å; T933-A935 VanDerWaalsContact O-N 3.16Å; T933-S936 WeakPolarHBondContact O-CB 3.21Å; T933-S936 PolarHBondContact O-N 2.82Å; T933-S936 PolarHBondContact O-OG 3.18Å; T933-S936 WeakPolarHBondContact OG1-CB 3.37Å; T933-S936 PolarHBondContact OG1-N 3.2Å; T933-S936 PolarHBondContact OG1-OG 2.98Å; T933-L937 PolarHBondContact O-N 2.6Å
934	V	50.4	Low	51.4	Low	82 Å²	82	74.2 Å²	74.2	50%	0.497	41%	0.408	S	S	.	.	H	α-helix	trans	-52.2	-39.4	176.3	-180	0	0	0	0	111.2	S936 L937 Q938 I978	V934-S936 PolarHBondContact O-N 2.81Å; V934-L937 PolarHBondContact O-N 2.95Å; V934-Q938 VanDerWaalsContact O-CB 3.27Å; V934-Q938 WeakPolarHBondContact O-CB 3.45Å; V934-Q938 PolarHBondContact O-N 2.98Å; V934-I978 HydrophobicContact CG1-CD1 4.45Å
935	A	58.1	Low	52	Low	46 Å²	46	73.7 Å²	73.7	38%	0.38	41%	0.406	S	S	.	.	H	α-helix	trans	-62.5	-37.3	176.3	0	0	0	0	0	113.5	T933 T939	T933-A935 PolarHBondContact O-N 3.05Å; T933-A935 VanDerWaalsContact O-N 3.16Å; A935-T939 VanDerWaalsContact O-CB 3.26Å; A935-T939 WeakPolarHBondContact O-CB 3.33Å; A935-T939 PolarHBondContact O-N 3.28Å; A935-T939 PolarHBondContact O-OG1 2.93Å
936	S	55.8	Low	53	Low	46 Å²	46	76 Å²	76	32%	0.322	41%	0.413	S	S	.	.	H	α-helix	trans	-66.8	-40.3	176.3	74.5	0	0	0	0	111.7	T933 V934 T939 A940	T933-S936 WeakPolarHBondContact O-CB 3.21Å; T933-S936 PolarHBondContact O-N 2.82Å; T933-S936 PolarHBondContact O-OG 3.18Å; T933-S936 WeakPolarHBondContact OG1-CB 3.37Å; T933-S936 PolarHBondContact OG1-N 3.2Å; T933-S936 PolarHBondContact OG1-OG 2.98Å; V934-S936 PolarHBondContact O-N 2.81Å; S936-T939 WeakPolarHBondContact O-CB 3.23Å; S936-T939 PolarHBondContact O-N 2.66Å; S936-A940 PolarHBondContact O-N 2.82Å
937	L	55.1	Low	53.8	Low	11 Å²	11	75.9 Å²	75.9	6%	0.058	41%	0.405	C	S	.	.	H	α-helix	trans	-76.7	-39.6	-177.9	-164.3	144.8	0	0	0	111.6	M892 I901 F917 L921 I932 T933 V934 T939 A940 L941	M892-L937 HydrophobicContact CE-CD1 3.92Å; I901-L937 HydrophobicContact CD1-CD1 4.38Å; F917-L937 HydrophobicContact CE1-CD2 3.59Å; F917-L937 HydrophobicContact CZ-CD2 3.81Å; L921-L937 HydrophobicContact CD2-CD1 3.81Å; L921-L937 HydrophobicContact CD2-CD2 4.39Å; I932-L937 HydrophobicContact CG2-CB 4.38Å; I932-L937 HydrophobicContact CG2-CD1 4.02Å; T933-L937 PolarHBondContact O-N 2.6Å; V934-L937 PolarHBondContact O-N 2.95Å; L937-T939 VanDerWaalsContact C-N 3.29Å; L937-T939 PolarHBondContact O-N 2.85Å; L937-A940 PolarHBondContact O-N 2.84Å; L937-L941 WeakPolarHBondContact O-CB 3.47Å; L937-L941 PolarHBondContact O-N 3.46Å
938	Q	59.2	Low	54.4	Low	98 Å²	98	70.8 Å²	70.8	46%	0.458	38%	0.377	S	S	.	.	H	α-helix	trans	-60.2	-38	168.5	-169.2	-177.7	28.6	0	0	111.6	V934 L941 N942	V934-Q938 VanDerWaalsContact O-CB 3.27Å; V934-Q938 WeakPolarHBondContact O-CB 3.45Å; V934-Q938 PolarHBondContact O-N 2.98Å; Q938-L941 PolarHBondContact O-N 3.11Å; Q938-N942 VanDerWaalsContact O-CB 3.3Å; Q938-N942 WeakPolarHBondContact O-CB 3.35Å; Q938-N942 VanDerWaalsContact O-CG 3.23Å; Q938-N942 PolarHBondContact O-N 3.05Å; Q938-N942 PolarHBondContact O-ND2 3.38Å
939	T	64.6	Low	55.3	Low	70 Å²	70	72.8 Å²	72.8	43%	0.429	38%	0.382	S	S	.	.	H	α-helix	trans	-67.4	-37.5	174.7	-62.8	0	0	0	0	112.4	A935 S936 L937 K943	A935-T939 VanDerWaalsContact O-CB 3.26Å; A935-T939 WeakPolarHBondContact O-CB 3.33Å; A935-T939 PolarHBondContact O-N 3.28Å; A935-T939 PolarHBondContact O-OG1 2.93Å; S936-T939 WeakPolarHBondContact O-CB 3.23Å; S936-T939 PolarHBondContact O-N 2.66Å; L937-T939 VanDerWaalsContact C-N 3.29Å; L937-T939 PolarHBondContact O-N 2.85Å; T939-K943 HydrophobicContact CG2-CD 4.42Å; T939-K943 WeakPolarHBondContact O-CG 3.49Å; T939-K943 PolarHBondContact O-N 2.89Å
940	A	59	Low	55.7	Low	13 Å²	13	65 Å²	65	11%	0.107	36%	0.358	C	S	.	.	H	α-helix	trans	-67.9	-45.1	174.5	0	0	0	0	0	111.4	I901 F903 S936 L937 K943 W944	I901-A940 HydrophobicContact CB-CB 4.18Å; I901-A940 HydrophobicContact CG2-CB 4.17Å; F903-A940 HydrophobicContact CD2-CB 4.18Å; F903-A940 HydrophobicContact CE2-CB 3.8Å; S936-A940 PolarHBondContact O-N 2.82Å; L937-A940 PolarHBondContact O-N 2.84Å; A940-K943 PolarHBondContact O-N 3.18Å; A940-W944 WeakPolarHBondContact O-CB 3.49Å; A940-W944 PolarHBondContact O-N 3.26Å
941	L	59.2	Low	55.8	Low	31 Å²	31	66 Å²	66	16%	0.162	36%	0.363	C	S	.	.	H	α-helix	trans	-61.1	-47.9	177.5	-171	75.4	0	0	0	111.4	F903 L937 Q938 K943 W944 L945 L974	F903-L941 HydrophobicContact CE2-CB 4.42Å; L937-L941 WeakPolarHBondContact O-CB 3.47Å; L937-L941 PolarHBondContact O-N 3.46Å; Q938-L941 PolarHBondContact O-N 3.11Å; L941-K943 VanDerWaalsContact C-N 3.32Å; L941-K943 PolarHBondContact O-N 3.44Å; L941-W944 PolarHBondContact O-N 2.92Å; L941-L945 HydrophobicContact CG-CD1 4.13Å; L941-L945 WeakPolarHBondContact O-CB 3.3Å; L941-L945 WeakPolarHBondContact O-CG 3.25Å; L941-L945 PolarHBondContact O-N 3.07Å; L941-L974 HydrophobicContact CD2-CD1 3.65Å
942	N	63.5	Low	55.4	Low	69 Å²	69	66.5 Å²	66.5	37%	0.369	36%	0.361	S	S	.	.	H	α-helix	trans	-59.3	-40.7	178	-77.9	-21.1	0	0	0	112.3	Q938 L945 E946	Q938-N942 VanDerWaalsContact O-CB 3.3Å; Q938-N942 WeakPolarHBondContact O-CB 3.35Å; Q938-N942 VanDerWaalsContact O-CG 3.23Å; Q938-N942 PolarHBondContact O-N 3.05Å; Q938-N942 PolarHBondContact O-ND2 3.38Å; N942-L945 PolarHBondContact O-N 3.45Å; N942-E946 WeakPolarHBondContact O-CB 3.48Å; N942-E946 WeakPolarHBondContact O-CG 3.47Å; N942-E946 PolarHBondContact O-N 3.4Å
943	K	62.7	Low	54.8	Low	129 Å²	129	72 Å²	72	56%	0.561	39%	0.385	S	S	*	.	H	α-helix	trans	-69.2	-37.6	176.4	-75.5	173.4	179.6	173.5	0	113.1	T939 A940 L941 E946 F947	T939-K943 HydrophobicContact CG2-CD 4.42Å; T939-K943 WeakPolarHBondContact O-CG 3.49Å; T939-K943 PolarHBondContact O-N 2.89Å; A940-K943 PolarHBondContact O-N 3.18Å; L941-K943 VanDerWaalsContact C-N 3.32Å; L941-K943 PolarHBondContact O-N 3.44Å; K943-E946 PolarHBondContact O-N 2.9Å; K943-F947 WeakPolarHBondContact O-CB 3.44Å; K943-F947 PolarHBondContact O-N 2.9Å
944	W	62	Low	53.8	Low	19 Å²	19	73.3 Å²	73.3	7%	0.072	40%	0.398	C	S	.	.	H	α-helix	trans	-68.3	-39.8	175.4	178.6	91.1	0	0	0	110.9	F903 L910 A940 L941 F947 M948	F903-W944 HydrophobicContact CB-CB 4.33Å; F903-W944 VanDerWaalsContact CB-CD1 3.48Å; F903-W944 HydrophobicContact CB-CG 3.91Å; F903-W944 HydrophobicContact CD2-CB 4.14Å; F903-W944 HydrophobicContact CD2-CG 4.44Å; F903-W944 HydrophobicContact CG-CG 4.45Å; L910-W944 HydrophobicContact CB-CH2 4.01Å; L910-W944 HydrophobicContact CD1-CH2 3.77Å; L910-W944 HydrophobicContact CD1-CZ2 4.38Å; L910-W944 HydrophobicContact CD2-CH2 3.82Å; L910-W944 HydrophobicContact CD2-CZ3 3.89Å; L910-W944 HydrophobicContact CG-CH2 4.06Å; A940-W944 WeakPolarHBondContact O-CB 3.49Å; A940-W944 PolarHBondContact O-N 3.26Å; L941-W944 PolarHBondContact O-N 2.92Å; W944-F947 WeakPolarHBondContact O-CB 3.48Å; W944-F947 PolarHBondContact O-N 3.43Å; W944-M948 HydrophobicContact CD2-CG 3.95Å; W944-M948 HydrophobicContact CE3-CG 4.2Å; W944-M948 HydrophobicContact CH2-CG 3.78Å; W944-M948 HydrophobicContact CZ2-CE 4.27Å; W944-M948 HydrophobicContact CZ2-CG 3.55Å; W944-M948 HydrophobicContact CZ2-SD 4.09Å; W944-M948 HydrophobicContact CZ3-CG 4.11Å; W944-M948 WeakPolarHBondContact O-CB 3.37Å; W944-M948 WeakPolarHBondContact O-CG 3.48Å; W944-M948 PolarHBondContact O-N 2.84Å
945	L	55.1	Low	52.8	Low	40 Å²	40	73.2 Å²	73.2	21%	0.209	40%	0.4	C	S	.	.	H	α-helix	trans	-62.4	-44.8	170.9	-72.7	169.3	0	0	0	112.1	L941 N942 F947 M948 I949	L941-L945 HydrophobicContact CG-CD1 4.13Å; L941-L945 WeakPolarHBondContact O-CB 3.3Å; L941-L945 WeakPolarHBondContact O-CG 3.25Å; L941-L945 PolarHBondContact O-N 3.07Å; N942-L945 PolarHBondContact O-N 3.45Å; L945-F947 VanDerWaalsContact C-N 3.3Å; L945-F947 PolarHBondContact O-N 3.13Å; L945-M948 PolarHBondContact O-N 2.86Å; L945-I949 WeakPolarHBondContact O-CB 3.3Å; L945-I949 WeakPolarHBondContact O-CD1 3.31Å; L945-I949 WeakPolarHBondContact O-CG1 3.13Å; L945-I949 PolarHBondContact O-N 3.35Å
946	E	60.3	Low	51.5	Low	143 Å²	143	77.1 Å²	77.1	67%	0.668	42%	0.422	S	S	*	.	H	α-helix	trans	-58.5	-40.3	173.4	-78.5	-177.9	158.6	0	0	111.9	N942 K943 G950	N942-E946 WeakPolarHBondContact O-CB 3.48Å; N942-E946 WeakPolarHBondContact O-CG 3.47Å; N942-E946 PolarHBondContact O-N 3.4Å; K943-E946 PolarHBondContact O-N 2.9Å; E946-G950 PolarHBondContact O-N 2.84Å
947	F	54.6	Low	50.4	Low	91 Å²	91	80.7 Å²	80.7	40%	0.399	44%	0.442	S	S	.	.	H	α-helix	trans	-66	-48.6	175.4	178.7	-93.9	0	0	0	112.2	P905 K943 W944 L945 I949 G950 Q951	P905-F947 HydrophobicContact CB-CD1 4.41Å; P905-F947 HydrophobicContact CB-CE1 3.62Å; P905-F947 HydrophobicContact CB-CZ 4.05Å; K943-F947 WeakPolarHBondContact O-CB 3.44Å; K943-F947 PolarHBondContact O-N 2.9Å; W944-F947 WeakPolarHBondContact O-CB 3.48Å; W944-F947 PolarHBondContact O-N 3.43Å; L945-F947 VanDerWaalsContact C-N 3.3Å; L945-F947 PolarHBondContact O-N 3.13Å; F947-I949 PolarHBondContact O-N 3.46Å; F947-G950 CarbonylContact O-C 3.59Å; F947-G950 WeakPolarHBondContact O-CA 3.37Å; F947-G950 PolarHBondContact O-N 3.07Å; F947-Q951 HydrophobicContact CD1-CG 4.2Å; F947-Q951 HydrophobicContact CE1-CG 3.87Å; F947-Q951 HydrophobicContact CZ-CG 4.08Å; F947-Q951 WeakPolarHBondContact O-CG 3.47Å; F947-Q951 PolarHBondContact O-N 3.05Å
948	M	49.1	Very low	49.2	Very low	28 Å²	28	84.8 Å²	84.8	14%	0.138	47%	0.467	C	S	.	.	H	α-helix	trans	-65.4	-36	-179.9	-71.4	-59.8	-72.5	0	0	113.1	L907 W944 L945 G950 N952	L907-M948 WeakPolarHBondContact O-CE 3.33Å; W944-M948 HydrophobicContact CD2-CG 3.95Å; W944-M948 HydrophobicContact CE3-CG 4.2Å; W944-M948 HydrophobicContact CH2-CG 3.78Å; W944-M948 HydrophobicContact CZ2-CE 4.27Å; W944-M948 HydrophobicContact CZ2-CG 3.55Å; W944-M948 HydrophobicContact CZ2-SD 4.09Å; W944-M948 HydrophobicContact CZ3-CG 4.11Å; W944-M948 WeakPolarHBondContact O-CB 3.37Å; W944-M948 WeakPolarHBondContact O-CG 3.48Å; W944-M948 PolarHBondContact O-N 2.84Å; L945-M948 PolarHBondContact O-N 2.86Å; M948-G950 VanDerWaalsContact C-N 3.34Å; M948-N952 PolarHBondContact O-N 3.1Å; M948-N952 PolarHBondContact O-ND2 2.81Å
949	I	54.4	Low	47.9	Very low	101 Å²	101	84.1 Å²	84.1	52%	0.518	47%	0.474	S	S	.	.	H	α-helix	trans	-65.8	-40	170.4	-68.5	166.3	0	0	0	110	L945 F947 H953	L945-I949 WeakPolarHBondContact O-CB 3.3Å; L945-I949 WeakPolarHBondContact O-CD1 3.31Å; L945-I949 WeakPolarHBondContact O-CG1 3.13Å; L945-I949 PolarHBondContact O-N 3.35Å; F947-I949 PolarHBondContact O-N 3.46Å; I949-H953 PolarHBondContact O-CD2 2.85Å; I949-H953 VanDerWaalsContact O-CD2 3.3Å
950	G	50.5	Low	46.4	Very low	44 Å²	44	86.9 Å²	86.9	45%	0.454	49%	0.49	S	S	.	.	H	α-helix	trans	-63.3	-36.3	176.4	0	0	0	0	0	114.9	E946 F947 M948	E946-G950 PolarHBondContact O-N 2.84Å; F947-G950 CarbonylContact O-C 3.59Å; F947-G950 WeakPolarHBondContact O-CA 3.37Å; F947-G950 PolarHBondContact O-N 3.07Å; M948-G950 VanDerWaalsContact C-N 3.34Å
951	Q	46.4	Very low	45.4	Very low	113 Å²	113	90.1 Å²	90.1	53%	0.528	51%	0.512	S	S	.	.	H	α-helix	trans	-72.7	-34.4	179.5	-66.8	-65	-8	0	0	113	F947 H953	F947-Q951 HydrophobicContact CD1-CG 4.2Å; F947-Q951 HydrophobicContact CE1-CG 3.87Å; F947-Q951 HydrophobicContact CZ-CG 4.08Å; F947-Q951 WeakPolarHBondContact O-CG 3.47Å; F947-Q951 PolarHBondContact O-N 3.05Å; Q951-H953 PolarHBondContact O-N 3.03Å
952	N	40.1	Very low	44.4	Very low	100 Å²	100	91.5 Å²	91.5	54%	0.535	52%	0.523	S	S	.	.			trans	-78.9	35.6	-175	-79.8	-61.4	0	0	0	114.6	M948	M948-N952 PolarHBondContact O-N 3.1Å; M948-N952 PolarHBondContact O-ND2 2.81Å
953	H	35.7	Very low	43.1	Very low	158 Å²	158	95 Å²	95	73%	0.731	54%	0.535	S	S	*	.			trans	-98.7	20.6	-175.6	-96.5	-77.2	0	0	0	114.7	I949 Q951	I949-H953 PolarHBondContact O-CD2 2.85Å; I949-H953 VanDerWaalsContact O-CD2 3.3Å; Q951-H953 PolarHBondContact O-N 3.03Å
954	S	34	Very low	42	Very low	108 Å²	108	94.3 Å²	94.3	76%	0.755	54%	0.537	S	S	*	.			trans	-121.5	21.6	-169.8	52.5	0	0	0	0	115.8
955	S	30	Very low	40.9	Very low	79 Å²	79	98.9 Å²	98.9	55%	0.552	56%	0.563	S	S	*	*			trans	-134.1	118.2	173.5	57.9	0	0	0	0	113	T957	S955-T957 PolarHBondContact O-N 3.32Å
956	P	30.5	Very low	40.2	Very low	129 Å²	129	101.5 Å²	101.5	84%	0.838	58%	0.576	S	S	*	*			trans	-94.3	26.1	-169.2	36.9	-36.2	0	0	0	115.3
957	T	32.5	Very low	39.4	Very low	120 Å²	120	99.8 Å²	99.8	74%	0.736	57%	0.567	S	S	*	*			trans	-140.4	41.1	-167.4	57	0	0	0	0	115.9	S955	S955-T957 PolarHBondContact O-N 3.32Å
958	V	30.8	Very low	39	Very low	98 Å²	98	99.3 Å²	99.3	59%	0.594	57%	0.568	S	S	*	*			trans	-136.3	133.3	167.4	-172.3	0	0	0	0	110.7
959	S	31.2	Very low	38.7	Very low	84 Å²	84	101.2 Å²	101.2	59%	0.587	58%	0.584	S	S	*	*			trans	-65.1	155.9	179.8	50.7	0	0	0	0	112.9	S961 P962	S959-S961 VanDerWaalsContact C-N 3.29Å; S959-S961 PolarHBondContact O-N 2.88Å; S959-P962 VanDerWaalsContact O-CD 3.28Å; S959-P962 WeakPolarHBondContact O-CD 3.45Å
960	T	33.3	Very low	38.3	Very low	128 Å²	128	98.6 Å²	98.6	79%	0.785	57%	0.571	S	S	*	*	S	Bend	trans	-81.7	10.4	-167	40.1	0	0	0	0	115.9
961	S	37.7	Very low	38.3	Very low	81 Å²	81	100.1 Å²	100.1	57%	0.566	57%	0.566	S	S	*	*	S	Bend	trans	-80.7	-39	-176.2	44.2	0	0	0	0	117.1	S959	S959-S961 VanDerWaalsContact C-N 3.29Å; S959-S961 PolarHBondContact O-N 2.88Å
962	P	37.2	Very low	38.4	Very low	60 Å²	60	99.1 Å²	99.1	39%	0.39	56%	0.564	S	S	.	*	H	α-helix	trans	-81	-25.6	-174.6	31.4	-33.4	0	0	0	113.2	S959 L964 N965 L966	S959-P962 VanDerWaalsContact O-CD 3.28Å; S959-P962 WeakPolarHBondContact O-CD 3.45Å; P962-L964 VanDerWaalsContact C-N 3.28Å; P962-L964 PolarHBondContact O-N 3.46Å; P962-N965 PolarHBondContact O-N 3.48Å; P962-L966 PolarHBondContact O-N 3.14Å
963	K	37.3	Very low	38.7	Very low	141 Å²	141	96.1 Å²	96.1	61%	0.613	55%	0.551	S	S	*	*	H	α-helix	trans	-65.9	-25.5	-171.6	-63.8	-170.1	176.7	-171.6	0	114
964	L	38.9	Very low	39.2	Very low	115 Å²	115	91 Å²	91	60%	0.602	53%	0.529	S	S	*	.	H	α-helix	trans	-83.6	-41.9	173.3	-99.3	159	0	0	0	112.1	P962 L966 K967 L968	P962-L964 VanDerWaalsContact C-N 3.28Å; P962-L964 PolarHBondContact O-N 3.46Å; L964-L966 PolarHBondContact O-N 3.2Å; L964-K967 PolarHBondContact O-N 3.01Å; L964-L968 HydrophobicContact CD2-CD1 4.48Å; L964-L968 WeakPolarHBondContact O-CB 3.43Å; L964-L968 PolarHBondContact O-N 3.19Å
965	N	38.3	Very low	39.9	Very low	115 Å²	115	90.3 Å²	90.3	62%	0.615	52%	0.516	S	S	*	.	H	α-helix	trans	-63.1	-40.2	178.8	-76.6	-0.1	0	0	0	112.3	P962 L968 S969	P962-N965 PolarHBondContact O-N 3.48Å; N965-L968 PolarHBondContact O-N 3.3Å; N965-S969 VanDerWaalsContact O-CB 3.26Å; N965-S969 WeakPolarHBondContact O-CB 3.34Å; N965-S969 PolarHBondContact O-N 2.98Å
966	L	40.7	Very low	40.7	Very low	95 Å²	95	92.8 Å²	92.8	50%	0.497	52%	0.519	S	S	.	.	H	α-helix	trans	-65.4	-41.3	179.9	-139	164.8	0	0	0	111.2	P962 L964 S969 I970	P962-L966 PolarHBondContact O-N 3.14Å; L964-L966 PolarHBondContact O-N 3.2Å; L966-S969 PolarHBondContact O-N 2.88Å; L966-I970 HydrophobicContact CD2-CD1 3.58Å; L966-I970 HydrophobicContact CD2-CG1 4.22Å; L966-I970 WeakPolarHBondContact O-CG1 3.27Å; L966-I970 PolarHBondContact O-N 2.82Å
967	K	44.6	Very low	41.2	Very low	107 Å²	107	88 Å²	88	47%	0.465	49%	0.491	S	S	.	.	H	α-helix	trans	-62.7	-50.4	172.6	177.5	169.4	175.7	168.7	0	111.9	L964 S969 I970 E971	L964-K967 PolarHBondContact O-N 3.01Å; K967-S969 VanDerWaalsContact C-N 3.29Å; K967-S969 PolarHBondContact O-N 3.45Å; K967-I970 PolarHBondContact O-N 3.13Å; K967-E971 WeakPolarHBondContact CE-OE1 3.38Å; K967-E971 WeakPolarHBondContact CE-OE2 3.34Å; K967-E971 HydrophobicContact CG-CG 4.37Å; K967-E971 IonicContact NZ-OE1 3.59Å; K967-E971 PolarHBondContact NZ-OE1 3.28Å; K967-E971 WeakPolarHBondContact O-CB 3.41Å; K967-E971 WeakPolarHBondContact O-CG 3.42Å; K967-E971 PolarHBondContact O-N 3.16Å
968	L	46.4	Very low	41.6	Very low	81 Å²	81	85.6 Å²	85.6	42%	0.424	47%	0.473	S	S	.	.	H	α-helix	trans	-62.5	-33.9	178.2	-91.3	152.7	0	0	0	112.6	L964 N965 N972	L964-L968 HydrophobicContact CD2-CD1 4.48Å; L964-L968 WeakPolarHBondContact O-CB 3.43Å; L964-L968 PolarHBondContact O-N 3.19Å; N965-L968 PolarHBondContact O-N 3.3Å; L968-N972 WeakPolarHBondContact O-CB 3.3Å; L968-N972 PolarHBondContact O-N 3.11Å; L968-N972 PolarHBondContact O-ND2 3.37Å
969	S	42.4	Very low	42.1	Very low	69 Å²	69	85.5 Å²	85.5	48%	0.483	47%	0.469	S	S	.	.	H	α-helix	trans	-70.3	-42	177	-161.6	0	0	0	0	111.6	N965 L966 K967 S973	N965-S969 VanDerWaalsContact O-CB 3.26Å; N965-S969 WeakPolarHBondContact O-CB 3.34Å; N965-S969 PolarHBondContact O-N 2.98Å; L966-S969 PolarHBondContact O-N 2.88Å; K967-S969 VanDerWaalsContact C-N 3.29Å; K967-S969 PolarHBondContact O-N 3.45Å; S969-S973 WeakPolarHBondContact O-CB 3.31Å; S969-S973 PolarHBondContact O-N 3.42Å; S969-S973 PolarHBondContact O-OG 3.32Å
970	I	46.4	Very low	42.6	Very low	45 Å²	45	85.5 Å²	85.5	23%	0.231	47%	0.465	C	S	.	.	H	α-helix	trans	-67	-45.7	175.1	-69.6	170.9	0	0	0	110.5	L966 K967 L974	L966-I970 HydrophobicContact CD2-CD1 3.58Å; L966-I970 HydrophobicContact CD2-CG1 4.22Å; L966-I970 WeakPolarHBondContact O-CG1 3.27Å; L966-I970 PolarHBondContact O-N 2.82Å; K967-I970 PolarHBondContact O-N 3.13Å; I970-L974 HydrophobicContact CG2-CD1 3.77Å; I970-L974 VanDerWaalsContact O-CB 3.3Å; I970-L974 WeakPolarHBondContact O-CB 3.48Å; I970-L974 WeakPolarHBondContact O-CG 3.5Å; I970-L974 PolarHBondContact O-N 3.17Å
971	E	50.9	Low	42.7	Very low	77 Å²	77	84.9 Å²	84.9	36%	0.36	45%	0.454	S	S	.	.	H	α-helix	trans	-61.7	-43.6	176.5	-74.5	179.2	152.7	0	0	111.6	K967 L975	K967-E971 WeakPolarHBondContact CE-OE1 3.38Å; K967-E971 WeakPolarHBondContact CE-OE2 3.34Å; K967-E971 HydrophobicContact CG-CG 4.37Å; K967-E971 IonicContact NZ-OE1 3.59Å; K967-E971 PolarHBondContact NZ-OE1 3.28Å; K967-E971 WeakPolarHBondContact O-CB 3.41Å; K967-E971 WeakPolarHBondContact O-CG 3.42Å; K967-E971 PolarHBondContact O-N 3.16Å; E971-L975 WeakPolarHBondContact O-CB 3.33Å; E971-L975 PolarHBondContact O-N 3.36Å
972	N	47.7	Very low	42.5	Very low	91 Å²	91	87.8 Å²	87.8	49%	0.487	46%	0.462	S	S	.	.	H	α-helix	trans	-68.4	-48.5	178.1	-73.3	-16.3	0	0	0	112.5	L968 L974 L975 E976	L968-N972 WeakPolarHBondContact O-CB 3.3Å; L968-N972 PolarHBondContact O-N 3.11Å; L968-N972 PolarHBondContact O-ND2 3.37Å; N972-L974 VanDerWaalsContact C-N 3.31Å; N972-L974 PolarHBondContact O-N 3.5Å; N972-L975 CarbonylContact O-C 3.57Å; N972-L975 PolarHBondContact O-N 2.79Å; N972-L975 VanDerWaalsContact O-N 3.17Å; N972-E976 VanDerWaalsContact O-CB 3.29Å; N972-E976 WeakPolarHBondContact O-CB 3.41Å; N972-E976 PolarHBondContact O-N 2.97Å
973	S	45.9	Very low	42.2	Very low	38 Å²	38	92 Å²	92	27%	0.266	48%	0.481	S	S	.	.	H	α-helix	trans	-67.6	-30	-179.5	-65.6	0	0	0	0	112.8	S969 A977	S969-S973 WeakPolarHBondContact O-CB 3.31Å; S969-S973 PolarHBondContact O-N 3.42Å; S969-S973 PolarHBondContact O-OG 3.32Å; S973-A977 WeakPolarHBondContact O-CB 3.42Å; S973-A977 PolarHBondContact O-N 3.13Å
974	L	45.5	Very low	41.8	Very low	49 Å²	49	92 Å²	92	26%	0.257	49%	0.485	S	S	.	.	H	α-helix	trans	-71.1	-41.2	169.7	-74.7	168.6	0	0	0	111.8	L941 I970 N972 E976 I978	L941-L974 HydrophobicContact CD2-CD1 3.65Å; I970-L974 HydrophobicContact CG2-CD1 3.77Å; I970-L974 VanDerWaalsContact O-CB 3.3Å; I970-L974 WeakPolarHBondContact O-CB 3.48Å; I970-L974 WeakPolarHBondContact O-CG 3.5Å; I970-L974 PolarHBondContact O-N 3.17Å; N972-L974 VanDerWaalsContact C-N 3.31Å; N972-L974 PolarHBondContact O-N 3.5Å; L974-E976 VanDerWaalsContact C-N 3.32Å; L974-E976 PolarHBondContact O-N 3.13Å; L974-I978 VanDerWaalsContact O-CB 3.26Å; L974-I978 WeakPolarHBondContact O-CB 3.5Å; L974-I978 WeakPolarHBondContact O-CD1 3.25Å; L974-I978 WeakPolarHBondContact O-CG1 3.27Å; L974-I978 PolarHBondContact O-N 3.46Å
975	L	50.1	Low	41.3	Very low	95 Å²	95	92.5 Å²	92.5	50%	0.497	50%	0.499	S	S	.	.	H	α-helix	trans	-62.4	-38.8	172.1	-92.9	156.8	0	0	0	112.1	E971 N972 N979	E971-L975 WeakPolarHBondContact O-CB 3.33Å; E971-L975 PolarHBondContact O-N 3.36Å; N972-L975 CarbonylContact O-C 3.57Å; N972-L975 PolarHBondContact O-N 2.79Å; N972-L975 VanDerWaalsContact O-N 3.17Å; L975-N979 VanDerWaalsContact O-CB 3.3Å; L975-N979 WeakPolarHBondContact O-CB 3.5Å; L975-N979 VanDerWaalsContact O-CG 3.24Å; L975-N979 PolarHBondContact O-N 3Å; L975-N979 PolarHBondContact O-ND2 3.12Å
976	E	46.1	Very low	40.8	Very low	130 Å²	130	96.4 Å²	96.4	61%	0.607	51%	0.513	S	S	*	.	H	α-helix	trans	-68.8	-45.8	179.8	-166.7	163.6	-136.2	0	0	110.8	N972 L974 N979 T980	N972-E976 VanDerWaalsContact O-CB 3.29Å; N972-E976 WeakPolarHBondContact O-CB 3.41Å; N972-E976 PolarHBondContact O-N 2.97Å; L974-E976 VanDerWaalsContact C-N 3.32Å; L974-E976 PolarHBondContact O-N 3.13Å; E976-N979 PolarHBondContact O-N 3.34Å; E976-T980 WeakPolarHBondContact O-CG2 3.48Å; E976-T980 PolarHBondContact O-N 3.04Å; E976-T980 PolarHBondContact O-OG1 3.4Å
977	A	40.4	Very low	40.3	Very low	30 Å²	30	101.1 Å²	101.1	25%	0.248	53%	0.533	C	S	.	.	H	α-helix	trans	-63.1	-41.1	173.2	0	0	0	0	0	113.2	S973 N979 T980 E981	S973-A977 WeakPolarHBondContact O-CB 3.42Å; S973-A977 PolarHBondContact O-N 3.13Å; A977-N979 VanDerWaalsContact C-N 3.29Å; A977-N979 PolarHBondContact O-N 2.82Å; A977-T980 PolarHBondContact O-N 3.48Å; A977-T980 PolarHBondContact O-OG1 2.76Å; A977-E981 PolarHBondContact O-N 3.31Å
978	I	42	Very low	39.5	Very low	68 Å²	68	103.5 Å²	103.5	35%	0.349	55%	0.551	S	S	.	*	H	α-helix	trans	-65.6	-32	176.3	-72.1	166.6	0	0	0	111.4	V934 L974	V934-I978 HydrophobicContact CG1-CD1 4.45Å; L974-I978 VanDerWaalsContact O-CB 3.26Å; L974-I978 WeakPolarHBondContact O-CB 3.5Å; L974-I978 WeakPolarHBondContact O-CD1 3.25Å; L974-I978 WeakPolarHBondContact O-CG1 3.27Å; L974-I978 PolarHBondContact O-N 3.46Å
979	N	40.9	Very low	38.7	Very low	97 Å²	97	104.3 Å²	104.3	52%	0.519	56%	0.563	S	S	.	*	H	α-helix	trans	-87.2	-21.9	179.6	-73.1	-51.1	0	0	0	114.1	L975 E976 A977	L975-N979 VanDerWaalsContact O-CB 3.3Å; L975-N979 WeakPolarHBondContact O-CB 3.5Å; L975-N979 VanDerWaalsContact O-CG 3.24Å; L975-N979 PolarHBondContact O-N 3Å; L975-N979 PolarHBondContact O-ND2 3.12Å; E976-N979 PolarHBondContact O-N 3.34Å; A977-N979 VanDerWaalsContact C-N 3.29Å; A977-N979 PolarHBondContact O-N 2.82Å
980	T	41.1	Very low	37.9	Very low	83 Å²	83	108.8 Å²	108.8	51%	0.509	58%	0.581	S	S	.	*	H	α-helix	trans	-88	-33.6	-178.5	49.7	0	0	0	0	114.3	E976 A977	E976-T980 WeakPolarHBondContact O-CG2 3.48Å; E976-T980 PolarHBondContact O-N 3.04Å; E976-T980 PolarHBondContact O-OG1 3.4Å; A977-T980 PolarHBondContact O-N 3.48Å; A977-T980 PolarHBondContact O-OG1 2.76Å
981	E	35.4	Very low	37.1	Very low	116 Å²	116	113.5 Å²	113.5	54%	0.542	61%	0.612	S	S	.	*	H	α-helix	trans	-81.8	-18.1	176.3	-72.6	-176.6	-170	0	0	113.3	T918 A977 L983	T918-E981 VanDerWaalsContact CB-OE1 3.23Å; T918-E981 WeakPolarHBondContact CB-OE1 3.46Å; T918-E981 WeakPolarHBondContact CB-OE2 3.3Å; T918-E981 WeakPolarHBondContact CG2-OE1 3.37Å; T918-E981 VanDerWaalsContact CG2-OE2 3.26Å; T918-E981 WeakPolarHBondContact CG2-OE2 3.42Å; T918-E981 PolarHBondContact OG1-OE1 2.88Å; A977-E981 PolarHBondContact O-N 3.31Å; E981-L983 PolarHBondContact O-N 3.47Å; E981-L983 VanDerWaalsContact O-N 3.1Å
982	L	34.3	Very low	35.9	Very low	141 Å²	141	118.4 Å²	118.4	74%	0.738	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	9.1	175.3	-109.1	166.6	0	0	0	114.7
983	L	30.3	Very low	35	Very low	150 Å²	150	124.3 Å²	124.3	79%	0.785	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.3	8.9	-175.7	-88.4	164.8	0	0	0	114.1	E981	E981-L983 PolarHBondContact O-N 3.47Å; E981-L983 VanDerWaalsContact O-N 3.1Å
984	I	29.7	Very low	34.2	Very low	139 Å²	139	126.4 Å²	126.4	71%	0.713	69%	0.686	S	S	*	*	S	Bend	trans	-131.3	74.4	-177.1	-48.9	179.9	0	0	0	110.8
985	S	29.4	Very low	33.1	Very low	126 Å²	126	132 Å²	132	88%	0.881	72%	0.715	S	S	*	*			trans	-172.9	32.2	156.4	-116.8	0	0	0	0	115.2
986	E	26.7	Very low	32	Very low	197 Å²	197	136.4 Å²	136.4	92%	0.921	73%	0.733	S	S	*	*			trans	-110.8	77.9	169.7	-77.6	-164	159.8	0	0	111.6
987	E	29.8	Very low	31.3	Very low	195 Å²	195	136.7 Å²	136.7	91%	0.911	74%	0.744	S	S	*	*			trans	-128.9	74.2	162.3	-75.2	-160.8	139.2	0	0	110.6
988	D	29.2	Very low	30.8	Very low	157 Å²	157	142.1 Å²	142.1	84%	0.84	77%	0.767	S	S	*	*	S	Bend	trans	-160.9	138	130.9	-125.5	-29.8	0	0	0	115
989	S	28.5	Very low	30.1	Very low	98 Å²	98	146.5 Å²	146.5	69%	0.685	79%	0.791	S	S	*	*			trans	63.6	70.3	162.8	69.4	0	0	0	0	121.6
990	L	25.7	Very low	29.4	Very low	162 Å²	162	146.3 Å²	146.3	85%	0.848	80%	0.798	S	S	*	*				44.8	113.4	122.6	-64.7	154.7	0	0	0	118.8
991	T	30.4	Very low	29	Very low	144 Å²	144	151.5 Å²	151.5	88%	0.883	81%	0.813	S	S	*	*				-164	128.5	84.7	17.4	0	0	0	0	114
992	M	24.9	Very low	28.8	Very low	181 Å²	181	156 Å²	156	89%	0.892	83%	0.831	S	S	*	*			trans	-83.8	146.1	-178.8	-77.1	-131.8	-67.2	0	0	115.4
993	K	28.8	Very low	28.6	Very low	215 Å²	215	158 Å²	158	94%	0.935	84%	0.837	S	S	*	*				-180	120.5	129.1	-97	150.7	-172.9	171.8	0	111
994	G	28.7	Very low	28.7	Very low	82 Å²	82	158.3 Å²	158.3	85%	0.845	84%	0.839	S	S	*	*			trans	177.4	-27.9	171.5	0	0	0	0	0	119.8
995	L	22.6	Very low	28.9	Very low	167 Å²	167	161.3 Å²	161.3	87%	0.874	85%	0.847	S	S	*	*			trans	-116.8	127	-171.9	-130	78.5	0	0	0	112.8
996	H	27.8	Very low	28.9	Very low	186 Å²	186	164.5 Å²	164.5	86%	0.861	85%	0.847	S	S	*	*			trans	-178.4	92	153.4	-104.3	-60.5	0	0	0	112.3
997	T	30.7	Very low	28.9	Very low	137 Å²	137	163.4 Å²	163.4	84%	0.84	85%	0.847	S	S	*	*			trans	-174.9	126.3	154.8	0.7	0	0	0	0	110.3
998	I	29.4	Very low	29	Very low	143 Å²	143	158.7 Å²	158.7	73%	0.733	84%	0.842	S	S	*	*			cis	-157.9	145.9	-27.2	-124.7	164.8	0	0	0	106.4
999	D	27.9	Very low	28.8	Very low	161 Å²	161	159.5 Å²	159.5	86%	0.861	85%	0.845	S	S	*	*			trans	-69.9	135	173.1	-98	-63	0	0	0	112.3
1000	S	27	Very low	28.6	Very low	93 Å²	93	163.7 Å²	163.7	65%	0.65	86%	0.856	S	S	*	*			trans	169.3	81.1	155	38.1	0	0	0	0	112.8
1001	K	32.2	Very low	28.8	Very low	192 Å²	192	161 Å²	161	84%	0.835	85%	0.851	S	S	*	*	S	Bend	trans	-168.1	-14	158.8	-112.2	138.9	-163.4	161.8	0	118.8
1002	F	30.4	Very low	28.8	Very low	211 Å²	211	162.9 Å²	162.9	93%	0.925	85%	0.849	S	S	*	*	S	Bend	trans	-95.1	-1	-169.9	-106.1	-90.5	0	0	0	116.4
1003	H	31.2	Very low	28.9	Very low	183 Å²	183	158.9 Å²	158.9	85%	0.847	84%	0.84	S	S	*	*	S	Bend	trans	-98	-13.3	-175.8	-138.6	62.5	0	0	0	114.9
1004	D	32.5	Very low	28.7	Very low	155 Å²	155	154.4 Å²	154.4	83%	0.829	83%	0.83	S	S	*	*	S	Bend	trans	-97.7	23.4	-168.1	-77.1	-43.2	0	0	0	115.6
1005	K	33	Very low	28.7	Very low	203 Å²	203	158.9 Å²	158.9	88%	0.883	83%	0.829	S	S	*	*	S	Bend	trans	-138.6	5.6	-172.8	-117.3	177	-176.4	-179.8	0	118.8
1006	Q	28.7	Very low	28.8	Very low	192 Å²	192	157.7 Å²	157.7	90%	0.897	83%	0.828	S	S	*	*	S	Bend	trans	-111.2	7.7	-173.7	-150	168.4	2.7	0	0	114.6
1007	L	28.2	Very low	28.8	Very low	175 Å²	175	154.1 Å²	154.1	92%	0.916	82%	0.822	S	S	*	*	S	Bend	trans	-133.1	19	-164.6	-119.4	162.3	0	0	0	115.3
1008	A	30.4	Very low	28.6	Very low	96 Å²	96	153 Å²	153	79%	0.793	82%	0.819	S	S	*	*	S	Bend	trans	-126.2	9.9	-167	0	0	0	0	0	116.6
1009	L	26.8	Very low	28.4	Very low	174 Å²	174	155.3 Å²	155.3	91%	0.911	83%	0.825	S	S	*	*			trans	-138.4	20.2	-175.8	-103.9	166.3	0	0	0	115.2
1010	M	23.7	Very low	28.4	Very low	185 Å²	185	154.4 Å²	154.4	91%	0.911	82%	0.82	S	S	*	*			trans	-103.8	77.2	171.1	-72.4	-171	71.8	0	0	111.6
1011	S	30.4	Very low	28.4	Very low	107 Å²	107	156.8 Å²	156.8	75%	0.748	83%	0.83	S	S	*	*			trans	-168	140	158.9	4.7	0	0	0	0	111.9
1012	Q	30.6	Very low	28.1	Very low	182 Å²	182	152.5 Å²	152.5	85%	0.85	82%	0.82	S	S	*	*			trans	53	92.5	158.9	-60.6	174.2	11.9	0	0	116.5
1013	S	25.2	Very low	27.8	Very low	98 Å²	98	151 Å²	151	69%	0.685	81%	0.813	S	S	*	*				92.5	151.5	60.9	68.9	0	0	0	0	114.6
1014	T	25.8	Very low	27.6	Very low	120 Å²	120	149.7 Å²	149.7	74%	0.736	81%	0.812	S	S	*	*			trans	67.7	123.1	169	42.1	0	0	0	0	119.4
1015	E	27.8	Very low	27.3	Very low	177 Å²	177	150.4 Å²	150.4	83%	0.827	81%	0.814	S	S	*	*			trans	67.6	109	152.7	-67.5	167.2	-144.5	0	0	118.2
1016	V	25.4	Very low	26.8	Very low	141 Å²	141	145.9 Å²	145.9	86%	0.855	80%	0.803	S	S	*	*				99.7	138	61.4	158	0	0	0	0	110.8
1017	P	27.4	Very low	26.7	Very low	112 Å²	112	146 Å²	146	73%	0.727	80%	0.804	S	S	*	*			trans	-124.1	153.5	-134.6	40.8	-29.6	0	0	0	118.2
1018	S	27.6	Very low	26.6	Very low	112 Å²	112	141.6 Å²	141.6	78%	0.783	79%	0.793	S	S	*	*			trans	-165.2	112.4	150.9	51.8	0	0	0	0	106.9
1019	F	24.9	Very low	26.3	Very low	193 Å²	193	146.4 Å²	146.4	85%	0.846	80%	0.796	S	S	*	*				64.3	72.3	52.1	-115.2	-72.7	0	0	0	113.8
1020	D	27.7	Very low	26.4	Very low	142 Å²	142	143.7 Å²	143.7	76%	0.759	79%	0.792	S	S	*	*			trans	-152.6	79	163.5	-135.2	-18.6	0	0	0	113.7
1021	V	26.1	Very low	26.6	Very low	142 Å²	142	142.5 Å²	142.5	86%	0.861	79%	0.788	S	S	*	*			trans	-132.4	62.2	158.9	-172.6	0	0	0	0	107.4
1022	V	25.8	Very low	26.5	Very low	103 Å²	103	142.6 Å²	142.6	62%	0.624	79%	0.786	S	S	*	*			trans	-108.1	77.6	-175	-174	0	0	0	0	110.6
1023	K	24.7	Very low	26.4	Very low	179 Å²	179	138.9 Å²	138.9	78%	0.778	78%	0.78	S	S	*	*	S	Bend	trans	-165.1	151.9	156.7	-104.9	153.6	-174.1	174.9	0	109.5
1024	D	26.7	Very low	26.4	Very low	156 Å²	156	139.1 Å²	139.1	83%	0.834	78%	0.778	S	S	*	*	S	Bend	trans	82.2	-0.1	172	-54.9	-3.9	0	0	0	119.8
1025	I	26.2	Very low	26.4	Very low	170 Å²	170	138.8 Å²	138.8	87%	0.872	78%	0.775	S	S	*	*	S	Bend	trans	-114.6	56.3	154.2	-47.8	-175.5	0	0	0	109.7
1026	V	23.3	Very low	26.3	Very low	108 Å²	108	136.6 Å²	136.6	66%	0.655	77%	0.768	S	S	*	*			trans	-128.6	98	179.1	177.8	0	0	0	0	109
1027	Q	25.6	Very low	26.3	Very low	194 Å²	194	133.9 Å²	133.9	91%	0.907	76%	0.755	S	S	*	*	S	Bend	trans	166.6	-19.6	150.8	-97.3	171.5	8.2	0	0	113.6
1028	A	27.1	Very low	26.2	Very low	83 Å²	83	134.5 Å²	134.5	69%	0.686	75%	0.752	S	S	*	*	S	Bend	trans	-75.2	-29.6	-160.5	0	0	0	0	0	117.5
1029	F	24.5	Very low	26	Very low	197 Å²	197	134 Å²	134	86%	0.864	76%	0.755	S	S	*	*			trans	-138.9	110.5	-174.2	-72	-80.4	0	0	0	112.3
1030	S	28	Very low	26	Very low	117 Å²	117	132.4 Å²	132.4	82%	0.818	75%	0.75	S	S	*	*			trans	-136.5	131.9	171	49.1	0	0	0	0	110.3
1031	L	26.9	Very low	25.9	Very low	159 Å²	159	131.3 Å²	131.3	83%	0.832	75%	0.753	S	S	*	*			trans	-123.4	149.4	176.9	-79.4	165.2	0	0	0	108.4
1032	P	30.1	Very low	25.8	Very low	109 Å²	109	131 Å²	131	71%	0.708	75%	0.752	S	S	*	*			trans	-150	150.7	134.8	36.8	-20.9	0	0	0	116.4
1033	S	27.2	Very low	25.9	Very low	104 Å²	104	132 Å²	132	73%	0.727	76%	0.76	S	S	*	*			trans	64.7	159.4	142.4	59.5	0	0	0	0	120
1034	T	26.5	Very low	25.8	Very low	103 Å²	103	132.9 Å²	132.9	63%	0.632	77%	0.765	S	S	*	*			cis	-171.6	156.7	-8.8	25.3	0	0	0	0	108.6
1035	V	25.9	Very low	25.8	Very low	113 Å²	113	129.1 Å²	129.1	69%	0.685	76%	0.762	S	S	*	*			cis	-163.8	168.3	-25	95.8	0	0	0	0	111.9
1036	I	24.9	Very low	25.7	Very low	132 Å²	132	132.7 Å²	132.7	68%	0.677	77%	0.765	S	S	*	*			trans	-2.9	132.3	163.1	-59.4	152.3	0	0	0	120.9	L1038	I1036-L1038 HydrophobicContact CG2-CD1 4.29Å
1037	S	25.7	Very low	25.7	Very low	83 Å²	83	131.1 Å²	131.1	58%	0.58	77%	0.77	S	S	*	*				170.3	143.5	126	41.7	0	0	0	0	111.5
1038	L	25.1	Very low	25.6	Very low	126 Å²	126	127.9 Å²	127.9	66%	0.66	77%	0.767	S	S	*	*			cis	-148.8	145.5	-19.1	-153.9	84.3	0	0	0	108.2	I1036 Q1040	I1036-L1038 HydrophobicContact CG2-CD1 4.29Å; L1038-Q1040 HydrophobicContact CD2-CB 4.25Å; L1038-Q1040 HydrophobicContact CD2-CG 4.44Å; L1038-Q1040 HydrophobicContact CG-CG 4.32Å
1039	A	22.7	Very low	25.6	Very low	102 Å²	102	129.3 Å²	129.3	84%	0.843	77%	0.768	S	S	*	*			trans	-140.5	94.3	168.5	0	0	0	0	0	108.6
1040	Q	25	Very low	25.6	Very low	158 Å²	158	129 Å²	129	74%	0.738	77%	0.766	S	S	*	*			trans	-151.1	104.7	-174.7	-72.3	-172.4	-34.1	0	0	111.7	L1038	L1038-Q1040 HydrophobicContact CD2-CB 4.25Å; L1038-Q1040 HydrophobicContact CD2-CG 4.44Å; L1038-Q1040 HydrophobicContact CG-CG 4.32Å
1041	S	25.9	Very low	25.4	Very low	119 Å²	119	131.1 Å²	131.1	83%	0.832	76%	0.763	S	S	*	*			trans	176.7	97.4	135.6	58.8	0	0	0	0	111
1042	T	24.4	Very low	25.4	Very low	136 Å²	136	129.1 Å²	129.1	83%	0.834	76%	0.76	S	S	*	*			trans	-96.4	150.4	150.3	47.5	0	0	0	0	108.1
1043	P	27.1	Very low	25.1	Very low	124 Å²	124	130.7 Å²	130.7	81%	0.805	76%	0.76	S	S	*	*				-142.7	171.7	114.7	36.7	-22.5	0	0	0	115
1044	F	23.6	Very low	25	Very low	198 Å²	198	132.8 Å²	132.8	87%	0.868	76%	0.762	S	S	*	*			trans	-68.9	154.1	-174.6	-80.2	-110.6	0	0	0	115.8
1045	G	26.1	Very low	25	Very low	76 Å²	76	132.7 Å²	132.7	78%	0.784	77%	0.765	S	S	*	*			trans	-145	140.8	152.9	0	0	0	0	0	110
1046	R	23.3	Very low	24.9	Very low	246 Å²	246	131.8 Å²	131.8	93%	0.928	76%	0.764	S	S	*	*			trans	-114.1	144.9	-175.7	-69.6	179.3	173.3	179.8	-3.5	111.6
1047	G	24.7	Very low	25	Very low	74 Å²	74	131 Å²	131	76%	0.763	77%	0.77	S	S	*	*			trans	176.1	85.3	170	0	0	0	0	0	117.4
1048	C	24.1	Very low	25.1	Very low	126 Å²	126	132.7 Å²	132.7	85%	0.851	78%	0.782	S	S	*	*				11.2	143.1	121.5	-76.7	0	0	0	0	119.6
1049	V	25.3	Very low	25.3	Very low	114 Å²	114	136 Å²	136	69%	0.691	79%	0.794	S	S	*	*			cis	-171.3	165.2	8.9	79.1	0	0	0	0	114.6
1050	K	25.1	Very low	25.6	Very low	189 Å²	189	136 Å²	136	82%	0.822	78%	0.784	S	S	*	*			trans	76.5	124.9	157.1	-74.5	170.7	-170.4	177.7	0	121.7
1051	Q	24.4	Very low	25.9	Very low	162 Å²	162	131.8 Å²	131.8	76%	0.757	77%	0.766	S	S	*	*			trans	-97.5	171	147.1	-65.4	172.7	-44.5	0	0	110.3
1052	P	26	Very low	26.1	Very low	118 Å²	118	130.6 Å²	130.6	77%	0.766	76%	0.756	S	S	*	*				-132.6	146.6	111.3	36.2	-26.7	0	0	0	111.9
1053	I	24.6	Very low	26.5	Very low	141 Å²	141	129.1 Å²	129.1	72%	0.723	74%	0.743	S	S	*	*			cis	80.8	144.4	48.2	-57.1	166.9	0	0	0	113.4
1054	I	25.2	Very low	26.9	Very low	149 Å²	149	128.3 Å²	128.3	76%	0.764	73%	0.728	S	S	*	*			trans	90.8	98.7	-178.4	-51.8	-177.8	0	0	0	112.4
1055	S	25.3	Very low	27.3	Very low	100 Å²	100	121.1 Å²	121.1	70%	0.699	71%	0.705	S	S	*	*				76.7	149.6	66.2	105.3	0	0	0	0	114
1056	S	25.5	Very low	27.7	Very low	95 Å²	95	122.5 Å²	122.5	66%	0.664	69%	0.694	S	S	*	*			cis	-165.4	155.2	-0.3	24.5	0	0	0	0	112.1
1057	S	26.5	Very low	28.3	Very low	114 Å²	114	113 Å²	113	80%	0.797	67%	0.668	S	S	*	*			trans	51.2	117.3	148.7	63	0	0	0	0	122
1058	S	27.6	Very low	28.6	Very low	120 Å²	120	115.2 Å²	115.2	84%	0.839	66%	0.662	S	S	*	*				-156.7	164.2	123.8	58.8	0	0	0	0	111.2
1059	Q	29.4	Very low	29	Very low	194 Å²	194	114.8 Å²	114.8	91%	0.907	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-79.2	147.8	-165	-64.8	134.3	-32.5	0	0	113.9
1060	V	28.7	Very low	29.3	Very low	103 Å²	103	117.2 Å²	117.2	62%	0.624	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-95.7	142.9	168.8	171	0	0	0	0	109.7	E1064	V1060-E1064 HydrophobicContact CG1-CB 3.83Å
1061	N	31.2	Very low	29.6	Very low	70 Å²	70	114.8 Å²	114.8	37%	0.374	65%	0.65	S	S	.	*	P	Polyproline II helix	trans	-73.3	139.2	-174.5	-177.2	12.1	0	0	0	111.9	D1063 E1064 A1065	N1061-D1063 WeakPolarHBondContact ND2-CB 3.31Å; N1061-D1063 PolarHBondContact ND2-OD2 3.23Å; N1061-D1063 PolarHBondContact O-N 3.29Å; N1061-D1063 VanDerWaalsContact O-N 3.14Å; N1061-D1063 PolarHBondContact OD1-N 2.9Å; N1061-D1063 PolarHBondContact OD1-OD2 3.45Å; N1061-E1064 HydrophobicContact CB-CG 4.31Å; N1061-E1064 PolarHBondContact N-OE2 2.95Å; N1061-E1064 WeakPolarHBondContact O-CB 3.28Å; N1061-E1064 PolarHBondContact O-N 3.02Å; N1061-A1065 PolarHBondContact O-N 2.88Å; N1061-A1065 VanDerWaalsContact O-N 3.08Å
1062	P	30.8	Very low	29.8	Very low	93 Å²	93	109.8 Å²	109.8	60%	0.604	63%	0.633	S	S	*	*	H	α-helix	trans	-49.4	-31.9	168.2	16.1	-32.4	0	0	0	114.9	E1064 A1065 L1066	P1062-E1064 VanDerWaalsContact C-N 3.33Å; P1062-E1064 PolarHBondContact O-N 3.48Å; P1062-A1065 WeakPolarHBondContact O-CB 3.4Å; P1062-A1065 PolarHBondContact O-N 3.1Å; P1062-L1066 PolarHBondContact O-N 3.42Å
1063	D	32.9	Very low	29.9	Very low	105 Å²	105	111.2 Å²	111.2	56%	0.561	64%	0.64	S	S	*	*	H	α-helix	trans	-66.6	-33.7	175.3	-53.5	-45.8	0	0	0	112.5	N1061 A1067	N1061-D1063 WeakPolarHBondContact ND2-CB 3.31Å; N1061-D1063 PolarHBondContact ND2-OD2 3.23Å; N1061-D1063 PolarHBondContact O-N 3.29Å; N1061-D1063 VanDerWaalsContact O-N 3.14Å; N1061-D1063 PolarHBondContact OD1-N 2.9Å; N1061-D1063 PolarHBondContact OD1-OD2 3.45Å; D1063-A1067 PolarHBondContact O-N 3.08Å
1064	E	35.7	Very low	30	Very low	108 Å²	108	110.6 Å²	110.6	51%	0.505	64%	0.637	S	S	.	*	H	α-helix	trans	-74.7	-32.8	173.6	-69	179.9	115	0	0	111.5	V1060 N1061 P1062 A1067 L1068	V1060-E1064 HydrophobicContact CG1-CB 3.83Å; N1061-E1064 HydrophobicContact CB-CG 4.31Å; N1061-E1064 PolarHBondContact N-OE2 2.95Å; N1061-E1064 WeakPolarHBondContact O-CB 3.28Å; N1061-E1064 PolarHBondContact O-N 3.02Å; P1062-E1064 VanDerWaalsContact C-N 3.33Å; P1062-E1064 PolarHBondContact O-N 3.48Å; E1064-A1067 PolarHBondContact O-N 2.84Å; E1064-L1068 WeakPolarHBondContact O-CB 3.4Å; E1064-L1068 VanDerWaalsContact O-CG 3.27Å; E1064-L1068 WeakPolarHBondContact O-CG 3.34Å; E1064-L1068 PolarHBondContact O-N 3.15Å
1065	A	31.6	Very low	30.2	Very low	46 Å²	46	113 Å²	113	38%	0.38	64%	0.644	S	S	.	*	H	α-helix	trans	-64.9	-39.3	171.8	0	0	0	0	0	111.7	N1061 P1062 L1068 L1069	N1061-A1065 PolarHBondContact O-N 2.88Å; N1061-A1065 VanDerWaalsContact O-N 3.08Å; P1062-A1065 WeakPolarHBondContact O-CB 3.4Å; P1062-A1065 PolarHBondContact O-N 3.1Å; A1065-L1068 PolarHBondContact O-N 3.35Å; A1065-L1069 WeakPolarHBondContact O-CG 3.13Å; A1065-L1069 PolarHBondContact O-N 3.21Å
1066	L	33.7	Very low	30.3	Very low	105 Å²	105	115.4 Å²	115.4	55%	0.55	65%	0.648	S	S	.	*	H	α-helix	trans	-62.6	-48.3	170.9	-88.4	158.3	0	0	0	111.7	P1062 L1068 L1069 E1070	P1062-L1066 PolarHBondContact O-N 3.42Å; L1066-L1068 PolarHBondContact O-N 3.05Å; L1066-L1069 WeakPolarHBondContact O-CB 3.14Å; L1066-L1069 PolarHBondContact O-N 3.43Å; L1066-L1069 VanDerWaalsContact O-N 3.09Å; L1066-E1070 PolarHBondContact O-N 3.12Å
1067	A	36.7	Very low	30.3	Very low	46 Å²	46	116.9 Å²	116.9	38%	0.38	65%	0.649	S	S	.	*	H	α-helix	trans	-62.1	-29.9	176.5	0	0	0	0	0	113.3	D1063 E1064 N1071	D1063-A1067 PolarHBondContact O-N 3.08Å; E1064-A1067 PolarHBondContact O-N 2.84Å; A1067-N1071 PolarHBondContact O-ND2 3.21Å
1068	L	31.1	Very low	30.3	Very low	122 Å²	122	115 Å²	115	64%	0.639	64%	0.641	S	S	*	*	H	α-helix	trans	-75.3	-35.2	172.8	-75.8	166.5	0	0	0	112.7	E1064 A1065 L1066 N1071 S1072	E1064-L1068 WeakPolarHBondContact O-CB 3.4Å; E1064-L1068 VanDerWaalsContact O-CG 3.27Å; E1064-L1068 WeakPolarHBondContact O-CG 3.34Å; E1064-L1068 PolarHBondContact O-N 3.15Å; A1065-L1068 PolarHBondContact O-N 3.35Å; L1066-L1068 PolarHBondContact O-N 3.05Å; L1068-N1071 PolarHBondContact O-N 3.04Å; L1068-S1072 PolarHBondContact O-N 3.41Å
1069	L	31.4	Very low	30.3	Very low	116 Å²	116	113.3 Å²	113.3	61%	0.607	63%	0.628	S	S	*	*	H	α-helix	trans	-66.5	-43.6	174.2	-77.8	164.4	0	0	0	111.8	A1065 L1066 N1071 S1072	A1065-L1069 WeakPolarHBondContact O-CG 3.13Å; A1065-L1069 PolarHBondContact O-N 3.21Å; L1066-L1069 WeakPolarHBondContact O-CB 3.14Å; L1066-L1069 PolarHBondContact O-N 3.43Å; L1066-L1069 VanDerWaalsContact O-N 3.09Å; L1069-N1071 PolarHBondContact O-N 2.89Å; L1069-N1071 VanDerWaalsContact O-N 3.12Å; L1069-S1072 WeakPolarHBondContact O-CB 3.46Å; L1069-S1072 PolarHBondContact O-N 3.09Å; L1069-S1072 PolarHBondContact O-OG 3.28Å
1070	E	33	Very low	30.3	Very low	166 Å²	166	109.7 Å²	109.7	78%	0.776	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.4	-21.2	175.3	-72.6	-169.7	141.4	0	0	113.7	L1066	L1066-E1070 PolarHBondContact O-N 3.12Å
1071	N	31.1	Very low	30.3	Very low	138 Å²	138	111.8 Å²	111.8	74%	0.738	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.3	8.6	177.7	-75.3	-82.5	0	0	0	113.7	A1067 L1068 L1069	A1067-N1071 PolarHBondContact O-ND2 3.21Å; L1068-N1071 PolarHBondContact O-N 3.04Å; L1069-N1071 PolarHBondContact O-N 2.89Å; L1069-N1071 VanDerWaalsContact O-N 3.12Å
1072	S	27.5	Very low	30.2	Very low	57 Å²	57	116 Å²	116	40%	0.399	65%	0.648	S	S	.	*	S	Bend	trans	-100.1	136.1	-179	75.9	0	0	0	0	112.4	L1068 L1069 I1074	L1068-S1072 PolarHBondContact O-N 3.41Å; L1069-S1072 WeakPolarHBondContact O-CB 3.46Å; L1069-S1072 PolarHBondContact O-N 3.09Å; L1069-S1072 PolarHBondContact O-OG 3.28Å; S1072-I1074 PolarHBondContact O-N 2.97Å
1073	T	27.8	Very low	30	Very low	148 Å²	148	119.3 Å²	119.3	91%	0.908	66%	0.661	S	S	*	*	S	Bend	trans	-84.2	39.4	-173	60.1	0	0	0	0	113.5
1074	I	27.5	Very low	29.8	Very low	128 Å²	128	123.1 Å²	123.1	66%	0.656	68%	0.675	S	S	*	*			trans	-132.4	94.5	-177.9	-55.2	178.7	0	0	0	108.9	S1072 L1076	S1072-I1074 PolarHBondContact O-N 2.97Å; I1074-L1076 PolarHBondContact O-N 3.39Å
1075	H	28.8	Very low	29.5	Very low	199 Å²	199	126.7 Å²	126.7	92%	0.921	69%	0.692	S	S	*	*			trans	-74.6	104.2	165.8	-95.4	-75.8	0	0	0	109.3
1076	L	27.4	Very low	29.4	Very low	150 Å²	150	132.9 Å²	132.9	79%	0.785	72%	0.718	S	S	*	*			trans	-71.6	131	156.9	-73.5	166.6	0	0	0	108.2	I1074 A1078	I1074-L1076 PolarHBondContact O-N 3.39Å; L1076-A1078 PolarHBondContact O-N 2.99Å
1077	D	26.3	Very low	29	Very low	127 Å²	127	133.7 Å²	133.7	68%	0.679	73%	0.727	S	S	*	*			trans	-80.3	89.4	-179.5	-154.9	-31.9	0	0	0	109.4	S1079	D1077-S1079 PolarHBondContact O-N 2.93Å; D1077-S1079 WeakPolarHBondContact OD1-CB 3.23Å; D1077-S1079 PolarHBondContact OD1-OG 2.81Å
1078	A	27	Very low	28.6	Very low	75 Å²	75	138.5 Å²	138.5	62%	0.62	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-72.7	18.1	-175	0	0	0	0	0	114.1	L1076 T1080	L1076-A1078 PolarHBondContact O-N 2.99Å; A1078-T1080 VanDerWaalsContact C-N 3.35Å
1079	S	27.5	Very low	28.5	Very low	83 Å²	83	140.7 Å²	140.7	58%	0.58	76%	0.757	S	S	*	*	G	3₁₀ helix	trans	-82.2	-5.3	-177.9	55.9	0	0	0	0	114.5	D1077	D1077-S1079 PolarHBondContact O-N 2.93Å; D1077-S1079 WeakPolarHBondContact OD1-CB 3.23Å; D1077-S1079 PolarHBondContact OD1-OG 2.81Å
1080	T	29.3	Very low	28.2	Very low	118 Å²	118	143.7 Å²	143.7	72%	0.724	77%	0.767	S	S	*	*	G	3₁₀ helix	trans	-121.1	26.2	-175.8	69.1	0	0	0	0	114.1	A1078	A1078-T1080 VanDerWaalsContact C-N 3.35Å
1081	L	28.5	Very low	28.1	Very low	147 Å²	147	144 Å²	144	77%	0.77	77%	0.774	S	S	*	*	S	Bend	trans	-134.5	16.8	-171.8	-86.3	171	0	0	0	115.1
1082	L	28.7	Very low	28	Very low	159 Å²	159	142.2 Å²	142.2	83%	0.832	77%	0.77	S	S	*	*	S	Bend	trans	-134.7	3.7	-177.9	-72	175.3	0	0	0	115.6
1083	D	27.2	Very low	28.1	Very low	162 Å²	162	145.1 Å²	145.1	87%	0.866	79%	0.785	S	S	*	*	S	Bend	trans	-103.3	53.4	-179.8	-83.2	-33.5	0	0	0	112.9
1084	E	28.4	Very low	28.1	Very low	185 Å²	185	144.2 Å²	144.2	86%	0.864	78%	0.78	S	S	*	*	S	Bend	trans	-158.3	153.8	155.4	-117.1	161.3	-154	0	0	111.1
1085	E	29	Very low	28.2	Very low	183 Å²	183	142.4 Å²	142.4	86%	0.855	78%	0.784	S	S	*	*			trans	55.8	88.2	179.1	-56.3	-158.2	146.2	0	0	119
1086	L	29.8	Very low	28.2	Very low	177 Å²	177	141.6 Å²	141.6	93%	0.927	78%	0.78	S	S	*	*				179.5	123.1	108.5	-94.8	165.4	0	0	0	112.2
1087	T	26	Very low	28.2	Very low	121 Å²	121	138.9 Å²	138.9	74%	0.742	77%	0.774	S	S	*	*			trans	-106	176.5	176.9	49	0	0	0	0	111.7
1088	I	27.3	Very low	28.3	Very low	148 Å²	148	139 Å²	139	76%	0.759	78%	0.779	S	S	*	*			trans	87.5	87.1	164.2	-52.1	156.4	0	0	0	116.6
1089	L	28.4	Very low	28.3	Very low	168 Å²	168	140.8 Å²	140.8	88%	0.88	78%	0.782	S	S	*	*				177	138.2	114.5	-99.4	155.3	0	0	0	113.3
1090	E	26.5	Very low	28.4	Very low	178 Å²	178	147 Å²	147	83%	0.832	80%	0.798	S	S	*	*			trans	-96.4	160.1	174.8	-55.6	179.4	118.4	0	0	112.3
1091	L	29.7	Very low	28.5	Very low	173 Å²	173	145.9 Å²	145.9	91%	0.906	80%	0.802	S	S	*	*			trans	-167.8	150.5	133.9	-98.7	147.1	0	0	0	110.6
1092	P	30.4	Very low	28.5	Very low	101 Å²	101	142.6 Å²	142.6	66%	0.656	80%	0.803	S	S	*	*			trans	-127.6	-171.4	-155.2	44.3	-31.5	0	0	0	117.4
1093	T	29.7	Very low	28.5	Very low	118 Å²	118	140.6 Å²	140.6	72%	0.724	80%	0.802	S	S	*	*			trans	92.2	129.1	147.7	40.6	0	0	0	0	124.5
1094	T	27.2	Very low	29.2	Very low	129 Å²	129	138.2 Å²	138.2	79%	0.791	80%	0.796	S	S	*	*			trans	100.2	122.1	131.9	39.6	0	0	0	0	125.2
1095	A	28.7	Very low	29.4	Very low	90 Å²	90	138.9 Å²	138.9	74%	0.744	80%	0.796	S	S	*	*			trans	73.7	155	138.1	0	0	0	0	0	120.4
1096	Q	29.1	Very low	29.7	Very low	182 Å²	182	134.6 Å²	134.6	85%	0.85	78%	0.784	S	S	*	*			cis	-168.3	167.3	-21.4	-107.4	-167.6	33.2	0	0	108.2
1097	S	27.5	Very low	29.7	Very low	93 Å²	93	134.5 Å²	134.5	65%	0.65	78%	0.779	S	S	*	*			cis	-129.6	-116.4	-12.5	45.6	0	0	0	0	110.6
1098	V	28.8	Very low	29.9	Very low	128 Å²	128	136.3 Å²	136.3	78%	0.776	78%	0.783	S	S	*	*			cis	-138.8	165.9	4.5	177.6	0	0	0	0	107.8
1099	V	27.7	Very low	29.8	Very low	113 Å²	113	134.5 Å²	134.5	69%	0.685	78%	0.784	S	S	*	*			trans	-142.1	155.8	-167	175.8	0	0	0	0	113.4	A1101	V1099-A1101 HydrophobicContact CG1-CB 4.39Å
1100	F	29.3	Very low	29.9	Very low	213 Å²	213	130 Å²	130	93%	0.934	78%	0.778	S	S	*	*			trans	-144.3	151.7	146.7	-102.9	-75.2	0	0	0	111.7
1101	A	29.7	Very low	29.9	Very low	96 Å²	96	130.5 Å²	130.5	79%	0.793	78%	0.778	S	S	*	*			trans	-160.7	170.3	-163	0	0	0	0	0	116.2	V1099	V1099-A1101 HydrophobicContact CG1-CB 4.39Å
1102	G	29.2	Very low	29.9	Very low	77 Å²	77	129.2 Å²	129.2	79%	0.794	77%	0.767	S	S	*	*			trans	141.4	147.8	167.3	0	0	0	0	0	113.5
1103	S	30	Very low	29.7	Very low	117 Å²	117	132.7 Å²	132.7	82%	0.818	77%	0.771	S	S	*	*			cis	-160.1	161.3	-7.6	55.6	0	0	0	0	111.8
1104	P	41.3	Very low	29.5	Very low	113 Å²	113	132 Å²	132	73%	0.734	77%	0.772	S	S	*	*			trans	-118	-177.9	-177.9	41.9	-32.1	0	0	0	115.1
1105	F	32.9	Very low	29.4	Very low	199 Å²	199	131.8 Å²	131.8	87%	0.873	77%	0.77	S	S	*	*			trans	179.4	167.4	141.5	-110	-121.2	0	0	0	111.6
1106	P	34	Very low	29.2	Very low	92 Å²	92	134.5 Å²	134.5	60%	0.597	77%	0.772	S	S	*	*			trans	-148.7	-166.1	-132	47.1	-26.7	0	0	0	120
1107	Q	30.2	Very low	29	Very low	176 Å²	176	133.3 Å²	133.3	82%	0.822	77%	0.77	S	S	*	*			trans	94.3	156	141.2	-88.8	179.8	12.3	0	0	124.3
1108	L	29.7	Very low	28.8	Very low	159 Å²	159	139 Å²	139	83%	0.832	78%	0.784	S	S	*	*			trans	76.9	142.6	171.4	-61.8	157.4	0	0	0	118.4
1109	S	26.1	Very low	28.6	Very low	109 Å²	109	138.5 Å²	138.5	76%	0.762	78%	0.781	S	S	*	*			cis	178.7	137.1	-41.2	47.7	0	0	0	0	110.4
1110	G	30.2	Very low	28.4	Very low	74 Å²	74	141.5 Å²	141.5	76%	0.763	79%	0.785	S	S	*	*			trans	168.4	74.9	170.6	0	0	0	0	0	122
1111	F	27.5	Very low	28.3	Very low	189 Å²	189	139.6 Å²	139.6	83%	0.829	78%	0.78	S	S	*	*			trans	51.8	105.1	141.3	-74.5	-70.6	0	0	0	125.4
1112	H	27.8	Very low	28.1	Very low	145 Å²	145	140.4 Å²	140.4	67%	0.671	78%	0.775	S	S	*	*				92.2	124	115	-102	-6.5	0	0	0	124.8
1113	K	26.7	Very low	28	Very low	174 Å²	174	145.8 Å²	145.8	76%	0.757	78%	0.776	S	S	*	*			trans	74.9	135.3	147.1	-65.8	176.3	-177.3	-179.6	0	117.6
1114	S	25.9	Very low	27.8	Very low	104 Å²	104	148.3 Å²	148.3	73%	0.727	78%	0.78	S	S	*	*			cis	-166	167.5	-1.8	41.8	0	0	0	0	112.8
1115	V	25.9	Very low	27.2	Very low	124 Å²	124	148.1 Å²	148.1	75%	0.752	78%	0.781	S	S	*	*			trans	83.2	74	170.2	-163.2	0	0	0	0	116.4
1116	D	24.1	Very low	26.9	Very low	147 Å²	147	147.3 Å²	147.3	79%	0.786	79%	0.785	S	S	*	*				21.7	118.5	125.5	-40	-35.3	0	0	0	119.1
1117	L	24.4	Very low	26.6	Very low	157 Å²	157	146.1 Å²	146.1	82%	0.822	79%	0.789	S	S	*	*				169.5	58.2	95.8	-162	78.1	0	0	0	112.6
1118	F	22.7	Very low	26.4	Very low	212 Å²	212	144.8 Å²	144.8	93%	0.93	79%	0.793	S	S	*	*			trans	-146.8	117.1	175.6	-89.7	-81.3	0	0	0	112.9
1119	T	24.8	Very low	26.5	Very low	118 Å²	118	146.3 Å²	146.3	72%	0.724	80%	0.796	S	S	*	*			trans	-163.9	149.6	175.5	42.1	0	0	0	0	107.7
1120	F	24.9	Very low	26.7	Very low	176 Å²	176	148.7 Å²	148.7	77%	0.772	80%	0.8	S	S	*	*			cis	-149	175.4	-16	-101.9	-58.2	0	0	0	104.6
1121	E	26.7	Very low	26.7	Very low	174 Å²	174	149 Å²	149	81%	0.813	80%	0.803	S	S	*	*			cis	-150.4	-158.5	18.9	-146.5	161.2	-121.2	0	0	111.6
1122	T	25.4	Very low	26.8	Very low	113 Å²	113	145.7 Å²	145.7	69%	0.693	79%	0.794	S	S	*	*			trans	-131	157.3	-158.1	64.8	0	0	0	0	116
1123	K	26.9	Very low	27	Very low	189 Å²	189	146 Å²	146	82%	0.822	80%	0.799	S	S	*	*				-171.5	113.6	129.2	-104.4	157	-171.8	168.5	0	116.6
1124	L	26.2	Very low	27.2	Very low	171 Å²	171	145.5 Å²	145.5	90%	0.895	80%	0.803	S	S	*	*			trans	61.7	143.6	140.1	-66.5	168	0	0	0	121.7
1125	S	27.3	Very low	27.2	Very low	108 Å²	108	148 Å²	148	76%	0.755	80%	0.8	S	S	*	*			trans	-137.1	152.2	-170.7	53.6	0	0	0	0	112.4
1126	L	27.9	Very low	27.3	Very low	183 Å²	183	147.3 Å²	147.3	96%	0.958	80%	0.798	S	S	*	*			trans	-175.8	128	162.3	-103.5	152.8	0	0	0	107.6
1127	G	28.3	Very low	27.7	Very low	67 Å²	67	147.2 Å²	147.2	69%	0.691	80%	0.803	S	S	*	*			cis	-157.3	170.7	-4.8	0	0	0	0	0	111.4
1128	T	26.1	Very low	28	Very low	147 Å²	147	147.7 Å²	147.7	90%	0.902	80%	0.801	S	S	*	*			trans	-104.1	91.3	-166.2	50.3	0	0	0	0	114
1129	E	30.5	Very low	28.2	Very low	192 Å²	192	144.2 Å²	144.2	90%	0.897	80%	0.798	S	S	*	*			trans	-141.1	70.8	169.3	-71.4	-164.1	174.5	0	0	112.2
1130	L	30.9	Very low	28.5	Very low	159 Å²	159	145 Å²	145	83%	0.832	80%	0.802	S	S	*	*			trans	-144.5	25.9	-178.9	-113.1	167.1	0	0	0	114.9
1131	G	29.9	Very low	28.6	Very low	80 Å²	80	144.1 Å²	144.1	83%	0.825	80%	0.801	S	S	*	*	S	Bend	trans	-94.6	-15.9	-172.6	0	0	0	0	0	118
1132	D	29.6	Very low	28.6	Very low	120 Å²	120	144 Å²	144	64%	0.642	80%	0.797	S	S	*	*	S	Bend	trans	-116.4	0.8	-161.4	-109.1	-50.7	0	0	0	116.4	K1135	D1132-K1135 IonicContact OD1-NZ 3.77Å; D1132-K1135 PolarHBondContact OD1-NZ 2.77Å
1133	I	31.9	Very low	28.8	Very low	152 Å²	152	146.9 Å²	146.9	78%	0.779	81%	0.805	S	S	*	*	S	Bend	trans	-90.9	-3.3	-167.9	-61.5	178.8	0	0	0	113.6
1134	I	30.4	Very low	28.9	Very low	163 Å²	163	144.2 Å²	144.2	84%	0.836	80%	0.8	S	S	*	*			trans	-116.6	95.7	176.2	-52.1	180	0	0	0	110.7
1135	K	27.2	Very low	29.2	Very low	155 Å²	155	141.9 Å²	141.9	67%	0.674	79%	0.793	S	S	*	*			trans	-126.6	123.3	163.5	-77.1	175.8	179.1	142.3	0	109.3	D1132	D1132-K1135 IonicContact OD1-NZ 3.77Å; D1132-K1135 PolarHBondContact OD1-NZ 2.77Å
1136	P	28.3	Very low	29.3	Very low	110 Å²	110	146.1 Å²	146.1	71%	0.714	80%	0.798	S	S	*	*			trans	-69.5	142	-176.3	29.1	-35	0	0	0	111.1	Q1138	P1136-Q1138 PolarHBondContact O-N 3.41Å
1137	T	30.9	Very low	29.4	Very low	145 Å²	145	141.1 Å²	141.1	89%	0.89	78%	0.778	S	S	*	*			trans	-79	81.5	-179.2	-42.8	0	0	0	0	110.8	T1139	T1137-T1139 PolarHBondContact O-N 2.88Å
1138	Q	31.5	Very low	29.5	Very low	168 Å²	168	144.5 Å²	144.5	79%	0.785	78%	0.781	S	S	*	*			trans	-66.7	131.1	172.2	-75.7	-172.2	-19.1	0	0	111.3	P1136	P1136-Q1138 PolarHBondContact O-N 3.41Å
1139	T	26.8	Very low	29.8	Very low	139 Å²	139	145.1 Å²	145.1	85%	0.853	78%	0.778	S	S	*	*			trans	-75	128.8	168.6	48.8	0	0	0	0	110.7	T1137	T1137-T1139 PolarHBondContact O-N 2.88Å
1140	T	30.7	Very low	29.7	Very low	134 Å²	134	143 Å²	143	82%	0.822	77%	0.773	S	S	*	*			trans	-127.7	140.1	164.9	46.2	0	0	0	0	110.3
1141	E	28	Very low	29.5	Very low	157 Å²	157	146.3 Å²	146.3	73%	0.734	77%	0.774	S	S	*	*			trans	-88.9	147.5	-179.3	-68.6	-166.8	91.3	0	0	112.7
1142	K	26.5	Very low	29.7	Very low	172 Å²	172	150.4 Å²	150.4	75%	0.748	78%	0.776	S	S	*	*			trans	27.3	114.8	147.3	-56.4	166.2	-171	131	0	118.2
1143	M	28.9	Very low	29.8	Very low	174 Å²	174	153.4 Å²	153.4	86%	0.857	78%	0.783	S	S	*	*				-174.5	120.5	103.2	-100.5	176.3	173.4	0	0	113.2
1144	D	30.1	Very low	29.7	Very low	132 Å²	132	153.1 Å²	153.1	71%	0.706	78%	0.784	S	S	*	*			trans	51.5	125.8	131.3	-61.2	-14.6	0	0	0	124.5
1145	T	31.1	Very low	29.7	Very low	123 Å²	123	148.4 Å²	148.4	76%	0.755	78%	0.775	S	S	*	*			trans	86	127.5	141.2	56.4	0	0	0	0	123.1
1146	F	29.8	Very low	29.9	Very low	196 Å²	196	150.5 Å²	150.5	86%	0.86	78%	0.78	S	S	*	*			trans	22.6	150.4	145.5	-63	-96.6	0	0	0	122.6
1147	S	29.8	Very low	30.1	Very low	78 Å²	78	153.7 Å²	153.7	55%	0.545	78%	0.783	S	S	.	*			cis	-171.5	174.4	-20.8	56.2	0	0	0	0	110.1
1148	D	31.8	Very low	30	Very low	138 Å²	138	150.7 Å²	150.7	74%	0.738	77%	0.768	S	S	*	*			trans	60.3	124.5	158	-52.5	-54.9	0	0	0	120.7
1149	L	30.7	Very low	29.8	Very low	161 Å²	161	149.4 Å²	149.4	84%	0.843	77%	0.772	S	S	*	*				167.8	130	90.3	-156.4	76.5	0	0	0	112.1
1150	D	28.1	Very low	30	Very low	147 Å²	147	146.7 Å²	146.7	79%	0.786	76%	0.763	S	S	*	*			trans	-72.3	154	166.7	-81.2	-57.4	0	0	0	112.9
1151	R	28.3	Very low	29.8	Very low	229 Å²	229	145 Å²	145	86%	0.864	76%	0.757	S	S	*	*				172.3	166.9	127.2	-92.4	153.8	-174.5	-156.1	0.6	114.3
1152	L	34.6	Very low	29.8	Very low	166 Å²	166	144.6 Å²	144.6	87%	0.869	76%	0.76	S	S	*	*			trans	69.4	96.9	174.7	-51.8	179.5	0	0	0	113.9
1153	K	30.1	Very low	29.9	Very low	182 Å²	182	141 Å²	141	79%	0.791	76%	0.757	S	S	*	*			cis	76	110	34.2	-84.1	-163	173.1	-177.5	0	118.1
1154	N	29.6	Very low	29.8	Very low	147 Å²	147	137.8 Å²	137.8	79%	0.786	75%	0.751	S	S	*	*			trans	80.6	133.5	132.3	-64.8	17.4	0	0	0	122.5
1155	G	31.2	Very low	29.6	Very low	64 Å²	64	139.2 Å²	139.2	66%	0.66	76%	0.758	S	S	*	*			trans	126.2	138.9	157.5	0	0	0	0	0	113.9
1156	Y	32	Very low	29.4	Very low	198 Å²	198	141 Å²	141	78%	0.776	76%	0.763	S	S	*	*			cis	-167.9	150.2	-7.1	-116.4	-66.4	0	0	0	111.1
1157	F	32	Very low	29.2	Very low	178 Å²	178	136.4 Å²	136.4	78%	0.781	76%	0.755	S	S	*	*			trans	60.1	153.2	161.5	-63.9	-64.6	0	0	0	120.3
1158	S	28.3	Very low	29	Very low	82 Å²	82	141.5 Å²	141.5	57%	0.573	77%	0.771	S	S	*	*			cis	-176.1	148.2	-40.1	46.6	0	0	0	0	112.4
1159	T	28	Very low	28.8	Very low	140 Å²	140	141 Å²	141	86%	0.859	77%	0.766	S	S	*	*			trans	63.8	148.1	153.6	49.7	0	0	0	0	118.5
1160	A	30.9	Very low	28.6	Very low	82 Å²	82	139.8 Å²	139.8	68%	0.678	76%	0.761	S	S	*	*			cis	-144.6	160.6	12.9	0	0	0	0	0	113.9
1161	S	27.2	Very low	28.7	Very low	98 Å²	98	143 Å²	143	69%	0.685	76%	0.762	S	S	*	*			trans	26.7	138.9	141.1	58.5	0	0	0	0	120.9
1162	N	27.7	Very low	28.6	Very low	149 Å²	149	135.6 Å²	135.6	80%	0.797	75%	0.745	S	S	*	*			cis	-160.8	169.2	23	-115.7	-9.3	0	0	0	112.7
1163	S	29	Very low	28.4	Very low	98 Å²	98	133.1 Å²	133.1	69%	0.685	74%	0.739	S	S	*	*			trans	41.6	110.2	157.9	56.2	0	0	0	0	119.1
1164	S	25.3	Very low	28.4	Very low	106 Å²	106	130.2 Å²	130.2	74%	0.741	74%	0.737	S	S	*	*				64.7	103.7	61.9	81.7	0	0	0	0	115.7
1165	L	26	Very low	28.3	Very low	161 Å²	161	129 Å²	129	84%	0.843	73%	0.726	S	S	*	*				-163.3	142.8	124	-133.4	75.7	0	0	0	110.7
1166	D	27.1	Very low	28.1	Very low	161 Å²	161	134.6 Å²	134.6	86%	0.861	74%	0.735	S	S	*	*			trans	-76	139.4	156.8	-68	-74.7	0	0	0	109.2
1167	S	26.7	Very low	27.8	Very low	100 Å²	100	130.8 Å²	130.8	70%	0.699	73%	0.733	S	S	*	*			trans	-157.2	156.3	163.7	58.1	0	0	0	0	112.4
1168	Q	25.4	Very low	27.6	Very low	185 Å²	185	128.2 Å²	128.2	86%	0.864	73%	0.732	S	S	*	*			trans	-66.2	134.7	-179.2	-59.6	124.2	-50.3	0	0	111.1	D1170	Q1168-D1170 PolarHBondContact O-N 2.76Å
1169	I	27.3	Very low	27.3	Very low	126 Å²	126	133.1 Å²	133.1	65%	0.646	75%	0.745	S	S	*	*			trans	-90.9	100.3	165.3	-52.3	-179.9	0	0	0	108	W1171	I1169-W1171 HydrophobicContact CG2-CD2 4.09Å; I1169-W1171 VanDerWaalsContact CG2-CE2 3.47Å; I1169-W1171 HydrophobicContact CG2-CG 4.44Å; I1169-W1171 HydrophobicContact CG2-CH2 4.46Å; I1169-W1171 HydrophobicContact CG2-CZ2 3.7Å; I1169-W1171 VanDerWaalsContact O-CD1 3.28Å
1170	D	26.8	Very low	27.4	Very low	136 Å²	136	132.6 Å²	132.6	73%	0.727	74%	0.742	S	S	*	*			trans	-80.5	129.2	169.4	-170.5	14.7	0	0	0	109.5	Q1168 S1172	Q1168-D1170 PolarHBondContact O-N 2.76Å; D1170-S1172 PolarHBondContact O-N 3.48Å
1171	W	28.9	Very low	27.2	Very low	215 Å²	215	135.5 Å²	135.5	81%	0.814	75%	0.745	S	S	*	*			trans	-106.1	69	-171.1	-71.7	95.2	0	0	0	111.3	I1169	I1169-W1171 HydrophobicContact CG2-CD2 4.09Å; I1169-W1171 VanDerWaalsContact CG2-CE2 3.47Å; I1169-W1171 HydrophobicContact CG2-CG 4.44Å; I1169-W1171 HydrophobicContact CG2-CH2 4.46Å; I1169-W1171 HydrophobicContact CG2-CZ2 3.7Å; I1169-W1171 VanDerWaalsContact O-CD1 3.28Å
1172	S	26.6	Very low	27.1	Very low	74 Å²	74	137.2 Å²	137.2	52%	0.517	75%	0.747	S	S	.	*			trans	-112.1	137.3	163.3	58.4	0	0	0	0	109.9	D1170 V1174	D1170-S1172 PolarHBondContact O-N 3.48Å; S1172-V1174 PolarHBondContact O-N 3.28Å
1173	P	31.2	Very low	27	Very low	113 Å²	113	136.5 Å²	136.5	73%	0.734	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-69.5	117.3	178.7	27.7	-33.1	0	0	0	110.1
1174	V	28.3	Very low	27	Very low	122 Å²	122	135.4 Å²	135.4	74%	0.739	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-81.6	127.5	176.8	174.7	0	0	0	0	109.9	S1172 Q1176	S1172-V1174 PolarHBondContact O-N 3.28Å; V1174-Q1176 PolarHBondContact O-N 2.81Å
1175	E	27.8	Very low	27.1	Very low	122 Å²	122	137 Å²	137	57%	0.57	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-63.4	123.6	166.4	-70.6	-170.8	124.1	0	0	110.2	H86 T1177	H86-E1175 IonicContact CE1-OE1 3.68Å; H86-E1175 PolarHBondContact CE1-OE1 2.72Å; H86-E1175 VanDerWaalsContact CE1-OE1 3.27Å; H86-E1175 IonicContact CE1-OE2 2.69Å; H86-E1175 PolarHBondContact CE1-OE2 2.77Å; H86-E1175 IonicContact CG-OE1 3.33Å; H86-E1175 VanDerWaalsContact ND1-CD 3.29Å; H86-E1175 IonicContact ND1-OE1 2.99Å; H86-E1175 PolarHBondContact ND1-OE1 3.1Å; H86-E1175 IonicContact ND1-OE2 3.37Å; H86-E1175 PolarHBondContact ND1-OE2 3.26Å; E1175-T1177 PolarHBondContact O-N 3.18Å; E1175-T1177 VanDerWaalsContact O-N 3.17Å
1176	Q	27.7	Very low	27.2	Very low	181 Å²	181	136.1 Å²	136.1	85%	0.846	75%	0.748	S	S	*	*			trans	-83.6	88	170.5	-75.1	-168.9	-23.8	0	0	110.7	V1174 T1178	V1174-Q1176 PolarHBondContact O-N 2.81Å; Q1176-T1178 PolarHBondContact O-N 3.35Å; Q1176-T1178 VanDerWaalsContact O-N 3.15Å
1177	T	24.8	Very low	27.2	Very low	118 Å²	118	134.1 Å²	134.1	72%	0.724	74%	0.736	S	S	*	*			trans	-67.9	101.5	162.9	50.2	0	0	0	0	109.8	E1175 E1179	E1175-T1177 PolarHBondContact O-N 3.18Å; E1175-T1177 VanDerWaalsContact O-N 3.17Å; T1177-E1179 PolarHBondContact O-N 3.34Å; T1177-E1179 VanDerWaalsContact O-N 3.16Å
1178	T	28.4	Very low	27.2	Very low	124 Å²	124	139.1 Å²	139.1	76%	0.761	74%	0.741	S	S	*	*			trans	-79.1	92.6	171.8	52.1	0	0	0	0	110.5	Q1176 V1180	Q1176-T1178 PolarHBondContact O-N 3.35Å; Q1176-T1178 VanDerWaalsContact O-N 3.15Å; T1178-V1180 PolarHBondContact O-N 3.13Å
1179	E	23.2	Very low	27.2	Very low	184 Å²	184	134.9 Å²	134.9	86%	0.86	73%	0.732	S	S	*	*			trans	-68.6	124.3	167.9	-67.1	-169.3	135.5	0	0	110.9	T1177	T1177-E1179 PolarHBondContact O-N 3.34Å; T1177-E1179 VanDerWaalsContact O-N 3.16Å
1180	V	30.1	Very low	27.2	Very low	129 Å²	129	133.5 Å²	133.5	78%	0.782	73%	0.734	S	S	*	*			trans	-134.1	84.7	163	-173.7	0	0	0	0	109.8	T1178	T1178-V1180 PolarHBondContact O-N 3.13Å
1181	L	25.7	Very low	27.1	Very low	143 Å²	143	132.7 Å²	132.7	75%	0.749	74%	0.739	S	S	*	*			trans	40.6	113.8	145.9	-66.5	166.5	0	0	0	120.3
1182	N	24.6	Very low	27.4	Very low	134 Å²	134	128.3 Å²	128.3	72%	0.717	74%	0.738	S	S	*	*				99.5	135.7	126.7	-74.5	-13.7	0	0	0	122.8
1183	T	26.7	Very low	27.4	Very low	134 Å²	134	132.7 Å²	132.7	82%	0.822	75%	0.754	S	S	*	*			trans	71.6	79.9	147.6	48	0	0	0	0	120.8
1184	G	28.2	Very low	27.1	Very low	75 Å²	75	136.9 Å²	136.9	77%	0.773	76%	0.76	S	S	*	*				83.1	164.1	123.1	0	0	0	0	0	119.3
1185	D	26.8	Very low	27.1	Very low	140 Å²	140	139.2 Å²	139.2	75%	0.749	77%	0.768	S	S	*	*			cis	-163.7	158.3	-15.8	-150.1	-15.9	0	0	0	110.1
1186	L	29.4	Very low	27.1	Very low	142 Å²	142	137.8 Å²	137.8	74%	0.743	77%	0.771	S	S	*	*			trans	64.7	153.1	164.5	-51.5	168	0	0	0	119.4
1187	L	26.1	Very low	27	Very low	119 Å²	119	135.1 Å²	135.1	62%	0.623	76%	0.763	S	S	*	*			cis	-172	143.2	-43.6	-115	-173.7	0	0	0	110.3
1188	Y	27.9	Very low	27.2	Very low	205 Å²	205	135.8 Å²	135.8	80%	0.804	76%	0.761	S	S	*	*			trans	57.4	163.9	161.4	-64.2	-56.2	0	0	0	120.1
1189	S	25	Very low	27.2	Very low	96 Å²	96	138.4 Å²	138.4	67%	0.671	76%	0.764	S	S	*	*			cis	-172.5	-173.8	-35.2	67.6	0	0	0	0	112.7
1190	S	26.9	Very low	27.4	Very low	98 Å²	98	133.4 Å²	133.4	69%	0.685	75%	0.754	S	S	*	*			trans	77.4	91.1	153.2	65.8	0	0	0	0	122.9
1191	S	25.4	Very low	27.3	Very low	118 Å²	118	134 Å²	134	83%	0.825	76%	0.758	S	S	*	*				52.1	151.9	116.9	54.7	0	0	0	0	123.8
1192	P	35.2	Very low	27.8	Very low	124 Å²	124	133.3 Å²	133.3	81%	0.805	76%	0.762	S	S	*	*			trans	-107.2	173.1	-161.9	42.5	-36.9	0	0	0	116.5
1193	I	26.4	Very low	28.1	Very low	165 Å²	165	130 Å²	130	85%	0.846	76%	0.759	S	S	*	*			trans	-134.9	141.2	171	-66.2	179.5	0	0	0	110.7
1194	K	24.8	Very low	28	Very low	201 Å²	201	130.5 Å²	130.5	87%	0.874	76%	0.757	S	S	*	*			trans	-93.5	154	169.3	-71.4	-178.3	177	179.5	0	111.3
1195	L	28	Very low	27.9	Very low	172 Å²	172	133.9 Å²	133.9	90%	0.901	75%	0.753	S	S	*	*			trans	-148.2	156.6	151	-109.2	164.2	0	0	0	110.2
1196	S	27.5	Very low	27.9	Very low	91 Å²	91	134.2 Å²	134.2	64%	0.636	75%	0.748	S	S	*	*			trans	-135.2	168.1	-167.6	56.2	0	0	0	0	112.7
1197	N	26.8	Very low	27.7	Very low	125 Å²	125	134.8 Å²	134.8	67%	0.668	74%	0.744	S	S	*	*			trans	152.3	128.6	136.4	-74.9	-0.2	0	0	0	112
1198	I	27.8	Very low	27.6	Very low	132 Å²	132	135 Å²	135	68%	0.677	75%	0.746	S	S	*	*				78.3	139.9	109.3	-64.1	174.7	0	0	0	112.8
1199	E	28.7	Very low	27.5	Very low	179 Å²	179	130.8 Å²	130.8	84%	0.836	74%	0.737	S	S	*	*			cis	-152.9	-180	17.8	-135.4	138.9	-133.1	0	0	109.5
1200	A	27.6	Very low	27.5	Very low	79 Å²	79	132.3 Å²	132.3	65%	0.653	74%	0.738	S	S	*	*				-166.8	150.9	-59.6	0	0	0	0	0	114.2
1201	V	28.9	Very low	27.4	Very low	143 Å²	143	135.8 Å²	135.8	87%	0.867	74%	0.741	S	S	*	*			trans	84.4	151	135.7	160.5	0	0	0	0	122.9
1202	P	36.1	Very low	27.3	Very low	127 Å²	127	135.2 Å²	135.2	83%	0.825	74%	0.737	S	S	*	*			trans	-136.1	-166.4	-159.6	44.3	-24	0	0	0	117.6
1203	G	29.1	Very low	26.8	Very low	64 Å²	64	134.6 Å²	134.6	66%	0.66	73%	0.734	S	S	*	*			trans	178.3	137.1	165.4	0	0	0	0	0	111.7
1204	N	26.4	Very low	26.7	Very low	146 Å²	146	134.9 Å²	134.9	78%	0.781	73%	0.732	S	S	*	*				77.3	139.9	67.2	-76.9	31.2	0	0	0	113.5
1205	E	26	Very low	26.7	Very low	145 Å²	145	130.7 Å²	130.7	68%	0.678	72%	0.724	S	S	*	*			cis	-165.6	154.1	14.6	-125.7	170.4	-113.3	0	0	116.4
1206	F	25.3	Very low	26.6	Very low	148 Å²	148	127.3 Å²	127.3	65%	0.649	71%	0.714	S	S	*	*			trans	50.7	140.6	141.4	-83.1	-40.9	0	0	0	129.7
1207	K	25.7	Very low	26.6	Very low	154 Å²	154	128.9 Å²	128.9	67%	0.67	72%	0.716	S	S	*	*			trans	76.3	152.6	134.3	-72.2	166.6	-170.6	157.3	0	120.5
1208	N	25.2	Very low	26.7	Very low	124 Å²	124	130 Å²	130	66%	0.663	72%	0.715	S	S	*	*			cis	-166.7	158.6	-14.5	-117.6	16.8	0	0	0	114.2
1209	N	25.3	Very low	26.5	Very low	115 Å²	115	130.2 Å²	130.2	62%	0.615	71%	0.713	S	S	*	*			trans	72.7	137.3	139.5	-73.9	17.9	0	0	0	126.3
1210	N	24.9	Very low	26.4	Very low	128 Å²	128	129 Å²	129	68%	0.684	71%	0.711	S	S	*	*			trans	78.2	147.4	134.9	-70.9	16.8	0	0	0	121.3
1211	F	24.4	Very low	26.4	Very low	172 Å²	172	130.3 Å²	130.3	75%	0.754	72%	0.716	S	S	*	*			cis	-168.2	155.1	-12.3	-140.2	-116.1	0	0	0	112.1
1212	S	23.9	Very low	26.4	Very low	105 Å²	105	126.6 Å²	126.6	73%	0.734	71%	0.706	S	S	*	*			trans	54.9	169.2	151.9	53.6	0	0	0	0	123.4
1213	C	23.6	Very low	25.9	Very low	111 Å²	111	127.3 Å²	127.3	75%	0.75	71%	0.708	S	S	*	*			cis	-175.9	178.4	-44	-155.8	0	0	0	0	111.2
1214	E	24.1	Very low	25.8	Very low	171 Å²	171	128.8 Å²	128.8	80%	0.799	71%	0.708	S	S	*	*			trans	72.1	151.7	159.3	-60.2	-179.1	169.2	0	0	120.6
1215	T	26.2	Very low	25.8	Very low	114 Å²	114	129.7 Å²	129.7	70%	0.699	71%	0.708	S	S	*	*			cis	-170	161.8	-19.8	29.2	0	0	0	0	113.1
1216	S	26	Very low	25.9	Very low	100 Å²	100	129.7 Å²	129.7	70%	0.699	71%	0.707	S	S	*	*			trans	70.9	154.4	143.9	69.8	0	0	0	0	121.7
1217	D	26.6	Very low	26	Very low	125 Å²	125	126.3 Å²	126.3	67%	0.668	70%	0.702	S	S	*	*			cis	-171.5	157.1	-9.7	-114.5	23.2	0	0	0	115.1
1218	K	28	Very low	26	Very low	149 Å²	149	125.3 Å²	125.3	65%	0.648	70%	0.703	S	S	*	*			trans	68.1	158.5	143	-67.5	170.4	173.8	-78.9	0	122.8
1219	E	25.3	Very low	26.2	Very low	135 Å²	135	123.4 Å²	123.4	63%	0.631	70%	0.7	S	S	*	*			cis	-170	154	-15.3	-110.2	165.8	-173	0	0	114.7
1220	L	26.9	Very low	26.3	Very low	154 Å²	154	121.7 Å²	121.7	81%	0.806	69%	0.689	S	S	*	*			trans	61.8	158.9	147.3	-62.8	165.2	0	0	0	122.7
1221	S	26.5	Very low	26.4	Very low	107 Å²	107	121.8 Å²	121.8	75%	0.748	68%	0.683	S	S	*	*			cis	-179.7	150	-26.2	59.6	0	0	0	0	115.2
1222	G	28.2	Very low	26.6	Very low	64 Å²	64	119 Å²	119	66%	0.66	68%	0.68	S	S	*	*			trans	116.4	118.2	152.3	0	0	0	0	0	119.8
1223	T	26.5	Very low	26.7	Very low	143 Å²	143	119.5 Å²	119.5	88%	0.877	67%	0.674	S	S	*	*				84.3	144.5	85.9	49	0	0	0	0	116.7
1224	S	26.2	Very low	26.8	Very low	94 Å²	94	120.2 Å²	120.2	66%	0.657	67%	0.67	S	S	*	*			cis	-180	141.1	-1	46.8	0	0	0	0	115.3
1225	H	27.6	Very low	26.9	Very low	166 Å²	166	118.7 Å²	118.7	77%	0.769	67%	0.667	S	S	*	*			trans	62.3	166.3	154.9	-74.9	-109	0	0	0	121.2
1226	E	27.3	Very low	27	Very low	144 Å²	144	115.9 Å²	115.9	67%	0.673	66%	0.661	S	S	*	*			cis	-178.1	177.1	-32.5	-101.7	-154.1	100	0	0	109.1
1227	S	27.8	Very low	26.9	Very low	78 Å²	78	118.1 Å²	118.1	55%	0.545	66%	0.664	S	S	.	*			cis	-172.8	176.6	-39	64.8	0	0	0	0	112
1228	L	26.7	Very low	26.8	Very low	132 Å²	132	117.5 Å²	117.5	69%	0.691	66%	0.661	S	S	*	*			trans	74.2	155.6	157.4	-67.2	170.2	0	0	0	122	D770	D770-L1228 WeakPolarHBondContact OD1-CD2 3.48Å
1229	S	28.2	Very low	26.7	Very low	85 Å²	85	118.5 Å²	118.5	59%	0.594	67%	0.665	S	S	*	*			cis	-139.9	-146	9.1	65.8	0	0	0	0	115.4
1230	E	26.9	Very low	26.6	Very low	79 Å²	79	120.5 Å²	120.5	37%	0.369	67%	0.672	S	S	.	*			trans	-142.5	169.6	-167.8	-62.6	-176.8	112	0	0	116.6	T767 T769	T767-E1230 WeakPolarHBondContact CB-OE2 3.33Å; T767-E1230 WeakPolarHBondContact CG2-OE2 3.48Å; T767-E1230 PolarHBondContact OG1-OE2 3.46Å; T769-E1230 VanDerWaalsContact CB-OE2 3.25Å; T769-E1230 WeakPolarHBondContact CB-OE2 3.44Å; T769-E1230 PolarHBondContact OG1-OE1 3.39Å; T769-E1230 VanDerWaalsContact OG1-OE1 3.14Å; T769-E1230 PolarHBondContact OG1-OE2 3.45Å; T769-E1230 VanDerWaalsContact OG1-OE2 3.11Å
1231	F	27.3	Very low	26.6	Very low	130 Å²	130	118.7 Å²	118.7	57%	0.57	67%	0.667	S	S	*	*			trans	83.6	167.5	145.9	-77.8	-56.6	0	0	0	123.9	T767	T767-F1231 HydrophobicContact CG2-CD2 3.66Å; T767-F1231 HydrophobicContact CG2-CE2 3.95Å
1232	T	28.6	Very low	26.7	Very low	113 Å²	113	123 Å²	123	69%	0.693	67%	0.667	S	S	*	*			cis	-151.9	136.8	11.8	-10.6	0	0	0	0	117.5
1233	L	26.7	Very low	26.6	Very low	116 Å²	116	126.1 Å²	126.1	61%	0.607	67%	0.668	S	S	*	*			trans	39.5	138.1	133.5	-74.7	177.1	0	0	0	126.3
1234	L	26	Very low	26.8	Very low	126 Å²	126	126.7 Å²	126.7	66%	0.66	66%	0.658	S	S	*	*				151.3	150.5	92.8	-116	158.5	0	0	0	116.7
1235	N	26.4	Very low	26.8	Very low	138 Å²	138	129.6 Å²	129.6	74%	0.738	67%	0.666	S	S	*	*			trans	71.7	144.5	167.8	-57.6	-49.7	0	0	0	119.3
1236	G	27.1	Very low	26.8	Very low	55 Å²	55	126.9 Å²	126.9	57%	0.567	66%	0.662	S	S	*	*			cis	171.5	135.4	-9.8	0	0	0	0	0	116.8
1237	L	23.6	Very low	26.8	Very low	148 Å²	148	128.4 Å²	128.4	78%	0.775	67%	0.666	S	S	*	*			trans	68	127.9	156.4	-69.6	174.3	0	0	0	124.5
1238	N	25	Very low	26.8	Very low	111 Å²	111	132.5 Å²	132.5	59%	0.594	68%	0.676	S	S	*	*			trans	89.1	105.4	137.3	-83	-49.8	0	0	0	124.4
1239	K	25.9	Very low	26.7	Very low	170 Å²	170	130.3 Å²	130.3	74%	0.739	68%	0.677	S	S	*	*				85.1	125.4	122.6	-79.9	169.9	-176.5	165.3	0	123.2
1240	K	24.3	Very low	26.5	Very low	177 Å²	177	130 Å²	130	77%	0.77	69%	0.687	S	S	*	*			trans	75.8	150.9	142.2	-72.8	-177.3	175.9	-176.9	0	119.1
1241	V	26.5	Very low	26.4	Very low	116 Å²	116	132 Å²	132	70%	0.703	71%	0.71	S	S	*	*			cis	-166.3	143.7	-37.3	111.8	0	0	0	0	110.2
1242	R	28.6	Very low	26.3	Very low	199 Å²	199	133.7 Å²	133.7	75%	0.751	72%	0.72	S	S	*	*			trans	30.5	132.2	160.3	-63.4	176.5	169	159.2	-3	121.3
1243	N	26.3	Very low	26.1	Very low	128 Å²	128	132.5 Å²	132.5	68%	0.684	71%	0.709	S	S	*	*				-167.3	128.8	96.8	-94.2	-28.1	0	0	0	109
1244	K	30	Very low	26	Very low	155 Å²	155	135.5 Å²	135.5	67%	0.674	72%	0.717	S	S	*	*				79	123.2	71.2	-80.5	-167.2	-172.6	175.7	0	114.5
1245	N	26.6	Very low	26	Very low	155 Å²	155	132.8 Å²	132.8	83%	0.829	70%	0.703	S	S	*	*			trans	-177.5	105.3	134.6	-84.9	-21.9	0	0	0	105.9
1246	T	27.6	Very low	25.9	Very low	109 Å²	109	130.7 Å²	130.7	67%	0.669	70%	0.699	S	S	*	*				66.1	110.8	63.8	68.7	0	0	0	0	116.1
1247	K	26	Very low	25.8	Very low	177 Å²	177	134.8 Å²	134.8	77%	0.77	70%	0.704	S	S	*	*				177.8	145.7	117.6	-104.3	177.6	168.1	-163.3	0	115.2
1248	H	27.6	Very low	25.9	Very low	163 Å²	163	130.8 Å²	130.8	76%	0.755	69%	0.692	S	S	*	*			trans	54.7	155.9	156	-58.3	-55.9	0	0	0	119.9
1249	A	25	Very low	25.8	Very low	86 Å²	86	128.3 Å²	128.3	71%	0.711	68%	0.677	S	S	*	*			cis	-161.2	156.4	-29.9	0	0	0	0	0	108.6
1250	G	25	Very low	25.7	Very low	78 Å²	78	125.7 Å²	125.7	80%	0.804	68%	0.679	S	S	*	*			trans	167.6	144.9	177	0	0	0	0	0	113.2
1251	S	24.3	Very low	25.8	Very low	121 Å²	121	120.9 Å²	120.9	85%	0.846	66%	0.664	S	S	*	*			trans	-82.6	116.6	-172.2	48.2	0	0	0	0	114.1
1252	E	25.2	Very low	25.8	Very low	166 Å²	166	119.7 Å²	119.7	78%	0.776	66%	0.661	S	S	*	*			trans	-164.6	136.9	142.1	-120.5	176.1	-143.6	0	0	109.8	F1254	E1252-F1254 HydrophobicContact CG-CD2 4.37Å
1253	L	24.8	Very low	25.6	Very low	89 Å²	89	116.7 Å²	116.7	47%	0.466	66%	0.66	S	S	.	*			trans	-129.5	47.1	-174.3	-125.5	170	0	0	0	112.5	R367 Q387 L1255	R367-L1253 PolarHBondContact NH2-O 3.48Å; Q387-L1253 HydrophobicContact CB-CD1 3.87Å; Q387-L1253 HydrophobicContact CG-CD1 4.33Å; L1253-L1255 PolarHBondContact O-N 3.33Å
1254	F	24	Very low	25.6	Very low	178 Å²	178	116.8 Å²	116.8	78%	0.781	66%	0.661	S	S	*	*			trans	-62.7	94.9	167.4	-95	-79.5	0	0	0	110.7	E1252 S1256	E1252-F1254 HydrophobicContact CG-CD2 4.37Å; F1254-S1256 VanDerWaalsContact C-N 3.3Å; F1254-S1256 PolarHBondContact O-N 2.99Å
1255	L	26.7	Very low	25.3	Very low	69 Å²	69	114.5 Å²	114.5	36%	0.361	66%	0.664	S	S	.	*			trans	-74.2	93.3	149.8	-90.9	159.7	0	0	0	107.1	A391 L1253 Q1257	A391-L1255 HydrophobicContact CB-CD1 3.58Å; L1253-L1255 PolarHBondContact O-N 3.33Å; L1255-Q1257 PolarHBondContact O-N 3.27Å
1256	S	24.7	Very low	25.3	Very low	95 Å²	95	113 Å²	113	66%	0.664	67%	0.666	S	S	*	*			trans	-48	129.6	161.6	56.9	0	0	0	0	108.9	F1254 A1258	F1254-S1256 VanDerWaalsContact C-N 3.3Å; F1254-S1256 PolarHBondContact O-N 2.99Å; S1256-A1258 PolarHBondContact O-N 2.99Å
1257	Q	24.5	Very low	25.1	Very low	141 Å²	141	115.1 Å²	115.1	66%	0.659	67%	0.673	S	S	*	*			trans	-57.9	109.8	176.6	-68.4	-179.9	-4.9	0	0	108.4	L1255 E1259	L1255-Q1257 PolarHBondContact O-N 3.27Å; Q1257-E1259 HydrophobicContact CB-CG 4.39Å; Q1257-E1259 PolarHBondContact O-N 3.33Å
1258	A	24.7	Very low	25	Very low	64 Å²	64	114.5 Å²	114.5	53%	0.529	67%	0.673	S	S	.	*			trans	-78.9	40.4	-179.9	0	0	0	0	0	111.9	S1256	S1256-A1258 PolarHBondContact O-N 2.99Å
1259	E	23.6	Very low	25	Very low	58 Å²	58	112.1 Å²	112.1	27%	0.271	66%	0.661	S	S	.	*	S	Bend	trans	-65.8	156.4	156.9	-57.5	-100.4	128.7	0	0	107.5	K360 Q1257 T1261	K360-E1259 IonicContact NZ-OE1 2.86Å; K360-E1259 PolarHBondContact NZ-OE1 3.15Å; Q1257-E1259 HydrophobicContact CB-CG 4.39Å; Q1257-E1259 PolarHBondContact O-N 3.33Å; E1259-T1261 PolarHBondContact O-N 3.16Å
1260	C	24.7	Very low	25	Very low	115 Å²	115	114.1 Å²	114.1	78%	0.777	66%	0.655	S	S	*	*	S	Bend	trans	-84.6	49.2	-177.9	-73.6	0	0	0	0	112.9
1261	T	24.9	Very low	25.1	Very low	77 Å²	77	114.1 Å²	114.1	47%	0.472	64%	0.641	S	S	.	*			trans	-137.7	107.6	179.9	32.6	0	0	0	0	108.7	E1259	E1259-T1261 PolarHBondContact O-N 3.16Å
1262	S	27	Very low	25.3	Very low	91 Å²	91	112.7 Å²	112.7	64%	0.636	62%	0.62	S	S	*	*			trans	-89.5	123.8	-174.5	57	0	0	0	0	112
1263	N	23.9	Very low	25.5	Very low	135 Å²	135	110.9 Å²	110.9	72%	0.722	62%	0.616	S	S	*	*			trans	-80.5	163.5	-178.5	-118.3	49.9	0	0	0	114.3
1264	D	26.7	Very low	25.7	Very low	131 Å²	131	112.2 Å²	112.2	70%	0.701	62%	0.62	S	S	*	*			trans	78.5	120.9	152.8	-52.6	-29.7	0	0	0	123
1265	S	24	Very low	25.8	Very low	107 Å²	107	109.3 Å²	109.3	75%	0.748	61%	0.613	S	S	*	*			trans	79.1	62.7	136.8	69.9	0	0	0	0	121
1266	S	25.7	Very low	25.8	Very low	124 Å²	124	110.4 Å²	110.4	87%	0.867	62%	0.618	S	S	*	*			trans	-173	151.3	132.5	28	0	0	0	0	112.9	Q1268	S1266-Q1268 PolarHBondContact O-N 3.48Å
1267	D	24	Very low	26	Very low	152 Å²	152	115.5 Å²	115.5	81%	0.813	62%	0.624	S	S	*	*	S	Bend	trans	-56.4	98.4	-169	-59.7	-50.5	0	0	0	115.6
1268	Q	25	Very low	26.3	Very low	165 Å²	165	111.9 Å²	111.9	77%	0.771	61%	0.609	S	S	*	*			trans	-176	126.4	145.1	-103.5	147.4	102.8	0	0	115.4	S1266	S1266-Q1268 PolarHBondContact O-N 3.48Å
1269	F	26.1	Very low	26.6	Very low	113 Å²	113	112.2 Å²	112.2	50%	0.496	60%	0.602	S	S	.	*			trans	25.7	102.5	156.9	-58.6	-63.1	0	0	0	120.9
1270	H	26.2	Very low	26.9	Very low	128 Å²	128	110.5 Å²	110.5	59%	0.593	60%	0.596	S	S	*	*			trans	-142.1	133.7	145.1	-104.7	-94.8	0	0	0	111	E1272	H1270-E1272 IonicContact CE1-OE1 2.69Å; H1270-E1272 PolarHBondContact CE1-OE1 3.02Å; H1270-E1272 IonicContact ND1-OE1 3.95Å; H1270-E1272 PolarHBondContact ND1-OE1 3.46Å
1271	P	26.5	Very low	27.1	Very low	78 Å²	78	112.9 Å²	112.9	51%	0.506	59%	0.594	S	S	.	*			trans	-102.1	70.5	166.7	37	-28.1	0	0	0	109.7	T166	T166-P1271 HydrophobicContact CG2-CB 4.3Å; T166-P1271 HydrophobicContact CG2-CG 4.04Å
1272	E	29.5	Very low	27.3	Very low	90 Å²	90	112 Å²	112	42%	0.421	59%	0.586	S	S	.	*			trans	-131.8	47.7	-178.9	-71.8	-169.5	-127	0	0	112.3	H1270 Q1274	H1270-E1272 IonicContact CE1-OE1 2.69Å; H1270-E1272 PolarHBondContact CE1-OE1 3.02Å; H1270-E1272 IonicContact ND1-OE1 3.95Å; H1270-E1272 PolarHBondContact ND1-OE1 3.46Å; E1272-Q1274 PolarHBondContact O-N 2.9Å
1273	D	28.1	Very low	27.3	Very low	129 Å²	129	114.1 Å²	114.1	69%	0.69	59%	0.59	S	S	*	*			trans	-64.5	89.7	155	-69.7	-27.2	0	0	0	107.8
1274	Q	28.5	Very low	27.5	Very low	116 Å²	116	114.5 Å²	114.5	54%	0.542	59%	0.592	S	S	.	*			trans	-85.5	122.4	166.1	-64.8	-173.9	29.9	0	0	107.7	E1272 I1276	E1272-Q1274 PolarHBondContact O-N 2.9Å; Q1274-I1276 VanDerWaalsContact C-N 3.29Å; Q1274-I1276 HydrophobicContact CB-CG1 4.3Å; Q1274-I1276 PolarHBondContact O-N 3.39Å
1275	D	27.7	Very low	27.5	Very low	117 Å²	117	117 Å²	117	63%	0.626	60%	0.599	S	S	*	*			trans	-64.7	90.2	166.7	-74.9	-53.7	0	0	0	108.9	Y1277	D1275-Y1277 PolarHBondContact O-N 3.28Å
1276	I	26.1	Very low	27.7	Very low	92 Å²	92	120.1 Å²	120.1	47%	0.472	60%	0.596	S	S	.	*			trans	-77.6	64.1	175.1	-54.1	170.9	0	0	0	109	Q1274 D1278	Q1274-I1276 VanDerWaalsContact C-N 3.29Å; Q1274-I1276 HydrophobicContact CB-CG1 4.3Å; Q1274-I1276 PolarHBondContact O-N 3.39Å; I1276-D1278 PolarHBondContact O-N 2.97Å
1277	Y	28.4	Very low	27.7	Very low	203 Å²	203	119.8 Å²	119.8	80%	0.796	59%	0.589	S	S	*	*			trans	-78	97.5	156.5	-90.2	-93	0	0	0	108.1	D1275 D1279	D1275-Y1277 PolarHBondContact O-N 3.28Å; Y1277-D1279 PolarHBondContact O-N 3.39Å
1278	D	30.3	Very low	27.7	Very low	64 Å²	64	120.1 Å²	120.1	34%	0.342	59%	0.591	S	S	.	*			trans	-69	84.2	165.7	-168.1	-20.3	0	0	0	107.8	K360 Y361 I1276 S1280	K360-D1278 IonicContact NZ-OD2 3.01Å; Y361-D1278 HydrophobicContact CD2-CB 4.27Å; Y361-D1278 HydrophobicContact CG-CB 4.49Å; I1276-D1278 PolarHBondContact O-N 2.97Å; D1278-S1280 PolarHBondContact O-N 2.81Å; D1278-S1280 PolarHBondContact O-OG 3.09Å
1279	D	31.2	Very low	27.8	Very low	71 Å²	71	118.8 Å²	118.8	38%	0.38	59%	0.594	S	S	.	*			trans	-69.4	47.5	-173.9	-165.8	13.1	0	0	0	112.8	R657 Y1277 F1281	R657-D1279 IonicContact CZ-OD1 2.81Å; R657-D1279 IonicContact CZ-OD2 2.78Å; R657-D1279 IonicContact NH1-OD1 2.8Å; R657-D1279 PolarHBondContact NH1-OD1 2.93Å; R657-D1279 IonicContact NH1-OD2 3.77Å; R657-D1279 PolarHBondContact NH1-OD2 3.28Å; R657-D1279 IonicContact NH2-OD1 3.14Å; Y1277-D1279 PolarHBondContact O-N 3.39Å; D1279-F1281 PolarHBondContact O-N 3Å
1280	S	30.9	Very low	27.7	Very low	22 Å²	22	119.9 Å²	119.9	15%	0.154	61%	0.61	C	S	.	*			trans	-72.4	10.7	164.5	58.6	0	0	0	0	112.7	Y361 D1278 I1282	Y361-S1280 WeakPolarHBondContact CB-OG 3.37Å; Y361-S1280 WeakPolarHBondContact CD1-OG 3.22Å; D1278-S1280 PolarHBondContact O-N 2.81Å; D1278-S1280 PolarHBondContact O-OG 3.09Å; S1280-I1282 PolarHBondContact O-N 2.72Å
1281	F	27.7	Very low	27.7	Very low	165 Å²	165	118.7 Å²	118.7	72%	0.724	61%	0.614	S	S	*	*			trans	-78.4	50.9	178.7	-132.7	-75.9	0	0	0	111.9	R657 D1279	R657-F1281 PolarHBondContact NH2-O 3.32Å; D1279-F1281 PolarHBondContact O-N 3Å
1282	I	29.3	Very low	27.7	Very low	58 Å²	58	120.5 Å²	120.5	30%	0.297	62%	0.62	S	S	.	*			trans	-141	72.3	170.9	-46.4	173.5	0	0	0	108	V653 S1280	V653-I1282 HydrophobicContact CB-CD1 3.95Å; V653-I1282 HydrophobicContact CG1-CD1 3.73Å; V653-I1282 HydrophobicContact CG2-CD1 4.19Å; S1280-I1282 PolarHBondContact O-N 2.72Å
1283	N	28.6	Very low	27.7	Very low	136 Å²	136	119.8 Å²	119.8	73%	0.727	63%	0.625	S	S	*	*			trans	-94.6	120.5	147	-85.9	-4.6	0	0	0	106.4
1284	D	26.4	Very low	27.9	Very low	143 Å²	143	117.1 Å²	117.1	77%	0.765	62%	0.616	S	S	*	*	S	Bend	trans	-61.4	154.3	157.6	-59.4	-59.1	0	0	0	108.7
1285	E	27.6	Very low	28.1	Very low	183 Å²	183	120 Å²	120	86%	0.855	62%	0.622	S	S	*	*			trans	69.7	63.5	-177.4	-52.7	-177.2	167.8	0	0	116.5
1286	Y	29	Very low	28.2	Very low	173 Å²	173	117.3 Å²	117.3	68%	0.678	61%	0.613	S	S	*	*			trans	-145.6	108.5	139.7	-107.2	-71.1	0	0	0	112.9	Y351	Y351-Y1286 HydrophobicContact CD2-CE2 4.27Å; Y351-Y1286 AromaticContact CE2-CE2 3.7Å; Y351-Y1286 HydrophobicContact CE2-CE2 3.7Å; Y351-Y1286 PolarHBondContact OH-OH 2.9Å; Y351-Y1286 VanDerWaalsContact OH-OH 3.12Å
1287	T	24.3	Very low	28.5	Very low	118 Å²	118	118.2 Å²	118.2	72%	0.724	62%	0.619	S	S	*	*			trans	-93.3	146.1	171.2	47.9	0	0	0	0	111.4
1288	N	23.8	Very low	28.6	Very low	158 Å²	158	113.8 Å²	113.8	85%	0.845	61%	0.607	S	S	*	*			trans	61.6	76.7	161.7	-56.2	-13.2	0	0	0	117.5
1289	V	27.2	Very low	28.7	Very low	138 Å²	138	117.8 Å²	117.8	84%	0.836	62%	0.621	S	S	*	*			trans	-131.9	121	144.2	-177	0	0	0	0	109.1
1290	T	24.6	Very low	28.7	Very low	135 Å²	135	120.7 Å²	120.7	83%	0.828	63%	0.634	S	S	*	*			trans	-84.8	126.9	173.7	44.1	0	0	0	0	110.5
1291	C	26.7	Very low	28.7	Very low	103 Å²	103	124.9 Å²	124.9	70%	0.696	65%	0.647	S	S	*	*			trans	-112.9	91.5	172.5	-151.8	0	0	0	0	109.1	S1293	C1291-S1293 PolarHBondContact O-N 3.24Å; C1291-S1293 PolarHBondContact SG-OG 2.99Å
1292	D	25.7	Very low	29	Very low	116 Å²	116	122.6 Å²	122.6	62%	0.62	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	19.3	-171.8	-138.5	1	0	0	0	112.7	R1295	D1292-R1295 WeakPolarHBondContact OD1-CD 3.27Å; D1292-R1295 IonicContact OD1-NH1 2.8Å; D1292-R1295 PolarHBondContact OD1-NH1 3.13Å; D1292-R1295 VanDerWaalsContact OD1-NH1 3.13Å
1293	S	29.9	Very low	29.1	Very low	76 Å²	76	125.1 Å²	125.1	53%	0.531	65%	0.652	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.8	-23.7	-174.9	50.4	0	0	0	0	114.6	C1291 R1295 S1296	C1291-S1293 PolarHBondContact O-N 3.24Å; C1291-S1293 PolarHBondContact SG-OG 2.99Å; S1293-R1295 PolarHBondContact O-N 3.01Å; S1293-S1296 PolarHBondContact O-OG 3.14Å
1294	S	32.8	Very low	29.3	Very low	72 Å²	72	123 Å²	123	50%	0.503	65%	0.648	S	S	.	*	H	α-helix	trans	-73.5	-5.5	177.6	59.4	0	0	0	0	114
1295	R	31.1	Very low	29.7	Very low	176 Å²	176	119.1 Å²	119.1	66%	0.664	63%	0.627	S	S	*	*	H	α-helix	trans	-90.4	-17.9	-173.5	-114.3	174.2	179.3	157.9	-0.6	115	D1292 S1293	D1292-R1295 WeakPolarHBondContact OD1-CD 3.27Å; D1292-R1295 IonicContact OD1-NH1 2.8Å; D1292-R1295 PolarHBondContact OD1-NH1 3.13Å; D1292-R1295 VanDerWaalsContact OD1-NH1 3.13Å; S1293-R1295 PolarHBondContact O-N 3.01Å
1296	S	31.4	Very low	29.6	Very low	61 Å²	61	120 Å²	120	43%	0.427	62%	0.622	S	S	.	*	H	α-helix	trans	-71.8	-52.7	171.9	39.9	0	0	0	0	110.7	S1293 M1298 K1299 M1300	S1293-S1296 PolarHBondContact O-OG 3.14Å; S1296-M1298 PolarHBondContact O-N 3.36Å; S1296-K1299 WeakPolarHBondContact O-CA 3.49Å; S1296-K1299 WeakPolarHBondContact O-CB 3.39Å; S1296-K1299 PolarHBondContact O-N 3.22Å; S1296-M1300 PolarHBondContact O-N 2.99Å; S1296-M1300 VanDerWaalsContact O-N 3.09Å
1297	D	31	Very low	29.6	Very low	112 Å²	112	115.2 Å²	115.2	60%	0.599	61%	0.614	S	S	*	*	H	α-helix	trans	-72.4	-38.9	-165.6	-50.7	-1.7	0	0	0	110.4	K1299 M1300 Y1301	D1297-K1299 PolarHBondContact O-N 3.04Å; D1297-M1300 PolarHBondContact O-N 3.47Å; D1297-Y1301 WeakPolarHBondContact O-CB 3.43Å; D1297-Y1301 PolarHBondContact O-N 3.12Å
1298	M	31.9	Very low	29.6	Very low	110 Å²	110	115.1 Å²	115.1	54%	0.542	62%	0.616	S	S	.	*	H	α-helix	trans	-62.9	-26.9	172.3	-159.2	179.6	-61.9	0	0	112.3	S1296 L1302	S1296-M1298 PolarHBondContact O-N 3.36Å; M1298-L1302 WeakPolarHBondContact O-CB 3.47Å; M1298-L1302 VanDerWaalsContact O-CG 3.28Å; M1298-L1302 WeakPolarHBondContact O-CG 3.36Å; M1298-L1302 PolarHBondContact O-N 3.43Å; M1298-L1302 VanDerWaalsContact O-N 3.12Å
1299	K	31.1	Very low	29.8	Very low	148 Å²	148	115.3 Å²	115.3	64%	0.643	61%	0.611	S	S	*	*	H	α-helix	trans	-75.7	-41.6	175.3	-136.5	174.5	-174.2	178.3	0	111.4	S1296 D1297 L1302 Q1303	S1296-K1299 WeakPolarHBondContact O-CA 3.49Å; S1296-K1299 WeakPolarHBondContact O-CB 3.39Å; S1296-K1299 PolarHBondContact O-N 3.22Å; D1297-K1299 PolarHBondContact O-N 3.04Å; K1299-L1302 PolarHBondContact O-N 3.48Å; K1299-Q1303 VanDerWaalsContact O-CG 3.31Å; K1299-Q1303 WeakPolarHBondContact O-CG 3.39Å; K1299-Q1303 PolarHBondContact O-N 3.08Å
1300	M	31.4	Very low	29.7	Very low	131 Å²	131	116.2 Å²	116.2	65%	0.645	61%	0.61	S	S	*	*	H	α-helix	trans	-62.2	-45.2	172.2	-71.7	-71.8	-78.2	0	0	111.3	S1296 D1297 L1302 Q1303 S1304	S1296-M1300 PolarHBondContact O-N 2.99Å; S1296-M1300 VanDerWaalsContact O-N 3.09Å; D1297-M1300 PolarHBondContact O-N 3.47Å; M1300-L1302 VanDerWaalsContact C-N 3.33Å; M1300-L1302 PolarHBondContact O-N 2.94Å; M1300-Q1303 WeakPolarHBondContact O-CB 3.4Å; M1300-Q1303 PolarHBondContact O-N 3.26Å; M1300-S1304 PolarHBondContact O-N 3.14Å
1301	Y	31.7	Very low	29.7	Very low	110 Å²	110	117.4 Å²	117.4	43%	0.431	60%	0.604	S	S	.	*	H	α-helix	trans	-64.6	-34.4	178.3	-160.7	-91.9	0	0	0	112.8	R253 D1297 Q1303 S1304 I1305	R253-Y1301 PolarHBondContact NE-OH 3.27Å; D1297-Y1301 WeakPolarHBondContact O-CB 3.43Å; D1297-Y1301 PolarHBondContact O-N 3.12Å; Y1301-Q1303 VanDerWaalsContact C-N 3.35Å; Y1301-S1304 PolarHBondContact O-OG 3.39Å; Y1301-S1304 VanDerWaalsContact O-OG 3.08Å; Y1301-I1305 HydrophobicContact CD1-CD1 4.12Å; Y1301-I1305 HydrophobicContact CE1-CD1 3.99Å; Y1301-I1305 WeakPolarHBondContact O-CD1 3.47Å
1302	L	34	Very low	29.8	Very low	117 Å²	117	118.4 Å²	118.4	61%	0.613	61%	0.609	S	S	*	*	H	α-helix	trans	-78.7	-15.2	172.7	-71.5	171.5	0	0	0	113.8	M1298 K1299 M1300	M1298-L1302 WeakPolarHBondContact O-CB 3.47Å; M1298-L1302 VanDerWaalsContact O-CG 3.28Å; M1298-L1302 WeakPolarHBondContact O-CG 3.36Å; M1298-L1302 PolarHBondContact O-N 3.43Å; M1298-L1302 VanDerWaalsContact O-N 3.12Å; K1299-L1302 PolarHBondContact O-N 3.48Å; M1300-L1302 VanDerWaalsContact C-N 3.33Å; M1300-L1302 PolarHBondContact O-N 2.94Å
1303	Q	31.2	Very low	29.8	Very low	111 Å²	111	123.9 Å²	123.9	52%	0.519	62%	0.621	S	S	.	*	H	α-helix	trans	-82.8	-39.2	171.8	-78.8	172	-34.4	0	0	112	K1299 M1300 Y1301 I1305 R1306	K1299-Q1303 VanDerWaalsContact O-CG 3.31Å; K1299-Q1303 WeakPolarHBondContact O-CG 3.39Å; K1299-Q1303 PolarHBondContact O-N 3.08Å; M1300-Q1303 WeakPolarHBondContact O-CB 3.4Å; M1300-Q1303 PolarHBondContact O-N 3.26Å; Y1301-Q1303 VanDerWaalsContact C-N 3.35Å; Q1303-I1305 PolarHBondContact O-N 3.05Å; Q1303-R1306 WeakPolarHBondContact O-CB 3.48Å; Q1303-R1306 PolarHBondContact O-N 3.35Å
1304	S	32.3	Very low	29.6	Very low	92 Å²	92	127.3 Å²	127.3	64%	0.643	63%	0.633	S	S	*	*	H	α-helix	trans	-66	-21	-178.2	65.8	0	0	0	0	114.7	M1300 Y1301 R1306	M1300-S1304 PolarHBondContact O-N 3.14Å; Y1301-S1304 PolarHBondContact O-OG 3.39Å; Y1301-S1304 VanDerWaalsContact O-OG 3.08Å; S1304-R1306 VanDerWaalsContact C-N 3.34Å
1305	I	34.3	Very low	29.4	Very low	62 Å²	62	130.9 Å²	130.9	32%	0.318	65%	0.652	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.7	-9.9	-179.7	-62.2	170.5	0	0	0	112.4	Y1301 Q1303 S1307	Y1301-I1305 HydrophobicContact CD1-CD1 4.12Å; Y1301-I1305 HydrophobicContact CE1-CD1 3.99Å; Y1301-I1305 WeakPolarHBondContact O-CD1 3.47Å; Q1303-I1305 PolarHBondContact O-N 3.05Å; I1305-S1307 PolarHBondContact O-N 2.84Å
1306	R	26.8	Very low	29.3	Very low	201 Å²	201	133.1 Å²	133.1	76%	0.758	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-70.6	119.5	179.8	-70.4	-174.6	169.6	-159.9	-5.2	112	Q1303 S1304	Q1303-R1306 WeakPolarHBondContact O-CB 3.48Å; Q1303-R1306 PolarHBondContact O-N 3.35Å; S1304-R1306 VanDerWaalsContact C-N 3.34Å
1307	S	27.8	Very low	29.2	Very low	73 Å²	73	136.7 Å²	136.7	51%	0.51	68%	0.675	S	S	.	*	P	Polyproline II helix	trans	-58.8	150.3	171.1	-47	0	0	0	0	112.1	I1305	I1305-S1307 PolarHBondContact O-N 2.84Å
1308	P	25.5	Very low	29.4	Very low	116 Å²	116	135.9 Å²	135.9	75%	0.753	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-58.6	142.2	173.9	-22.8	33.5	0	0	0	112.4	I1310	P1308-I1310 PolarHBondContact O-N 3.44Å
1309	Q	26.6	Very low	29.3	Very low	162 Å²	162	141.5 Å²	141.5	76%	0.757	69%	0.691	S	S	*	*			trans	-75.4	95.2	173.9	-72.5	-168.1	-11.8	0	0	111	F1311	Q1309-F1311 HydrophobicContact CB-CD2 4.15Å; Q1309-F1311 HydrophobicContact CB-CE2 3.94Å; Q1309-F1311 PolarHBondContact O-N 3.04Å
1310	I	25.6	Very low	29.2	Very low	156 Å²	156	139.2 Å²	139.2	80%	0.8	69%	0.689	S	S	*	*			trans	-74.3	91.9	171.7	-56.3	177.4	0	0	0	108.8	P1308 P1312	P1308-I1310 PolarHBondContact O-N 3.44Å; I1310-P1312 WeakPolarHBondContact O-CD 3.49Å
1311	F	24.5	Very low	29.1	Very low	161 Å²	161	138 Å²	138	71%	0.706	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-73.4	123.6	171.5	-82.8	-89.2	0	0	0	111	Q1309 R1313	Q1309-F1311 HydrophobicContact CB-CD2 4.15Å; Q1309-F1311 HydrophobicContact CB-CE2 3.94Å; Q1309-F1311 PolarHBondContact O-N 3.04Å; F1311-R1313 PolarHBondContact O-N 3.48Å
1312	P	28.6	Very low	28.9	Very low	124 Å²	124	140 Å²	140	81%	0.805	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-70.1	129.3	169.3	29.3	-32.9	0	0	0	110	I1310	I1310-P1312 WeakPolarHBondContact O-CD 3.49Å
1313	R	25.7	Very low	28.6	Very low	231 Å²	231	144 Å²	144	87%	0.872	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-84.9	150.4	179.6	-98.7	-173.4	175	179.3	-0.4	112.7	F1311	F1311-R1313 PolarHBondContact O-N 3.48Å
1314	N	26.7	Very low	28.5	Very low	147 Å²	147	144.9 Å²	144.9	79%	0.786	71%	0.712	S	S	*	*			trans	78.9	98.8	161	-52.7	-25.3	0	0	0	118.7
1315	V	28.8	Very low	28.4	Very low	148 Å²	148	146.9 Å²	146.9	90%	0.897	71%	0.714	S	S	*	*				-135	148.2	123.2	-173.9	0	0	0	0	109.8
1316	R	27.4	Very low	28	Very low	222 Å²	222	151.6 Å²	151.6	84%	0.838	74%	0.739	S	S	*	*			trans	-55.9	168.7	171.9	-71.9	172.5	175	163.6	-3.2	112.8
1317	N	30.6	Very low	28.4	Very low	137 Å²	137	147 Å²	147	73%	0.733	74%	0.735	S	S	*	*			cis	-170.1	-171.9	5	-119.6	7.2	0	0	0	107.1
1318	P	35.1	Very low	28.3	Very low	95 Å²	95	152.5 Å²	152.5	62%	0.617	75%	0.75	S	S	*	*				-110.3	-176.8	-55.4	34.2	-16.6	0	0	0	109.5
1319	W	29.9	Very low	28.4	Very low	227 Å²	227	154.3 Å²	154.3	86%	0.86	75%	0.751	S	S	*	*				-165.5	160.1	89.8	-104.6	73.3	0	0	0	111
1320	T	28.4	Very low	28.4	Very low	100 Å²	100	151 Å²	151	61%	0.613	75%	0.746	S	S	*	*			trans	-54.6	162.3	175.5	65.7	0	0	0	0	113.8
1321	N	29.3	Very low	28.4	Very low	107 Å²	107	150.8 Å²	150.8	57%	0.572	74%	0.742	S	S	*	*			cis	-170.1	140.5	34.4	-131.5	-29.4	0	0	0	111.6
1322	K	28	Very low	28.5	Very low	151 Å²	151	150.3 Å²	150.3	66%	0.657	74%	0.739	S	S	*	*			trans	60.8	145.8	146.9	-68.6	159.8	-172.4	157.6	0	118.2
1323	R	28.3	Very low	28.4	Very low	200 Å²	200	149.8 Å²	149.8	76%	0.755	74%	0.738	S	S	*	*			cis	-166.2	142.4	10.3	-125.3	164.3	-177	167.4	-3.9	109.5
1324	N	28.3	Very low	28.3	Very low	131 Å²	131	145.2 Å²	145.2	70%	0.701	73%	0.73	S	S	*	*			trans	62.2	153.9	139.6	-66.4	17.3	0	0	0	119.5
1325	I	31	Very low	28.2	Very low	133 Å²	133	145.3 Å²	145.3	68%	0.682	73%	0.731	S	S	*	*			cis	-150.3	136.4	0.1	-126.6	160.9	0	0	0	111.7
1326	L	26	Very low	28.1	Very low	162 Å²	162	146 Å²	146	85%	0.848	73%	0.726	S	S	*	*			trans	41.4	159.4	149.5	-63	167.9	0	0	0	124.3
1327	P	34.7	Very low	27.8	Very low	104 Å²	104	139.6 Å²	139.6	68%	0.675	72%	0.716	S	S	*	*			trans	-135.1	-156.1	-164.1	41.8	-19.8	0	0	0	114.6
1328	K	25.1	Very low	27.5	Very low	189 Å²	189	139.5 Å²	139.5	82%	0.822	72%	0.715	S	S	*	*			trans	78.6	138.6	179.8	-51.8	-177.8	179.5	-175.3	0	112.6
1329	I	28.9	Very low	26.9	Very low	153 Å²	153	139.3 Å²	139.3	79%	0.785	72%	0.716	S	S	*	*				-157.2	117.1	75.4	-86.1	154.3	0	0	0	105.7
1330	S	25.2	Very low	26.6	Very low	93 Å²	93	136.5 Å²	136.5	65%	0.65	71%	0.71	S	S	*	*				60.8	132.8	77.3	69.8	0	0	0	0	116.1
1331	E	26.5	Very low	26.4	Very low	152 Å²	152	137.6 Å²	137.6	71%	0.71	71%	0.711	S	S	*	*			trans	106.2	141.1	165.3	-58.9	-161.8	146.4	0	0	115.2
1332	K	25.7	Very low	26.2	Very low	150 Å²	150	140.5 Å²	140.5	65%	0.652	72%	0.719	S	S	*	*			cis	-167.4	-174.1	-11.3	-116.5	169.2	-178	160	0	108.4
1333	C	26.5	Very low	26	Very low	113 Å²	113	136.9 Å²	136.9	76%	0.764	71%	0.713	S	S	*	*			trans	71.9	97.7	172.8	-52.4	0	0	0	0	112.3
1334	D	24.9	Very low	25.8	Very low	135 Å²	135	134.9 Å²	134.9	72%	0.722	71%	0.712	S	S	*	*			cis	74.6	127.3	36.4	-42.4	-62.2	0	0	0	114.5
1335	D	24.4	Very low	25.7	Very low	150 Å²	150	134.6 Å²	134.6	80%	0.802	72%	0.715	S	S	*	*			trans	71.7	151	147.6	-76	-19.8	0	0	0	124.1
1336	M	25.3	Very low	25.7	Very low	161 Å²	161	133.3 Å²	133.3	79%	0.793	72%	0.715	S	S	*	*			trans	64.1	123.6	170.7	-57	-164.6	177.7	0	0	116.5
1337	S	22.6	Very low	25.8	Very low	89 Å²	89	134.6 Å²	134.6	62%	0.622	72%	0.717	S	S	*	*			cis	69.4	149.6	42.7	94.7	0	0	0	0	113.9
1338	N	23.8	Very low	25.4	Very low	135 Å²	135	137 Å²	137	72%	0.722	72%	0.719	S	S	*	*			trans	64.3	93.6	177	-60.4	-28.6	0	0	0	115
1339	S	23.4	Very low	25.6	Very low	90 Å²	90	134.4 Å²	134.4	63%	0.629	71%	0.714	S	S	*	*				90.6	-172.3	75.6	69.9	0	0	0	0	112.5
1340	F	23.2	Very low	25.4	Very low	168 Å²	168	133.9 Å²	133.9	74%	0.737	71%	0.709	S	S	*	*			trans	74.5	121.6	-173.4	-63.6	-89.4	0	0	0	114.2
1341	I	24	Very low	25.7	Very low	124 Å²	124	138.4 Å²	138.4	64%	0.636	71%	0.713	S	S	*	*				82.6	127.7	61.2	-77.7	165.3	0	0	0	109.8
1342	F	24.5	Very low	25.8	Very low	167 Å²	167	138.8 Å²	138.8	73%	0.732	72%	0.715	S	S	*	*			cis	-142.9	158.9	16.7	-116.8	173.4	0	0	0	111.8
1343	S	23.8	Very low	25.9	Very low	75 Å²	75	137.8 Å²	137.8	52%	0.524	71%	0.714	S	S	.	*				44.8	123.6	92.5	103.3	0	0	0	0	114.1
1344	Q	24.9	Very low	26	Very low	159 Å²	159	138.2 Å²	138.2	74%	0.743	71%	0.708	S	S	*	*				175.5	158.8	80.5	-106.3	152.6	46.5	0	0	107.9
1345	T	25.9	Very low	26.2	Very low	125 Å²	125	135.4 Å²	135.4	77%	0.767	70%	0.699	S	S	*	*			cis	-160.4	169.6	-18.6	7.9	0	0	0	0	107.7
1346	P	29.9	Very low	26.4	Very low	105 Å²	105	137 Å²	137	68%	0.682	70%	0.7	S	S	*	*			trans	-96.2	156.4	-172.4	37.6	-34.6	0	0	0	115.2
1347	E	29.5	Very low	26.5	Very low	190 Å²	190	134 Å²	134	89%	0.888	69%	0.693	S	S	*	*			trans	-134.2	124.6	156.2	-61.2	-179.8	146.9	0	0	104.9
1348	Q	26	Very low	27	Very low	155 Å²	155	135.8 Å²	135.8	72%	0.724	70%	0.7	S	S	*	*			cis	74	120.2	42.6	-62.4	-146.6	-98.7	0	0	113.9
1349	D	28.1	Very low	27.2	Very low	134 Å²	134	135.1 Å²	135.1	72%	0.717	70%	0.696	S	S	*	*			cis	-125.7	-117.3	-11.8	-71.3	-56.2	0	0	0	112.7
1350	E	26.7	Very low	27.7	Very low	142 Å²	142	138 Å²	138	66%	0.664	70%	0.704	S	S	*	*			cis	-152.8	162.7	2.7	-150.9	-174.3	172.7	0	0	110.4
1351	Y	31.2	Very low	28.2	Very low	187 Å²	187	136.9 Å²	136.9	73%	0.733	71%	0.707	S	S	*	*			trans	63.9	99.8	175.4	-65.3	-67.9	0	0	0	120.8
1352	Q	27.6	Very low	28.7	Very low	161 Å²	161	137.3 Å²	137.3	75%	0.752	71%	0.71	S	S	*	*			trans	-90.2	-159.2	158.3	-63.5	-177.3	-33.3	0	0	112
1353	M	27.6	Very low	28.8	Very low	129 Å²	129	134.4 Å²	134.4	64%	0.635	71%	0.711	S	S	*	*			trans	75.9	122.2	177.8	-50.2	-63.6	144.7	0	0	113	Q777	Q777-M1353 PolarHBondContact NE2-O 3.13Å
1354	D	29.9	Very low	29.4	Very low	122 Å²	122	136.1 Å²	136.1	65%	0.652	72%	0.72	S	S	*	*			cis	-155.7	176.9	24.2	-90.4	-66.1	0	0	0	111.4
1355	S	28.3	Very low	29.5	Very low	75 Å²	75	133.6 Å²	133.6	52%	0.524	72%	0.72	S	S	.	*			cis	-179	174.8	-47.1	57.4	0	0	0	0	108.9
1356	F	28.1	Very low	29.7	Very low	185 Å²	185	135.6 Å²	135.6	81%	0.811	73%	0.725	S	S	*	*			trans	64.4	130.9	-177	-63.8	-93.6	0	0	0	115.9
1357	C	28.6	Very low	29.8	Very low	98 Å²	98	138.9 Å²	138.9	66%	0.662	73%	0.731	S	S	*	*			cis	71.3	137.7	44.3	-52.4	0	0	0	0	111.8
1358	V	32.4	Very low	29.9	Very low	126 Å²	126	139.2 Å²	139.2	76%	0.764	73%	0.729	S	S	*	*			cis	-146.5	164.2	20.2	175.2	0	0	0	0	109.7
1359	D	28.7	Very low	30	Very low	121 Å²	121	139.7 Å²	139.7	65%	0.647	73%	0.732	S	S	*	*			cis	-168.4	-141.4	-50	-74.7	-35.7	0	0	0	107.1
1360	D	34.1	Very low	30.1	Very low	149 Å²	149	138.9 Å²	138.9	80%	0.797	73%	0.732	S	S	*	*			trans	62.1	146.4	171.7	-60.4	-6.5	0	0	0	120.7
1361	D	32.8	Very low	30.3	Very low	146 Å²	146	139.9 Å²	139.9	78%	0.781	74%	0.736	S	S	*	*			cis	-159.8	159.9	-38.1	-140.1	3.2	0	0	0	113.8
1362	D	33.4	Very low	30.3	Very low	133 Å²	133	139.3 Å²	139.3	71%	0.711	74%	0.737	S	S	*	*			trans	3.4	126.9	167.6	-101.1	-12.7	0	0	0	127.7
1363	S	27.6	Very low	30.2	Very low	106 Å²	106	139 Å²	139	74%	0.741	74%	0.74	S	S	*	*				80.1	165.9	118.7	90.9	0	0	0	0	122.7
1364	P	37.2	Very low	30.3	Very low	111 Å²	111	141.2 Å²	141.2	72%	0.721	75%	0.753	S	S	*	*			trans	-125.8	169.3	-152.8	44.3	-33.2	0	0	0	119.7
1365	S	26.7	Very low	30.4	Very low	106 Å²	106	139.5 Å²	139.5	74%	0.741	76%	0.755	S	S	*	*			trans	76.4	125.2	153	77.8	0	0	0	0	120.8
1366	L	30.5	Very low	30.6	Very low	167 Å²	167	141.3 Å²	141.3	87%	0.874	77%	0.768	S	S	*	*				-175.3	166.9	107.3	-139.4	71.8	0	0	0	112.2
1367	H	30.1	Very low	30.7	Very low	173 Å²	173	142 Å²	142	80%	0.801	77%	0.771	S	S	*	*			trans	-78.2	144.9	173.3	-66.2	-106.4	0	0	0	113.1
1368	K	32	Very low	31.2	Very low	197 Å²	197	142.4 Å²	142.4	86%	0.857	77%	0.772	S	S	*	*				-179.4	175.4	105.5	-100.7	175.4	179	175.9	0	114.3
1369	E	28.5	Very low	31.1	Very low	166 Å²	166	143.4 Å²	143.4	78%	0.776	77%	0.773	S	S	*	*			trans	-95.8	175.6	-162.7	-57.3	151.6	99.6	0	0	115.1
1370	T	30.2	Very low	31.3	Very low	117 Å²	117	150 Å²	150	72%	0.718	79%	0.788	S	S	*	*			trans	112.7	107.8	147.3	70	0	0	0	0	120.8
1371	H	30.7	Very low	31.2	Very low	163 Å²	163	153.9 Å²	153.9	76%	0.755	79%	0.792	S	S	*	*				64.7	126.4	128.1	-72.1	-51.4	0	0	0	125.5
1372	K	30.7	Very low	31.1	Very low	174 Å²	174	158.1 Å²	158.1	76%	0.757	80%	0.797	S	S	*	*			trans	92	112	132.5	-75.9	172.4	-178.9	176.7	0	121.9
1373	L	26.9	Very low	31.2	Very low	156 Å²	156	157.5 Å²	157.5	82%	0.817	80%	0.798	S	S	*	*				63.9	118.8	128	-68	163.8	0	0	0	121.5
1374	I	30.1	Very low	31.5	Very low	175 Å²	175	163 Å²	163	90%	0.897	80%	0.802	S	S	*	*			trans	-136.6	154.9	157.4	-61.2	-177.4	0	0	0	108.6
1375	A	31	Very low	31.5	Very low	85 Å²	85	164 Å²	164	70%	0.702	81%	0.806	S	S	*	*			trans	-132.9	168.7	-172.7	0	0	0	0	0	115.5
1376	S	33.5	Very low	31.8	Very low	113 Å²	113	162.3 Å²	162.3	79%	0.79	81%	0.806	S	S	*	*			trans	64.4	100.2	159	47.2	0	0	0	0	122.3
1377	K	29.3	Very low	32	Very low	201 Å²	201	160.4 Å²	160.4	87%	0.874	80%	0.802	S	S	*	*				3.6	162.9	111.8	-75.2	179.8	175.5	173.2	0	118.7
1378	P	38.8	Very low	32.1	Very low	105 Å²	105	161 Å²	161	68%	0.682	81%	0.805	S	S	*	*			cis	-154.9	175.2	31.4	44.5	-23.2	0	0	0	121.6
1379	N	31.4	Very low	32.2	Very low	147 Å²	147	158.8 Å²	158.8	79%	0.786	80%	0.801	S	S	*	*			trans	63	125.7	139.6	-73	-21.4	0	0	0	125.7
1380	R	32.5	Very low	32.5	Very low	260 Å²	260	158.3 Å²	158.3	98%	0.981	80%	0.799	S	S	*	*				-156.5	169.8	114.2	-110.8	175.3	-177.6	-170.6	0.9	112.4
1381	R	30.7	Very low	32.6	Very low	230 Å²	230	160.4 Å²	160.4	87%	0.868	80%	0.8	S	S	*	*			trans	-129.3	151.4	-161.8	-68.1	170.4	163.1	169.7	-8.1	114.6
1382	R	32.2	Very low	32.8	Very low	235 Å²	235	157.3 Å²	157.3	89%	0.887	79%	0.794	S	S	*	*				-179.2	126	126.1	-98.4	170.8	176.4	-178.6	-1.1	109.6
1383	V	35.2	Very low	32.6	Very low	120 Å²	120	158.3 Å²	158.3	73%	0.727	80%	0.799	S	S	*	*				79.3	127.4	74.2	163.7	0	0	0	0	111.2
1384	R	34.1	Very low	32.7	Very low	221 Å²	221	164.4 Å²	164.4	83%	0.834	82%	0.82	S	S	*	*			cis	-156.1	157.4	27.3	-141	163.8	-171	168.4	-0.1	113.7
1385	T	35.9	Very low	32.9	Very low	132 Å²	132	163.9 Å²	163.9	81%	0.81	82%	0.816	S	S	*	*			trans	5.2	153.4	151.8	57.7	0	0	0	0	121.6
1386	G	33.8	Very low	32.9	Very low	72 Å²	72	168.1 Å²	168.1	74%	0.742	82%	0.822	S	S	*	*			cis	170.8	179.6	9.1	0	0	0	0	0	108
1387	T	34.5	Very low	32.9	Very low	126 Å²	126	171.1 Å²	171.1	77%	0.773	82%	0.824	S	S	*	*			cis	-148.3	127.7	8.1	37.5	0	0	0	0	108.6
1388	Q	31.6	Very low	33.1	Very low	185 Å²	185	169.4 Å²	169.4	86%	0.864	82%	0.821	S	S	*	*				55.1	108.8	102.5	-82.8	-172.5	-29.1	0	0	118.1
1389	I	35.3	Very low	32.8	Very low	152 Å²	152	173.4 Å²	173.4	78%	0.779	83%	0.829	S	S	*	*				-163	108.8	121.6	-95.2	154.9	0	0	0	103.5
1390	Q	34.1	Very low	32.9	Very low	156 Å²	156	175.1 Å²	175.1	73%	0.729	83%	0.832	S	S	*	*				56.2	137.3	95.9	-79.6	-174.1	-44.9	0	0	114
1391	Q	32.7	Very low	32.9	Very low	161 Å²	161	169.1 Å²	169.1	75%	0.752	82%	0.822	S	S	*	*			cis	-171.2	-176.4	-16.6	-137.2	177	-18.6	0	0	106.5
1392	P	34	Very low	33.1	Very low	97 Å²	97	164.4 Å²	164.4	63%	0.63	82%	0.818	S	S	*	*				-118.5	171	-99.2	40.5	-26.4	0	0	0	115.8
1393	F	27.9	Very low	33.2	Very low	196 Å²	196	158.5 Å²	158.5	86%	0.86	81%	0.812	S	S	*	*			trans	52.8	102.6	150.2	-83.1	-126.2	0	0	0	118.2
1394	F	28.9	Very low	33	Very low	284 Å²	284	162 Å²	162	100%	1.246	82%	0.82	S	S	*	*				-136.2	0	92.9	-116.3	-84.4	0	0	0	109.7

Retrieved 1,394 of 1,394 residues in 522.8 ms (Link to these results)

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