A0A087XVA7_POEFO Loading...

non-specific serine/threonine protein kinase

AlphaFold DB , UniProt , Accession A0A087XVA7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,211 aa.

						>A0A087XVA7_POEFO|A0A087XVA7
MTSTPEKKRIEEDEDEDASQSDAWDKTAAELSIGWDSAEESGVTLSDSTREELPWQRQKQEARDEEETEAVGSSPDGRFLKFNIEIGRGSFKTVYKGLDTEKTVEVAWCELQTHRLSKAERQRFSEEVEMLKVLQHPNIVRFYDSWKSAKCIILVTELMTSGTLKTYVRRFRPMKLKLLQRWSLQILKGLHFLHSRSPPILHRDLKCDNVFINGPTASVKIGDLGLSTLKKASFAKSVIGTPEFMAPEMYEEKYDEAVDIYAFGMCMLEMATSEYPYSECQNAAQIYRKVTNGIKPDNFSKVQNQELKEIIEGCIRTNSSERFTVQDLLGHRFFQEKTGYYVELAEEDDGTKAALKLWLRVEDKKKLLGKYKDNNAIEFLFELYKDVPEEVAQEMVILGFVCKADYKVIAKVIRNRVTAIKQQRDKKRRLLEEVTALESPYIPSVMHCTNTQAPPTAPSPAGMLLASSSPADSGISVLSNKTEEDGDEDQDKTTRHASHSSAASDCETGVFFNTPPAAPETLPPSLSSAPNPGTPPPLRRTPSKAPPFPMLRFPKSIAVSQSSEKHPTDSSCGFSSPVDSYSSDITSSLSDGNDGQSDWSKQEAAKREATKQFRRRARARLRIVGVSDKVDRVVECQLQTHNNKMVTFKFDLDGDNPEDIASVMLLRDFILPSEREGFILRMYEIIKRAELMMHQQHPAGANRLPNLTASALPESQLNEAIKGLSRTLSSSSLPDIDNNDPSPLKAVDFRIDTEATPLVRPLRSQSFQTPSVPSHRLPAGRGDGYLLICFISCAILRSMQCRVDLLTSSYQHPQFSLHYPHPDSNSTPQPHLPHAAQYQLQTHPYSTYTASFPTMPPISRLSRVQSNPSLFTPTSSPSAPNPHQWPSPDQPYFSLANVISVAMSVAQSLLPQSGAPNQGLYPHTPPLSPPFTNPQTPLSSSGSPSLSSTALTVKLTYPHPLTVQVSPPVSPSGRMSPSLTVKEPGFTVGRFQVSPSSGDPSVSHQGSSTQDNTTATTQSATPSNKNQPEHTGSSTETSQSESSNPTVTISPPGNYDGLSGQEQRTTGSRRLSVSLWEGSGSSQSRSRSATYSSDESEGEEIWEELMELRHRHLGQVQSLQVSQKREIEELYRQKGKAPPPSIIPPAAMLKHRHRRLSKPANYTLPRRNSLQRRDIPPPSGIMRKNSVSGSSSGSQDRVLKGVTFAPGHSCM
					

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Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.4	Very low	34.9	Very low	228 Å²	228	147.3 Å²	147.3	100%	1.123	75%	0.749	S	S	*	*				0	119.8	0	-69.6	152.7	170.3	0	0	106.2
2	T	33.5	Very low	34.6	Very low	133 Å²	133	148.8 Å²	148.8	82%	0.816	75%	0.751	S	S	*	*				60.5	122.2	59.7	66.4	0	0	0	0	111.6
3	S	30	Very low	34.4	Very low	114 Å²	114	148.5 Å²	148.5	80%	0.797	75%	0.753	S	S	*	*			cis	-162.3	177	3.9	56.5	0	0	0	0	112.9
4	T	35	Very low	34.4	Very low	120 Å²	120	149.9 Å²	149.9	74%	0.736	76%	0.755	S	S	*	*			trans	-75.5	-165.6	153.3	53.6	0	0	0	0	109.9
5	P	56.9	Low	34.2	Very low	118 Å²	118	149.4 Å²	149.4	77%	0.766	76%	0.755	S	S	*	*			cis	-118.6	-144.8	-13.5	30.4	-5.2	0	0	0	109.9
6	E	39.3	Very low	34.2	Very low	116 Å²	116	150.8 Å²	150.8	54%	0.542	76%	0.759	S	S	.	*			cis	-164.6	154.7	3.5	-157	-155.7	69.7	0	0	110.9	K8	E6-K8 VanDerWaalsContact OE1-CD 3.25Å; E6-K8 WeakPolarHBondContact OE1-CD 3.33Å; E6-K8 VanDerWaalsContact OE1-CE 3.27Å; E6-K8 WeakPolarHBondContact OE1-CE 3.42Å; E6-K8 IonicContact OE1-NZ 2.78Å; E6-K8 PolarHBondContact OE1-NZ 3.47Å; E6-K8 WeakPolarHBondContact OE2-CE 3.47Å; E6-K8 IonicContact OE2-NZ 2.69Å; E6-K8 PolarHBondContact OE2-NZ 3.3Å
7	K	31.2	Very low	33.8	Very low	192 Å²	192	151 Å²	151	84%	0.835	76%	0.762	S	S	*	*			trans	148.1	156.3	134.8	-83.7	172.3	179.3	179.7	0	113.6
8	K	36	Very low	33.5	Very low	143 Å²	143	147.1 Å²	147.1	62%	0.622	76%	0.757	S	S	*	*			cis	176.6	157	-44.3	-116.4	-174.9	-175.3	141.2	0	108.7	E6	E6-K8 VanDerWaalsContact OE1-CD 3.25Å; E6-K8 WeakPolarHBondContact OE1-CD 3.33Å; E6-K8 VanDerWaalsContact OE1-CE 3.27Å; E6-K8 WeakPolarHBondContact OE1-CE 3.42Å; E6-K8 IonicContact OE1-NZ 2.78Å; E6-K8 PolarHBondContact OE1-NZ 3.47Å; E6-K8 WeakPolarHBondContact OE2-CE 3.47Å; E6-K8 IonicContact OE2-NZ 2.69Å; E6-K8 PolarHBondContact OE2-NZ 3.3Å
9	R	27.4	Very low	33.3	Very low	209 Å²	209	144.8 Å²	144.8	79%	0.789	76%	0.755	S	S	*	*			trans	72.5	109.7	178.7	-77.7	-178.4	165.9	171.1	-4.8	115.1
10	I	32.5	Very low	33	Very low	123 Å²	123	146.6 Å²	146.6	63%	0.631	76%	0.76	S	S	*	*			cis	66.4	135.6	12	-31.1	159.6	0	0	0	108.3
11	E	32.8	Very low	32.8	Very low	124 Å²	124	144 Å²	144	58%	0.579	75%	0.754	S	S	*	*			cis	-99.2	-112.2	37.7	-78.3	61.7	-97.2	0	0	115.2
12	E	31.7	Very low	32.7	Very low	166 Å²	166	140.1 Å²	140.1	78%	0.776	74%	0.738	S	S	*	*			cis	-161.4	168	3.1	-91.7	125.1	-108.1	0	0	109.1
13	D	31.3	Very low	32.4	Very low	145 Å²	145	137.1 Å²	137.1	78%	0.775	73%	0.727	S	S	*	*			trans	-134.2	-179.6	-156.3	-31.7	-89	0	0	0	113.6
14	E	34.9	Very low	32.3	Very low	167 Å²	167	143 Å²	143	78%	0.78	73%	0.732	S	S	*	*			cis	-168.8	149.9	-0.4	-137.3	169.2	-151	0	0	111.4
15	D	31	Very low	32	Very low	143 Å²	143	142.7 Å²	142.7	77%	0.765	73%	0.725	S	S	*	*			trans	30.1	171.2	148.1	-62.6	-18.8	0	0	0	125.4
16	E	33.5	Very low	30.5	Very low	172 Å²	172	145.8 Å²	145.8	80%	0.804	73%	0.727	S	S	*	*			cis	-156.4	-163.4	-13.9	-125.1	-167.6	158.8	0	0	111.7
17	D	27.7	Very low	29.9	Very low	154 Å²	154	146 Å²	146	82%	0.824	74%	0.737	S	S	*	*			trans	71.7	147.8	163.3	-88.9	-18.7	0	0	0	120.7
18	A	29.2	Very low	29.7	Very low	81 Å²	81	141.3 Å²	141.3	67%	0.669	73%	0.733	S	S	*	*			cis	-152.6	131.1	-13.5	0	0	0	0	0	114.1
19	S	29.3	Very low	29.2	Very low	103 Å²	103	138.8 Å²	138.8	72%	0.72	74%	0.739	S	S	*	*			trans	-11.3	140.6	152	63	0	0	0	0	124.5
20	Q	27.5	Very low	29.1	Very low	180 Å²	180	136.6 Å²	136.6	84%	0.841	74%	0.738	S	S	*	*				-176.1	119.9	122.8	-97.5	159.7	27.2	0	0	108.6
21	S	28.6	Very low	28.7	Very low	93 Å²	93	137.2 Å²	137.2	65%	0.65	74%	0.742	S	S	*	*				79	141.2	74.3	105.8	0	0	0	0	113
22	D	27.7	Very low	28.3	Very low	147 Å²	147	135.9 Å²	135.9	79%	0.786	75%	0.746	S	S	*	*			cis	-149.2	169.5	12.5	-99.8	-57.4	0	0	0	113.9
23	A	27.3	Very low	28	Very low	70 Å²	70	136.1 Å²	136.1	58%	0.579	75%	0.751	S	S	*	*			trans	26.1	148.3	146.7	0	0	0	0	0	122.4
24	W	26.5	Very low	27.6	Very low	237 Å²	237	132.2 Å²	132.2	90%	0.898	75%	0.745	S	S	*	*			cis	-147.3	139.1	36.3	-118.2	-66	0	0	0	117
25	D	29.4	Very low	27.3	Very low	113 Å²	113	136.9 Å²	136.9	60%	0.604	76%	0.755	S	S	*	*			trans	-63.7	144.9	161.3	164.6	54.6	0	0	0	113.9
26	K	26.7	Very low	26.9	Very low	183 Å²	183	137.6 Å²	137.6	80%	0.796	76%	0.759	S	S	*	*				-174	164.4	122.7	-102.6	165	-171.7	172.8	0	116.9
27	T	26.2	Very low	26.6	Very low	122 Å²	122	134.2 Å²	134.2	75%	0.748	76%	0.755	S	S	*	*			trans	-129.8	150.6	-170.5	-25.9	0	0	0	0	112.9
28	A	26.8	Very low	26.6	Very low	92 Å²	92	131.2 Å²	131.2	76%	0.76	75%	0.751	S	S	*	*			trans	71.1	166.3	144.2	0	0	0	0	0	121.3
29	A	26.1	Very low	26.5	Very low	91 Å²	91	136.1 Å²	136.1	75%	0.752	76%	0.76	S	S	*	*			trans	72.9	144.7	168.2	0	0	0	0	0	116.9
30	E	24.4	Very low	26.6	Very low	162 Å²	162	140 Å²	140	76%	0.757	77%	0.767	S	S	*	*			cis	-160.4	171.2	-12.7	-121.6	-175.6	147.5	0	0	111.8
31	L	24.9	Very low	26.6	Very low	136 Å²	136	137.3 Å²	137.3	71%	0.712	77%	0.768	S	S	*	*			trans	32.6	124.8	147.3	-64.5	162.8	0	0	0	120.7
32	S	23.3	Very low	26.8	Very low	96 Å²	96	136.6 Å²	136.6	67%	0.671	78%	0.775	S	S	*	*				156.4	141.1	107.6	-76.3	0	0	0	0	116.4
33	I	25.8	Very low	26.9	Very low	172 Å²	172	136.3 Å²	136.3	88%	0.882	78%	0.778	S	S	*	*			trans	58.1	137.7	135.6	-61.2	166.3	0	0	0	120
34	G	22.3	Very low	27.5	Very low	62 Å²	62	139.2 Å²	139.2	64%	0.639	79%	0.789	S	S	*	*			trans	127.9	120.2	136.1	0	0	0	0	0	116.9
35	W	29.3	Very low	27.7	Very low	266 Å²	266	135.8 Å²	135.8	100%	1.008	79%	0.788	S	S	*	*			trans	-106.5	122.5	143.6	-76.7	20.4	0	0	0	106.5
36	D	23.2	Very low	27.9	Very low	158 Å²	158	135.1 Å²	135.1	85%	0.845	79%	0.792	S	S	*	*			trans	-153.6	-176.3	142.9	-145.1	-24	0	0	0	110
37	S	27.5	Very low	28.3	Very low	101 Å²	101	134.1 Å²	134.1	71%	0.706	80%	0.795	S	S	*	*			trans	-103.7	152.8	-138.7	-55.1	0	0	0	0	116.8
38	A	27.3	Very low	28.8	Very low	90 Å²	90	132.7 Å²	132.7	74%	0.744	79%	0.79	S	S	*	*			trans	90.3	157.9	137	0	0	0	0	0	121.4
39	E	27.1	Very low	29.8	Very low	185 Å²	185	134.6 Å²	134.6	86%	0.864	79%	0.792	S	S	*	*			trans	61.5	102.1	166.1	-52.2	-170.6	174.6	0	0	116.2
40	E	30.1	Very low	30.4	Very low	185 Å²	185	141.1 Å²	141.1	86%	0.864	80%	0.798	S	S	*	*				93.5	107.2	71.7	-175.9	175.1	-107.5	0	0	112.7
41	S	27.6	Very low	31.5	Very low	122 Å²	122	141.8 Å²	141.8	85%	0.853	80%	0.801	S	S	*	*			trans	-176.6	129.2	141.3	29.5	0	0	0	0	108.7
42	G	33.9	Very low	32.5	Very low	79 Å²	79	141.5 Å²	141.5	81%	0.814	80%	0.796	S	S	*	*			trans	-104.1	135.9	-179	0	0	0	0	0	112.1
43	V	30.1	Very low	34.1	Very low	140 Å²	140	141 Å²	141	85%	0.848	79%	0.785	S	S	*	*			trans	-130	121	161	-175.5	0	0	0	0	108.6
44	T	38.7	Very low	35.3	Very low	131 Å²	131	137.6 Å²	137.6	80%	0.804	78%	0.775	S	S	*	*			trans	-75.2	139.9	173.4	50.4	0	0	0	0	110.9
45	L	30.9	Very low	36.4	Very low	166 Å²	166	142.2 Å²	142.2	87%	0.869	77%	0.773	S	S	*	*			trans	-153.2	153.1	152.1	-109.7	157.3	0	0	0	111.2
46	S	33.6	Very low	37.3	Very low	99 Å²	99	133.3 Å²	133.3	69%	0.692	74%	0.742	S	S	*	*			trans	-67.8	146.6	-161.9	47.5	0	0	0	0	115.8
47	D	36.2	Very low	38.8	Very low	161 Å²	161	132.7 Å²	132.7	86%	0.861	73%	0.728	S	S	*	*			trans	-58.5	144.9	157.4	-178.5	24.7	0	0	0	111
48	S	36.3	Very low	40.1	Very low	93 Å²	93	134.4 Å²	134.4	65%	0.65	73%	0.725	S	S	*	*			trans	-154	105	175	171.5	0	0	0	0	109	R50	S48-R50 PolarHBondContact O-N 3.46Å
49	T	47.8	Very low	41.6	Very low	131 Å²	131	137.5 Å²	137.5	80%	0.804	72%	0.722	S	S	*	*			trans	-7.3	103.3	165.4	33.6	0	0	0	0	115.5
50	R	37.5	Very low	42.8	Very low	228 Å²	228	132.8 Å²	132.8	86%	0.86	70%	0.699	S	S	*	*			trans	-92.3	100.9	165.3	-175.8	177.2	-174.6	161.5	2.3	109	S48 E52	S48-R50 PolarHBondContact O-N 3.46Å; R50-E52 PolarHBondContact O-N 3.02Å
51	E	47.6	Very low	44.1	Very low	176 Å²	176	128.4 Å²	128.4	82%	0.822	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-64.2	124	169.4	-64.5	-168.8	142.4	0	0	109.8
52	E	47	Very low	45.6	Very low	130 Å²	130	125.2 Å²	125.2	61%	0.607	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-75.1	130.6	170.2	-68.3	-167.7	127.4	0	0	110	R50	R50-E52 PolarHBondContact O-N 3.02Å
53	L	57.3	Low	46.8	Very low	85 Å²	85	127.7 Å²	127.7	45%	0.445	65%	0.645	S	S	.	*	P	Polyproline II helix	trans	-69.7	138.2	-172.6	-64.2	165.3	0	0	0	110.5	W55 Q56 R57	L53-W55 HydrophobicContact CB-CG 4.48Å; L53-W55 HydrophobicContact CB-CZ2 4.36Å; L53-W55 HydrophobicContact CD1-CZ2 3.69Å; L53-W55 PolarHBondContact O-N 3.5Å; L53-Q56 HydrophobicContact CB-CG 4.47Å; L53-Q56 WeakPolarHBondContact O-CB 3.28Å; L53-Q56 PolarHBondContact O-N 2.71Å; L53-R57 PolarHBondContact O-N 3.37Å
54	P	50.9	Low	48.3	Very low	102 Å²	102	124.5 Å²	124.5	66%	0.662	62%	0.623	S	S	*	*	H	α-helix	trans	-54.1	-33.5	-173.7	-30.7	35.9	0	0	0	115.1	Q56 R57 Q58	P54-Q56 VanDerWaalsContact C-N 3.29Å; P54-Q56 PolarHBondContact O-N 2.89Å; P54-R57 PolarHBondContact O-N 3.19Å; P54-Q58 WeakPolarHBondContact O-CB 3.32Å; P54-Q58 PolarHBondContact O-N 3.08Å
55	W	44.3	Very low	49.3	Very low	158 Å²	158	124.8 Å²	124.8	60%	0.598	62%	0.615	S	S	*	*	H	α-helix	trans	-70.4	-20.6	177.1	61.9	-99.4	0	0	0	113.9	L53 K59	L53-W55 HydrophobicContact CB-CG 4.48Å; L53-W55 HydrophobicContact CB-CZ2 4.36Å; L53-W55 HydrophobicContact CD1-CZ2 3.69Å; L53-W55 PolarHBondContact O-N 3.5Å; W55-K59 WeakPolarHBondContact O-CB 3.48Å; W55-K59 PolarHBondContact O-N 3.45Å
56	Q	48.8	Very low	50.7	Low	80 Å²	80	123.7 Å²	123.7	37%	0.374	61%	0.606	S	S	.	*	H	α-helix	trans	-74.1	-44.7	170.3	-66.9	-178.5	-104.8	0	0	110.2	L53 P54 K59 Q60	L53-Q56 HydrophobicContact CB-CG 4.47Å; L53-Q56 WeakPolarHBondContact O-CB 3.28Å; L53-Q56 PolarHBondContact O-N 2.71Å; P54-Q56 VanDerWaalsContact C-N 3.29Å; P54-Q56 PolarHBondContact O-N 2.89Å; Q56-K59 PolarHBondContact O-N 3.36Å; Q56-Q60 PolarHBondContact O-N 2.86Å
57	R	54.3	Low	52.1	Low	145 Å²	145	122.5 Å²	122.5	55%	0.547	59%	0.589	S	S	.	*	H	α-helix	trans	-62.4	-49.5	175.7	-168.5	-175.9	-62.1	159.4	5.9	111.1	L53 P54 K59 Q60 E61	L53-R57 PolarHBondContact O-N 3.37Å; P54-R57 PolarHBondContact O-N 3.19Å; R57-K59 PolarHBondContact O-N 3.31Å; R57-Q60 CarbonylContact O-C 3.58Å; R57-Q60 WeakPolarHBondContact O-CA 3.23Å; R57-Q60 WeakPolarHBondContact O-CB 3.44Å; R57-Q60 PolarHBondContact O-N 2.79Å; R57-E61 VanDerWaalsContact CD-OE1 3.26Å; R57-E61 WeakPolarHBondContact CD-OE1 3.42Å; R57-E61 HydrophobicContact CG-CG 4.18Å; R57-E61 WeakPolarHBondContact CG-OE1 3.39Å; R57-E61 WeakPolarHBondContact O-CG 3.43Å; R57-E61 PolarHBondContact O-N 3.01Å
58	Q	55.4	Low	53.7	Low	136 Å²	136	119.3 Å²	119.3	64%	0.636	58%	0.575	S	S	*	*	H	α-helix	trans	-64.2	-27.4	-179.6	-160.5	166.4	42.7	0	0	113.2	P54 E61 A62	P54-Q58 WeakPolarHBondContact O-CB 3.32Å; P54-Q58 PolarHBondContact O-N 3.08Å; Q58-E61 WeakPolarHBondContact CA-OE2 3.37Å; Q58-A62 VanDerWaalsContact O-CB 3.28Å; Q58-A62 WeakPolarHBondContact O-CB 3.38Å; Q58-A62 PolarHBondContact O-N 2.76Å; Q58-A62 VanDerWaalsContact O-N 3.09Å
59	K	57.3	Low	55.9	Low	156 Å²	156	121.3 Å²	121.3	68%	0.678	58%	0.575	S	S	*	*	H	α-helix	trans	-79.5	-23.9	171.6	-175.8	171.4	-178.9	176.5	0	113.4	W55 Q56 R57 R63	W55-K59 WeakPolarHBondContact O-CB 3.48Å; W55-K59 PolarHBondContact O-N 3.45Å; Q56-K59 PolarHBondContact O-N 3.36Å; R57-K59 PolarHBondContact O-N 3.31Å; K59-R63 VanDerWaalsContact O-CB 3.31Å; K59-R63 WeakPolarHBondContact O-CB 3.39Å; K59-R63 PolarHBondContact O-N 2.78Å
60	Q	52.6	Low	57.9	Low	85 Å²	85	117.2 Å²	117.2	40%	0.397	55%	0.554	S	S	.	*	H	α-helix	trans	-79.7	-45.9	171.4	-172.3	58.6	47.5	0	0	110.2	Q56 R57 A62 R63 D64	Q56-Q60 PolarHBondContact O-N 2.86Å; R57-Q60 CarbonylContact O-C 3.58Å; R57-Q60 WeakPolarHBondContact O-CA 3.23Å; R57-Q60 WeakPolarHBondContact O-CB 3.44Å; R57-Q60 PolarHBondContact O-N 2.79Å; Q60-A62 PolarHBondContact O-N 3.41Å; Q60-R63 CarbonylContact O-C 3.55Å; Q60-R63 WeakPolarHBondContact O-CA 3.21Å; Q60-R63 WeakPolarHBondContact O-CB 3.42Å; Q60-R63 PolarHBondContact O-N 3Å; Q60-D64 VanDerWaalsContact NE2-CG 3.34Å; Q60-D64 PolarHBondContact NE2-OD1 3.29Å; Q60-D64 PolarHBondContact NE2-OD2 3.13Å; Q60-D64 PolarHBondContact O-N 3.3Å
61	E	57.4	Low	60.5	Low	94 Å²	94	110 Å²	110	44%	0.439	54%	0.535	S	S	.	.	H	α-helix	trans	-55	-53	173.9	-70.9	163.4	164.9	0	0	111.2	R57 Q58 R63 D64 E65	R57-E61 VanDerWaalsContact CD-OE1 3.26Å; R57-E61 WeakPolarHBondContact CD-OE1 3.42Å; R57-E61 HydrophobicContact CG-CG 4.18Å; R57-E61 WeakPolarHBondContact CG-OE1 3.39Å; R57-E61 WeakPolarHBondContact O-CG 3.43Å; R57-E61 PolarHBondContact O-N 3.01Å; Q58-E61 WeakPolarHBondContact CA-OE2 3.37Å; E61-R63 PolarHBondContact O-N 3.09Å; E61-D64 PolarHBondContact O-N 3.17Å; E61-D64 VanDerWaalsContact O-N 3.14Å; E61-E65 WeakPolarHBondContact O-CG 3.49Å; E61-E65 PolarHBondContact O-N 2.96Å
62	A	59.7	Low	62.6	Low	54 Å²	54	102.9 Å²	102.9	45%	0.446	51%	0.508	S	S	.	.	H	α-helix	trans	-63	-24.4	176.9	0	0	0	0	0	113.9	Q58 Q60 E66	Q58-A62 VanDerWaalsContact O-CB 3.28Å; Q58-A62 WeakPolarHBondContact O-CB 3.38Å; Q58-A62 PolarHBondContact O-N 2.76Å; Q58-A62 VanDerWaalsContact O-N 3.09Å; Q60-A62 PolarHBondContact O-N 3.41Å; A62-E66 PolarHBondContact O-N 3.11Å
63	R	59.1	Low	64.9	Low	131 Å²	131	99.4 Å²	99.4	49%	0.494	50%	0.498	S	S	.	.	H	α-helix	trans	-80.6	-39.4	174.5	175.3	-177.7	172.2	-167.8	-5.9	111.6	K59 Q60 E61 E65 E66 E67	K59-R63 VanDerWaalsContact O-CB 3.31Å; K59-R63 WeakPolarHBondContact O-CB 3.39Å; K59-R63 PolarHBondContact O-N 2.78Å; Q60-R63 CarbonylContact O-C 3.55Å; Q60-R63 WeakPolarHBondContact O-CA 3.21Å; Q60-R63 WeakPolarHBondContact O-CB 3.42Å; Q60-R63 PolarHBondContact O-N 3Å; E61-R63 PolarHBondContact O-N 3.09Å; R63-E65 VanDerWaalsContact C-N 3.26Å; R63-E66 PolarHBondContact O-N 3.42Å; R63-E67 IonicContact CZ-OE1 3.2Å; R63-E67 IonicContact NE-OE1 2.69Å; R63-E67 PolarHBondContact NE-OE1 3.3Å; R63-E67 IonicContact NH2-OE1 2.75Å; R63-E67 PolarHBondContact NH2-OE1 3.04Å; R63-E67 WeakPolarHBondContact O-CB 3.48Å; R63-E67 WeakPolarHBondContact O-CG 3.35Å; R63-E67 PolarHBondContact O-N 3.08Å
64	D	61.2	Low	66.7	Low	73 Å²	73	95.7 Å²	95.7	39%	0.39	48%	0.48	S	S	.	.	H	α-helix	trans	-69.3	-30	176.8	-63.5	-26.6	0	0	0	110.3	Q60 E61 T68	Q60-D64 VanDerWaalsContact NE2-CG 3.34Å; Q60-D64 PolarHBondContact NE2-OD1 3.29Å; Q60-D64 PolarHBondContact NE2-OD2 3.13Å; Q60-D64 PolarHBondContact O-N 3.3Å; E61-D64 PolarHBondContact O-N 3.17Å; E61-D64 VanDerWaalsContact O-N 3.14Å; D64-T68 WeakPolarHBondContact O-CB 3.47Å; D64-T68 VanDerWaalsContact O-CG2 3.31Å; D64-T68 WeakPolarHBondContact O-CG2 3.5Å; D64-T68 PolarHBondContact O-N 3.44Å; D64-T68 VanDerWaalsContact O-N 3.13Å; D64-T68 PolarHBondContact O-OG1 3.45Å
65	E	60.4	Low	68.7	Low	137 Å²	137	95.8 Å²	95.8	64%	0.64	48%	0.481	S	S	*	.	H	α-helix	trans	-64.9	-48.6	166	-72.2	175.9	168.2	0	0	112	E61 R63 E67 T68 E69	E61-E65 WeakPolarHBondContact O-CG 3.49Å; E61-E65 PolarHBondContact O-N 2.96Å; R63-E65 VanDerWaalsContact C-N 3.26Å; E65-E67 VanDerWaalsContact C-N 3.35Å; E65-E67 PolarHBondContact O-N 3.03Å; E65-T68 WeakPolarHBondContact CA-OG1 3.47Å; E65-T68 PolarHBondContact O-N 3.02Å; E65-T68 VanDerWaalsContact O-N 3.1Å; E65-T68 PolarHBondContact O-OG1 3.17Å; E65-E69 PolarHBondContact O-N 3.31Å; E65-E69 VanDerWaalsContact O-N 3.12Å
66	E	61.1	Low	71	Confident	144 Å²	144	93 Å²	93	67%	0.673	48%	0.477	S	S	*	.	H	α-helix	trans	-63.9	-36	175.7	-170.4	179.1	-170.2	0	0	112.6	A62 R63 T68	A62-E66 PolarHBondContact O-N 3.11Å; R63-E66 PolarHBondContact O-N 3.42Å; E66-T68 VanDerWaalsContact C-N 3.26Å; E66-T68 PolarHBondContact O-N 3.05Å
67	E	62.8	Low	73.1	Confident	74 Å²	74	90.9 Å²	90.9	35%	0.346	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-12.2	174.7	-75.3	-170.4	-149.5	0	0	113.2	R63 E65 I84	R63-E67 IonicContact CZ-OE1 3.2Å; R63-E67 IonicContact NE-OE1 2.69Å; R63-E67 PolarHBondContact NE-OE1 3.3Å; R63-E67 IonicContact NH2-OE1 2.75Å; R63-E67 PolarHBondContact NH2-OE1 3.04Å; R63-E67 WeakPolarHBondContact O-CB 3.48Å; R63-E67 WeakPolarHBondContact O-CG 3.35Å; R63-E67 PolarHBondContact O-N 3.08Å; E65-E67 VanDerWaalsContact C-N 3.35Å; E65-E67 PolarHBondContact O-N 3.03Å; E67-I84 HydrophobicContact CB-CD1 4.14Å; E67-I84 HydrophobicContact CG-CD1 4.45Å; E67-I84 WeakPolarHBondContact O-CD1 3.48Å
68	T	68.2	Low	75.1	Confident	93 Å²	93	86.2 Å²	86.2	57%	0.571	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.1	-3.7	176.4	51.8	0	0	0	0	115.2	D64 E65 E66 A70 F82	D64-T68 WeakPolarHBondContact O-CB 3.47Å; D64-T68 VanDerWaalsContact O-CG2 3.31Å; D64-T68 WeakPolarHBondContact O-CG2 3.5Å; D64-T68 PolarHBondContact O-N 3.44Å; D64-T68 VanDerWaalsContact O-N 3.13Å; D64-T68 PolarHBondContact O-OG1 3.45Å; E65-T68 WeakPolarHBondContact CA-OG1 3.47Å; E65-T68 PolarHBondContact O-N 3.02Å; E65-T68 VanDerWaalsContact O-N 3.1Å; E65-T68 PolarHBondContact O-OG1 3.17Å; E66-T68 VanDerWaalsContact C-N 3.26Å; E66-T68 PolarHBondContact O-N 3.05Å; T68-A70 PolarHBondContact O-N 3.03Å; T68-F82 WeakPolarHBondContact O-CE1 3.49Å
69	E	83.8	Confident	77.1	Confident	136 Å²	136	79.9 Å²	79.9	64%	0.636	43%	0.43	S	S	*	.			trans	-70.5	128.9	175	-167.5	177.4	-166.8	0	0	112.5	E65 V71	E65-E69 PolarHBondContact O-N 3.31Å; E65-E69 VanDerWaalsContact O-N 3.12Å; E69-V71 PolarHBondContact O-N 2.85Å; E69-V71 VanDerWaalsContact O-N 3.15Å
70	A	89.1	Confident	79	Confident	45 Å²	45	74.4 Å²	74.4	37%	0.372	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	88.2	-179.1	0	0	0	0	0	112.1	T68 G72 L80 K81	T68-A70 PolarHBondContact O-N 3.03Å; A70-G72 PolarHBondContact O-N 3.48Å; A70-L80 HydrophobicContact CB-CB 4.14Å; A70-L80 HydrophobicContact CB-CD1 4.11Å; A70-L80 HydrophobicContact CB-CD2 4.27Å; A70-L80 HydrophobicContact CB-CG 4.4Å; A70-K81 CarbonylContact C-O 3.52Å; A70-K81 WeakPolarHBondContact CA-O 3.34Å
71	V	93.2	Very high	81	Confident	77 Å²	77	71.5 Å²	71.5	47%	0.467	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	7.4	179.1	-58.4	0	0	0	0	115.4	E69 K81 N83	E69-V71 PolarHBondContact O-N 2.85Å; E69-V71 VanDerWaalsContact O-N 3.15Å; V71-K81 HydrophobicContact CG2-CD 4.17Å; V71-K81 HydrophobicContact CG2-CG 4.21Å; V71-K81 PolarHBondContact N-O 3.34Å; V71-N83 HydrophobicContact CG1-CB 4.03Å; V71-N83 HydrophobicContact CG2-CB 4.03Å
72	G	91.1	Very high	82.8	Confident	25 Å²	25	68.2 Å²	68.2	26%	0.258	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.5	161.7	175.1	0	0	0	0	0	113.1	A70 L80 K81	A70-G72 PolarHBondContact O-N 3.48Å; G72-L80 WeakPolarHBondContact O-CA 3.45Å; G72-K81 PolarHBondContact O-N 2.71Å
73	S	94.4	Very high	84.4	Confident	57 Å²	57	70.9 Å²	70.9	40%	0.399	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	158.7	178.2	-172.8	0	0	0	0	111.8	G77 F79	S73-G77 WeakPolarHBondContact OG-CA 3.42Å; S73-G77 PolarHBondContact OG-O 3.34Å; S73-F79 CarbonylContact C-O 3.58Å; S73-F79 WeakPolarHBondContact CA-O 3.35Å; S73-F79 PolarHBondContact OG-O 2.83Å
74	S	94.8	Very high	86	Confident	8 Å²	8	67 Å²	67	6%	0.056	37%	0.373	C	S	.	.			trans	-72.9	163.6	173	57.6	0	0	0	0	112.1	D76 G77 R78 F79	S74-D76 VanDerWaalsContact CB-OD1 3.23Å; S74-D76 WeakPolarHBondContact CB-OD1 3.28Å; S74-D76 PolarHBondContact O-N 3.1Å; S74-D76 VanDerWaalsContact O-N 3.12Å; S74-D76 PolarHBondContact OG-OD1 3.3Å; S74-G77 PolarHBondContact O-N 3.48Å; S74-R78 PolarHBondContact OG-N 3.08Å; S74-R78 VanDerWaalsContact OG-N 3.15Å; S74-F79 PolarHBondContact N-O 2.97Å; S74-F79 PolarHBondContact OG-N 3.07Å
75	P	93.6	Very high	87.5	Confident	104 Å²	104	67.2 Å²	67.2	68%	0.675	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-19.6	-174.8	-23	35	0	0	0	114.9	W146	P75-W146 HydrophobicContact CG-CB 4.02Å; P75-W146 HydrophobicContact CG-CD2 4.17Å; P75-W146 HydrophobicContact CG-CG 3.67Å
76	D	92.9	Very high	88.8	Confident	98 Å²	98	64.8 Å²	64.8	52%	0.524	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-0	176	63.7	-16.8	0	0	0	113.3	S74 R78	S74-D76 VanDerWaalsContact CB-OD1 3.23Å; S74-D76 WeakPolarHBondContact CB-OD1 3.28Å; S74-D76 PolarHBondContact O-N 3.1Å; S74-D76 VanDerWaalsContact O-N 3.12Å; S74-D76 PolarHBondContact OG-OD1 3.3Å; D76-R78 VanDerWaalsContact CG-CB 3.49Å; D76-R78 PolarHBondContact O-N 3.27Å; D76-R78 WeakPolarHBondContact OD1-CB 3.32Å; D76-R78 PolarHBondContact OD1-N 2.82Å; D76-R78 VanDerWaalsContact OD2-CB 3.22Å; D76-R78 WeakPolarHBondContact OD2-CB 3.4Å
77	G	93.4	Very high	89.9	Confident	37 Å²	37	59.4 Å²	59.4	38%	0.381	35%	0.346	S	S	.	.	S	Bend	trans	78.2	-11.2	-176	0	0	0	0	0	115.3	S73 S74 F79	S73-G77 WeakPolarHBondContact OG-CA 3.42Å; S73-G77 PolarHBondContact OG-O 3.34Å; S74-G77 PolarHBondContact O-N 3.48Å; G77-F79 PolarHBondContact O-N 2.95Å
78	R	95.9	Very high	90.9	Very high	46 Å²	46	63.8 Å²	63.8	17%	0.174	36%	0.36	C	S	.	.			trans	-61.5	-47.3	-169.5	177.4	-175.5	174.7	113.7	33.5	114.1	S74 D76 D99 T100 E101	S74-R78 PolarHBondContact OG-N 3.08Å; S74-R78 VanDerWaalsContact OG-N 3.15Å; D76-R78 VanDerWaalsContact CG-CB 3.49Å; D76-R78 PolarHBondContact O-N 3.27Å; D76-R78 WeakPolarHBondContact OD1-CB 3.32Å; D76-R78 PolarHBondContact OD1-N 2.82Å; D76-R78 VanDerWaalsContact OD2-CB 3.22Å; D76-R78 WeakPolarHBondContact OD2-CB 3.4Å; R78-D99 IonicContact CZ-OD1 2.77Å; R78-D99 VanDerWaalsContact CZ-OD1 3.28Å; R78-D99 IonicContact CZ-OD2 2.67Å; R78-D99 IonicContact NE-OD1 3.46Å; R78-D99 PolarHBondContact NE-OD1 3.19Å; R78-D99 IonicContact NE-OD2 3.74Å; R78-D99 IonicContact NH2-OD1 2.65Å; R78-D99 PolarHBondContact NH2-OD1 3.12Å; R78-D99 IonicContact NH2-OD2 3.42Å; R78-D99 PolarHBondContact NH2-OD2 3.05Å; R78-D99 VanDerWaalsContact NH2-OD2 3.07Å; R78-T100 WeakPolarHBondContact O-CB 3.31Å; R78-T100 WeakPolarHBondContact O-CG2 3.41Å; R78-T100 PolarHBondContact O-N 2.9Å; R78-T100 PolarHBondContact O-OG1 3.09Å; R78-E101 HydrophobicContact CG-CG 4.36Å; R78-E101 IonicContact CZ-OE1 2.88Å; R78-E101 IonicContact CZ-OE2 2.76Å; R78-E101 IonicContact NE-OE1 2.68Å; R78-E101 IonicContact NH1-OE1 2.79Å; R78-E101 PolarHBondContact NH1-OE1 2.88Å; R78-E101 IonicContact NH1-OE2 2.64Å; R78-E101 PolarHBondContact NH1-OE2 2.99Å; R78-E101 IonicContact NH2-OE1 2.69Å; R78-E101 IonicContact NH2-OE2 3.27Å; R78-E101 PolarHBondContact NH2-OE2 3.07Å
79	F	97.1	Very high	91	Very high	3 Å²	3	61.2 Å²	61.2	1%	0.013	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	133.5	-176.4	-58	-72.8	0	0	0	110.1	S73 S74 G77 L98 D99 V106 W108 Y143 D144 W146 V155	S73-F79 CarbonylContact C-O 3.58Å; S73-F79 WeakPolarHBondContact CA-O 3.35Å; S73-F79 PolarHBondContact OG-O 2.83Å; S74-F79 PolarHBondContact N-O 2.97Å; S74-F79 PolarHBondContact OG-N 3.07Å; G77-F79 PolarHBondContact O-N 2.95Å; F79-L98 CarbonylContact C-O 3.51Å; F79-L98 VanDerWaalsContact CA-O 3.28Å; F79-L98 WeakPolarHBondContact CA-O 3.19Å; F79-D99 HydrophobicContact CD1-CB 3.92Å; F79-D99 HydrophobicContact CE1-CB 3.74Å; F79-V106 HydrophobicContact CD1-CG2 4.2Å; F79-W108 HydrophobicContact CB-CE3 4.45Å; F79-W108 HydrophobicContact CB-CZ3 4.19Å; F79-Y143 HydrophobicContact CZ-CG 4.47Å; F79-D144 HydrophobicContact CE2-CB 3.97Å; F79-W146 HydrophobicContact CB-CH2 4.38Å; F79-W146 HydrophobicContact CD2-CH2 4.32Å; F79-W146 HydrophobicContact CD2-CZ3 4.08Å; F79-V155 HydrophobicContact CB-CG2 4.4Å; F79-V155 HydrophobicContact CD1-CG1 3.73Å; F79-V155 HydrophobicContact CD2-CG1 4.5Å; F79-V155 HydrophobicContact CD2-CG2 4.13Å; F79-V155 HydrophobicContact CE1-CG1 3.81Å; F79-V155 HydrophobicContact CG-CG1 4.09Å; F79-V155 HydrophobicContact CG-CG2 4.13Å; F79-V155 HydrophobicContact CZ-CG1 4.24Å
80	L	96.3	Very high	90.1	Very high	42 Å²	42	59.5 Å²	59.5	22%	0.22	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	149.8	172.3	-58.2	178.9	0	0	0	110.6	A70 G72 G97 L98 T100	A70-L80 HydrophobicContact CB-CB 4.14Å; A70-L80 HydrophobicContact CB-CD1 4.11Å; A70-L80 HydrophobicContact CB-CD2 4.27Å; A70-L80 HydrophobicContact CB-CG 4.4Å; G72-L80 WeakPolarHBondContact O-CA 3.45Å; L80-G97 CarbonylContact O-C 3.6Å; L80-G97 WeakPolarHBondContact O-CA 3.31Å; L80-L98 HydrophobicContact CB-CB 4.44Å; L80-L98 PolarHBondContact N-O 2.84Å; L80-L98 PolarHBondContact O-N 3.38Å; L80-T100 HydrophobicContact CD1-CG2 3.76Å; L80-T100 HydrophobicContact CG-CG2 3.76Å
81	K	95.9	Very high	89	Confident	23 Å²	23	64 Å²	64	10%	0.1	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	130.7	172	-176.2	-169.1	-179.3	176.4	0	109.6	A70 V71 G72 W108 E110	A70-K81 CarbonylContact C-O 3.52Å; A70-K81 WeakPolarHBondContact CA-O 3.34Å; V71-K81 HydrophobicContact CG2-CD 4.17Å; V71-K81 HydrophobicContact CG2-CG 4.21Å; V71-K81 PolarHBondContact N-O 3.34Å; G72-K81 PolarHBondContact O-N 2.71Å; K81-W108 HydrophobicContact CB-CD2 3.74Å; K81-W108 HydrophobicContact CB-CE3 3.82Å; K81-W108 HydrophobicContact CB-CG 4.32Å; K81-W108 HydrophobicContact CB-CH2 3.85Å; K81-W108 HydrophobicContact CB-CZ2 3.81Å; K81-W108 HydrophobicContact CB-CZ3 3.88Å; K81-W108 HydrophobicContact CD-CD2 4.38Å; K81-W108 HydrophobicContact CD-CG 4.49Å; K81-W108 HydrophobicContact CD-CZ2 4.09Å; K81-W108 HydrophobicContact CG-CD2 4Å; K81-W108 HydrophobicContact CG-CG 4.09Å; K81-W108 HydrophobicContact CG-CZ2 4.34Å; K81-E110 WeakPolarHBondContact CE-OE1 3.46Å; K81-E110 IonicContact NZ-OE1 3.47Å; K81-E110 PolarHBondContact NZ-OE1 2.89Å; K81-E110 IonicContact NZ-OE2 2.63Å; K81-E110 PolarHBondContact NZ-OE2 3.04Å; K81-E110 VanDerWaalsContact NZ-OE2 3.09Å
82	F	94.8	Very high	88.3	Confident	25 Å²	25	62.9 Å²	62.9	11%	0.11	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	158.5	166.3	-51.9	-70.3	0	0	0	110.1	T68 I84 K96 L98	T68-F82 WeakPolarHBondContact O-CE1 3.49Å; F82-I84 HydrophobicContact CB-CD1 4.35Å; F82-I84 HydrophobicContact CB-CG1 4.38Å; F82-I84 PolarHBondContact O-N 2.86Å; F82-K96 HydrophobicContact CB-CB 4.45Å; F82-K96 HydrophobicContact CD2-CB 4.22Å; F82-K96 HydrophobicContact CD2-CD 4.26Å; F82-K96 HydrophobicContact CD2-CG 4.09Å; F82-K96 PolarHBondContact N-O 3.37Å; F82-L98 HydrophobicContact CE2-CB 3.88Å; F82-L98 HydrophobicContact CZ-CB 3.98Å
83	N	92.8	Very high	88.1	Confident	111 Å²	111	62.2 Å²	62.2	59%	0.594	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77	18.9	-179.3	-158.5	27	0	0	0	114.2	V71 E85	V71-N83 HydrophobicContact CG1-CB 4.03Å; V71-N83 HydrophobicContact CG2-CB 4.03Å; N83-E85 PolarHBondContact O-N 2.65Å
84	I	92.9	Very high	87.9	Confident	48 Å²	48	60.5 Å²	60.5	25%	0.246	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	103.4	-176.1	-59.6	169.2	0	0	0	108.7	E67 F82 I86 Y95 K96	E67-I84 HydrophobicContact CB-CD1 4.14Å; E67-I84 HydrophobicContact CG-CD1 4.45Å; E67-I84 WeakPolarHBondContact O-CD1 3.48Å; F82-I84 HydrophobicContact CB-CD1 4.35Å; F82-I84 HydrophobicContact CB-CG1 4.38Å; F82-I84 PolarHBondContact O-N 2.86Å; I84-I86 PolarHBondContact O-N 2.9Å; I84-Y95 CarbonylContact O-C 3.53Å; I84-Y95 VanDerWaalsContact O-CA 3.26Å; I84-Y95 WeakPolarHBondContact O-CA 3.29Å; I84-K96 HydrophobicContact CB-CB 3.91Å; I84-K96 HydrophobicContact CD1-CD 3.93Å; I84-K96 HydrophobicContact CG2-CB 4.25Å; I84-K96 PolarHBondContact O-N 3.03Å
85	E	93	Very high	87.8	Confident	79 Å²	79	61.4 Å²	61.4	37%	0.369	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	114.9	174.7	-173.5	167.6	135.3	0	0	110.7	N83 R88 T93 Y95	N83-E85 PolarHBondContact O-N 2.65Å; E85-R88 WeakPolarHBondContact OE1-CB 3.43Å; E85-R88 IonicContact OE1-CZ 3.12Å; E85-R88 IonicContact OE1-NE 2.86Å; E85-R88 PolarHBondContact OE1-NE 3.29Å; E85-R88 IonicContact OE1-NH2 2.63Å; E85-R88 PolarHBondContact OE1-NH2 2.87Å; E85-R88 IonicContact OE2-CZ 2.72Å; E85-R88 IonicContact OE2-NE 3.68Å; E85-R88 IonicContact OE2-NH2 3.86Å; E85-R88 PolarHBondContact OE2-NH2 2.83Å; E85-T93 HydrophobicContact CG-CG2 3.7Å; E85-T93 VanDerWaalsContact OE2-CG2 3.28Å; E85-T93 WeakPolarHBondContact OE2-CG2 3.27Å; E85-Y95 HydrophobicContact CB-CD1 4.16Å; E85-Y95 HydrophobicContact CB-CE1 3.94Å; E85-Y95 HydrophobicContact CG-CE1 4.37Å
86	I	88.2	Confident	87.9	Confident	85 Å²	85	58.9 Å²	58.9	44%	0.436	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	-28.8	-179.3	-58.2	-175.2	0	0	0	111	I84 V94 K96 L158	I84-I86 PolarHBondContact O-N 2.9Å; I86-V94 PolarHBondContact N-O 2.8Å; I86-K96 HydrophobicContact CD1-CB 3.81Å; I86-K96 HydrophobicContact CD1-CG 4.18Å; I86-K96 HydrophobicContact CG1-CB 4.26Å; I86-L158 HydrophobicContact CD1-CD1 3.54Å; I86-L158 HydrophobicContact CD1-CD2 4.16Å
87	G	82.9	Confident	88	Confident	32 Å²	32	54.2 Å²	54.2	33%	0.33	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.8	158.9	175.1	0	0	0	0	0	113.9	V94	G87-V94 PolarHBondContact N-O 2.79Å; G87-V94 PolarHBondContact O-N 2.89Å
88	R	83.9	Confident	88.2	Confident	166 Å²	166	54.6 Å²	54.6	63%	0.626	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.6	133.7	-176.7	-173.2	-178	-66.5	-142.9	-2.2	111.1	E85 T93	E85-R88 WeakPolarHBondContact OE1-CB 3.43Å; E85-R88 IonicContact OE1-CZ 3.12Å; E85-R88 IonicContact OE1-NE 2.86Å; E85-R88 PolarHBondContact OE1-NE 3.29Å; E85-R88 IonicContact OE1-NH2 2.63Å; E85-R88 PolarHBondContact OE1-NH2 2.87Å; E85-R88 IonicContact OE2-CZ 2.72Å; E85-R88 IonicContact OE2-NE 3.68Å; E85-R88 IonicContact OE2-NH2 3.86Å; E85-R88 PolarHBondContact OE2-NH2 2.83Å; R88-T93 HydrophobicContact CB-CG2 4.48Å; R88-T93 HydrophobicContact CG-CG2 4.49Å
89	G	70.6	Confident	88.2	Confident	39 Å²	39	52.4 Å²	52.4	40%	0.402	27%	0.274	S	S	.	.			trans	-112.8	-171.8	170.1	0	0	0	0	0	111.7	F91 K92	G89-F91 VanDerWaalsContact C-N 3.34Å; G89-F91 PolarHBondContact O-N 2.82Å; G89-K92 PolarHBondContact N-O 3.21Å
90	S	64.7	Low	88.1	Confident	99 Å²	99	55 Å²	55	69%	0.692	29%	0.29	S	S	*	.	S	Bend	trans	-65.9	-31.9	177.7	45.1	0	0	0	0	114.1
91	F	66.8	Low	88	Confident	140 Å²	140	59.2 Å²	59.2	61%	0.614	31%	0.308	S	S	*	.	S	Bend	trans	-123.2	-7.2	-173.6	-55.7	-65.7	0	0	0	114.5	G89 L111 Q112	G89-F91 VanDerWaalsContact C-N 3.34Å; G89-F91 PolarHBondContact O-N 2.82Å; F91-L111 WeakPolarHBondContact O-CA 3.34Å; F91-Q112 PolarHBondContact O-N 3.17Å; F91-Q112 VanDerWaalsContact O-N 3.14Å
92	K	79.1	Confident	87.9	Confident	53 Å²	53	62.7 Å²	62.7	23%	0.23	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	149.3	-177	76.7	-175.8	-177.8	-169.6	0	112.5	G89 V94 E110 L111 D223	G89-K92 PolarHBondContact N-O 3.21Å; K92-V94 HydrophobicContact CD-CG2 4.36Å; K92-V94 HydrophobicContact CG-CG2 4.48Å; K92-E110 CarbonylContact C-O 3.51Å; K92-E110 VanDerWaalsContact CA-O 3.27Å; K92-E110 WeakPolarHBondContact CA-O 3.32Å; K92-L111 HydrophobicContact CB-CD1 3.96Å; K92-L111 HydrophobicContact CB-CG 3.97Å; K92-D223 IonicContact NZ-OD1 3.09Å; K92-D223 PolarHBondContact NZ-OD1 2.95Å; K92-D223 IonicContact NZ-OD2 2.69Å; K92-D223 PolarHBondContact NZ-OD2 3.43Å
93	T	86.6	Confident	87.8	Confident	11 Å²	11	67.1 Å²	67.1	7%	0.067	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	138.6	162.5	-50.5	0	0	0	0	108.9	E85 R88 Y95 C109 E110	E85-T93 HydrophobicContact CG-CG2 3.7Å; E85-T93 VanDerWaalsContact OE2-CG2 3.28Å; E85-T93 WeakPolarHBondContact OE2-CG2 3.27Å; R88-T93 HydrophobicContact CB-CG2 4.48Å; R88-T93 HydrophobicContact CG-CG2 4.49Å; T93-Y95 HydrophobicContact CG2-CD2 4.25Å; T93-Y95 HydrophobicContact CG2-CE1 4.32Å; T93-Y95 HydrophobicContact CG2-CE2 3.53Å; T93-C109 CarbonylContact O-C 3.6Å; T93-C109 WeakPolarHBondContact O-CA 3.46Å; T93-E110 PolarHBondContact N-O 3.09Å; T93-E110 PolarHBondContact O-N 2.84Å
94	V	89.9	Confident	87.9	Confident	21 Å²	21	65.1 Å²	65.1	13%	0.127	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	123.1	-177.4	-173.5	0	0	0	0	109.1	I86 G87 K92 A107 W108 C109	I86-V94 PolarHBondContact N-O 2.8Å; G87-V94 PolarHBondContact N-O 2.79Å; G87-V94 PolarHBondContact O-N 2.89Å; K92-V94 HydrophobicContact CD-CG2 4.36Å; K92-V94 HydrophobicContact CG-CG2 4.48Å; V94-A107 HydrophobicContact CG1-CB 3.93Å; V94-W108 CarbonylContact C-O 3.59Å; V94-W108 WeakPolarHBondContact CA-O 3.3Å; V94-C109 HydrophobicContact CG2-CB 4.45Å
95	Y	93.4	Very high	87.9	Confident	28 Å²	28	66.8 Å²	66.8	11%	0.11	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	159.7	179.4	-64.7	-85.1	0	0	0	111.3	I84 E85 T93 W108 E110	I84-Y95 CarbonylContact O-C 3.53Å; I84-Y95 VanDerWaalsContact O-CA 3.26Å; I84-Y95 WeakPolarHBondContact O-CA 3.29Å; E85-Y95 HydrophobicContact CB-CD1 4.16Å; E85-Y95 HydrophobicContact CB-CE1 3.94Å; E85-Y95 HydrophobicContact CG-CE1 4.37Å; T93-Y95 HydrophobicContact CG2-CD2 4.25Å; T93-Y95 HydrophobicContact CG2-CE1 4.32Å; T93-Y95 HydrophobicContact CG2-CE2 3.53Å; Y95-W108 PolarHBondContact N-O 2.64Å; Y95-W108 PolarHBondContact O-N 3.14Å; Y95-E110 HydrophobicContact CD2-CG 4.11Å; Y95-E110 HydrophobicContact CE2-CG 4.17Å; Y95-E110 WeakPolarHBondContact CE2-OE2 3.17Å
96	K	94.9	Very high	88	Confident	51 Å²	51	63 Å²	63	22%	0.222	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	142.2	166.4	-160.1	-176.4	-177.1	-173	0	110	F82 I84 I86 E105	F82-K96 HydrophobicContact CB-CB 4.45Å; F82-K96 HydrophobicContact CD2-CB 4.22Å; F82-K96 HydrophobicContact CD2-CD 4.26Å; F82-K96 HydrophobicContact CD2-CG 4.09Å; F82-K96 PolarHBondContact N-O 3.37Å; I84-K96 HydrophobicContact CB-CB 3.91Å; I84-K96 HydrophobicContact CD1-CD 3.93Å; I84-K96 HydrophobicContact CG2-CB 4.25Å; I84-K96 PolarHBondContact O-N 3.03Å; I86-K96 HydrophobicContact CD1-CB 3.81Å; I86-K96 HydrophobicContact CD1-CG 4.18Å; I86-K96 HydrophobicContact CG1-CB 4.26Å; K96-E105 WeakPolarHBondContact CE-OE1 3.33Å; K96-E105 WeakPolarHBondContact CE-OE2 3.49Å; K96-E105 IonicContact NZ-OE1 2.64Å; K96-E105 PolarHBondContact NZ-OE1 3.49Å; K96-E105 IonicContact NZ-OE2 2.76Å
97	G	95.7	Very high	88.3	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	-179.2	171.4	0	0	0	0	0	112.8	L80 E105 V106	L80-G97 CarbonylContact O-C 3.6Å; L80-G97 WeakPolarHBondContact O-CA 3.31Å; G97-E105 WeakPolarHBondContact O-CA 3.46Å; G97-V106 VanDerWaalsContact C-CG2 3.5Å; G97-V106 PolarHBondContact N-O 2.67Å; G97-V106 PolarHBondContact O-N 3.45Å
98	L	96.1	Very high	88.8	Confident	45 Å²	45	58 Å²	58	24%	0.236	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	131.4	-179.1	-175.1	69.8	0	0	0	110.9	F79 L80 F82 T100	F79-L98 CarbonylContact C-O 3.51Å; F79-L98 VanDerWaalsContact CA-O 3.28Å; F79-L98 WeakPolarHBondContact CA-O 3.19Å; L80-L98 HydrophobicContact CB-CB 4.44Å; L80-L98 PolarHBondContact N-O 2.84Å; L80-L98 PolarHBondContact O-N 3.38Å; F82-L98 HydrophobicContact CE2-CB 3.88Å; F82-L98 HydrophobicContact CZ-CB 3.98Å; L98-T100 PolarHBondContact O-N 3.02Å
99	D	96.6	Very high	89.2	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	99.1	165.3	-177	8.5	0	0	0	108.9	R78 F79 E101 K102 T103 V104 V106	R78-D99 IonicContact CZ-OD1 2.77Å; R78-D99 VanDerWaalsContact CZ-OD1 3.28Å; R78-D99 IonicContact CZ-OD2 2.67Å; R78-D99 IonicContact NE-OD1 3.46Å; R78-D99 PolarHBondContact NE-OD1 3.19Å; R78-D99 IonicContact NE-OD2 3.74Å; R78-D99 IonicContact NH2-OD1 2.65Å; R78-D99 PolarHBondContact NH2-OD1 3.12Å; R78-D99 IonicContact NH2-OD2 3.42Å; R78-D99 PolarHBondContact NH2-OD2 3.05Å; R78-D99 VanDerWaalsContact NH2-OD2 3.07Å; F79-D99 HydrophobicContact CD1-CB 3.92Å; F79-D99 HydrophobicContact CE1-CB 3.74Å; D99-E101 VanDerWaalsContact C-N 3.29Å; D99-E101 PolarHBondContact O-N 3.11Å; D99-K102 CarbonylContact O-C 3.53Å; D99-K102 PolarHBondContact O-N 3.34Å; D99-K102 WeakPolarHBondContact OD2-CD 3.42Å; D99-K102 WeakPolarHBondContact OD2-CG 3.31Å; D99-K102 IonicContact OD2-NZ 3.38Å; D99-K102 PolarHBondContact OD2-NZ 2.91Å; D99-T103 WeakPolarHBondContact O-CA 3.3Å; D99-T103 PolarHBondContact O-N 3.3Å; D99-V104 PolarHBondContact N-O 3.44Å; D99-V106 HydrophobicContact CB-CG1 3.99Å
100	T	94.9	Very high	90	Very high	58 Å²	58	50.7 Å²	50.7	36%	0.356	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-31.8	-171.1	57.4	0	0	0	0	113.4	R78 L80 L98 K102	R78-T100 WeakPolarHBondContact O-CB 3.31Å; R78-T100 WeakPolarHBondContact O-CG2 3.41Å; R78-T100 PolarHBondContact O-N 2.9Å; R78-T100 PolarHBondContact O-OG1 3.09Å; L80-T100 HydrophobicContact CD1-CG2 3.76Å; L80-T100 HydrophobicContact CG-CG2 3.76Å; L98-T100 PolarHBondContact O-N 3.02Å; T100-K102 VanDerWaalsContact C-N 3.28Å; T100-K102 PolarHBondContact O-N 2.91Å
101	E	95.1	Very high	90.7	Very high	129 Å²	129	47.3 Å²	47.3	60%	0.603	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63	-32.6	174.4	-74.6	179.1	-152.3	0	0	113.2	R78 D99	R78-E101 HydrophobicContact CG-CG 4.36Å; R78-E101 IonicContact CZ-OE1 2.88Å; R78-E101 IonicContact CZ-OE2 2.76Å; R78-E101 IonicContact NE-OE1 2.68Å; R78-E101 IonicContact NH1-OE1 2.79Å; R78-E101 PolarHBondContact NH1-OE1 2.88Å; R78-E101 IonicContact NH1-OE2 2.64Å; R78-E101 PolarHBondContact NH1-OE2 2.99Å; R78-E101 IonicContact NH2-OE1 2.69Å; R78-E101 IonicContact NH2-OE2 3.27Å; R78-E101 PolarHBondContact NH2-OE2 3.07Å; D99-E101 VanDerWaalsContact C-N 3.29Å; D99-E101 PolarHBondContact O-N 3.11Å
102	K	93.4	Very high	91.2	Very high	97 Å²	97	45 Å²	45	42%	0.422	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	-11.6	-173.9	-57.8	-164.8	-163.6	81	0	113.5	D99 T100 V104	D99-K102 CarbonylContact O-C 3.53Å; D99-K102 PolarHBondContact O-N 3.34Å; D99-K102 WeakPolarHBondContact OD2-CD 3.42Å; D99-K102 WeakPolarHBondContact OD2-CG 3.31Å; D99-K102 IonicContact OD2-NZ 3.38Å; D99-K102 PolarHBondContact OD2-NZ 2.91Å; T100-K102 VanDerWaalsContact C-N 3.28Å; T100-K102 PolarHBondContact O-N 2.91Å; K102-V104 HydrophobicContact CB-CB 4.31Å; K102-V104 HydrophobicContact CB-CG2 4Å; K102-V104 PolarHBondContact O-N 3.17Å
103	T	92.8	Very high	90.7	Very high	118 Å²	118	43.1 Å²	43.1	72%	0.724	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.1	32.7	-169.6	61	0	0	0	0	113.6	D99	D99-T103 WeakPolarHBondContact O-CA 3.3Å; D99-T103 PolarHBondContact O-N 3.3Å
104	V	93.6	Very high	89.7	Confident	68 Å²	68	48.3 Å²	48.3	41%	0.412	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	135.7	-178.2	174.8	0	0	0	0	110.8	D99 K102	D99-V104 PolarHBondContact N-O 3.44Å; K102-V104 HydrophobicContact CB-CB 4.31Å; K102-V104 HydrophobicContact CB-CG2 4Å; K102-V104 PolarHBondContact O-N 3.17Å
105	E	94.2	Very high	88.3	Confident	83 Å²	83	56.1 Å²	56.1	39%	0.388	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	137.2	175.6	-54.9	-168.3	160.8	0	0	112	K96 G97 L158	K96-E105 WeakPolarHBondContact CE-OE1 3.33Å; K96-E105 WeakPolarHBondContact CE-OE2 3.49Å; K96-E105 IonicContact NZ-OE1 2.64Å; K96-E105 PolarHBondContact NZ-OE1 3.49Å; K96-E105 IonicContact NZ-OE2 2.76Å; G97-E105 WeakPolarHBondContact O-CA 3.46Å; E105-L158 HydrophobicContact CB-CD2 3.76Å
106	V	95.1	Very high	87	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	157.9	-178.7	-65.7	0	0	0	0	111.6	F79 G97 D99 Y143 V155 T156	F79-V106 HydrophobicContact CD1-CG2 4.2Å; G97-V106 VanDerWaalsContact C-CG2 3.5Å; G97-V106 PolarHBondContact N-O 2.67Å; G97-V106 PolarHBondContact O-N 3.45Å; D99-V106 HydrophobicContact CB-CG1 3.99Å; V106-Y143 HydrophobicContact CG1-CD2 4.01Å; V106-Y143 HydrophobicContact CG1-CE2 3.77Å; V106-V155 HydrophobicContact CB-CG1 3.72Å; V106-V155 HydrophobicContact CG1-CG1 4.16Å; V106-V155 HydrophobicContact CG2-CG1 3.66Å; V106-T156 WeakPolarHBondContact CB-O 3.43Å
107	A	94.3	Very high	85.8	Confident	7 Å²	7	57.8 Å²	57.8	6%	0.058	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	115.4	172.4	0	0	0	0	0	109.6	V94 V155 T156 L158	V94-A107 HydrophobicContact CG1-CB 3.93Å; A107-V155 WeakPolarHBondContact O-CA 3.48Å; A107-T156 PolarHBondContact N-O 2.99Å; A107-T156 PolarHBondContact O-N 2.74Å; A107-L158 HydrophobicContact CB-CD1 4.11Å
108	W	93.9	Very high	84.8	Confident	6 Å²	6	67.2 Å²	67.2	2%	0.023	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	105.5	178.6	178.3	-68.8	0	0	0	109.2	F79 K81 V94 Y95 E110 W146 I153 V155	F79-W108 HydrophobicContact CB-CE3 4.45Å; F79-W108 HydrophobicContact CB-CZ3 4.19Å; K81-W108 HydrophobicContact CB-CD2 3.74Å; K81-W108 HydrophobicContact CB-CE3 3.82Å; K81-W108 HydrophobicContact CB-CG 4.32Å; K81-W108 HydrophobicContact CB-CH2 3.85Å; K81-W108 HydrophobicContact CB-CZ2 3.81Å; K81-W108 HydrophobicContact CB-CZ3 3.88Å; K81-W108 HydrophobicContact CD-CD2 4.38Å; K81-W108 HydrophobicContact CD-CG 4.49Å; K81-W108 HydrophobicContact CD-CZ2 4.09Å; K81-W108 HydrophobicContact CG-CD2 4Å; K81-W108 HydrophobicContact CG-CG 4.09Å; K81-W108 HydrophobicContact CG-CZ2 4.34Å; V94-W108 CarbonylContact C-O 3.59Å; V94-W108 WeakPolarHBondContact CA-O 3.3Å; Y95-W108 PolarHBondContact N-O 2.64Å; Y95-W108 PolarHBondContact O-N 3.14Å; W108-E110 PolarHBondContact NE1-OE1 3.44Å; W108-W146 HydrophobicContact CE3-CH2 4.21Å; W108-W146 HydrophobicContact CE3-CZ2 4.33Å; W108-W146 HydrophobicContact CH2-CH2 4.16Å; W108-W146 AromaticContact CH2-CZ2 3.53Å; W108-W146 HydrophobicContact CH2-CZ2 3.53Å; W108-W146 AromaticContact CZ2-CZ2 3.91Å; W108-W146 HydrophobicContact CZ2-CZ2 3.91Å; W108-W146 AromaticContact CZ3-CH2 3.87Å; W108-W146 HydrophobicContact CZ3-CH2 3.87Å; W108-W146 AromaticContact CZ3-CZ2 3.74Å; W108-W146 HydrophobicContact CZ3-CZ2 3.74Å; W108-I153 HydrophobicContact CD2-CG2 3.91Å; W108-I153 HydrophobicContact CG-CG2 4.2Å; W108-I153 HydrophobicContact CZ2-CD1 3.71Å; W108-I153 HydrophobicContact CZ2-CG1 4.38Å; W108-I153 HydrophobicContact CZ2-CG2 4.18Å; W108-V155 HydrophobicContact CE3-CG2 4.49Å
109	C	90.9	Very high	83.5	Confident	12 Å²	12	68 Å²	68	8%	0.081	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	115.1	-172.9	-57.7	0	0	0	0	111.2	T93 V94 L111 I153 L154	T93-C109 CarbonylContact O-C 3.6Å; T93-C109 WeakPolarHBondContact O-CA 3.46Å; V94-C109 HydrophobicContact CG2-CB 4.45Å; C109-L111 HydrophobicContact CB-CD1 4.11Å; C109-I153 CarbonylContact O-C 3.55Å; C109-I153 WeakPolarHBondContact O-CA 3.32Å; C109-L154 HydrophobicContact CB-CB 4.24Å; C109-L154 PolarHBondContact N-O 2.98Å; C109-L154 PolarHBondContact O-N 2.68Å
110	E	88	Confident	82.2	Confident	38 Å²	38	72.3 Å²	72.3	18%	0.178	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	113.5	179.3	-53.3	-167.1	151.3	0	0	110.7	K81 K92 T93 Y95 W108 I153	K81-E110 WeakPolarHBondContact CE-OE1 3.46Å; K81-E110 IonicContact NZ-OE1 3.47Å; K81-E110 PolarHBondContact NZ-OE1 2.89Å; K81-E110 IonicContact NZ-OE2 2.63Å; K81-E110 PolarHBondContact NZ-OE2 3.04Å; K81-E110 VanDerWaalsContact NZ-OE2 3.09Å; K92-E110 CarbonylContact C-O 3.51Å; K92-E110 VanDerWaalsContact CA-O 3.27Å; K92-E110 WeakPolarHBondContact CA-O 3.32Å; T93-E110 PolarHBondContact N-O 3.09Å; T93-E110 PolarHBondContact O-N 2.84Å; Y95-E110 HydrophobicContact CD2-CG 4.11Å; Y95-E110 HydrophobicContact CE2-CG 4.17Å; Y95-E110 WeakPolarHBondContact CE2-OE2 3.17Å; W108-E110 PolarHBondContact NE1-OE1 3.44Å; E110-I153 HydrophobicContact CG-CG1 4.25Å
111	L	80.1	Confident	81.1	Confident	28 Å²	28	74.3 Å²	74.3	15%	0.147	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	129.8	-179.4	-78.4	73.3	0	0	0	111.2	F91 K92 C109 T113 F124 C151 I152 L154	F91-L111 WeakPolarHBondContact O-CA 3.34Å; K92-L111 HydrophobicContact CB-CD1 3.96Å; K92-L111 HydrophobicContact CB-CG 3.97Å; C109-L111 HydrophobicContact CB-CD1 4.11Å; L111-T113 PolarHBondContact O-N 3.46Å; L111-T113 VanDerWaalsContact O-N 3.14Å; L111-F124 HydrophobicContact CD2-CE2 3.77Å; L111-F124 HydrophobicContact CD2-CZ 3.63Å; L111-C151 CarbonylContact O-C 3.3Å; L111-C151 WeakPolarHBondContact O-CA 3.32Å; L111-C151 WeakPolarHBondContact O-CB 3.39Å; L111-I152 PolarHBondContact N-O 2.76Å; L111-I152 PolarHBondContact O-N 3.17Å; L111-L154 HydrophobicContact CD1-CD1 3.85Å; L111-L154 HydrophobicContact CD1-CG 4.1Å; L111-L154 HydrophobicContact CD2-CD1 4.26Å
112	Q	75.4	Confident	80	Confident	93 Å²	93	73.1 Å²	73.1	44%	0.435	36%	0.359	S	S	.	.			trans	-80.5	96	-170	-60.9	-172.7	15.4	0	0	112.7	F91 H114	F91-Q112 PolarHBondContact O-N 3.17Å; F91-Q112 VanDerWaalsContact O-N 3.14Å; Q112-H114 PolarHBondContact O-N 3.48Å; Q112-H114 PolarHBondContact OE1-CE1 3.16Å
113	T	69.1	Low	78.8	Confident	12 Å²	12	73.5 Å²	73.5	7%	0.074	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-78.9	-9.5	-173.8	48.4	0	0	0	0	115.7	L111 R115 L116 R121 K150 C151 I152	L111-T113 PolarHBondContact O-N 3.46Å; L111-T113 VanDerWaalsContact O-N 3.14Å; T113-R115 PolarHBondContact O-N 2.83Å; T113-R115 VanDerWaalsContact O-N 3.07Å; T113-L116 HydrophobicContact CG2-CD1 4.36Å; T113-L116 PolarHBondContact O-N 3.28Å; T113-R121 PolarHBondContact O-NH2 2.83Å; T113-R121 VanDerWaalsContact O-NH2 3.12Å; T113-K150 PolarHBondContact OG1-O 3.21Å; T113-C151 WeakPolarHBondContact OG1-CA 3.42Å; T113-I152 HydrophobicContact CG2-CB 4.09Å; T113-I152 HydrophobicContact CG2-CD1 3.57Å; T113-I152 HydrophobicContact CG2-CG1 3.61Å
114	H	65.8	Low	77.9	Confident	121 Å²	121	68.9 Å²	68.9	56%	0.56	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-62.7	-16.5	-177.7	73.5	-92.7	0	0	0	114	Q112	Q112-H114 PolarHBondContact O-N 3.48Å; Q112-H114 PolarHBondContact OE1-CE1 3.16Å
115	R	61.3	Low	76.9	Confident	185 Å²	185	67.3 Å²	67.3	70%	0.698	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-99.1	-4.4	177.6	-54.3	-169.1	178.6	-162.9	-3.3	114.3	T113	T113-R115 PolarHBondContact O-N 2.83Å; T113-R115 VanDerWaalsContact O-N 3.07Å
116	L	66.3	Low	75.9	Confident	57 Å²	57	68.6 Å²	68.6	30%	0.298	33%	0.326	S	S	.	.			trans	-98	127.3	-175.2	-59.1	-179	0	0	0	111.3	T113 E120 R121	T113-L116 HydrophobicContact CG2-CD1 4.36Å; T113-L116 PolarHBondContact O-N 3.28Å; L116-E120 HydrophobicContact CB-CB 4.31Å; L116-E120 HydrophobicContact CD2-CB 4.38Å; L116-R121 PolarHBondContact O-NH2 2.79Å
117	S	69.6	Low	74.9	Confident	57 Å²	57	69.7 Å²	69.7	40%	0.399	33%	0.331	S	S	.	.			trans	-61.8	169	172.4	71.1	0	0	0	0	112.3	A119 E120 R121	S117-A119 PolarHBondContact O-N 2.84Å; S117-A119 PolarHBondContact OG-N 3.08Å; S117-E120 WeakPolarHBondContact CA-OE2 3.34Å; S117-E120 WeakPolarHBondContact CB-OE2 3.49Å; S117-E120 PolarHBondContact N-OE2 3.3Å; S117-E120 PolarHBondContact O-N 3.15Å; S117-E120 WeakPolarHBondContact OG-CG 3.5Å; S117-E120 PolarHBondContact OG-N 3.4Å; S117-E120 PolarHBondContact OG-OE2 3.43Å; S117-R121 VanDerWaalsContact O-CB 3.23Å; S117-R121 WeakPolarHBondContact O-CB 3.35Å; S117-R121 PolarHBondContact O-N 3.21Å
118	K	74.9	Confident	74.2	Confident	197 Å²	197	69.7 Å²	69.7	86%	0.857	33%	0.331	S	S	*	.	H	α-helix	trans	-59.1	-35.5	175.1	-66.8	179.4	-179.3	173.9	0	112.3	Q122	K118-Q122 PolarHBondContact O-N 2.83Å; K118-Q122 VanDerWaalsContact O-N 3.16Å
119	A	68.8	Low	73.4	Confident	61 Å²	61	74.6 Å²	74.6	50%	0.504	35%	0.354	S	S	.	.	H	α-helix	trans	-74	-44.7	-178.9	0	0	0	0	0	112.5	S117 R121 Q122 R123	S117-A119 PolarHBondContact O-N 2.84Å; S117-A119 PolarHBondContact OG-N 3.08Å; A119-R121 VanDerWaalsContact C-N 3.33Å; A119-R121 PolarHBondContact O-N 2.98Å; A119-Q122 PolarHBondContact O-N 2.7Å; A119-R123 PolarHBondContact O-N 2.85Å
120	E	68.8	Low	72.8	Confident	91 Å²	91	75.4 Å²	75.4	43%	0.425	36%	0.357	S	S	.	.	H	α-helix	trans	-63.7	-41.3	175.5	-67.3	157	123	0	0	111	L116 S117 Q122 R123 F124	L116-E120 HydrophobicContact CB-CB 4.31Å; L116-E120 HydrophobicContact CD2-CB 4.38Å; S117-E120 WeakPolarHBondContact CA-OE2 3.34Å; S117-E120 WeakPolarHBondContact CB-OE2 3.49Å; S117-E120 PolarHBondContact N-OE2 3.3Å; S117-E120 PolarHBondContact O-N 3.15Å; S117-E120 WeakPolarHBondContact OG-CG 3.5Å; S117-E120 PolarHBondContact OG-N 3.4Å; S117-E120 PolarHBondContact OG-OE2 3.43Å; E120-Q122 PolarHBondContact O-N 2.83Å; E120-R123 PolarHBondContact O-N 3.41Å; E120-F124 VanDerWaalsContact O-CB 3.27Å; E120-F124 WeakPolarHBondContact O-CB 3.44Å; E120-F124 PolarHBondContact O-N 3.04Å
121	R	72.1	Confident	72.5	Confident	101 Å²	101	74 Å²	74	38%	0.381	35%	0.35	S	S	.	.	H	α-helix	trans	-66.6	-23.5	177.4	-161.1	179.7	-53.7	-169.3	3.8	113.3	T113 L116 S117 A119 S125	T113-R121 PolarHBondContact O-NH2 2.83Å; T113-R121 VanDerWaalsContact O-NH2 3.12Å; L116-R121 PolarHBondContact O-NH2 2.79Å; S117-R121 VanDerWaalsContact O-CB 3.23Å; S117-R121 WeakPolarHBondContact O-CB 3.35Å; S117-R121 PolarHBondContact O-N 3.21Å; A119-R121 VanDerWaalsContact C-N 3.33Å; A119-R121 PolarHBondContact O-N 2.98Å; R121-S125 WeakPolarHBondContact O-CB 3.24Å; R121-S125 PolarHBondContact O-N 2.98Å
122	Q	72.2	Confident	72.5	Confident	104 Å²	104	75.2 Å²	75.2	49%	0.486	36%	0.355	S	S	.	.	H	α-helix	trans	-77.3	-52.9	171.6	179.4	58.1	29.5	0	0	111	K118 A119 E120 F124 S125 E126	K118-Q122 PolarHBondContact O-N 2.83Å; K118-Q122 VanDerWaalsContact O-N 3.16Å; A119-Q122 PolarHBondContact O-N 2.7Å; E120-Q122 PolarHBondContact O-N 2.83Å; Q122-F124 VanDerWaalsContact C-N 3.31Å; Q122-F124 PolarHBondContact O-N 3.16Å; Q122-S125 WeakPolarHBondContact O-CA 3.46Å; Q122-S125 VanDerWaalsContact O-CB 3.28Å; Q122-S125 WeakPolarHBondContact O-CB 3.45Å; Q122-S125 PolarHBondContact O-N 2.87Å; Q122-E126 WeakPolarHBondContact CG-OE1 3.35Å; Q122-E126 PolarHBondContact NE2-OE1 3.45Å; Q122-E126 PolarHBondContact O-N 3.5Å; Q122-E126 VanDerWaalsContact O-N 3.09Å
123	R	68.6	Low	72.9	Confident	104 Å²	104	76 Å²	76	39%	0.392	37%	0.365	S	S	.	.	H	α-helix	trans	-53	-47.8	176.1	-68.8	175.9	-178.2	-174.9	-2.8	111.9	A119 E120 S125 E126 E127	A119-R123 PolarHBondContact O-N 2.85Å; E120-R123 PolarHBondContact O-N 3.41Å; R123-S125 PolarHBondContact O-N 2.68Å; R123-E126 WeakPolarHBondContact O-CB 3.04Å; R123-E126 PolarHBondContact O-N 2.68Å; R123-E127 WeakPolarHBondContact O-CG 3.1Å; R123-E127 PolarHBondContact O-N 2.94Å
124	F	72.7	Confident	73.8	Confident	21 Å²	21	75.7 Å²	75.7	9%	0.092	36%	0.363	C	S	.	.	H	α-helix	trans	-60.5	-32.8	176.5	-174.8	-90.9	0	0	0	112.6	L111 E120 Q122 V128 I152 L154	L111-F124 HydrophobicContact CD2-CE2 3.77Å; L111-F124 HydrophobicContact CD2-CZ 3.63Å; E120-F124 VanDerWaalsContact O-CB 3.27Å; E120-F124 WeakPolarHBondContact O-CB 3.44Å; E120-F124 PolarHBondContact O-N 3.04Å; Q122-F124 VanDerWaalsContact C-N 3.31Å; Q122-F124 PolarHBondContact O-N 3.16Å; F124-V128 HydrophobicContact CD1-CG2 3.97Å; F124-V128 HydrophobicContact CE1-CG2 3.44Å; F124-V128 VanDerWaalsContact CE1-CG2 3.44Å; F124-V128 HydrophobicContact CE2-CG2 4.41Å; F124-V128 HydrophobicContact CZ-CG2 3.68Å; F124-V128 VanDerWaalsContact O-CB 3.26Å; F124-V128 WeakPolarHBondContact O-CB 3.46Å; F124-V128 VanDerWaalsContact O-CG2 3.24Å; F124-V128 WeakPolarHBondContact O-CG2 3.39Å; F124-V128 PolarHBondContact O-N 2.73Å; F124-I152 HydrophobicContact CD1-CD1 3.65Å; F124-I152 HydrophobicContact CE1-CB 4.24Å; F124-I152 HydrophobicContact CE1-CD1 3.76Å; F124-I152 HydrophobicContact CE1-CG2 3.83Å; F124-L154 HydrophobicContact CE1-CD2 4.26Å; F124-L154 HydrophobicContact CZ-CD1 4.2Å; F124-L154 HydrophobicContact CZ-CD2 4.09Å
125	S	73.6	Confident	75.1	Confident	36 Å²	36	75.1 Å²	75.1	25%	0.252	36%	0.361	S	S	.	.	H	α-helix	trans	-72.5	-29.2	176.3	-152.8	0	0	0	0	112.8	R121 Q122 R123 E129 K147	R121-S125 WeakPolarHBondContact O-CB 3.24Å; R121-S125 PolarHBondContact O-N 2.98Å; Q122-S125 WeakPolarHBondContact O-CA 3.46Å; Q122-S125 VanDerWaalsContact O-CB 3.28Å; Q122-S125 WeakPolarHBondContact O-CB 3.45Å; Q122-S125 PolarHBondContact O-N 2.87Å; R123-S125 PolarHBondContact O-N 2.68Å; S125-E129 PolarHBondContact O-N 3.03Å; S125-K147 PolarHBondContact OG-NZ 2.96Å
126	E	72.8	Confident	76.6	Confident	109 Å²	109	68.6 Å²	68.6	51%	0.509	34%	0.338	S	S	.	.	H	α-helix	trans	-77.4	-41.2	174.5	-67	162	-166.3	0	0	111.1	Q122 R123 E129 M130	Q122-E126 WeakPolarHBondContact CG-OE1 3.35Å; Q122-E126 PolarHBondContact NE2-OE1 3.45Å; Q122-E126 PolarHBondContact O-N 3.5Å; Q122-E126 VanDerWaalsContact O-N 3.09Å; R123-E126 WeakPolarHBondContact O-CB 3.04Å; R123-E126 PolarHBondContact O-N 2.68Å; E126-E129 PolarHBondContact O-N 3.43Å; E126-M130 PolarHBondContact O-N 3.45Å; E126-M130 VanDerWaalsContact O-N 3.15Å
127	E	74.5	Confident	77.9	Confident	23 Å²	23	70.1 Å²	70.1	11%	0.107	35%	0.352	C	S	.	.	H	α-helix	trans	-59.7	-47.3	172.9	-73.1	162.1	-169.4	0	0	111.2	R123 E129 M130 L131 T228	R123-E127 WeakPolarHBondContact O-CG 3.1Å; R123-E127 PolarHBondContact O-N 2.94Å; E127-E129 PolarHBondContact O-N 2.89Å; E127-M130 HydrophobicContact CB-CE 4.42Å; E127-M130 CarbonylContact O-C 3.58Å; E127-M130 WeakPolarHBondContact O-CA 3.46Å; E127-M130 WeakPolarHBondContact O-CB 3.41Å; E127-M130 PolarHBondContact O-N 2.89Å; E127-M130 VanDerWaalsContact O-N 3.14Å; E127-L131 WeakPolarHBondContact O-CG 3.37Å; E127-L131 PolarHBondContact O-N 3.2Å; E127-T228 WeakPolarHBondContact OE1-CB 3.39Å; E127-T228 VanDerWaalsContact OE1-CG2 3.29Å; E127-T228 WeakPolarHBondContact OE1-CG2 3.23Å
128	V	78	Confident	79.2	Confident	8 Å²	8	68 Å²	68	5%	0.048	34%	0.336	C	S	.	.	H	α-helix	trans	-59.4	-41.8	178.3	155.3	0	0	0	0	113.5	F124 M130 L131 K132 F142 S145 L154	F124-V128 HydrophobicContact CD1-CG2 3.97Å; F124-V128 HydrophobicContact CE1-CG2 3.44Å; F124-V128 VanDerWaalsContact CE1-CG2 3.44Å; F124-V128 HydrophobicContact CE2-CG2 4.41Å; F124-V128 HydrophobicContact CZ-CG2 3.68Å; F124-V128 VanDerWaalsContact O-CB 3.26Å; F124-V128 WeakPolarHBondContact O-CB 3.46Å; F124-V128 VanDerWaalsContact O-CG2 3.24Å; F124-V128 WeakPolarHBondContact O-CG2 3.39Å; F124-V128 PolarHBondContact O-N 2.73Å; V128-M130 VanDerWaalsContact C-N 3.3Å; V128-M130 PolarHBondContact O-N 3.34Å; V128-L131 WeakPolarHBondContact O-CB 3.21Å; V128-L131 PolarHBondContact O-N 2.77Å; V128-K132 PolarHBondContact O-N 2.99Å; V128-F142 HydrophobicContact CG1-CZ 4.1Å; V128-S145 WeakPolarHBondContact CG1-OG 3.42Å; V128-L154 HydrophobicContact CG2-CD2 3.66Å
129	E	78.4	Confident	80.1	Confident	108 Å²	108	58.8 Å²	58.8	51%	0.505	30%	0.296	S	S	.	.	H	α-helix	trans	-69.3	-33.3	177.6	-164.9	58.7	-147.2	0	0	111.1	S125 E126 E127 K132	S125-E129 PolarHBondContact O-N 3.03Å; E126-E129 PolarHBondContact O-N 3.43Å; E127-E129 PolarHBondContact O-N 2.89Å; E129-K132 PolarHBondContact O-N 3.02Å; E129-K132 WeakPolarHBondContact OE2-CD 3.34Å; E129-K132 WeakPolarHBondContact OE2-CE 3.35Å; E129-K132 IonicContact OE2-NZ 3.4Å; E129-K132 PolarHBondContact OE2-NZ 3.12Å
130	M	78.1	Confident	81.3	Confident	30 Å²	30	56.6 Å²	56.6	15%	0.148	28%	0.276	C	S	.	.	H	α-helix	trans	-64.3	-35.1	169.7	169.8	-83.7	-67.5	0	0	112.7	E126 E127 V128 K132 V133 L134 I200 L229	E126-M130 PolarHBondContact O-N 3.45Å; E126-M130 VanDerWaalsContact O-N 3.15Å; E127-M130 HydrophobicContact CB-CE 4.42Å; E127-M130 CarbonylContact O-C 3.58Å; E127-M130 WeakPolarHBondContact O-CA 3.46Å; E127-M130 WeakPolarHBondContact O-CB 3.41Å; E127-M130 PolarHBondContact O-N 2.89Å; E127-M130 VanDerWaalsContact O-N 3.14Å; V128-M130 VanDerWaalsContact C-N 3.3Å; V128-M130 PolarHBondContact O-N 3.34Å; M130-K132 VanDerWaalsContact C-N 3.34Å; M130-K132 PolarHBondContact O-N 2.86Å; M130-V133 WeakPolarHBondContact O-CG2 3.38Å; M130-V133 PolarHBondContact O-N 2.88Å; M130-L134 WeakPolarHBondContact O-CG 3.3Å; M130-L134 HydrophobicContact SD-CD1 3.94Å; M130-L134 HydrophobicContact SD-CG 4.39Å; M130-I200 HydrophobicContact CE-CD1 4.47Å; M130-I200 HydrophobicContact CE-CG1 4.4Å; M130-I200 HydrophobicContact CE-CG2 4.29Å; M130-I200 HydrophobicContact CG-CD1 4.22Å; M130-I200 HydrophobicContact SD-CD1 3.41Å; M130-I200 WeakPolarHBondContact SD-CD1 3.44Å; M130-I200 HydrophobicContact SD-CG1 3.9Å; M130-I200 HydrophobicContact SD-CG2 4.46Å; M130-L229 HydrophobicContact CE-CD2 4.02Å; M130-L229 HydrophobicContact CG-CD2 4.21Å
131	L	81.3	Confident	82.3	Confident	8 Å²	8	56.2 Å²	56.2	4%	0.042	27%	0.271	C	S	.	.	H	α-helix	trans	-63.4	-34.7	176.3	-63.9	-176.1	0	0	0	113.2	E127 V128 V133 L134 F142 L224	E127-L131 WeakPolarHBondContact O-CG 3.37Å; E127-L131 PolarHBondContact O-N 3.2Å; V128-L131 WeakPolarHBondContact O-CB 3.21Å; V128-L131 PolarHBondContact O-N 2.77Å; L131-V133 PolarHBondContact O-N 2.9Å; L131-L134 HydrophobicContact CD2-CD1 3.79Å; L131-L134 WeakPolarHBondContact O-CB 3.43Å; L131-L134 PolarHBondContact O-N 3.4Å; L131-F142 HydrophobicContact CB-CB 4.22Å; L131-F142 HydrophobicContact CB-CD1 4.2Å; L131-F142 HydrophobicContact CB-CD2 3.67Å; L131-F142 HydrophobicContact CB-CE1 4.45Å; L131-F142 HydrophobicContact CB-CE2 3.95Å; L131-F142 HydrophobicContact CB-CG 3.78Å; L131-F142 HydrophobicContact CB-CZ 4.31Å; L131-F142 HydrophobicContact CD1-CD2 3.79Å; L131-F142 HydrophobicContact CD1-CE2 3.65Å; L131-F142 HydrophobicContact CD1-CZ 4.48Å; L131-F142 HydrophobicContact CG-CD2 4.38Å; L131-F142 HydrophobicContact CG-CE2 4.46Å; L131-L224 HydrophobicContact CD2-CB 3.55Å; L131-L224 HydrophobicContact CD2-CD1 4.21Å
132	K	81.4	Confident	83.2	Confident	54 Å²	54	52.1 Å²	52.1	24%	0.235	26%	0.256	C	S	.	.	H	α-helix	trans	-59.3	-31.3	-178.3	-70.4	178.4	179.1	177.6	0	114.1	V128 E129 M130 F142 D144	V128-K132 PolarHBondContact O-N 2.99Å; E129-K132 PolarHBondContact O-N 3.02Å; E129-K132 WeakPolarHBondContact OE2-CD 3.34Å; E129-K132 WeakPolarHBondContact OE2-CE 3.35Å; E129-K132 IonicContact OE2-NZ 3.4Å; E129-K132 PolarHBondContact OE2-NZ 3.12Å; M130-K132 VanDerWaalsContact C-N 3.34Å; M130-K132 PolarHBondContact O-N 2.86Å; K132-F142 HydrophobicContact CB-CD1 4.36Å; K132-F142 HydrophobicContact CG-CD1 3.63Å; K132-F142 HydrophobicContact CG-CE1 3.56Å; K132-D144 WeakPolarHBondContact CE-OD1 3.23Å; K132-D144 IonicContact NZ-OD1 2.71Å; K132-D144 PolarHBondContact NZ-OD1 3.04Å
133	V	83.6	Confident	84.1	Confident	108 Å²	108	49.6 Å²	49.6	66%	0.655	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-4.5	179.2	-63.5	0	0	0	0	113.5	M130 L131 Q135	M130-V133 WeakPolarHBondContact O-CG2 3.38Å; M130-V133 PolarHBondContact O-N 2.88Å; L131-V133 PolarHBondContact O-N 2.9Å; V133-Q135 PolarHBondContact O-N 2.88Å
134	L	88	Confident	85.1	Confident	7 Å²	7	46.7 Å²	46.7	4%	0.037	24%	0.235	C	C	.	.			trans	-81.7	107	179.7	-56	-174.9	0	0	0	111.6	M130 L131 F192 L193 R196 I200 L224	M130-L134 WeakPolarHBondContact O-CG 3.3Å; M130-L134 HydrophobicContact SD-CD1 3.94Å; M130-L134 HydrophobicContact SD-CG 4.39Å; L131-L134 HydrophobicContact CD2-CD1 3.79Å; L131-L134 WeakPolarHBondContact O-CB 3.43Å; L131-L134 PolarHBondContact O-N 3.4Å; L134-F192 HydrophobicContact CB-CE1 4.22Å; L134-F192 HydrophobicContact CD2-CE1 4.02Å; L134-L193 HydrophobicContact CD1-CD2 4.01Å; L134-R196 HydrophobicContact CD2-CG 4.34Å; L134-I200 HydrophobicContact CD1-CD1 3.92Å; L134-I200 HydrophobicContact CD2-CD1 3.58Å; L134-I200 HydrophobicContact CG-CD1 4.36Å; L134-L224 HydrophobicContact CD1-CD1 3.77Å
135	Q	91.7	Very high	85.9	Confident	109 Å²	109	46.6 Å²	46.6	51%	0.509	24%	0.236	S	C	.	.			trans	-131.6	104.7	179.5	-53.8	-171.4	34.2	0	0	109.7	V133 R141	V133-Q135 PolarHBondContact O-N 2.88Å; Q135-R141 VanDerWaalsContact NE2-NH2 3.12Å
136	H	94.3	Very high	86.6	Confident	47 Å²	47	46.4 Å²	46.4	22%	0.218	23%	0.23	C	C	.	.			trans	-152.2	138.2	-179.3	-179.7	-101.1	0	0	0	110.3	N138 I139 K188 F192	H136-N138 PolarHBondContact ND1-N 2.84Å; H136-N138 PolarHBondContact O-N 2.89Å; H136-I139 HydrophobicContact CB-CB 4.26Å; H136-I139 HydrophobicContact CB-CG1 3.9Å; H136-I139 PolarHBondContact O-N 3.15Å; H136-K188 PolarHBondContact CE1-O 2.78Å; H136-F192 HydrophobicContact CB-CB 4.36Å; H136-F192 HydrophobicContact CB-CD1 3.68Å; H136-F192 HydrophobicContact CB-CD2 3.86Å; H136-F192 HydrophobicContact CB-CE1 3.84Å; H136-F192 HydrophobicContact CB-CE2 4.01Å; H136-F192 HydrophobicContact CB-CG 3.69Å; H136-F192 HydrophobicContact CB-CZ 4Å; H136-F192 AromaticContact CD2-CD2 3.76Å; H136-F192 AromaticContact CD2-CG 3.85Å; H136-F192 AromaticContact CG-CD2 3.94Å; H136-F192 AromaticContact CG-CG 3.69Å
137	P	93.4	Very high	87.2	Confident	90 Å²	90	47.2 Å²	47.2	58%	0.584	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-14.1	-174.6	23.4	-36.4	0	0	0	115.7	K220	P137-K220 WeakPolarHBondContact O-CE 3.47Å; P137-K220 WeakPolarHBondContact O-CG 3.3Å
138	N	96.2	Very high	87.5	Confident	12 Å²	12	48.9 Å²	48.9	6%	0.064	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113	18.7	174.5	-54.7	115.5	0	0	0	113.9	H136 Q185 V219 K220 I221	H136-N138 PolarHBondContact ND1-N 2.84Å; H136-N138 PolarHBondContact O-N 2.89Å; N138-Q185 WeakPolarHBondContact CB-O 3.21Å; N138-Q185 WeakPolarHBondContact ND2-CB 3.48Å; N138-Q185 WeakPolarHBondContact ND2-CG 3.48Å; N138-V219 PolarHBondContact ND2-O 2.88Å; N138-K220 WeakPolarHBondContact O-CA 3.29Å; N138-I221 PolarHBondContact O-N 3.22Å
139	I	94.5	Very high	87.2	Confident	3 Å²	3	53.5 Å²	53.5	2%	0.015	29%	0.285	C	S	.	.	B	Isolated β-bridge	trans	-116.5	140.9	166.7	-58.8	-60.5	0	0	0	107.5	H136 R141 F192 L193 I221 L224	H136-I139 HydrophobicContact CB-CB 4.26Å; H136-I139 HydrophobicContact CB-CG1 3.9Å; H136-I139 PolarHBondContact O-N 3.15Å; I139-R141 PolarHBondContact O-N 2.81Å; I139-F192 HydrophobicContact CG1-CD1 4.1Å; I139-L193 HydrophobicContact CD1-CD1 3.93Å; I139-L193 HydrophobicContact CD1-CD2 4.26Å; I139-L193 HydrophobicContact CD1-CG 4.01Å; I139-I221 CarbonylContact C-O 3.46Å; I139-I221 WeakPolarHBondContact CA-O 3.4Å; I139-I221 HydrophobicContact CD1-CB 4Å; I139-I221 HydrophobicContact CD1-CD1 4.24Å; I139-I221 HydrophobicContact CD1-CG1 4.42Å; I139-L224 HydrophobicContact CG2-CD1 3.61Å
140	V	92.8	Very high	87.1	Confident	16 Å²	16	56.6 Å²	56.6	10%	0.097	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-66.7	124.2	172.9	175.3	0	0	0	0	107.9	F142 E157 M159 F211 K220 I221	V140-F142 PolarHBondContact O-N 3.05Å; V140-E157 HydrophobicContact CG1-CB 4.06Å; V140-M159 HydrophobicContact CG1-CG 4.35Å; V140-M159 HydrophobicContact CG2-CG 4Å; V140-M159 HydrophobicContact CG2-SD 4.15Å; V140-F211 HydrophobicContact CG2-CB 4.42Å; V140-F211 HydrophobicContact CG2-CD2 3.97Å; V140-F211 HydrophobicContact CG2-CG 4.45Å; V140-K220 HydrophobicContact CG2-CB 3.7Å; V140-I221 PolarHBondContact N-O 3.45Å
141	R	91.1	Very high	87.2	Confident	83 Å²	83	56 Å²	56	31%	0.313	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-67.1	130.4	-174.4	175.8	170.2	-172.2	110.9	20.4	111.4	Q135 I139 Y143 T156 E157	Q135-R141 VanDerWaalsContact NE2-NH2 3.12Å; I139-R141 PolarHBondContact O-N 2.81Å; R141-Y143 HydrophobicContact CG-CD1 4.32Å; R141-Y143 HydrophobicContact CG-CE1 4.06Å; R141-T156 CarbonylContact O-C 3.5Å; R141-T156 VanDerWaalsContact O-CA 3.25Å; R141-T156 WeakPolarHBondContact O-CA 3.43Å; R141-T156 WeakPolarHBondContact O-CB 3.4Å; R141-E157 HydrophobicContact CB-CB 4.05Å; R141-E157 PolarHBondContact N-OE2 3.32Å; R141-E157 VanDerWaalsContact N-OE2 3.07Å; R141-E157 PolarHBondContact O-N 3.08Å
142	F	91	Very high	87.4	Confident	14 Å²	14	55.9 Å²	55.9	6%	0.061	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	140.2	163.1	-160.9	-90.2	0	0	0	110.1	V128 L131 K132 V140 L154 T156	V128-F142 HydrophobicContact CG1-CZ 4.1Å; L131-F142 HydrophobicContact CB-CB 4.22Å; L131-F142 HydrophobicContact CB-CD1 4.2Å; L131-F142 HydrophobicContact CB-CD2 3.67Å; L131-F142 HydrophobicContact CB-CE1 4.45Å; L131-F142 HydrophobicContact CB-CE2 3.95Å; L131-F142 HydrophobicContact CB-CG 3.78Å; L131-F142 HydrophobicContact CB-CZ 4.31Å; L131-F142 HydrophobicContact CD1-CD2 3.79Å; L131-F142 HydrophobicContact CD1-CE2 3.65Å; L131-F142 HydrophobicContact CD1-CZ 4.48Å; L131-F142 HydrophobicContact CG-CD2 4.38Å; L131-F142 HydrophobicContact CG-CE2 4.46Å; K132-F142 HydrophobicContact CB-CD1 4.36Å; K132-F142 HydrophobicContact CG-CD1 3.63Å; K132-F142 HydrophobicContact CG-CE1 3.56Å; V140-F142 PolarHBondContact O-N 3.05Å; F142-L154 HydrophobicContact CE2-CB 4.03Å; F142-L154 HydrophobicContact CE2-CD1 4.37Å; F142-L154 HydrophobicContact CE2-CD2 4.1Å; F142-L154 HydrophobicContact CE2-CG 4.39Å; F142-L154 HydrophobicContact CZ-CB 4.37Å; F142-L154 HydrophobicContact CZ-CD2 4Å; F142-T156 HydrophobicContact CD2-CG2 4.04Å
143	Y	90.5	Very high	87.7	Confident	51 Å²	51	53.7 Å²	53.7	20%	0.2	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	-66.5	174.8	-66.8	-69.1	0	0	0	111.5	F79 V106 R141 V155 E157	F79-Y143 HydrophobicContact CZ-CG 4.47Å; V106-Y143 HydrophobicContact CG1-CD2 4.01Å; V106-Y143 HydrophobicContact CG1-CE2 3.77Å; R141-Y143 HydrophobicContact CG-CD1 4.32Å; R141-Y143 HydrophobicContact CG-CE1 4.06Å; Y143-V155 HydrophobicContact CD2-CG1 4.23Å; Y143-V155 PolarHBondContact N-O 2.84Å; Y143-E157 HydrophobicContact CE2-CB 4.2Å
144	D	90.3	Very high	88	Confident	44 Å²	44	49 Å²	49	24%	0.235	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	179.9	179.8	-167.4	32.3	0	0	0	112.3	F79 K132 V155	F79-D144 HydrophobicContact CE2-CB 3.97Å; K132-D144 WeakPolarHBondContact CE-OD1 3.23Å; K132-D144 IonicContact NZ-OD1 2.71Å; K132-D144 PolarHBondContact NZ-OD1 3.04Å; D144-V155 PolarHBondContact O-N 3.21Å
145	S	88.7	Confident	88.2	Confident	18 Å²	18	48.7 Å²	48.7	13%	0.126	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	144.5	-175.3	55.7	0	0	0	0	112.8	V128 I153	V128-S145 WeakPolarHBondContact CG1-OG 3.42Å; S145-I153 CarbonylContact C-O 3.59Å; S145-I153 WeakPolarHBondContact CA-O 3.39Å; S145-I153 WeakPolarHBondContact CB-O 3.48Å
146	W	88.1	Confident	88.3	Confident	33 Å²	33	44.8 Å²	44.8	13%	0.125	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	163.9	174.1	59.2	97.4	0	0	0	112.5	P75 F79 W108 I153 V155	P75-W146 HydrophobicContact CG-CB 4.02Å; P75-W146 HydrophobicContact CG-CD2 4.17Å; P75-W146 HydrophobicContact CG-CG 3.67Å; F79-W146 HydrophobicContact CB-CH2 4.38Å; F79-W146 HydrophobicContact CD2-CH2 4.32Å; F79-W146 HydrophobicContact CD2-CZ3 4.08Å; W108-W146 HydrophobicContact CE3-CH2 4.21Å; W108-W146 HydrophobicContact CE3-CZ2 4.33Å; W108-W146 HydrophobicContact CH2-CH2 4.16Å; W108-W146 AromaticContact CH2-CZ2 3.53Å; W108-W146 HydrophobicContact CH2-CZ2 3.53Å; W108-W146 AromaticContact CZ2-CZ2 3.91Å; W108-W146 HydrophobicContact CZ2-CZ2 3.91Å; W108-W146 AromaticContact CZ3-CH2 3.87Å; W108-W146 HydrophobicContact CZ3-CH2 3.87Å; W108-W146 AromaticContact CZ3-CZ2 3.74Å; W108-W146 HydrophobicContact CZ3-CZ2 3.74Å; W146-I153 HydrophobicContact CD2-CB 4.31Å; W146-I153 HydrophobicContact CD2-CG2 4.49Å; W146-I153 HydrophobicContact CH2-CB 4.47Å; W146-I153 HydrophobicContact CH2-CG2 3.66Å; W146-I153 HydrophobicContact CZ2-CB 3.93Å; W146-I153 HydrophobicContact CZ2-CD1 3.97Å; W146-I153 HydrophobicContact CZ2-CG2 3.44Å; W146-I153 VanDerWaalsContact CZ2-CG2 3.44Å; W146-I153 HydrophobicContact CZ3-CG2 4.31Å; W146-I153 PolarHBondContact N-O 3.08Å; W146-I153 VanDerWaalsContact N-O 3.07Å; W146-I153 VanDerWaalsContact NE1-CD1 3.33Å; W146-I153 PolarHBondContact O-N 2.94Å; W146-V155 HydrophobicContact CH2-CG2 3.43Å; W146-V155 VanDerWaalsContact CH2-CG2 3.43Å; W146-V155 HydrophobicContact CZ3-CG2 3.53Å
147	K	84.8	Confident	88.2	Confident	125 Å²	125	44.1 Å²	44.1	54%	0.543	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	120.7	178	-73.5	153.6	-172.6	163.4	0	108.8	S125 I152	S125-K147 PolarHBondContact OG-NZ 2.96Å; K147-I152 HydrophobicContact CB-CG1 4.48Å; K147-I152 HydrophobicContact CG-CD1 4.11Å; K147-I152 HydrophobicContact CG-CG1 3.62Å
148	S	81.1	Confident	88.1	Confident	59 Å²	59	41 Å²	41	41%	0.413	21%	0.214	S	C	.	.			trans	-96.3	168.7	167.2	178.4	0	0	0	0	109.7	K150 C151	S148-K150 PolarHBondContact O-N 3.07Å; S148-C151 CarbonylContact C-O 3.59Å; S148-C151 WeakPolarHBondContact CA-O 3.39Å; S148-C151 PolarHBondContact N-O 3.35Å; S148-C151 VanDerWaalsContact O-O 3.08Å
149	A	73	Confident	87.8	Confident	105 Å²	105	41.2 Å²	41.2	87%	0.868	22%	0.215	S	C	*	.	S	Bend	trans	-61.4	-18.8	-175.5	0	0	0	0	0	114.6
150	K	74.5	Confident	87.4	Confident	172 Å²	172	45.8 Å²	45.8	75%	0.748	24%	0.243	S	C	*	.	S	Bend	trans	-129.4	-11.5	-175.9	-62.1	178.7	-177.9	174.4	0	114.8	T113 S148	T113-K150 PolarHBondContact OG1-O 3.21Å; S148-K150 PolarHBondContact O-N 3.07Å
151	C	82.1	Confident	87.2	Confident	18 Å²	18	47.8 Å²	47.8	12%	0.122	26%	0.258	C	S	.	.			trans	-154.1	165.1	-171	52.8	0	0	0	0	111.4	L111 T113 S148	L111-C151 CarbonylContact O-C 3.3Å; L111-C151 WeakPolarHBondContact O-CA 3.32Å; L111-C151 WeakPolarHBondContact O-CB 3.39Å; T113-C151 WeakPolarHBondContact OG1-CA 3.42Å; S148-C151 CarbonylContact C-O 3.59Å; S148-C151 WeakPolarHBondContact CA-O 3.39Å; S148-C151 PolarHBondContact N-O 3.35Å; S148-C151 VanDerWaalsContact O-O 3.08Å
152	I	83.8	Confident	87.1	Confident	6 Å²	6	45 Å²	45	3%	0.031	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	137.8	158.2	-73.5	160.2	0	0	0	107.7	L111 T113 F124 K147 L154	L111-I152 PolarHBondContact N-O 2.76Å; L111-I152 PolarHBondContact O-N 3.17Å; T113-I152 HydrophobicContact CG2-CB 4.09Å; T113-I152 HydrophobicContact CG2-CD1 3.57Å; T113-I152 HydrophobicContact CG2-CG1 3.61Å; F124-I152 HydrophobicContact CD1-CD1 3.65Å; F124-I152 HydrophobicContact CE1-CB 4.24Å; F124-I152 HydrophobicContact CE1-CD1 3.76Å; F124-I152 HydrophobicContact CE1-CG2 3.83Å; K147-I152 HydrophobicContact CB-CG1 4.48Å; K147-I152 HydrophobicContact CG-CD1 4.11Å; K147-I152 HydrophobicContact CG-CG1 3.62Å; I152-L154 HydrophobicContact CG2-CD2 3.87Å
153	I	89.2	Confident	87.2	Confident	7 Å²	7	45.4 Å²	45.4	4%	0.036	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	135.1	173	-64.3	153.4	0	0	0	107.9	W108 C109 E110 S145 W146 V155	W108-I153 HydrophobicContact CD2-CG2 3.91Å; W108-I153 HydrophobicContact CG-CG2 4.2Å; W108-I153 HydrophobicContact CZ2-CD1 3.71Å; W108-I153 HydrophobicContact CZ2-CG1 4.38Å; W108-I153 HydrophobicContact CZ2-CG2 4.18Å; C109-I153 CarbonylContact O-C 3.55Å; C109-I153 WeakPolarHBondContact O-CA 3.32Å; E110-I153 HydrophobicContact CG-CG1 4.25Å; S145-I153 CarbonylContact C-O 3.59Å; S145-I153 WeakPolarHBondContact CA-O 3.39Å; S145-I153 WeakPolarHBondContact CB-O 3.48Å; W146-I153 HydrophobicContact CD2-CB 4.31Å; W146-I153 HydrophobicContact CD2-CG2 4.49Å; W146-I153 HydrophobicContact CH2-CB 4.47Å; W146-I153 HydrophobicContact CH2-CG2 3.66Å; W146-I153 HydrophobicContact CZ2-CB 3.93Å; W146-I153 HydrophobicContact CZ2-CD1 3.97Å; W146-I153 HydrophobicContact CZ2-CG2 3.44Å; W146-I153 VanDerWaalsContact CZ2-CG2 3.44Å; W146-I153 HydrophobicContact CZ3-CG2 4.31Å; W146-I153 PolarHBondContact N-O 3.08Å; W146-I153 VanDerWaalsContact N-O 3.07Å; W146-I153 VanDerWaalsContact NE1-CD1 3.33Å; W146-I153 PolarHBondContact O-N 2.94Å; I153-V155 HydrophobicContact CG2-CG2 4.38Å
154	L	89.3	Confident	87.4	Confident	11 Å²	11	43 Å²	43	6%	0.058	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	139.5	168	-44.3	174.1	0	0	0	108	C109 L111 F124 V128 F142 I152	C109-L154 HydrophobicContact CB-CB 4.24Å; C109-L154 PolarHBondContact N-O 2.98Å; C109-L154 PolarHBondContact O-N 2.68Å; L111-L154 HydrophobicContact CD1-CD1 3.85Å; L111-L154 HydrophobicContact CD1-CG 4.1Å; L111-L154 HydrophobicContact CD2-CD1 4.26Å; F124-L154 HydrophobicContact CE1-CD2 4.26Å; F124-L154 HydrophobicContact CZ-CD1 4.2Å; F124-L154 HydrophobicContact CZ-CD2 4.09Å; V128-L154 HydrophobicContact CG2-CD2 3.66Å; F142-L154 HydrophobicContact CE2-CB 4.03Å; F142-L154 HydrophobicContact CE2-CD1 4.37Å; F142-L154 HydrophobicContact CE2-CD2 4.1Å; F142-L154 HydrophobicContact CE2-CG 4.39Å; F142-L154 HydrophobicContact CZ-CB 4.37Å; F142-L154 HydrophobicContact CZ-CD2 4Å; I152-L154 HydrophobicContact CG2-CD2 3.87Å
155	V	92.6	Very high	87.6	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	123.6	174.8	-175	0	0	0	0	109.4	F79 V106 A107 W108 Y143 D144 W146 I153	F79-V155 HydrophobicContact CB-CG2 4.4Å; F79-V155 HydrophobicContact CD1-CG1 3.73Å; F79-V155 HydrophobicContact CD2-CG1 4.5Å; F79-V155 HydrophobicContact CD2-CG2 4.13Å; F79-V155 HydrophobicContact CE1-CG1 3.81Å; F79-V155 HydrophobicContact CG-CG1 4.09Å; F79-V155 HydrophobicContact CG-CG2 4.13Å; F79-V155 HydrophobicContact CZ-CG1 4.24Å; V106-V155 HydrophobicContact CB-CG1 3.72Å; V106-V155 HydrophobicContact CG1-CG1 4.16Å; V106-V155 HydrophobicContact CG2-CG1 3.66Å; A107-V155 WeakPolarHBondContact O-CA 3.48Å; W108-V155 HydrophobicContact CE3-CG2 4.49Å; Y143-V155 HydrophobicContact CD2-CG1 4.23Å; Y143-V155 PolarHBondContact N-O 2.84Å; D144-V155 PolarHBondContact O-N 3.21Å; W146-V155 HydrophobicContact CH2-CG2 3.43Å; W146-V155 VanDerWaalsContact CH2-CG2 3.43Å; W146-V155 HydrophobicContact CZ3-CG2 3.53Å; I153-V155 HydrophobicContact CG2-CG2 4.38Å
156	T	92.8	Very high	87.7	Confident	27 Å²	27	44.3 Å²	44.3	17%	0.166	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	167.8	179.9	69.1	0	0	0	0	111.9	V106 A107 R141 F142	V106-T156 WeakPolarHBondContact CB-O 3.43Å; A107-T156 PolarHBondContact N-O 2.99Å; A107-T156 PolarHBondContact O-N 2.74Å; R141-T156 CarbonylContact O-C 3.5Å; R141-T156 VanDerWaalsContact O-CA 3.25Å; R141-T156 WeakPolarHBondContact O-CA 3.43Å; R141-T156 WeakPolarHBondContact O-CB 3.4Å; F142-T156 HydrophobicContact CD2-CG2 4.04Å
157	E	91.9	Very high	88	Confident	33 Å²	33	45.9 Å²	45.9	15%	0.154	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55	133.7	169	176.9	177.6	-163.1	0	0	111.7	V140 R141 Y143 M159 K220	V140-E157 HydrophobicContact CG1-CB 4.06Å; R141-E157 HydrophobicContact CB-CB 4.05Å; R141-E157 PolarHBondContact N-OE2 3.32Å; R141-E157 VanDerWaalsContact N-OE2 3.07Å; R141-E157 PolarHBondContact O-N 3.08Å; Y143-E157 HydrophobicContact CE2-CB 4.2Å; E157-M159 HydrophobicContact CG-SD 4.04Å; E157-K220 IonicContact OE1-NZ 2.64Å; E157-K220 PolarHBondContact OE1-NZ 3.47Å; E157-K220 IonicContact OE2-NZ 3.01Å; E157-K220 PolarHBondContact OE2-NZ 2.95Å
158	L	91.4	Very high	88.4	Confident	24 Å²	24	39.9 Å²	39.9	13%	0.126	24%	0.236	C	C	.	.			trans	-85	123.2	178.6	-179.6	58	0	0	0	111.3	I86 E105 A107 T160	I86-L158 HydrophobicContact CD1-CD1 3.54Å; I86-L158 HydrophobicContact CD1-CD2 4.16Å; E105-L158 HydrophobicContact CB-CD2 3.76Å; A107-L158 HydrophobicContact CB-CD1 4.11Å; L158-T160 HydrophobicContact CD2-CG2 4.16Å; L158-T160 HydrophobicContact CG-CG2 4.04Å; L158-T160 PolarHBondContact O-N 2.8Å
159	M	91.1	Very high	88.8	Confident	17 Å²	17	45.4 Å²	45.4	8%	0.084	25%	0.247	C	C	.	.			trans	-101.6	77	-176	-58.8	-60.9	-58	0	0	111.5	V140 E157 S161 G162 F211 N213 K220	V140-M159 HydrophobicContact CG1-CG 4.35Å; V140-M159 HydrophobicContact CG2-CG 4Å; V140-M159 HydrophobicContact CG2-SD 4.15Å; E157-M159 HydrophobicContact CG-SD 4.04Å; M159-S161 VanDerWaalsContact C-N 3.26Å; M159-S161 PolarHBondContact O-N 2.65Å; M159-S161 VanDerWaalsContact O-N 3.13Å; M159-G162 PolarHBondContact O-N 3.07Å; M159-G162 VanDerWaalsContact O-N 3.11Å; M159-F211 HydrophobicContact CB-CB 3.66Å; M159-F211 HydrophobicContact CB-CD1 3.69Å; M159-F211 HydrophobicContact CB-CG 3.92Å; M159-F211 HydrophobicContact CE-CB 3.71Å; M159-F211 HydrophobicContact CG-CB 3.58Å; M159-F211 HydrophobicContact CG-CD1 4.09Å; M159-F211 HydrophobicContact CG-CG 3.87Å; M159-F211 HydrophobicContact SD-CB 4.4Å; M159-N213 HydrophobicContact CE-CB 3.88Å; M159-K220 HydrophobicContact CE-CB 4.01Å; M159-K220 HydrophobicContact CE-CD 4.01Å; M159-K220 HydrophobicContact CE-CG 4.24Å; M159-K220 HydrophobicContact SD-CD 4.02Å
160	T	85.2	Confident	89.6	Confident	99 Å²	99	49.5 Å²	49.5	61%	0.607	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-24	-168.9	58.4	0	0	0	0	115.7	L158 G162	L158-T160 HydrophobicContact CD2-CG2 4.16Å; L158-T160 HydrophobicContact CG-CG2 4.04Å; L158-T160 PolarHBondContact O-N 2.8Å; T160-G162 VanDerWaalsContact C-N 3.3Å; T160-G162 PolarHBondContact O-N 3.44Å
161	S	88.3	Confident	90.2	Very high	57 Å²	57	46.7 Å²	46.7	40%	0.399	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	10.3	178.8	-59.8	0	0	0	0	114.4	M159 I212 G214	M159-S161 VanDerWaalsContact C-N 3.26Å; M159-S161 PolarHBondContact O-N 2.65Å; M159-S161 VanDerWaalsContact O-N 3.13Å; S161-I212 WeakPolarHBondContact CB-O 3.41Å; S161-G214 WeakPolarHBondContact OG-CA 3.34Å; S161-G214 PolarHBondContact OG-N 2.68Å
162	G	90.1	Very high	90.4	Very high	24 Å²	24	52.6 Å²	52.6	25%	0.247	25%	0.248	C	C	.	.			trans	74.4	-157.5	171.7	0	0	0	0	0	114.3	M159 T160 F211 I212	M159-G162 PolarHBondContact O-N 3.07Å; M159-G162 VanDerWaalsContact O-N 3.11Å; T160-G162 VanDerWaalsContact C-N 3.3Å; T160-G162 PolarHBondContact O-N 3.44Å; G162-F211 WeakPolarHBondContact O-CA 3.46Å; G162-I212 PolarHBondContact O-N 2.64Å
163	T	93.6	Very high	90.5	Very high	24 Å²	24	57.9 Å²	57.9	15%	0.147	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	-104.2	154.6	-169.1	76.8	0	0	0	0	112.2	K165 T166 Y167 D208 V210 F211	T163-K165 PolarHBondContact O-N 3.11Å; T163-T166 PolarHBondContact N-OG1 3.14Å; T163-T166 VanDerWaalsContact N-OG1 3.16Å; T163-T166 PolarHBondContact O-N 3.17Å; T163-T166 PolarHBondContact O-OG1 2.77Å; T163-T166 PolarHBondContact OG1-N 3.25Å; T163-Y167 PolarHBondContact O-N 3.04Å; T163-D208 WeakPolarHBondContact CB-O 2.99Å; T163-D208 WeakPolarHBondContact CG2-O 3.47Å; T163-V210 CarbonylContact C-O 3.59Å; T163-V210 WeakPolarHBondContact CA-O 3.49Å; T163-F211 HydrophobicContact CG2-CD1 4.01Å; T163-F211 HydrophobicContact CG2-CE1 3.83Å; T163-F211 HydrophobicContact CG2-CZ 4.5Å
164	L	94.6	Very high	90.5	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-53.7	-38.5	176.1	178.3	58.5	0	0	0	111.6	Y167 V168 M174 W182 I186 C207 V210 M270	L164-Y167 WeakPolarHBondContact O-CB 3.48Å; L164-Y167 PolarHBondContact O-N 3.45Å; L164-V168 HydrophobicContact CD1-CG2 4.12Å; L164-V168 HydrophobicContact CG-CG2 4.41Å; L164-V168 VanDerWaalsContact O-CG2 3.31Å; L164-V168 WeakPolarHBondContact O-CG2 3.47Å; L164-V168 PolarHBondContact O-N 2.89Å; L164-M174 HydrophobicContact CD1-CE 4.07Å; L164-W182 HydrophobicContact CD1-CE3 3.51Å; L164-W182 HydrophobicContact CD1-CZ3 3.64Å; L164-I186 HydrophobicContact CD2-CD1 4.18Å; L164-C207 HydrophobicContact CB-CB 4.22Å; L164-C207 HydrophobicContact CD2-CB 4.32Å; L164-C207 HydrophobicContact CG-CB 4.16Å; L164-C207 PolarHBondContact N-O 3.42Å; L164-V210 HydrophobicContact CB-CB 4.06Å; L164-V210 HydrophobicContact CB-CG1 4.14Å; L164-V210 WeakPolarHBondContact CB-O 3.5Å; L164-V210 HydrophobicContact CD2-CB 4.1Å; L164-V210 HydrophobicContact CD2-CG1 3.97Å; L164-V210 PolarHBondContact N-O 3.01Å; L164-M270 HydrophobicContact CD1-CG 4.1Å; L164-M270 HydrophobicContact CD1-SD 3.82Å; L164-M270 HydrophobicContact CD2-CE 4.19Å; L164-M270 HydrophobicContact CD2-CG 4.14Å; L164-M270 HydrophobicContact CD2-SD 3.78Å; L164-M270 HydrophobicContact CG-CG 4.31Å; L164-M270 HydrophobicContact CG-SD 4.28Å
165	K	92.9	Very high	90.4	Very high	35 Å²	35	66.1 Å²	66.1	15%	0.152	32%	0.319	C	S	.	.	H	α-helix	trans	-63.6	-42.9	174.3	-169.9	179.4	-161.3	169.6	0	112.6	T163 Y167 V168 R169 C207 D208	T163-K165 PolarHBondContact O-N 3.11Å; K165-Y167 VanDerWaalsContact C-N 3.25Å; K165-Y167 PolarHBondContact O-N 2.86Å; K165-V168 PolarHBondContact O-N 2.94Å; K165-R169 WeakPolarHBondContact O-CB 3.32Å; K165-R169 VanDerWaalsContact O-CG 3.31Å; K165-R169 WeakPolarHBondContact O-CG 3.49Å; K165-R169 PolarHBondContact O-N 3.39Å; K165-C207 HydrophobicContact CB-CB 3.76Å; K165-C207 WeakPolarHBondContact CB-O 3.32Å; K165-C207 PolarHBondContact N-O 3.37Å; K165-D208 HydrophobicContact CD-CB 4.47Å; K165-D208 WeakPolarHBondContact CD-OD1 3.4Å; K165-D208 WeakPolarHBondContact CD-OD2 3.29Å; K165-D208 WeakPolarHBondContact CE-OD1 3.44Å; K165-D208 IonicContact NZ-OD1 3.38Å; K165-D208 PolarHBondContact NZ-OD1 3.36Å; K165-D208 IonicContact NZ-OD2 3.63Å; K165-D208 PolarHBondContact NZ-OD2 2.65Å
166	T	92.3	Very high	90.2	Very high	55 Å²	55	69.9 Å²	69.9	34%	0.337	34%	0.338	S	S	.	.	H	α-helix	trans	-63.9	-34	175	62.9	0	0	0	0	111.8	T163 R170	T163-T166 PolarHBondContact N-OG1 3.14Å; T163-T166 VanDerWaalsContact N-OG1 3.16Å; T163-T166 PolarHBondContact O-N 3.17Å; T163-T166 PolarHBondContact O-OG1 2.77Å; T163-T166 PolarHBondContact OG1-N 3.25Å; T166-R170 WeakPolarHBondContact O-CB 3.32Å; T166-R170 VanDerWaalsContact O-CG 3.23Å; T166-R170 WeakPolarHBondContact O-CG 3.42Å; T166-R170 PolarHBondContact O-N 2.88Å
167	Y	93	Very high	90	Very high	65 Å²	65	76.4 Å²	76.4	26%	0.255	36%	0.364	S	S	.	.	H	α-helix	trans	-68.4	-51.5	173.2	-172.2	-81.2	0	0	0	112.2	T163 L164 K165 R169 R170 F171 M174 L178 W182 I212	T163-Y167 PolarHBondContact O-N 3.04Å; L164-Y167 WeakPolarHBondContact O-CB 3.48Å; L164-Y167 PolarHBondContact O-N 3.45Å; K165-Y167 VanDerWaalsContact C-N 3.25Å; K165-Y167 PolarHBondContact O-N 2.86Å; Y167-R169 PolarHBondContact O-N 3.33Å; Y167-R170 PolarHBondContact O-N 3.2Å; Y167-F171 HydrophobicContact CD1-CB 4.29Å; Y167-F171 HydrophobicContact CD1-CD2 4.16Å; Y167-F171 AromaticContact CD2-CD2 3.46Å; Y167-F171 HydrophobicContact CD2-CD2 3.46Å; Y167-F171 VanDerWaalsContact CD2-CD2 3.46Å; Y167-F171 AromaticContact CD2-CE2 3.83Å; Y167-F171 HydrophobicContact CD2-CE2 3.83Å; Y167-F171 HydrophobicContact CD2-CG 4.5Å; Y167-F171 HydrophobicContact CE1-CB 3.86Å; Y167-F171 HydrophobicContact CE1-CD2 4.13Å; Y167-F171 HydrophobicContact CE1-CG 4.35Å; Y167-F171 AromaticContact CE2-CD2 3.42Å; Y167-F171 HydrophobicContact CE2-CD2 3.42Å; Y167-F171 VanDerWaalsContact CE2-CD2 3.42Å; Y167-F171 AromaticContact CE2-CE2 3.84Å; Y167-F171 HydrophobicContact CE2-CE2 3.84Å; Y167-F171 HydrophobicContact CE2-CG 4.14Å; Y167-F171 AromaticContact CG-CD2 3.83Å; Y167-F171 HydrophobicContact CG-CD2 3.83Å; Y167-F171 AromaticContact CZ-CD2 3.77Å; Y167-F171 PolarHBondContact O-N 3.36Å; Y167-M174 HydrophobicContact CD1-CE 3.65Å; Y167-M174 HydrophobicContact CE1-CE 3.78Å; Y167-L178 HydrophobicContact CE1-CD2 3.85Å; Y167-L178 VanDerWaalsContact OH-CD2 3.31Å; Y167-L178 WeakPolarHBondContact OH-CD2 3.49Å; Y167-W182 AromaticContact CD1-CH2 3.87Å; Y167-W182 HydrophobicContact CD1-CH2 3.87Å; Y167-W182 AromaticContact CD1-CZ3 3.6Å; Y167-W182 HydrophobicContact CD1-CZ3 3.6Å; Y167-W182 AromaticContact CD2-CH2 3.82Å; Y167-W182 HydrophobicContact CD2-CH2 3.82Å; Y167-W182 HydrophobicContact CD2-CZ3 4.36Å; Y167-W182 AromaticContact CE1-CH2 3.89Å; Y167-W182 HydrophobicContact CE1-CH2 3.89Å; Y167-W182 AromaticContact CE1-CZ3 3.82Å; Y167-W182 HydrophobicContact CE1-CZ3 3.82Å; Y167-W182 AromaticContact CE2-CH2 3.84Å; Y167-W182 HydrophobicContact CE2-CH2 3.84Å; Y167-W182 AromaticContact CG-CH2 3.84Å; Y167-W182 HydrophobicContact CG-CH2 3.84Å; Y167-W182 AromaticContact CG-CZ3 3.91Å; Y167-W182 HydrophobicContact CG-CZ3 3.91Å; Y167-W182 AromaticContact CZ-CH2 3.89Å; Y167-I212 VanDerWaalsContact CB-CD1 3.47Å; Y167-I212 HydrophobicContact CD2-CD1 3.86Å; Y167-I212 HydrophobicContact CG-CD1 3.83Å
168	V	92.6	Very high	89.9	Confident	0 Å²	0	76.6 Å²	76.6	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-62.7	-27.1	179	173.6	0	0	0	0	112.3	L164 K165 R172 M174 E269 M270	L164-V168 HydrophobicContact CD1-CG2 4.12Å; L164-V168 HydrophobicContact CG-CG2 4.41Å; L164-V168 VanDerWaalsContact O-CG2 3.31Å; L164-V168 WeakPolarHBondContact O-CG2 3.47Å; L164-V168 PolarHBondContact O-N 2.89Å; K165-V168 PolarHBondContact O-N 2.94Å; V168-R172 WeakPolarHBondContact O-CG 3.24Å; V168-R172 PolarHBondContact O-NE 3.43Å; V168-M174 HydrophobicContact CG2-CE 3.62Å; V168-E269 HydrophobicContact CG1-CG 4.23Å; V168-M270 HydrophobicContact CG2-CG 3.97Å
169	R	90.8	Very high	90	Very high	174 Å²	174	75.7 Å²	75.7	66%	0.657	36%	0.361	S	S	*	.	H	α-helix	trans	-76.4	-30.6	170.7	-74	-176.4	65.8	171.3	1.2	114	K165 Y167	K165-R169 WeakPolarHBondContact O-CB 3.32Å; K165-R169 VanDerWaalsContact O-CG 3.31Å; K165-R169 WeakPolarHBondContact O-CG 3.49Å; K165-R169 PolarHBondContact O-N 3.39Å; Y167-R169 PolarHBondContact O-N 3.33Å
170	R	89.7	Confident	90.1	Very high	192 Å²	192	76.6 Å²	76.6	73%	0.725	37%	0.365	S	S	*	.	H	α-helix	trans	-89.4	-37.1	-177.7	-74.7	173.6	177.6	-178.2	-0.1	113.7	T166 Y167	T166-R170 WeakPolarHBondContact O-CB 3.32Å; T166-R170 VanDerWaalsContact O-CG 3.23Å; T166-R170 WeakPolarHBondContact O-CG 3.42Å; T166-R170 PolarHBondContact O-N 2.88Å; Y167-R170 PolarHBondContact O-N 3.2Å
171	F	87.4	Confident	90.4	Very high	112 Å²	112	77.4 Å²	77.4	49%	0.491	36%	0.357	S	S	.	.	S	Bend	trans	-120	86.3	-168.8	-59.3	-71.8	0	0	0	111.2	Y167	Y167-F171 HydrophobicContact CD1-CB 4.29Å; Y167-F171 HydrophobicContact CD1-CD2 4.16Å; Y167-F171 AromaticContact CD2-CD2 3.46Å; Y167-F171 HydrophobicContact CD2-CD2 3.46Å; Y167-F171 VanDerWaalsContact CD2-CD2 3.46Å; Y167-F171 AromaticContact CD2-CE2 3.83Å; Y167-F171 HydrophobicContact CD2-CE2 3.83Å; Y167-F171 HydrophobicContact CD2-CG 4.5Å; Y167-F171 HydrophobicContact CE1-CB 3.86Å; Y167-F171 HydrophobicContact CE1-CD2 4.13Å; Y167-F171 HydrophobicContact CE1-CG 4.35Å; Y167-F171 AromaticContact CE2-CD2 3.42Å; Y167-F171 HydrophobicContact CE2-CD2 3.42Å; Y167-F171 VanDerWaalsContact CE2-CD2 3.42Å; Y167-F171 AromaticContact CE2-CE2 3.84Å; Y167-F171 HydrophobicContact CE2-CE2 3.84Å; Y167-F171 HydrophobicContact CE2-CG 4.14Å; Y167-F171 AromaticContact CG-CD2 3.83Å; Y167-F171 HydrophobicContact CG-CD2 3.83Å; Y167-F171 AromaticContact CZ-CD2 3.77Å; Y167-F171 PolarHBondContact O-N 3.36Å
172	R	86	Confident	90.8	Very high	143 Å²	143	75 Å²	75	54%	0.54	34%	0.339	S	S	.	.			trans	-115.6	138.7	-176.3	-61	-175.5	169.4	174.4	-9.8	111.3	V168 S273	V168-R172 WeakPolarHBondContact O-CG 3.24Å; V168-R172 PolarHBondContact O-NE 3.43Å; R172-S273 PolarHBondContact NE-O 2.92Å; R172-S273 PolarHBondContact NH2-O 3.32Å
173	P	84.9	Confident	91.1	Very high	117 Å²	117	73.8 Å²	73.8	76%	0.76	33%	0.327	S	S	*	.	S	Bend	cis	-74	152.4	-12.1	32.2	-35.2	0	0	0	112.1
174	M	89.2	Confident	91.2	Very high	21 Å²	21	74.6 Å²	74.6	10%	0.103	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-67.1	135.4	173.8	-179	174.3	-80.7	0	0	111.3	L164 Y167 V168 L176 L179 W182 M270	L164-M174 HydrophobicContact CD1-CE 4.07Å; Y167-M174 HydrophobicContact CD1-CE 3.65Å; Y167-M174 HydrophobicContact CE1-CE 3.78Å; V168-M174 HydrophobicContact CG2-CE 3.62Å; M174-L176 PolarHBondContact O-N 2.92Å; M174-L179 HydrophobicContact CG-CB 4.27Å; M174-L179 HydrophobicContact SD-CB 3.75Å; M174-L179 HydrophobicContact SD-CG 4.28Å; M174-W182 HydrophobicContact CE-CE3 3.8Å; M174-W182 HydrophobicContact CE-CZ3 3.64Å; M174-M270 HydrophobicContact CE-CG 4.12Å; M174-M270 HydrophobicContact CE-SD 4.29Å; M174-M270 HydrophobicContact SD-CB 3.9Å; M174-M270 HydrophobicContact SD-CG 3.92Å; M174-M270 HydrophobicContact SD-SD 3.92Å
175	K	88.4	Confident	91.3	Very high	170 Å²	170	76 Å²	76	74%	0.739	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-68.9	126.1	176.2	-65.8	176.7	-178.7	173.5	0	110.5	K177 L178 L179	K175-K177 VanDerWaalsContact C-N 3.29Å; K175-K177 PolarHBondContact O-N 2.8Å; K175-K177 VanDerWaalsContact O-N 3.11Å; K175-L178 HydrophobicContact CB-CB 4.48Å; K175-L178 WeakPolarHBondContact O-CA 2.98Å; K175-L178 VanDerWaalsContact O-CB 3.32Å; K175-L178 WeakPolarHBondContact O-CB 3.35Å; K175-L178 PolarHBondContact O-N 2.73Å; K175-L179 PolarHBondContact O-N 3.08Å
176	L	88.1	Confident	91.6	Very high	78 Å²	78	74.4 Å²	74.4	41%	0.408	33%	0.33	S	S	.	.	H	α-helix	trans	-52.5	-38.6	-174.2	-173.7	62.3	0	0	0	114.5	M174 L178 L179 Q180 L307 F333	M174-L176 PolarHBondContact O-N 2.92Å; L176-L178 VanDerWaalsContact C-N 3.29Å; L176-L178 PolarHBondContact O-N 2.89Å; L176-L179 PolarHBondContact O-N 3.41Å; L176-Q180 WeakPolarHBondContact O-CB 3.33Å; L176-Q180 PolarHBondContact O-N 3.26Å; L176-L307 HydrophobicContact CD1-CD2 3.95Å; L176-F333 HydrophobicContact CD1-CE2 3.93Å; L176-F333 HydrophobicContact CD1-CZ 3.89Å; L176-F333 HydrophobicContact CG-CE2 4.37Å
177	K	87.8	Confident	91.8	Very high	165 Å²	165	71.8 Å²	71.8	72%	0.717	31%	0.314	S	S	*	.	H	α-helix	trans	-65.9	-28	176.1	-68.8	-173.4	177.7	-177.9	0	113.7	K175 R181	K175-K177 VanDerWaalsContact C-N 3.29Å; K175-K177 PolarHBondContact O-N 2.8Å; K175-K177 VanDerWaalsContact O-N 3.11Å; K177-R181 WeakPolarHBondContact O-CB 3.45Å; K177-R181 PolarHBondContact O-N 2.89Å; K177-R181 VanDerWaalsContact O-N 3.13Å
178	L	90.7	Very high	92	Very high	37 Å²	37	73.4 Å²	73.4	19%	0.194	32%	0.322	C	S	.	.	H	α-helix	trans	-76.5	-45.3	175.8	-171.8	64.5	0	0	0	110.2	Y167 K175 L176 Q180 R181 W182	Y167-L178 HydrophobicContact CE1-CD2 3.85Å; Y167-L178 VanDerWaalsContact OH-CD2 3.31Å; Y167-L178 WeakPolarHBondContact OH-CD2 3.49Å; K175-L178 HydrophobicContact CB-CB 4.48Å; K175-L178 WeakPolarHBondContact O-CA 2.98Å; K175-L178 VanDerWaalsContact O-CB 3.32Å; K175-L178 WeakPolarHBondContact O-CB 3.35Å; K175-L178 PolarHBondContact O-N 2.73Å; L176-L178 VanDerWaalsContact C-N 3.29Å; L176-L178 PolarHBondContact O-N 2.89Å; L178-Q180 VanDerWaalsContact C-N 3.35Å; L178-Q180 PolarHBondContact O-N 2.85Å; L178-R181 PolarHBondContact O-N 3.33Å; L178-W182 HydrophobicContact CD1-CD2 3.98Å; L178-W182 HydrophobicContact CD1-CG 4.42Å; L178-W182 HydrophobicContact CD1-CH2 4.41Å; L178-W182 HydrophobicContact CD1-CZ2 3.8Å; L178-W182 HydrophobicContact CD2-CE3 4.32Å; L178-W182 HydrophobicContact CD2-CH2 3.85Å; L178-W182 HydrophobicContact CD2-CZ2 4.07Å; L178-W182 HydrophobicContact CD2-CZ3 3.99Å; L178-W182 HydrophobicContact CG-CD2 3.91Å; L178-W182 HydrophobicContact CG-CE3 4.04Å; L178-W182 HydrophobicContact CG-CH2 4.25Å; L178-W182 HydrophobicContact CG-CZ2 4.11Å; L178-W182 HydrophobicContact CG-CZ3 4.21Å; L178-W182 WeakPolarHBondContact O-CB 3.39Å; L178-W182 PolarHBondContact O-N 2.77Å
179	L	94	Very high	92.2	Very high	4 Å²	4	73.4 Å²	73.4	2%	0.021	32%	0.322	C	S	.	.	H	α-helix	trans	-53.3	-52.1	171.1	-171.9	164.6	0	0	0	110.4	M174 K175 L176 R181 W182 S183 M267 M270 A271 L307 F333	M174-L179 HydrophobicContact CG-CB 4.27Å; M174-L179 HydrophobicContact SD-CB 3.75Å; M174-L179 HydrophobicContact SD-CG 4.28Å; K175-L179 PolarHBondContact O-N 3.08Å; L176-L179 PolarHBondContact O-N 3.41Å; L179-R181 PolarHBondContact O-N 2.67Å; L179-W182 PolarHBondContact O-N 3.42Å; L179-S183 VanDerWaalsContact O-CB 3.29Å; L179-S183 WeakPolarHBondContact O-CB 3.3Å; L179-S183 PolarHBondContact O-N 2.77Å; L179-S183 PolarHBondContact O-OG 2.97Å; L179-M267 HydrophobicContact CD2-CE 4.09Å; L179-M267 HydrophobicContact CD2-CG 4.17Å; L179-M270 HydrophobicContact CD1-CB 3.8Å; L179-M270 HydrophobicContact CG-CB 3.88Å; L179-M270 HydrophobicContact CG-SD 4.38Å; L179-A271 HydrophobicContact CD1-CB 4.06Å; L179-L307 HydrophobicContact CD1-CD2 4.18Å; L179-L307 HydrophobicContact CD2-CD1 3.97Å; L179-F333 HydrophobicContact CD2-CE1 4.23Å; L179-F333 HydrophobicContact CD2-CZ 4.13Å
180	Q	92.6	Very high	92.5	Very high	37 Å²	37	65.1 Å²	65.1	17%	0.173	29%	0.291	C	S	.	.	H	α-helix	trans	-52.6	-50.1	175.5	-171.7	-166.5	8.6	0	0	112.4	L176 L178 L184 F333	L176-Q180 WeakPolarHBondContact O-CB 3.33Å; L176-Q180 PolarHBondContact O-N 3.26Å; L178-Q180 VanDerWaalsContact C-N 3.35Å; L178-Q180 PolarHBondContact O-N 2.85Å; Q180-L184 VanDerWaalsContact O-CB 3.29Å; Q180-L184 WeakPolarHBondContact O-CB 3.1Å; Q180-L184 PolarHBondContact O-N 2.92Å; Q180-F333 HydrophobicContact CB-CE1 4Å; Q180-F333 HydrophobicContact CB-CZ 4.02Å; Q180-F333 HydrophobicContact CG-CD1 4.33Å; Q180-F333 HydrophobicContact CG-CE1 4Å; Q180-F333 HydrophobicContact CG-CZ 4.26Å; Q180-F333 VanDerWaalsContact CG-O 3.3Å; Q180-F333 WeakPolarHBondContact CG-O 3.33Å; Q180-F333 PolarHBondContact NE2-O 3.41Å
181	R	92.3	Very high	92.8	Very high	116 Å²	116	59.5 Å²	59.5	44%	0.438	27%	0.273	S	S	.	.	H	α-helix	trans	-64.7	-42.4	179.6	170.6	174.1	158.1	147.1	-5.5	112.8	K177 L178 L179 Q185 T216 A217	K177-R181 WeakPolarHBondContact O-CB 3.45Å; K177-R181 PolarHBondContact O-N 2.89Å; K177-R181 VanDerWaalsContact O-N 3.13Å; L178-R181 PolarHBondContact O-N 3.33Å; L179-R181 PolarHBondContact O-N 2.67Å; R181-Q185 WeakPolarHBondContact O-CG 3.33Å; R181-Q185 PolarHBondContact O-N 3.47Å; R181-Q185 VanDerWaalsContact O-N 3.16Å; R181-T216 PolarHBondContact NH2-O 2.82Å; R181-A217 PolarHBondContact NE-O 3.47Å; R181-A217 PolarHBondContact NH2-O 3.01Å
182	W	96.1	Very high	93.2	Very high	5 Å²	5	55.6 Å²	55.6	2%	0.019	26%	0.256	C	S	.	.	H	α-helix	trans	-77.7	-41.6	-177.6	-72.6	-10.6	0	0	0	112.3	L164 Y167 M174 L178 L179 L184 Q185 I186 I212 A217 V219	L164-W182 HydrophobicContact CD1-CE3 3.51Å; L164-W182 HydrophobicContact CD1-CZ3 3.64Å; Y167-W182 AromaticContact CD1-CH2 3.87Å; Y167-W182 HydrophobicContact CD1-CH2 3.87Å; Y167-W182 AromaticContact CD1-CZ3 3.6Å; Y167-W182 HydrophobicContact CD1-CZ3 3.6Å; Y167-W182 AromaticContact CD2-CH2 3.82Å; Y167-W182 HydrophobicContact CD2-CH2 3.82Å; Y167-W182 HydrophobicContact CD2-CZ3 4.36Å; Y167-W182 AromaticContact CE1-CH2 3.89Å; Y167-W182 HydrophobicContact CE1-CH2 3.89Å; Y167-W182 AromaticContact CE1-CZ3 3.82Å; Y167-W182 HydrophobicContact CE1-CZ3 3.82Å; Y167-W182 AromaticContact CE2-CH2 3.84Å; Y167-W182 HydrophobicContact CE2-CH2 3.84Å; Y167-W182 AromaticContact CG-CH2 3.84Å; Y167-W182 HydrophobicContact CG-CH2 3.84Å; Y167-W182 AromaticContact CG-CZ3 3.91Å; Y167-W182 HydrophobicContact CG-CZ3 3.91Å; Y167-W182 AromaticContact CZ-CH2 3.89Å; M174-W182 HydrophobicContact CE-CE3 3.8Å; M174-W182 HydrophobicContact CE-CZ3 3.64Å; L178-W182 HydrophobicContact CD1-CD2 3.98Å; L178-W182 HydrophobicContact CD1-CG 4.42Å; L178-W182 HydrophobicContact CD1-CH2 4.41Å; L178-W182 HydrophobicContact CD1-CZ2 3.8Å; L178-W182 HydrophobicContact CD2-CE3 4.32Å; L178-W182 HydrophobicContact CD2-CH2 3.85Å; L178-W182 HydrophobicContact CD2-CZ2 4.07Å; L178-W182 HydrophobicContact CD2-CZ3 3.99Å; L178-W182 HydrophobicContact CG-CD2 3.91Å; L178-W182 HydrophobicContact CG-CE3 4.04Å; L178-W182 HydrophobicContact CG-CH2 4.25Å; L178-W182 HydrophobicContact CG-CZ2 4.11Å; L178-W182 HydrophobicContact CG-CZ3 4.21Å; L178-W182 WeakPolarHBondContact O-CB 3.39Å; L178-W182 PolarHBondContact O-N 2.77Å; L179-W182 PolarHBondContact O-N 3.42Å; W182-L184 VanDerWaalsContact C-N 3.31Å; W182-L184 PolarHBondContact O-N 3.17Å; W182-Q185 WeakPolarHBondContact O-CA 3.3Å; W182-Q185 WeakPolarHBondContact O-CB 3.4Å; W182-Q185 PolarHBondContact O-N 2.74Å; W182-I186 WeakPolarHBondContact O-CG1 3.35Å; W182-I186 PolarHBondContact O-N 2.96Å; W182-I212 HydrophobicContact CH2-CD1 3.54Å; W182-I212 HydrophobicContact CH2-CG1 3.98Å; W182-I212 HydrophobicContact CZ2-CD1 4.23Å; W182-I212 HydrophobicContact CZ2-CG1 4.2Å; W182-I212 HydrophobicContact CZ2-CG2 4.22Å; W182-I212 HydrophobicContact CZ3-CD1 3.95Å; W182-I212 HydrophobicContact CZ3-CG1 4.41Å; W182-A217 PolarHBondContact NE1-O 2.97Å; W182-A217 VanDerWaalsContact NE1-O 3.13Å; W182-V219 HydrophobicContact CB-CG1 4.11Å; W182-V219 HydrophobicContact CB-CG2 3.88Å; W182-V219 HydrophobicContact CD2-CG1 3.72Å; W182-V219 HydrophobicContact CE3-CG1 4.22Å; W182-V219 HydrophobicContact CG-CG1 3.67Å; W182-V219 HydrophobicContact CG-CG2 4.08Å; W182-V219 WeakPolarHBondContact O-CG2 3.33Å
183	S	97.1	Very high	93.5	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-57.6	-42.2	169.9	-76.9	0	0	0	0	111.9	L179 Q185 I186 L187 M267 M270	L179-S183 VanDerWaalsContact O-CB 3.29Å; L179-S183 WeakPolarHBondContact O-CB 3.3Å; L179-S183 PolarHBondContact O-N 2.77Å; L179-S183 PolarHBondContact O-OG 2.97Å; S183-Q185 VanDerWaalsContact C-N 3.29Å; S183-Q185 PolarHBondContact O-N 3.04Å; S183-I186 PolarHBondContact O-N 2.91Å; S183-L187 WeakPolarHBondContact O-CG 2.78Å; S183-L187 PolarHBondContact O-N 3Å; S183-M267 PolarHBondContact OG-SD 2.94Å; S183-M270 WeakPolarHBondContact OG-CE 3.42Å
184	L	95.6	Very high	93.9	Very high	40 Å²	40	44.5 Å²	44.5	21%	0.209	20%	0.2	C	C	.	.	H	α-helix	trans	-61.6	-35.5	173.5	178.7	56	0	0	0	112.9	Q180 W182 K188 L329 F334	Q180-L184 VanDerWaalsContact O-CB 3.29Å; Q180-L184 WeakPolarHBondContact O-CB 3.1Å; Q180-L184 PolarHBondContact O-N 2.92Å; W182-L184 VanDerWaalsContact C-N 3.31Å; W182-L184 PolarHBondContact O-N 3.17Å; L184-K188 WeakPolarHBondContact O-CG 3.46Å; L184-K188 PolarHBondContact O-N 3.44Å; L184-L329 HydrophobicContact CD1-CD2 3.56Å; L184-F334 HydrophobicContact CB-CD1 3.89Å; L184-F334 HydrophobicContact CB-CE1 4.38Å; L184-F334 HydrophobicContact CD1-CB 4.34Å
185	Q	96.2	Very high	94.1	Very high	31 Å²	31	46.3 Å²	46.3	15%	0.145	21%	0.214	C	C	.	.	H	α-helix	trans	-71.5	-38.6	176.7	-79	175.5	-10	0	0	112.1	N138 R181 W182 S183 K188 G189 S218 V219	N138-Q185 WeakPolarHBondContact CB-O 3.21Å; N138-Q185 WeakPolarHBondContact ND2-CB 3.48Å; N138-Q185 WeakPolarHBondContact ND2-CG 3.48Å; R181-Q185 WeakPolarHBondContact O-CG 3.33Å; R181-Q185 PolarHBondContact O-N 3.47Å; R181-Q185 VanDerWaalsContact O-N 3.16Å; W182-Q185 WeakPolarHBondContact O-CA 3.3Å; W182-Q185 WeakPolarHBondContact O-CB 3.4Å; W182-Q185 PolarHBondContact O-N 2.74Å; S183-Q185 VanDerWaalsContact C-N 3.29Å; S183-Q185 PolarHBondContact O-N 3.04Å; Q185-K188 PolarHBondContact O-N 2.67Å; Q185-G189 PolarHBondContact O-N 2.93Å; Q185-G189 VanDerWaalsContact O-N 3.07Å; Q185-S218 VanDerWaalsContact OE1-CA 3.25Å; Q185-V219 HydrophobicContact CB-CG2 3.54Å
186	I	98.1	Very high	94.1	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-62.8	-47	171.8	-60.8	162.8	0	0	0	110	L164 W182 S183 K188 G189 L190 L205 V210 V219 I221 F263 M270	L164-I186 HydrophobicContact CD2-CD1 4.18Å; W182-I186 WeakPolarHBondContact O-CG1 3.35Å; W182-I186 PolarHBondContact O-N 2.96Å; S183-I186 PolarHBondContact O-N 2.91Å; I186-K188 VanDerWaalsContact C-N 3.3Å; I186-K188 PolarHBondContact O-N 3.35Å; I186-G189 CarbonylContact O-C 3.55Å; I186-G189 WeakPolarHBondContact O-CA 3.49Å; I186-G189 PolarHBondContact O-N 3.23Å; I186-L190 HydrophobicContact CG2-CD1 4.32Å; I186-L190 HydrophobicContact CG2-CG 4.41Å; I186-L190 PolarHBondContact O-N 2.94Å; I186-L205 HydrophobicContact CG2-CD2 4.43Å; I186-V210 HydrophobicContact CD1-CG1 4.07Å; I186-V210 HydrophobicContact CD1-CG2 4.23Å; I186-V210 HydrophobicContact CG1-CG1 4.06Å; I186-V210 HydrophobicContact CG1-CG2 4.34Å; I186-V219 HydrophobicContact CG1-CG2 4.03Å; I186-I221 HydrophobicContact CG2-CD1 3.93Å; I186-I221 HydrophobicContact CG2-CG1 4.35Å; I186-F263 HydrophobicContact CB-CD2 4.23Å; I186-F263 HydrophobicContact CB-CE2 4.27Å; I186-F263 HydrophobicContact CG2-CD2 3.77Å; I186-F263 HydrophobicContact CG2-CE2 4.3Å; I186-M270 HydrophobicContact CD1-CE 4.27Å
187	L	97.9	Very high	93.9	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-58.5	-38.8	177.1	-71.8	170.1	0	0	0	113	S183 L190 H191 F263 V325 L328 L329 F334	S183-L187 WeakPolarHBondContact O-CG 2.78Å; S183-L187 PolarHBondContact O-N 3Å; L187-L190 PolarHBondContact O-N 2.88Å; L187-H191 WeakPolarHBondContact O-CB 3.42Å; L187-H191 PolarHBondContact O-N 3.25Å; L187-F263 HydrophobicContact CD1-CE1 4.26Å; L187-F263 HydrophobicContact CD1-CE2 4.3Å; L187-F263 HydrophobicContact CD1-CZ 3.71Å; L187-F263 HydrophobicContact CD2-CD1 4.04Å; L187-F263 HydrophobicContact CD2-CD2 4.22Å; L187-F263 HydrophobicContact CD2-CE1 3.78Å; L187-F263 HydrophobicContact CD2-CE2 3.96Å; L187-F263 HydrophobicContact CD2-CG 4.25Å; L187-F263 HydrophobicContact CD2-CZ 3.73Å; L187-F263 HydrophobicContact CG-CD2 4.36Å; L187-F263 HydrophobicContact CG-CE1 4.15Å; L187-F263 HydrophobicContact CG-CE2 3.7Å; L187-F263 HydrophobicContact CG-CZ 3.57Å; L187-V325 HydrophobicContact CB-CG1 4.37Å; L187-V325 HydrophobicContact CD2-CG1 4.12Å; L187-V325 VanDerWaalsContact O-CG1 3.31Å; L187-V325 WeakPolarHBondContact O-CG1 3.41Å; L187-L328 HydrophobicContact CD1-CB 3.82Å; L187-L328 HydrophobicContact CD2-CB 3.84Å; L187-L328 HydrophobicContact CD2-CD1 3.6Å; L187-L328 HydrophobicContact CD2-CG 4.36Å; L187-L328 HydrophobicContact CG-CB 4.49Å; L187-L329 HydrophobicContact CB-CD2 3.76Å; L187-L329 HydrophobicContact CB-CG 4.26Å; L187-F334 HydrophobicContact CD1-CD1 4.47Å; L187-F334 HydrophobicContact CD1-CD2 3.95Å; L187-F334 HydrophobicContact CD1-CE1 4.18Å; L187-F334 HydrophobicContact CD1-CE2 3.6Å; L187-F334 HydrophobicContact CD1-CG 4.35Å; L187-F334 HydrophobicContact CD1-CZ 3.7Å
188	K	96.8	Very high	93.8	Very high	98 Å²	98	39.3 Å²	39.3	43%	0.426	20%	0.199	S	C	.	.	H	α-helix	trans	-64.8	-38.8	172.9	-73.5	174.7	179.7	-174.5	0	112.3	H136 L184 Q185 I186 F192 L329	H136-K188 PolarHBondContact CE1-O 2.78Å; L184-K188 WeakPolarHBondContact O-CG 3.46Å; L184-K188 PolarHBondContact O-N 3.44Å; Q185-K188 PolarHBondContact O-N 2.67Å; I186-K188 VanDerWaalsContact C-N 3.3Å; I186-K188 PolarHBondContact O-N 3.35Å; K188-F192 PolarHBondContact O-N 3.31Å; K188-F192 VanDerWaalsContact O-N 3.09Å; K188-L329 HydrophobicContact CG-CD2 4.23Å
189	G	96.7	Very high	93.6	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-60.6	-49.5	172.2	0	0	0	0	0	112.6	Q185 I186 F192 L193	Q185-G189 PolarHBondContact O-N 2.93Å; Q185-G189 VanDerWaalsContact O-N 3.07Å; I186-G189 CarbonylContact O-C 3.55Å; I186-G189 WeakPolarHBondContact O-CA 3.49Å; I186-G189 PolarHBondContact O-N 3.23Å; G189-F192 WeakPolarHBondContact O-CB 3.38Å; G189-F192 PolarHBondContact O-N 3.04Å; G189-L193 WeakPolarHBondContact O-CG 3.28Å; G189-L193 PolarHBondContact O-N 3.2Å; G189-L193 VanDerWaalsContact O-N 3.14Å
190	L	96.6	Very high	93.3	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-63.1	-44	177.4	-64.5	-179.5	0	0	0	112.2	I186 L187 F192 L193 H194 L205 I221 D259 F263 V325	I186-L190 HydrophobicContact CG2-CD1 4.32Å; I186-L190 HydrophobicContact CG2-CG 4.41Å; I186-L190 PolarHBondContact O-N 2.94Å; L187-L190 PolarHBondContact O-N 2.88Å; L190-F192 PolarHBondContact O-N 2.93Å; L190-L193 PolarHBondContact O-N 3.14Å; L190-L193 VanDerWaalsContact O-N 3.08Å; L190-H194 WeakPolarHBondContact O-CB 3.34Å; L190-H194 VanDerWaalsContact O-CG 3.3Å; L190-H194 PolarHBondContact O-N 3.21Å; L190-L205 HydrophobicContact CD1-CD2 3.88Å; L190-L205 HydrophobicContact CD2-CD2 4.11Å; L190-L205 HydrophobicContact CG-CD2 4.47Å; L190-I221 HydrophobicContact CD2-CD1 3.94Å; L190-I221 HydrophobicContact CG-CD1 4.07Å; L190-D259 HydrophobicContact CD1-CB 4.38Å; L190-D259 HydrophobicContact CD2-CB 4.11Å; L190-F263 HydrophobicContact CD1-CB 4.09Å; L190-V325 HydrophobicContact CB-CG2 4.26Å
191	H	96.4	Very high	93.1	Very high	75 Å²	75	37.5 Å²	37.5	35%	0.347	19%	0.192	S	C	.	.	H	α-helix	trans	-57.3	-38.9	175.2	-173.9	80.4	0	0	0	111.9	L187 S195 V325 Q326 L329	L187-H191 WeakPolarHBondContact O-CB 3.42Å; L187-H191 PolarHBondContact O-N 3.25Å; H191-S195 WeakPolarHBondContact O-CB 3.36Å; H191-S195 PolarHBondContact O-N 3.39Å; H191-S195 PolarHBondContact O-OG 3.15Å; H191-V325 HydrophobicContact CB-CG1 3.76Å; H191-Q326 PolarHBondContact CE1-OE1 2.9Å; H191-Q326 VanDerWaalsContact CE1-OE1 3.24Å; H191-L329 HydrophobicContact CB-CD1 3.99Å
192	F	95.9	Very high	92.9	Very high	29 Å²	29	32 Å²	32	13%	0.127	17%	0.172	C	C	.	.	H	α-helix	trans	-63.9	-44.1	174.7	175.5	-95.4	0	0	0	112.3	L134 H136 I139 K188 G189 L190 S195 R196	L134-F192 HydrophobicContact CB-CE1 4.22Å; L134-F192 HydrophobicContact CD2-CE1 4.02Å; H136-F192 HydrophobicContact CB-CB 4.36Å; H136-F192 HydrophobicContact CB-CD1 3.68Å; H136-F192 HydrophobicContact CB-CD2 3.86Å; H136-F192 HydrophobicContact CB-CE1 3.84Å; H136-F192 HydrophobicContact CB-CE2 4.01Å; H136-F192 HydrophobicContact CB-CG 3.69Å; H136-F192 HydrophobicContact CB-CZ 4Å; H136-F192 AromaticContact CD2-CD2 3.76Å; H136-F192 AromaticContact CD2-CG 3.85Å; H136-F192 AromaticContact CG-CD2 3.94Å; H136-F192 AromaticContact CG-CG 3.69Å; I139-F192 HydrophobicContact CG1-CD1 4.1Å; K188-F192 PolarHBondContact O-N 3.31Å; K188-F192 VanDerWaalsContact O-N 3.09Å; G189-F192 WeakPolarHBondContact O-CB 3.38Å; G189-F192 PolarHBondContact O-N 3.04Å; L190-F192 PolarHBondContact O-N 2.93Å; F192-S195 PolarHBondContact O-OG 3.3Å; F192-S195 VanDerWaalsContact O-OG 3.06Å; F192-R196 PolarHBondContact O-NE 2.83Å; F192-R196 PolarHBondContact O-NH2 3.38Å
193	L	92.9	Very high	92.4	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-67.9	-46.3	178.9	-64.4	173.2	0	0	0	112.6	L134 I139 G189 L190 S195 R196 I200 L224	L134-L193 HydrophobicContact CD1-CD2 4.01Å; I139-L193 HydrophobicContact CD1-CD1 3.93Å; I139-L193 HydrophobicContact CD1-CD2 4.26Å; I139-L193 HydrophobicContact CD1-CG 4.01Å; G189-L193 WeakPolarHBondContact O-CG 3.28Å; G189-L193 PolarHBondContact O-N 3.2Å; G189-L193 VanDerWaalsContact O-N 3.14Å; L190-L193 PolarHBondContact O-N 3.14Å; L190-L193 VanDerWaalsContact O-N 3.08Å; L193-S195 VanDerWaalsContact C-N 3.3Å; L193-S195 PolarHBondContact O-N 3.03Å; L193-R196 WeakPolarHBondContact O-CB 3.46Å; L193-R196 PolarHBondContact O-N 3.37Å; L193-I200 HydrophobicContact CB-CB 4.27Å; L193-I200 HydrophobicContact CD2-CB 4.38Å; L193-I200 HydrophobicContact CD2-CD1 4.15Å; L193-I200 HydrophobicContact CD2-CG2 4.29Å; L193-I200 PolarHBondContact O-N 3.41Å; L193-I200 VanDerWaalsContact O-N 3.16Å; L193-L224 HydrophobicContact CD1-CD2 3.85Å; L193-L224 HydrophobicContact CD2-CD1 4.09Å; L193-L224 HydrophobicContact CD2-CD2 4.41Å
194	H	92.9	Very high	91.8	Very high	28 Å²	28	33.3 Å²	33.3	13%	0.13	18%	0.178	C	C	.	.	H	α-helix	trans	-69.1	-26.1	-179.9	-62.1	169.3	0	0	0	112.8	L190 R196 I200 D259 V325	L190-H194 WeakPolarHBondContact O-CB 3.34Å; L190-H194 VanDerWaalsContact O-CG 3.3Å; L190-H194 PolarHBondContact O-N 3.21Å; H194-R196 VanDerWaalsContact C-N 3.33Å; H194-I200 PolarHBondContact CD2-O 3.08Å; H194-D259 IonicContact CD2-OD2 3.86Å; H194-D259 IonicContact CE1-OD2 2.68Å; H194-D259 IonicContact NE2-OD2 3.47Å; H194-D259 PolarHBondContact NE2-OD2 3.4Å; H194-V325 VanDerWaalsContact ND1-CG2 3.32Å; H194-V325 WeakPolarHBondContact ND1-CG2 3.17Å
195	S	92.4	Very high	91.7	Very high	58 Å²	58	31.5 Å²	31.5	41%	0.406	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	6	174.8	61.4	0	0	0	0	114.8	H191 F192 L193	H191-S195 WeakPolarHBondContact O-CB 3.36Å; H191-S195 PolarHBondContact O-N 3.39Å; H191-S195 PolarHBondContact O-OG 3.15Å; F192-S195 PolarHBondContact O-OG 3.3Å; F192-S195 VanDerWaalsContact O-OG 3.06Å; L193-S195 VanDerWaalsContact C-N 3.3Å; L193-S195 PolarHBondContact O-N 3.03Å
196	R	90	Very high	91.6	Very high	94 Å²	94	31.3 Å²	31.3	36%	0.355	17%	0.167	S	C	.	.	S	Bend	trans	-73.8	161.6	169.3	-62.5	-47	86	-172.5	-3.2	110.6	L134 F192 L193 H194 P198 P199 I200	L134-R196 HydrophobicContact CD2-CG 4.34Å; F192-R196 PolarHBondContact O-NE 2.83Å; F192-R196 PolarHBondContact O-NH2 3.38Å; L193-R196 WeakPolarHBondContact O-CB 3.46Å; L193-R196 PolarHBondContact O-N 3.37Å; H194-R196 VanDerWaalsContact C-N 3.33Å; R196-P198 VanDerWaalsContact C-C 3.47Å; R196-P198 CarbonylContact C-O 3.55Å; R196-P198 VanDerWaalsContact C-O 3.31Å; R196-P198 WeakPolarHBondContact CB-O 3.36Å; R196-P198 CarbonylContact O-C 3.37Å; R196-P199 WeakPolarHBondContact O-CA 3.49Å; R196-P199 VanDerWaalsContact O-N 3.11Å; R196-I200 HydrophobicContact CB-CD1 4.07Å; R196-I200 HydrophobicContact CB-CG1 4.16Å; R196-I200 HydrophobicContact CG-CD1 3.56Å; R196-I200 HydrophobicContact CG-CG1 4.18Å
197	S	84.1	Confident	91.5	Very high	126 Å²	126	31.2 Å²	31.2	88%	0.881	17%	0.167	S	C	*	.	S	Bend	trans	-121.9	109.7	174.1	-171.4	0	0	0	0	109.8
198	P	83.9	Confident	91.1	Very high	46 Å²	46	33.6 Å²	33.6	30%	0.299	18%	0.179	S	C	.	.	S	Bend	cis	-68.2	161.8	-7.8	31.8	-36	0	0	0	112.6	R196 L229	R196-P198 VanDerWaalsContact C-C 3.47Å; R196-P198 CarbonylContact C-O 3.55Å; R196-P198 VanDerWaalsContact C-O 3.31Å; R196-P198 WeakPolarHBondContact CB-O 3.36Å; R196-P198 CarbonylContact O-C 3.37Å; P198-L229 HydrophobicContact CG-CB 4.24Å; P198-L229 HydrophobicContact CG-CD1 3.9Å; P198-L229 HydrophobicContact CG-CD2 4.22Å; P198-L229 HydrophobicContact CG-CG 4.35Å
199	P	87.9	Confident	90.9	Very high	37 Å²	37	29.2 Å²	29.2	24%	0.24	16%	0.161	C	C	.	.	P	Polyproline II helix	trans	-59.5	141.4	175.3	-27.4	36.5	0	0	0	113.2	R196 K230	R196-P199 WeakPolarHBondContact O-CA 3.49Å; R196-P199 VanDerWaalsContact O-N 3.11Å; P199-K230 PolarHBondContact O-N 2.9Å; P199-K230 VanDerWaalsContact O-N 3.15Å
200	I	87	Confident	90.9	Very high	3 Å²	3	29.2 Å²	29.2	2%	0.015	16%	0.161	C	C	.	.	B	Isolated β-bridge	trans	-99.8	129.7	175	-56	164	0	0	0	108.2	M130 L134 L193 H194 R196 L229	M130-I200 HydrophobicContact CE-CD1 4.47Å; M130-I200 HydrophobicContact CE-CG1 4.4Å; M130-I200 HydrophobicContact CE-CG2 4.29Å; M130-I200 HydrophobicContact CG-CD1 4.22Å; M130-I200 HydrophobicContact SD-CD1 3.41Å; M130-I200 WeakPolarHBondContact SD-CD1 3.44Å; M130-I200 HydrophobicContact SD-CG1 3.9Å; M130-I200 HydrophobicContact SD-CG2 4.46Å; L134-I200 HydrophobicContact CD1-CD1 3.92Å; L134-I200 HydrophobicContact CD2-CD1 3.58Å; L134-I200 HydrophobicContact CG-CD1 4.36Å; L193-I200 HydrophobicContact CB-CB 4.27Å; L193-I200 HydrophobicContact CD2-CB 4.38Å; L193-I200 HydrophobicContact CD2-CD1 4.15Å; L193-I200 HydrophobicContact CD2-CG2 4.29Å; L193-I200 PolarHBondContact O-N 3.41Å; L193-I200 VanDerWaalsContact O-N 3.16Å; H194-I200 PolarHBondContact CD2-O 3.08Å; R196-I200 HydrophobicContact CB-CD1 4.07Å; R196-I200 HydrophobicContact CB-CG1 4.16Å; R196-I200 HydrophobicContact CG-CD1 3.56Å; R196-I200 HydrophobicContact CG-CG1 4.18Å; I200-L229 HydrophobicContact CG1-CD2 3.81Å
201	L	87.8	Confident	90.8	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.169	C	C	.	.			trans	-105.9	129.4	177.5	-54	-177.2	0	0	0	109.5	R203 S227 K230 Y254 E256	L201-R203 HydrophobicContact CB-CG 4Å; L201-S227 WeakPolarHBondContact O-CA 3.39Å; L201-S227 WeakPolarHBondContact O-CB 3.38Å; L201-K230 HydrophobicContact CD1-CB 4.47Å; L201-K230 HydrophobicContact CD1-CG 4.46Å; L201-Y254 HydrophobicContact CD1-CD2 4.27Å; L201-Y254 HydrophobicContact CD1-CE2 4.48Å; L201-E256 HydrophobicContact CD2-CB 4.09Å
202	H	88.9	Confident	90.7	Very high	1 Å²	1	28 Å²	28	1%	0.005	16%	0.155	C	C	.	.			trans	-71.1	-46.6	-176.1	-170.9	-64.3	0	0	0	112.4	D204 L205 I221 G222 L224 S227 D259	H202-D204 PolarHBondContact CE1-O 3.33Å; H202-D204 VanDerWaalsContact ND1-C 3.28Å; H202-D204 PolarHBondContact ND1-O 3.02Å; H202-D204 PolarHBondContact O-N 3.44Å; H202-L205 HydrophobicContact CB-CB 4.44Å; H202-L205 WeakPolarHBondContact ND1-CA 3.43Å; H202-L205 PolarHBondContact ND1-N 3.47Å; H202-L205 VanDerWaalsContact ND1-N 3.17Å; H202-I221 WeakPolarHBondContact CD2-CG2 3.4Å; H202-I221 WeakPolarHBondContact NE2-CG2 3.49Å; H202-G222 PolarHBondContact NE2-O 2.98Å; H202-G222 VanDerWaalsContact NE2-O 3.09Å; H202-L224 WeakPolarHBondContact CD2-CD2 3.47Å; H202-S227 WeakPolarHBondContact CA-OG 3.37Å; H202-S227 PolarHBondContact O-OG 3.31Å; H202-D259 WeakPolarHBondContact CB-OD1 3.45Å; H202-D259 PolarHBondContact N-OD1 3.17Å; H202-D259 VanDerWaalsContact N-OD1 3.16Å; H202-D259 PolarHBondContact N-OD2 3.45Å
203	R	85.4	Confident	90.3	Very high	15 Å²	15	28 Å²	28	6%	0.057	16%	0.156	C	C	.	.			trans	69.2	-44.3	175.9	-51.1	175.5	-166.5	-150.9	3.8	116.6	L201 T228 L229 M249 Y254 D259	L201-R203 HydrophobicContact CB-CG 4Å; R203-T228 PolarHBondContact NH1-OG1 3.38Å; R203-T228 PolarHBondContact NH2-O 3.46Å; R203-T228 PolarHBondContact NH2-OG1 3.32Å; R203-L229 PolarHBondContact NH2-O 3.07Å; R203-M249 HydrophobicContact CB-CE 4.28Å; R203-M249 WeakPolarHBondContact O-CE 3.41Å; R203-Y254 HydrophobicContact CG-CE2 4.11Å; R203-Y254 PolarHBondContact NH1-OH 3.29Å; R203-D259 PolarHBondContact N-OD1 2.67Å
204	D	85.6	Confident	89.5	Confident	18 Å²	18	29.4 Å²	29.4	10%	0.096	17%	0.171	C	C	.	.	S	Bend	trans	-106	48.9	174.4	-171.6	47.2	0	0	0	111.4	H202 K206 N209 T241	H202-D204 PolarHBondContact CE1-O 3.33Å; H202-D204 VanDerWaalsContact ND1-C 3.28Å; H202-D204 PolarHBondContact ND1-O 3.02Å; H202-D204 PolarHBondContact O-N 3.44Å; D204-K206 PolarHBondContact O-N 2.79Å; D204-K206 IonicContact OD1-NZ 2.69Å; D204-K206 PolarHBondContact OD1-NZ 2.89Å; D204-K206 WeakPolarHBondContact OD2-CE 3.32Å; D204-K206 IonicContact OD2-NZ 2.99Å; D204-K206 PolarHBondContact OD2-NZ 2.83Å; D204-N209 PolarHBondContact O-ND2 3.05Å; D204-N209 PolarHBondContact OD2-ND2 3.13Å; D204-T241 PolarHBondContact OD1-OG1 2.67Å
205	L	93.3	Very high	88.5	Confident	1 Å²	1	33.8 Å²	33.8	1%	0.005	20%	0.202	C	C	.	.			trans	-78.6	122.2	178.1	-178.3	71.2	0	0	0	109.7	I186 L190 H202 V210 I221 A262 F263	I186-L205 HydrophobicContact CG2-CD2 4.43Å; L190-L205 HydrophobicContact CD1-CD2 3.88Å; L190-L205 HydrophobicContact CD2-CD2 4.11Å; L190-L205 HydrophobicContact CG-CD2 4.47Å; H202-L205 HydrophobicContact CB-CB 4.44Å; H202-L205 WeakPolarHBondContact ND1-CA 3.43Å; H202-L205 PolarHBondContact ND1-N 3.47Å; H202-L205 VanDerWaalsContact ND1-N 3.17Å; L205-V210 HydrophobicContact CD1-CG2 4.04Å; L205-I221 HydrophobicContact CD1-CD1 4.43Å; L205-I221 HydrophobicContact CD1-CG2 3.8Å; L205-A262 HydrophobicContact CB-CB 3.84Å; L205-A262 HydrophobicContact CD2-CB 4.29Å; L205-A262 HydrophobicContact CG-CB 4.42Å; L205-A262 WeakPolarHBondContact O-CB 3.23Å; L205-F263 HydrophobicContact CD2-CB 4.04Å
206	K	93.4	Very high	87.6	Confident	27 Å²	27	34.5 Å²	34.5	12%	0.117	20%	0.204	C	C	.	.	S	Bend	trans	-160.2	165.6	-179.7	63.3	-164.7	-178.6	-145.8	0	110.8	D204 D208 N209 V210 T241 F244 C266	D204-K206 PolarHBondContact O-N 2.79Å; D204-K206 IonicContact OD1-NZ 2.69Å; D204-K206 PolarHBondContact OD1-NZ 2.89Å; D204-K206 WeakPolarHBondContact OD2-CE 3.32Å; D204-K206 IonicContact OD2-NZ 2.99Å; D204-K206 PolarHBondContact OD2-NZ 2.83Å; K206-D208 HydrophobicContact CD-CB 4.29Å; K206-D208 HydrophobicContact CG-CB 3.99Å; K206-D208 PolarHBondContact O-N 3.06Å; K206-D208 VanDerWaalsContact O-N 3.15Å; K206-N209 WeakPolarHBondContact CE-OD1 3.41Å; K206-N209 HydrophobicContact CG-CB 4.18Å; K206-N209 PolarHBondContact O-N 2.82Å; K206-V210 PolarHBondContact O-N 3.38Å; K206-T241 HydrophobicContact CD-CG2 4.16Å; K206-T241 VanDerWaalsContact CD-OG1 3.25Å; K206-T241 WeakPolarHBondContact CD-OG1 3.36Å; K206-T241 PolarHBondContact NZ-OG1 2.77Å; K206-F244 HydrophobicContact CB-CD1 3.85Å; K206-F244 HydrophobicContact CB-CD2 3.84Å; K206-F244 HydrophobicContact CB-CE1 3.93Å; K206-F244 HydrophobicContact CB-CE2 3.91Å; K206-F244 HydrophobicContact CB-CG 3.82Å; K206-F244 HydrophobicContact CB-CZ 3.97Å; K206-C266 VanDerWaalsContact CA-SG 3.52Å
207	C	94.9	Very high	87.3	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-16.1	179.7	-63.4	0	0	0	0	114.3	L164 K165 E269	L164-C207 HydrophobicContact CB-CB 4.22Å; L164-C207 HydrophobicContact CD2-CB 4.32Å; L164-C207 HydrophobicContact CG-CB 4.16Å; L164-C207 PolarHBondContact N-O 3.42Å; K165-C207 HydrophobicContact CB-CB 3.76Å; K165-C207 WeakPolarHBondContact CB-O 3.32Å; K165-C207 PolarHBondContact N-O 3.37Å; C207-E269 WeakPolarHBondContact CB-OE2 3.38Å; C207-E269 PolarHBondContact SG-OE2 3.05Å
208	D	91.3	Very high	87.7	Confident	49 Å²	49	26.9 Å²	26.9	26%	0.262	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-37.1	167	-52.4	-99.3	0	0	0	112	T163 K165 K206	T163-D208 WeakPolarHBondContact CB-O 2.99Å; T163-D208 WeakPolarHBondContact CG2-O 3.47Å; K165-D208 HydrophobicContact CD-CB 4.47Å; K165-D208 WeakPolarHBondContact CD-OD1 3.4Å; K165-D208 WeakPolarHBondContact CD-OD2 3.29Å; K165-D208 WeakPolarHBondContact CE-OD1 3.44Å; K165-D208 IonicContact NZ-OD1 3.38Å; K165-D208 PolarHBondContact NZ-OD1 3.36Å; K165-D208 IonicContact NZ-OD2 3.63Å; K165-D208 PolarHBondContact NZ-OD2 2.65Å; K206-D208 HydrophobicContact CD-CB 4.29Å; K206-D208 HydrophobicContact CG-CB 3.99Å; K206-D208 PolarHBondContact O-N 3.06Å; K206-D208 VanDerWaalsContact O-N 3.15Å
209	N	92.4	Very high	88.3	Confident	6 Å²	6	24.8 Å²	24.8	3%	0.032	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-3.9	-170.9	-63.7	6.5	0	0	0	112.6	D204 K206 F211 G222 D223	D204-N209 PolarHBondContact O-ND2 3.05Å; D204-N209 PolarHBondContact OD2-ND2 3.13Å; K206-N209 WeakPolarHBondContact CE-OD1 3.41Å; K206-N209 HydrophobicContact CG-CB 4.18Å; K206-N209 PolarHBondContact O-N 2.82Å; N209-F211 VanDerWaalsContact O-CD2 3.3Å; N209-F211 WeakPolarHBondContact O-CD2 3.43Å; N209-F211 WeakPolarHBondContact O-CE2 3.26Å; N209-G222 PolarHBondContact O-N 3.27Å; N209-D223 HydrophobicContact CB-CB 4.13Å; N209-D223 PolarHBondContact OD1-OD2 3.28Å
210	V	95.7	Very high	88.6	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	117.4	168.9	178.9	0	0	0	0	108.7	T163 L164 I186 L205 K206 V219	T163-V210 CarbonylContact C-O 3.59Å; T163-V210 WeakPolarHBondContact CA-O 3.49Å; L164-V210 HydrophobicContact CB-CB 4.06Å; L164-V210 HydrophobicContact CB-CG1 4.14Å; L164-V210 WeakPolarHBondContact CB-O 3.5Å; L164-V210 HydrophobicContact CD2-CB 4.1Å; L164-V210 HydrophobicContact CD2-CG1 3.97Å; L164-V210 PolarHBondContact N-O 3.01Å; I186-V210 HydrophobicContact CD1-CG1 4.07Å; I186-V210 HydrophobicContact CD1-CG2 4.23Å; I186-V210 HydrophobicContact CG1-CG1 4.06Å; I186-V210 HydrophobicContact CG1-CG2 4.34Å; L205-V210 HydrophobicContact CD1-CG2 4.04Å; K206-V210 PolarHBondContact O-N 3.38Å; V210-V219 HydrophobicContact CG1-CB 3.76Å; V210-V219 HydrophobicContact CG1-CG1 4.04Å; V210-V219 HydrophobicContact CG1-CG2 4.34Å
211	F	94.8	Very high	89.1	Confident	40 Å²	40	24.2 Å²	24.2	18%	0.175	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	150.3	-174.8	-65.6	-92.7	0	0	0	111.9	V140 M159 G162 T163 N209 V219 K220	V140-F211 HydrophobicContact CG2-CB 4.42Å; V140-F211 HydrophobicContact CG2-CD2 3.97Å; V140-F211 HydrophobicContact CG2-CG 4.45Å; M159-F211 HydrophobicContact CB-CB 3.66Å; M159-F211 HydrophobicContact CB-CD1 3.69Å; M159-F211 HydrophobicContact CB-CG 3.92Å; M159-F211 HydrophobicContact CE-CB 3.71Å; M159-F211 HydrophobicContact CG-CB 3.58Å; M159-F211 HydrophobicContact CG-CD1 4.09Å; M159-F211 HydrophobicContact CG-CG 3.87Å; M159-F211 HydrophobicContact SD-CB 4.4Å; G162-F211 WeakPolarHBondContact O-CA 3.46Å; T163-F211 HydrophobicContact CG2-CD1 4.01Å; T163-F211 HydrophobicContact CG2-CE1 3.83Å; T163-F211 HydrophobicContact CG2-CZ 4.5Å; N209-F211 VanDerWaalsContact O-CD2 3.3Å; N209-F211 WeakPolarHBondContact O-CD2 3.43Å; N209-F211 WeakPolarHBondContact O-CE2 3.26Å; F211-V219 CarbonylContact O-C 3.57Å; F211-V219 WeakPolarHBondContact O-CA 3.17Å; F211-K220 PolarHBondContact N-O 3.33Å; F211-K220 PolarHBondContact O-N 3.35Å
212	I	93.4	Very high	89.2	Confident	11 Å²	11	24.4 Å²	24.4	6%	0.056	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	126.2	177.2	-63.2	160.6	0	0	0	109	S161 G162 Y167 W182 V219	S161-I212 WeakPolarHBondContact CB-O 3.41Å; G162-I212 PolarHBondContact O-N 2.64Å; Y167-I212 VanDerWaalsContact CB-CD1 3.47Å; Y167-I212 HydrophobicContact CD2-CD1 3.86Å; Y167-I212 HydrophobicContact CG-CD1 3.83Å; W182-I212 HydrophobicContact CH2-CD1 3.54Å; W182-I212 HydrophobicContact CH2-CG1 3.98Å; W182-I212 HydrophobicContact CZ2-CD1 4.23Å; W182-I212 HydrophobicContact CZ2-CG1 4.2Å; W182-I212 HydrophobicContact CZ2-CG2 4.22Å; W182-I212 HydrophobicContact CZ3-CD1 3.95Å; W182-I212 HydrophobicContact CZ3-CG1 4.41Å; I212-V219 HydrophobicContact CG1-CG1 3.96Å
213	N	87.8	Confident	88.7	Confident	27 Å²	27	26.9 Å²	26.9	14%	0.144	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	121	167.3	-167.8	31.9	0	0	0	109.7	M159 T216 A217 S218	M159-N213 HydrophobicContact CE-CB 3.88Å; N213-T216 PolarHBondContact ND2-OG1 3.47Å; N213-A217 WeakPolarHBondContact O-CA 3.32Å; N213-A217 PolarHBondContact O-N 3.02Å; N213-S218 WeakPolarHBondContact CB-O 3.43Å; N213-S218 PolarHBondContact N-O 2.73Å; N213-S218 PolarHBondContact O-N 3.4Å
214	G	76.7	Confident	87.9	Confident	31 Å²	31	26.8 Å²	26.8	32%	0.32	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-61.6	-176.9	0	0	0	0	0	113.4	S161 T216 A217	S161-G214 WeakPolarHBondContact OG-CA 3.34Å; S161-G214 PolarHBondContact OG-N 2.68Å; G214-T216 PolarHBondContact O-N 3.13Å; G214-T216 VanDerWaalsContact O-N 3.08Å; G214-A217 PolarHBondContact O-N 2.71Å
215	P	71.9	Confident	86.5	Confident	119 Å²	119	26.7 Å²	26.7	77%	0.773	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-27.8	-173.6	-28.6	36.3	0	0	0	115.4
216	T	74.6	Confident	84.8	Confident	73 Å²	73	30 Å²	30	45%	0.448	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	-3.5	-176.6	57.5	0	0	0	0	114.2	R181 N213 G214 S218	R181-T216 PolarHBondContact NH2-O 2.82Å; N213-T216 PolarHBondContact ND2-OG1 3.47Å; G214-T216 PolarHBondContact O-N 3.13Å; G214-T216 VanDerWaalsContact O-N 3.08Å; T216-S218 PolarHBondContact O-N 2.77Å; T216-S218 PolarHBondContact OG1-OG 3.24Å
217	A	83.3	Confident	83	Confident	46 Å²	46	28.8 Å²	28.8	38%	0.38	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	44.9	43.6	-172	0	0	0	0	0	113.1	R181 W182 N213 G214	R181-A217 PolarHBondContact NE-O 3.47Å; R181-A217 PolarHBondContact NH2-O 3.01Å; W182-A217 PolarHBondContact NE1-O 2.97Å; W182-A217 VanDerWaalsContact NE1-O 3.13Å; N213-A217 WeakPolarHBondContact O-CA 3.32Å; N213-A217 PolarHBondContact O-N 3.02Å; G214-A217 PolarHBondContact O-N 2.71Å
218	S	91.5	Very high	81.3	Confident	15 Å²	15	29.4 Å²	29.4	11%	0.105	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	143.2	-177.1	61.8	0	0	0	0	111.2	Q185 N213 T216	Q185-S218 VanDerWaalsContact OE1-CA 3.25Å; N213-S218 WeakPolarHBondContact CB-O 3.43Å; N213-S218 PolarHBondContact N-O 2.73Å; N213-S218 PolarHBondContact O-N 3.4Å; T216-S218 PolarHBondContact O-N 2.77Å; T216-S218 PolarHBondContact OG1-OG 3.24Å
219	V	96.4	Very high	79.4	Confident	1 Å²	1	29.3 Å²	29.3	1%	0.006	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	148.7	177.8	-68.5	0	0	0	0	113	N138 W182 Q185 I186 V210 F211 I212	N138-V219 PolarHBondContact ND2-O 2.88Å; W182-V219 HydrophobicContact CB-CG1 4.11Å; W182-V219 HydrophobicContact CB-CG2 3.88Å; W182-V219 HydrophobicContact CD2-CG1 3.72Å; W182-V219 HydrophobicContact CE3-CG1 4.22Å; W182-V219 HydrophobicContact CG-CG1 3.67Å; W182-V219 HydrophobicContact CG-CG2 4.08Å; W182-V219 WeakPolarHBondContact O-CG2 3.33Å; Q185-V219 HydrophobicContact CB-CG2 3.54Å; I186-V219 HydrophobicContact CG1-CG2 4.03Å; V210-V219 HydrophobicContact CG1-CB 3.76Å; V210-V219 HydrophobicContact CG1-CG1 4.04Å; V210-V219 HydrophobicContact CG1-CG2 4.34Å; F211-V219 CarbonylContact O-C 3.57Å; F211-V219 WeakPolarHBondContact O-CA 3.17Å; I212-V219 HydrophobicContact CG1-CG1 3.96Å
220	K	95.8	Very high	77.5	Confident	27 Å²	27	32.4 Å²	32.4	12%	0.117	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	133.6	174.6	-71.7	-175.1	166.6	-173.5	0	109.7	P137 N138 V140 E157 M159 F211	P137-K220 WeakPolarHBondContact O-CE 3.47Å; P137-K220 WeakPolarHBondContact O-CG 3.3Å; N138-K220 WeakPolarHBondContact O-CA 3.29Å; V140-K220 HydrophobicContact CG2-CB 3.7Å; E157-K220 IonicContact OE1-NZ 2.64Å; E157-K220 PolarHBondContact OE1-NZ 3.47Å; E157-K220 IonicContact OE2-NZ 3.01Å; E157-K220 PolarHBondContact OE2-NZ 2.95Å; M159-K220 HydrophobicContact CE-CB 4.01Å; M159-K220 HydrophobicContact CE-CD 4.01Å; M159-K220 HydrophobicContact CE-CG 4.24Å; M159-K220 HydrophobicContact SD-CD 4.02Å; F211-K220 PolarHBondContact N-O 3.33Å; F211-K220 PolarHBondContact O-N 3.35Å
221	I	95.5	Very high	75	Confident	1 Å²	1	41 Å²	41	1%	0.005	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	123.1	173.1	-48.8	176.1	0	0	0	108.2	N138 I139 V140 I186 L190 H202 L205	N138-I221 PolarHBondContact O-N 3.22Å; I139-I221 CarbonylContact C-O 3.46Å; I139-I221 WeakPolarHBondContact CA-O 3.4Å; I139-I221 HydrophobicContact CD1-CB 4Å; I139-I221 HydrophobicContact CD1-CD1 4.24Å; I139-I221 HydrophobicContact CD1-CG1 4.42Å; V140-I221 PolarHBondContact N-O 3.45Å; I186-I221 HydrophobicContact CG2-CD1 3.93Å; I186-I221 HydrophobicContact CG2-CG1 4.35Å; L190-I221 HydrophobicContact CD2-CD1 3.94Å; L190-I221 HydrophobicContact CG-CD1 4.07Å; H202-I221 WeakPolarHBondContact CD2-CG2 3.4Å; H202-I221 WeakPolarHBondContact NE2-CG2 3.49Å; L205-I221 HydrophobicContact CD1-CD1 4.43Å; L205-I221 HydrophobicContact CD1-CG2 3.8Å
222	G	89.8	Confident	72.8	Confident	4 Å²	4	40.7 Å²	40.7	4%	0.041	24%	0.237	C	C	.	.			trans	-111.2	-164.5	177.8	0	0	0	0	0	112.5	H202 N209 L224	H202-G222 PolarHBondContact NE2-O 2.98Å; H202-G222 VanDerWaalsContact NE2-O 3.09Å; N209-G222 PolarHBondContact O-N 3.27Å; G222-L224 PolarHBondContact O-N 2.89Å; G222-L224 VanDerWaalsContact O-N 3.12Å
223	D	79.4	Confident	70.7	Confident	53 Å²	53	40.7 Å²	40.7	28%	0.283	24%	0.239	S	C	.	.			trans	58.5	24.4	172.4	-70.5	-6.2	0	0	0	117.1	K92 N209 G225	K92-D223 IonicContact NZ-OD1 3.09Å; K92-D223 PolarHBondContact NZ-OD1 2.95Å; K92-D223 IonicContact NZ-OD2 2.69Å; K92-D223 PolarHBondContact NZ-OD2 3.43Å; N209-D223 HydrophobicContact CB-CB 4.13Å; N209-D223 PolarHBondContact OD1-OD2 3.28Å; D223-G225 PolarHBondContact O-N 2.98Å
224	L	69.5	Low	68.7	Low	14 Å²	14	46.8 Å²	46.8	7%	0.073	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-60.3	-2.8	172.5	-61.3	177.7	0	0	0	115.1	L131 L134 I139 L193 H202 G222 L226 S227	L131-L224 HydrophobicContact CD2-CB 3.55Å; L131-L224 HydrophobicContact CD2-CD1 4.21Å; L134-L224 HydrophobicContact CD1-CD1 3.77Å; I139-L224 HydrophobicContact CG2-CD1 3.61Å; L193-L224 HydrophobicContact CD1-CD2 3.85Å; L193-L224 HydrophobicContact CD2-CD1 4.09Å; L193-L224 HydrophobicContact CD2-CD2 4.41Å; H202-L224 WeakPolarHBondContact CD2-CD2 3.47Å; G222-L224 PolarHBondContact O-N 2.89Å; G222-L224 VanDerWaalsContact O-N 3.12Å; L224-L226 PolarHBondContact O-N 3.19Å; L224-S227 WeakPolarHBondContact CA-OG 3.38Å; L224-S227 VanDerWaalsContact O-CB 3.3Å; L224-S227 WeakPolarHBondContact O-CB 3.47Å; L224-S227 PolarHBondContact O-N 3.03Å; L224-S227 PolarHBondContact O-OG 2.92Å
225	G	55.8	Low	67.2	Low	15 Å²	15	46.2 Å²	46.2	16%	0.155	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-69.7	10.9	175.2	0	0	0	0	0	115.5	D223	D223-G225 PolarHBondContact O-N 2.98Å
226	L	56.4	Low	66.1	Low	72 Å²	72	49.3 Å²	49.3	38%	0.377	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-128.7	7.3	168.1	-63	174	0	0	0	111.9	L224 T228 I239	L224-L226 PolarHBondContact O-N 3.19Å; L226-T228 PolarHBondContact O-N 3.26Å; L226-I239 HydrophobicContact CB-CG2 4.49Å; L226-I239 HydrophobicContact CD1-CG2 4.11Å
227	S	57	Low	64.9	Low	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.257	C	S	.	.			trans	-93.6	97.8	-171.8	-60.5	0	0	0	0	111.6	L201 H202 L224	L201-S227 WeakPolarHBondContact O-CA 3.39Å; L201-S227 WeakPolarHBondContact O-CB 3.38Å; H202-S227 WeakPolarHBondContact CA-OG 3.37Å; H202-S227 PolarHBondContact O-OG 3.31Å; L224-S227 WeakPolarHBondContact CA-OG 3.38Å; L224-S227 VanDerWaalsContact O-CB 3.3Å; L224-S227 WeakPolarHBondContact O-CB 3.47Å; L224-S227 PolarHBondContact O-N 3.03Å; L224-S227 PolarHBondContact O-OG 2.92Å
228	T	57.8	Low	63.3	Low	13 Å²	13	52.3 Å²	52.3	8%	0.08	27%	0.273	C	S	.	.			trans	-88.5	153.4	-178.1	114.6	0	0	0	0	112.7	E127 R203 L226 A232	E127-T228 WeakPolarHBondContact OE1-CB 3.39Å; E127-T228 VanDerWaalsContact OE1-CG2 3.29Å; E127-T228 WeakPolarHBondContact OE1-CG2 3.23Å; R203-T228 PolarHBondContact NH1-OG1 3.38Å; R203-T228 PolarHBondContact NH2-O 3.46Å; R203-T228 PolarHBondContact NH2-OG1 3.32Å; L226-T228 PolarHBondContact O-N 3.26Å; T228-A232 PolarHBondContact OG1-O 3.32Å
229	L	51.5	Low	61.9	Low	47 Å²	47	55 Å²	55	25%	0.246	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-65.4	150.9	178.2	-57.8	179	0	0	0	111.8	M130 P198 I200 R203 K231 A232	M130-L229 HydrophobicContact CE-CD2 4.02Å; M130-L229 HydrophobicContact CG-CD2 4.21Å; P198-L229 HydrophobicContact CG-CB 4.24Å; P198-L229 HydrophobicContact CG-CD1 3.9Å; P198-L229 HydrophobicContact CG-CD2 4.22Å; P198-L229 HydrophobicContact CG-CG 4.35Å; I200-L229 HydrophobicContact CG1-CD2 3.81Å; R203-L229 PolarHBondContact NH2-O 3.07Å; L229-K231 PolarHBondContact O-N 3.47Å; L229-A232 PolarHBondContact O-N 3.08Å
230	K	52.6	Low	60.5	Low	72 Å²	72	56.3 Å²	56.3	31%	0.313	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-13.8	179.1	-166.7	169.6	-177.9	173.4	0	114.7	P199 L201 S233 E256	P199-K230 PolarHBondContact O-N 2.9Å; P199-K230 VanDerWaalsContact O-N 3.15Å; L201-K230 HydrophobicContact CD1-CB 4.47Å; L201-K230 HydrophobicContact CD1-CG 4.46Å; K230-S233 PolarHBondContact O-OG 3.12Å; K230-E256 WeakPolarHBondContact CD-OE2 3.37Å; K230-E256 WeakPolarHBondContact CE-OE2 3.44Å; K230-E256 IonicContact NZ-OE1 2.75Å; K230-E256 PolarHBondContact NZ-OE1 3.21Å; K230-E256 IonicContact NZ-OE2 2.74Å; K230-E256 PolarHBondContact NZ-OE2 2.88Å
231	K	44.1	Very low	59.9	Low	179 Å²	179	56.2 Å²	56.2	78%	0.778	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-16.1	173.2	-66.6	-173.8	177	-177.4	0	114.8	L229	L229-K231 PolarHBondContact O-N 3.47Å
232	A	47.6	Very low	59.4	Low	34 Å²	34	57.5 Å²	57.5	28%	0.281	31%	0.31	S	S	.	.	S	Bend	trans	-103.5	16.8	-179	0	0	0	0	0	112.2	T228 L229 F234	T228-A232 PolarHBondContact OG1-O 3.32Å; L229-A232 PolarHBondContact O-N 3.08Å; A232-F234 PolarHBondContact O-N 2.99Å
233	S	50.2	Low	59.5	Low	12 Å²	12	59 Å²	59	8%	0.084	32%	0.316	C	S	.	.			trans	-75.1	-18.4	-168.8	42.7	0	0	0	0	115.5	K230 A235	K230-S233 PolarHBondContact O-OG 3.12Å; S233-A235 PolarHBondContact O-N 2.86Å
234	F	45.7	Very low	60.2	Low	154 Å²	154	56.7 Å²	56.7	68%	0.675	30%	0.303	S	S	*	.			trans	-69.3	52.1	175	-59.7	-82.9	0	0	0	113.1	A232	A232-F234 PolarHBondContact O-N 2.99Å
235	A	44.4	Very low	61.2	Low	20 Å²	20	56.3 Å²	56.3	17%	0.165	30%	0.301	C	S	.	.			trans	-107.5	117.2	178.8	0	0	0	0	0	109.6	S233 S237	S233-A235 PolarHBondContact O-N 2.86Å; A235-S237 PolarHBondContact O-N 2.71Å
236	K	48.8	Very low	62.9	Low	183 Å²	183	55.6 Å²	55.6	80%	0.796	29%	0.294	S	S	*	.			trans	-82.6	40.8	-158.1	-140.7	176	-169.2	175	0	115	E252	K236-E252 WeakPolarHBondContact CA-OE1 3.45Å; K236-E252 WeakPolarHBondContact CG-OE1 3.32Å
237	S	49.1	Very low	64.6	Low	62 Å²	62	52.9 Å²	52.9	43%	0.434	28%	0.281	S	S	.	.	S	Bend	trans	-137.9	126.4	-166	54.9	0	0	0	0	111.8	A235 I239	A235-S237 PolarHBondContact O-N 2.71Å; S237-I239 VanDerWaalsContact C-N 3.3Å; S237-I239 PolarHBondContact O-N 3.5Å; S237-I239 WeakPolarHBondContact OG-CD1 3.4Å
238	V	50.6	Low	66.1	Low	120 Å²	120	53.9 Å²	53.9	73%	0.727	29%	0.285	S	S	*	.			trans	-69.8	85.4	175	-174.2	0	0	0	0	109.5	M245 Y250	V238-M245 HydrophobicContact CG1-CE 4.08Å; V238-Y250 HydrophobicContact CG1-CE1 4.45Å
239	I	61.9	Low	67.3	Low	72 Å²	72	54.1 Å²	54.1	37%	0.369	29%	0.286	S	S	.	.			trans	-100.7	116.8	175.3	-61.7	171.4	0	0	0	108	L226 S237	L226-I239 HydrophobicContact CB-CG2 4.49Å; L226-I239 HydrophobicContact CD1-CG2 4.11Å; S237-I239 VanDerWaalsContact C-N 3.3Å; S237-I239 PolarHBondContact O-N 3.5Å; S237-I239 WeakPolarHBondContact OG-CD1 3.4Å
240	G	67.7	Low	68.7	Low	29 Å²	29	54.6 Å²	54.6	30%	0.299	29%	0.285	S	S	.	.	S	Bend	trans	157.1	-179.9	174.2	0	0	0	0	0	112.6
241	T	82	Confident	69.7	Low	24 Å²	24	58 Å²	58	15%	0.147	30%	0.302	C	S	.	.			trans	-114.1	111	178.4	-51.5	0	0	0	0	106.4	D204 K206 E243 F244 M245 Y275	D204-T241 PolarHBondContact OD1-OG1 2.67Å; K206-T241 HydrophobicContact CD-CG2 4.16Å; K206-T241 VanDerWaalsContact CD-OG1 3.25Å; K206-T241 WeakPolarHBondContact CD-OG1 3.36Å; K206-T241 PolarHBondContact NZ-OG1 2.77Å; T241-E243 VanDerWaalsContact CG2-OE2 3.28Å; T241-E243 WeakPolarHBondContact CG2-OE2 3.17Å; T241-E243 PolarHBondContact O-N 3.17Å; T241-F244 HydrophobicContact CG2-CD2 4.03Å; T241-F244 HydrophobicContact CG2-CE2 4.45Å; T241-F244 PolarHBondContact O-N 3.06Å; T241-M245 WeakPolarHBondContact O-CG 3.3Å; T241-M245 PolarHBondContact O-N 3.45Å; T241-Y275 WeakPolarHBondContact CG2-OH 3.38Å
242	P	85.3	Confident	70.9	Confident	29 Å²	29	52.8 Å²	52.8	19%	0.188	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-22.9	-157.1	23	-34.3	0	0	0	114.3	F244 A283 I286	P242-F244 VanDerWaalsContact C-N 3.26Å; P242-F244 PolarHBondContact O-N 2.74Å; P242-A283 HydrophobicContact CB-CB 4.29Å; P242-A283 HydrophobicContact CG-CB 3.89Å; P242-I286 HydrophobicContact CB-CG2 4.26Å; P242-I286 HydrophobicContact CG-CD1 4.3Å; P242-I286 WeakPolarHBondContact O-CG2 3.31Å
243	E	92.1	Very high	72.2	Confident	34 Å²	34	59 Å²	59	16%	0.159	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-19.3	175.4	-54.4	86	169	0	0	113.6	T241 Y275 P276 Y277 I286	T241-E243 VanDerWaalsContact CG2-OE2 3.28Å; T241-E243 WeakPolarHBondContact CG2-OE2 3.17Å; T241-E243 PolarHBondContact O-N 3.17Å; E243-Y275 HydrophobicContact CB-CE1 4.12Å; E243-Y275 HydrophobicContact CG-CD1 4.33Å; E243-Y275 HydrophobicContact CG-CE1 3.59Å; E243-Y275 PolarHBondContact OE2-OH 3.39Å; E243-P276 HydrophobicContact CB-CB 4.46Å; E243-Y277 HydrophobicContact CB-CD2 4.46Å; E243-I286 HydrophobicContact CG-CD1 3.7Å
244	F	93.4	Very high	73.7	Confident	6 Å²	6	60.3 Å²	60.3	3%	0.026	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.1	-6.4	178.5	-61.6	-96.3	0	0	0	112.9	K206 T241 P242 Y261 A262 M265 Y275	K206-F244 HydrophobicContact CB-CD1 3.85Å; K206-F244 HydrophobicContact CB-CD2 3.84Å; K206-F244 HydrophobicContact CB-CE1 3.93Å; K206-F244 HydrophobicContact CB-CE2 3.91Å; K206-F244 HydrophobicContact CB-CG 3.82Å; K206-F244 HydrophobicContact CB-CZ 3.97Å; T241-F244 HydrophobicContact CG2-CD2 4.03Å; T241-F244 HydrophobicContact CG2-CE2 4.45Å; T241-F244 PolarHBondContact O-N 3.06Å; P242-F244 VanDerWaalsContact C-N 3.26Å; P242-F244 PolarHBondContact O-N 2.74Å; F244-Y261 WeakPolarHBondContact O-CD1 3.42Å; F244-A262 HydrophobicContact CB-CB 4.47Å; F244-A262 WeakPolarHBondContact O-CB 3.42Å; F244-M265 HydrophobicContact CD1-CB 3.59Å; F244-M265 HydrophobicContact CE1-CB 4Å; F244-M265 HydrophobicContact CG-CB 4.32Å; F244-Y275 AromaticContact CE2-CE2 3.64Å; F244-Y275 HydrophobicContact CE2-CE2 3.64Å; F244-Y275 AromaticContact CE2-CZ 3.83Å; F244-Y275 HydrophobicContact CZ-CE2 4.01Å
245	M	91.7	Very high	75.7	Confident	5 Å²	5	55.3 Å²	55.3	3%	0.025	29%	0.285	C	S	.	.			trans	-80.2	130.4	-177.6	-71.6	175.3	68.8	0	0	111.9	V238 T241 M249 Y250 Y261	V238-M245 HydrophobicContact CG1-CE 4.08Å; T241-M245 WeakPolarHBondContact O-CG 3.3Å; T241-M245 PolarHBondContact O-N 3.45Å; M245-M249 HydrophobicContact CB-SD 3.85Å; M245-M249 HydrophobicContact CE-CB 3.93Å; M245-M249 HydrophobicContact CE-CE 4.17Å; M245-M249 HydrophobicContact CG-CE 4.05Å; M245-M249 HydrophobicContact CG-SD 3.93Å; M245-Y250 HydrophobicContact CE-CD1 4.17Å; M245-Y250 HydrophobicContact CE-CE1 3.64Å; M245-Y250 HydrophobicContact SD-CE1 4.33Å; M245-Y261 VanDerWaalsContact O-CE1 3.23Å; M245-Y261 WeakPolarHBondContact O-CE1 3.43Å
246	A	92.1	Very high	77.9	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.291	C	S	.	.			trans	-71.1	151.3	172	0	0	0	0	0	111.2	E248 M249 V258 Y261	A246-E248 VanDerWaalsContact C-N 3.31Å; A246-E248 VanDerWaalsContact CB-OE2 3.3Å; A246-E248 WeakPolarHBondContact CB-OE2 3.5Å; A246-E248 PolarHBondContact O-N 3.08Å; A246-M249 HydrophobicContact CB-CG 4.21Å; A246-M249 HydrophobicContact CB-SD 4.42Å; A246-M249 PolarHBondContact N-SD 2.88Å; A246-M249 VanDerWaalsContact O-CB 3.3Å; A246-M249 WeakPolarHBondContact O-CB 3.43Å; A246-M249 PolarHBondContact O-N 3.05Å; A246-V258 HydrophobicContact CB-CB 4.12Å; A246-V258 HydrophobicContact CB-CG1 4.04Å; A246-Y261 HydrophobicContact CB-CD1 3.97Å; A246-Y261 HydrophobicContact CB-CD2 4.21Å; A246-Y261 HydrophobicContact CB-CG 3.73Å
247	P	91.1	Very high	80	Confident	16 Å²	16	49.3 Å²	49.3	10%	0.104	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-57.4	-38.7	-176.6	21.3	-32.4	0	0	0	113.6	M249 Y250 V290 T317	P247-M249 PolarHBondContact O-N 2.9Å; P247-Y250 VanDerWaalsContact O-CD2 3.29Å; P247-Y250 WeakPolarHBondContact O-CD2 3.41Å; P247-Y250 PolarHBondContact O-N 3.44Å; P247-V290 HydrophobicContact CB-CG1 4.03Å; P247-V290 HydrophobicContact CG-CG1 4.41Å; P247-T317 HydrophobicContact CG-CG2 3.99Å; P247-T317 WeakPolarHBondContact CG-O 3.38Å
248	E	88.4	Confident	82.1	Confident	21 Å²	21	46.4 Å²	46.4	10%	0.098	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-69.4	-13.8	179.7	70.9	-86.1	-156.4	0	0	113.9	A246 Y250 E251 V258 R322	A246-E248 VanDerWaalsContact C-N 3.31Å; A246-E248 VanDerWaalsContact CB-OE2 3.3Å; A246-E248 WeakPolarHBondContact CB-OE2 3.5Å; A246-E248 PolarHBondContact O-N 3.08Å; E248-Y250 PolarHBondContact O-N 3.22Å; E248-E251 PolarHBondContact O-N 3.13Å; E248-V258 HydrophobicContact CG-CG1 4.06Å; E248-V258 WeakPolarHBondContact OE1-CG1 3.31Å; E248-R322 IonicContact OE1-CZ 2.69Å; E248-R322 IonicContact OE1-NH1 2.77Å; E248-R322 PolarHBondContact OE1-NH1 2.86Å; E248-R322 IonicContact OE1-NH2 2.67Å; E248-R322 PolarHBondContact OE1-NH2 2.87Å; E248-R322 IonicContact OE2-CZ 2.73Å; E248-R322 IonicContact OE2-NH1 3.21Å; E248-R322 IonicContact OE2-NH2 2.7Å; E248-R322 PolarHBondContact OE2-NH2 2.99Å
249	M	84.2	Confident	84.3	Confident	18 Å²	18	40.7 Å²	40.7	9%	0.089	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-64.5	-22.9	173.6	-66.1	-178	70	0	0	112.4	R203 M245 A246 P247 E251 V258	R203-M249 HydrophobicContact CB-CE 4.28Å; R203-M249 WeakPolarHBondContact O-CE 3.41Å; M245-M249 HydrophobicContact CB-SD 3.85Å; M245-M249 HydrophobicContact CE-CB 3.93Å; M245-M249 HydrophobicContact CE-CE 4.17Å; M245-M249 HydrophobicContact CG-CE 4.05Å; M245-M249 HydrophobicContact CG-SD 3.93Å; A246-M249 HydrophobicContact CB-CG 4.21Å; A246-M249 HydrophobicContact CB-SD 4.42Å; A246-M249 PolarHBondContact N-SD 2.88Å; A246-M249 VanDerWaalsContact O-CB 3.3Å; A246-M249 WeakPolarHBondContact O-CB 3.43Å; A246-M249 PolarHBondContact O-N 3.05Å; P247-M249 PolarHBondContact O-N 2.9Å; M249-E251 VanDerWaalsContact C-N 3.31Å; M249-V258 HydrophobicContact CG-CB 4.02Å; M249-V258 HydrophobicContact CG-CG1 3.67Å; M249-V258 HydrophobicContact SD-CB 4.02Å; M249-V258 HydrophobicContact SD-CG1 4.35Å; M249-V258 HydrophobicContact SD-CG2 4.48Å
250	Y	79.6	Confident	86	Confident	56 Å²	56	37.5 Å²	37.5	22%	0.22	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-80.6	-10.7	174.8	-56.3	-69.7	0	0	0	113.1	V238 M245 P247 E248 Y287	V238-Y250 HydrophobicContact CG1-CE1 4.45Å; M245-Y250 HydrophobicContact CE-CD1 4.17Å; M245-Y250 HydrophobicContact CE-CE1 3.64Å; M245-Y250 HydrophobicContact SD-CE1 4.33Å; P247-Y250 VanDerWaalsContact O-CD2 3.29Å; P247-Y250 WeakPolarHBondContact O-CD2 3.41Å; P247-Y250 PolarHBondContact O-N 3.44Å; E248-Y250 PolarHBondContact O-N 3.22Å; Y250-Y287 AromaticContact CD1-CD2 3.98Å; Y250-Y287 HydrophobicContact CD1-CD2 3.98Å; Y250-Y287 HydrophobicContact CD1-CE2 4.04Å; Y250-Y287 AromaticContact CD2-CD2 3.71Å; Y250-Y287 HydrophobicContact CD2-CD2 3.71Å; Y250-Y287 AromaticContact CD2-CE2 3.71Å; Y250-Y287 HydrophobicContact CD2-CE2 3.71Å; Y250-Y287 AromaticContact CE1-CD2 3.95Å; Y250-Y287 HydrophobicContact CE1-CD2 3.95Å; Y250-Y287 HydrophobicContact CE1-CE2 4.48Å; Y250-Y287 AromaticContact CE2-CD2 3.71Å; Y250-Y287 HydrophobicContact CE2-CD2 3.71Å; Y250-Y287 HydrophobicContact CE2-CE2 4.21Å; Y250-Y287 AromaticContact CG-CD2 3.87Å; Y250-Y287 HydrophobicContact CG-CD2 3.87Å; Y250-Y287 AromaticContact CG-CE2 3.64Å; Y250-Y287 HydrophobicContact CG-CE2 3.64Å; Y250-Y287 AromaticContact CZ-CD2 3.84Å
251	E	73.6	Confident	87.4	Confident	145 Å²	145	36.4 Å²	36.4	68%	0.678	17%	0.173	S	C	*	.	G	3₁₀ helix	trans	-104	6.4	-178	-59	-171.1	-177.7	0	0	113.5	E248 M249 K253	E248-E251 PolarHBondContact O-N 3.13Å; M249-E251 VanDerWaalsContact C-N 3.31Å; E251-K253 PolarHBondContact O-N 3.13Å
252	E	68.9	Low	88.1	Confident	69 Å²	69	35.3 Å²	35.3	32%	0.322	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.5	-3.5	-179.3	-58.1	-176.2	177.2	0	0	116.1	K236	K236-E252 WeakPolarHBondContact CA-OE1 3.45Å; K236-E252 WeakPolarHBondContact CG-OE1 3.32Å
253	K	75.8	Confident	88.7	Confident	164 Å²	164	34 Å²	34	71%	0.713	16%	0.158	S	C	*	.			trans	-111.8	99	178.4	-66.2	176	-175.3	171	0	110.4	E251	E251-K253 PolarHBondContact O-N 3.13Å
254	Y	81.3	Confident	89	Confident	39 Å²	39	32.3 Å²	32.3	15%	0.153	15%	0.151	C	C	.	.			trans	-151.7	166.2	-176.1	54.9	-98.9	0	0	0	113.3	L201 R203 V258	L201-Y254 HydrophobicContact CD1-CD2 4.27Å; L201-Y254 HydrophobicContact CD1-CE2 4.48Å; R203-Y254 HydrophobicContact CG-CE2 4.11Å; R203-Y254 PolarHBondContact NH1-OH 3.29Å; Y254-V258 HydrophobicContact CD2-CG1 4.11Å; Y254-V258 HydrophobicContact CD2-CG2 4.36Å; Y254-V258 HydrophobicContact CG-CG1 4.08Å
255	D	87.8	Confident	89.2	Confident	50 Å²	50	32 Å²	32	27%	0.267	15%	0.149	S	C	.	.			trans	-139	-162.6	-173.6	71	2.9	0	0	0	112.6	A257 V258	D255-A257 PolarHBondContact O-N 3.39Å; D255-A257 VanDerWaalsContact O-N 3.07Å; D255-A257 WeakPolarHBondContact OD1-CB 3.39Å; D255-A257 PolarHBondContact OD1-N 3.4Å; D255-V258 WeakPolarHBondContact O-CG2 3.46Å; D255-V258 PolarHBondContact O-N 3.38Å
256	E	91.1	Very high	89.5	Confident	64 Å²	64	31.8 Å²	31.8	30%	0.299	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-20.1	175.8	47	-87.3	-161.5	0	0	115.2	L201 K230 V258 D259	L201-E256 HydrophobicContact CD2-CB 4.09Å; K230-E256 WeakPolarHBondContact CD-OE2 3.37Å; K230-E256 WeakPolarHBondContact CE-OE2 3.44Å; K230-E256 IonicContact NZ-OE1 2.75Å; K230-E256 PolarHBondContact NZ-OE1 3.21Å; K230-E256 IonicContact NZ-OE2 2.74Å; K230-E256 PolarHBondContact NZ-OE2 2.88Å; E256-V258 PolarHBondContact O-N 3.11Å; E256-D259 PolarHBondContact O-N 2.7Å
257	A	93.3	Very high	89.8	Confident	12 Å²	12	31.8 Å²	31.8	10%	0.099	15%	0.148	C	C	.	.	H	α-helix	trans	-67.5	-19.2	178.3	0	0	0	0	0	113.7	D255 I260 Y261 R322	D255-A257 PolarHBondContact O-N 3.39Å; D255-A257 VanDerWaalsContact O-N 3.07Å; D255-A257 WeakPolarHBondContact OD1-CB 3.39Å; D255-A257 PolarHBondContact OD1-N 3.4Å; A257-I260 WeakPolarHBondContact O-CB 3.47Å; A257-I260 PolarHBondContact O-N 3.3Å; A257-Y261 PolarHBondContact O-N 2.83Å; A257-Y261 VanDerWaalsContact O-N 3.16Å; A257-R322 VanDerWaalsContact C-NH1 3.35Å; A257-R322 PolarHBondContact O-NH1 3.07Å
258	V	93.3	Very high	90.1	Very high	1 Å²	1	31 Å²	31	1%	0.006	14%	0.143	C	C	.	.	H	α-helix	trans	-70.4	-38.1	175.7	-51.7	0	0	0	0	111.7	A246 E248 M249 Y254 D255 E256 I260 Y261 A262	A246-V258 HydrophobicContact CB-CB 4.12Å; A246-V258 HydrophobicContact CB-CG1 4.04Å; E248-V258 HydrophobicContact CG-CG1 4.06Å; E248-V258 WeakPolarHBondContact OE1-CG1 3.31Å; M249-V258 HydrophobicContact CG-CB 4.02Å; M249-V258 HydrophobicContact CG-CG1 3.67Å; M249-V258 HydrophobicContact SD-CB 4.02Å; M249-V258 HydrophobicContact SD-CG1 4.35Å; M249-V258 HydrophobicContact SD-CG2 4.48Å; Y254-V258 HydrophobicContact CD2-CG1 4.11Å; Y254-V258 HydrophobicContact CD2-CG2 4.36Å; Y254-V258 HydrophobicContact CG-CG1 4.08Å; D255-V258 WeakPolarHBondContact O-CG2 3.46Å; D255-V258 PolarHBondContact O-N 3.38Å; E256-V258 PolarHBondContact O-N 3.11Å; V258-I260 VanDerWaalsContact C-N 3.26Å; V258-I260 PolarHBondContact O-N 3.48Å; V258-Y261 PolarHBondContact O-N 3.48Å; V258-A262 WeakPolarHBondContact O-CB 3.32Å; V258-A262 PolarHBondContact O-N 2.69Å
259	D	95.2	Very high	90.5	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-69.9	-28.1	178.2	-64.9	-23.4	0	0	0	110.9	L190 H194 H202 R203 E256 F263	L190-D259 HydrophobicContact CD1-CB 4.38Å; L190-D259 HydrophobicContact CD2-CB 4.11Å; H194-D259 IonicContact CD2-OD2 3.86Å; H194-D259 IonicContact CE1-OD2 2.68Å; H194-D259 IonicContact NE2-OD2 3.47Å; H194-D259 PolarHBondContact NE2-OD2 3.4Å; H202-D259 WeakPolarHBondContact CB-OD1 3.45Å; H202-D259 PolarHBondContact N-OD1 3.17Å; H202-D259 VanDerWaalsContact N-OD1 3.16Å; H202-D259 PolarHBondContact N-OD2 3.45Å; R203-D259 PolarHBondContact N-OD1 2.67Å; E256-D259 PolarHBondContact O-N 2.7Å; D259-F263 VanDerWaalsContact O-CB 3.22Å; D259-F263 WeakPolarHBondContact O-CB 3.46Å; D259-F263 PolarHBondContact O-N 2.81Å
260	I	97.8	Very high	91.1	Very high	5 Å²	5	29.4 Å²	29.4	3%	0.026	14%	0.136	C	C	.	.	H	α-helix	trans	-66.2	-48.1	170.4	-58.7	-63.7	0	0	0	111.3	A257 V258 A262 F263 G264 C314 R322 F323 V325 L328	A257-I260 WeakPolarHBondContact O-CB 3.47Å; A257-I260 PolarHBondContact O-N 3.3Å; V258-I260 VanDerWaalsContact C-N 3.26Å; V258-I260 PolarHBondContact O-N 3.48Å; I260-A262 VanDerWaalsContact C-N 3.33Å; I260-A262 PolarHBondContact O-N 3.23Å; I260-F263 WeakPolarHBondContact O-CB 3.49Å; I260-F263 PolarHBondContact O-N 3.14Å; I260-G264 PolarHBondContact O-N 3.1Å; I260-C314 HydrophobicContact CG2-CB 3.94Å; I260-R322 HydrophobicContact CG2-CB 4.25Å; I260-F323 WeakPolarHBondContact CG1-O 3.15Å; I260-F323 WeakPolarHBondContact CG2-O 3.46Å; I260-V325 HydrophobicContact CD1-CB 4.41Å; I260-V325 HydrophobicContact CD1-CG2 3.57Å; I260-L328 HydrophobicContact CD1-CD1 4.07Å; I260-L328 HydrophobicContact CG2-CD1 4.38Å
261	Y	97.5	Very high	91.9	Very high	6 Å²	6	28.3 Å²	28.3	2%	0.024	14%	0.138	C	C	.	.	H	α-helix	trans	-59	-48.1	178.4	-177	-82.4	0	0	0	110.6	F244 M245 A246 A257 V258 F263 G264 M265 C314 I315	F244-Y261 WeakPolarHBondContact O-CD1 3.42Å; M245-Y261 VanDerWaalsContact O-CE1 3.23Å; M245-Y261 WeakPolarHBondContact O-CE1 3.43Å; A246-Y261 HydrophobicContact CB-CD1 3.97Å; A246-Y261 HydrophobicContact CB-CD2 4.21Å; A246-Y261 HydrophobicContact CB-CG 3.73Å; A257-Y261 PolarHBondContact O-N 2.83Å; A257-Y261 VanDerWaalsContact O-N 3.16Å; V258-Y261 PolarHBondContact O-N 3.48Å; Y261-F263 VanDerWaalsContact C-N 3.35Å; Y261-F263 PolarHBondContact O-N 3.45Å; Y261-G264 WeakPolarHBondContact O-CA 3.48Å; Y261-G264 PolarHBondContact O-N 2.69Å; Y261-G264 VanDerWaalsContact O-N 3.1Å; Y261-M265 HydrophobicContact CD1-CG 4.3Å; Y261-M265 HydrophobicContact CE1-CE 3.67Å; Y261-M265 HydrophobicContact CE1-CG 4.02Å; Y261-M265 HydrophobicContact CE2-CE 4.34Å; Y261-M265 VanDerWaalsContact CZ-CE 3.5Å; Y261-M265 PolarHBondContact O-N 2.78Å; Y261-M265 VanDerWaalsContact OH-CE 3.23Å; Y261-M265 WeakPolarHBondContact OH-CE 3.18Å; Y261-C314 WeakPolarHBondContact CA-O 3.46Å; Y261-I315 HydrophobicContact CD2-CB 4.21Å; Y261-I315 HydrophobicContact CE2-CB 4.02Å
262	A	97.1	Very high	92.9	Very high	2 Å²	2	22.6 Å²	22.6	2%	0.017	11%	0.113	C	C	.	.	H	α-helix	trans	-62.2	-38.6	176.5	0	0	0	0	0	112.7	L205 F244 V258 I260 M265 C266	L205-A262 HydrophobicContact CB-CB 3.84Å; L205-A262 HydrophobicContact CD2-CB 4.29Å; L205-A262 HydrophobicContact CG-CB 4.42Å; L205-A262 WeakPolarHBondContact O-CB 3.23Å; F244-A262 HydrophobicContact CB-CB 4.47Å; F244-A262 WeakPolarHBondContact O-CB 3.42Å; V258-A262 WeakPolarHBondContact O-CB 3.32Å; V258-A262 PolarHBondContact O-N 2.69Å; I260-A262 VanDerWaalsContact C-N 3.33Å; I260-A262 PolarHBondContact O-N 3.23Å; A262-M265 PolarHBondContact O-N 3.02Å; A262-C266 PolarHBondContact O-N 3.37Å; A262-C266 PolarHBondContact O-SG 3.44Å
263	F	98.4	Very high	94.1	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-62	-42.3	170.9	166.2	-96.7	0	0	0	112	I186 L187 L190 L205 D259 I260 Y261 M265 C266 M267 L328 F334	I186-F263 HydrophobicContact CB-CD2 4.23Å; I186-F263 HydrophobicContact CB-CE2 4.27Å; I186-F263 HydrophobicContact CG2-CD2 3.77Å; I186-F263 HydrophobicContact CG2-CE2 4.3Å; L187-F263 HydrophobicContact CD1-CE1 4.26Å; L187-F263 HydrophobicContact CD1-CE2 4.3Å; L187-F263 HydrophobicContact CD1-CZ 3.71Å; L187-F263 HydrophobicContact CD2-CD1 4.04Å; L187-F263 HydrophobicContact CD2-CD2 4.22Å; L187-F263 HydrophobicContact CD2-CE1 3.78Å; L187-F263 HydrophobicContact CD2-CE2 3.96Å; L187-F263 HydrophobicContact CD2-CG 4.25Å; L187-F263 HydrophobicContact CD2-CZ 3.73Å; L187-F263 HydrophobicContact CG-CD2 4.36Å; L187-F263 HydrophobicContact CG-CE1 4.15Å; L187-F263 HydrophobicContact CG-CE2 3.7Å; L187-F263 HydrophobicContact CG-CZ 3.57Å; L190-F263 HydrophobicContact CD1-CB 4.09Å; L205-F263 HydrophobicContact CD2-CB 4.04Å; D259-F263 VanDerWaalsContact O-CB 3.22Å; D259-F263 WeakPolarHBondContact O-CB 3.46Å; D259-F263 PolarHBondContact O-N 2.81Å; I260-F263 WeakPolarHBondContact O-CB 3.49Å; I260-F263 PolarHBondContact O-N 3.14Å; Y261-F263 VanDerWaalsContact C-N 3.35Å; Y261-F263 PolarHBondContact O-N 3.45Å; F263-M265 VanDerWaalsContact C-N 3.32Å; F263-M265 PolarHBondContact O-N 3.46Å; F263-C266 WeakPolarHBondContact O-CB 3.35Å; F263-C266 PolarHBondContact O-N 2.89Å; F263-M267 HydrophobicContact CE1-SD 3.84Å; F263-M267 HydrophobicContact CE2-SD 4.39Å; F263-M267 HydrophobicContact CZ-SD 3.52Å; F263-M267 VanDerWaalsContact CZ-SD 3.52Å; F263-M267 WeakPolarHBondContact O-CB 3.44Å; F263-M267 PolarHBondContact O-N 3.08Å; F263-L328 HydrophobicContact CD1-CD1 4.03Å; F263-L328 HydrophobicContact CE1-CD1 3.94Å; F263-F334 HydrophobicContact CZ-CZ 4.1Å
264	G	98	Very high	95	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-57.4	-43.4	173.9	0	0	0	0	0	112.4	I260 Y261 M267 L268	I260-G264 PolarHBondContact O-N 3.1Å; Y261-G264 WeakPolarHBondContact O-CA 3.48Å; Y261-G264 PolarHBondContact O-N 2.69Å; Y261-G264 VanDerWaalsContact O-N 3.1Å; G264-M267 PolarHBondContact O-N 3.06Å; G264-L268 WeakPolarHBondContact O-CB 3.47Å; G264-L268 PolarHBondContact O-N 2.78Å
265	M	98.1	Very high	95.6	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-68	-37.9	175.1	-66.6	-58.1	-174.9	0	0	113	F244 Y261 A262 F263 M267 L268 E269 P276 Y277 P296 I315	F244-M265 HydrophobicContact CD1-CB 3.59Å; F244-M265 HydrophobicContact CE1-CB 4Å; F244-M265 HydrophobicContact CG-CB 4.32Å; Y261-M265 HydrophobicContact CD1-CG 4.3Å; Y261-M265 HydrophobicContact CE1-CE 3.67Å; Y261-M265 HydrophobicContact CE1-CG 4.02Å; Y261-M265 HydrophobicContact CE2-CE 4.34Å; Y261-M265 VanDerWaalsContact CZ-CE 3.5Å; Y261-M265 PolarHBondContact O-N 2.78Å; Y261-M265 VanDerWaalsContact OH-CE 3.23Å; Y261-M265 WeakPolarHBondContact OH-CE 3.18Å; A262-M265 PolarHBondContact O-N 3.02Å; F263-M265 VanDerWaalsContact C-N 3.32Å; F263-M265 PolarHBondContact O-N 3.46Å; M265-M267 VanDerWaalsContact C-N 3.33Å; M265-M267 PolarHBondContact O-N 2.64Å; M265-L268 PolarHBondContact O-N 2.8Å; M265-L268 HydrophobicContact SD-CD2 4.04Å; M265-E269 PolarHBondContact O-N 3.07Å; M265-P276 HydrophobicContact CB-CG 4.28Å; M265-P276 HydrophobicContact SD-CB 4.05Å; M265-P276 HydrophobicContact SD-CG 4.37Å; M265-Y277 HydrophobicContact CE-CE2 3.82Å; M265-P296 HydrophobicContact CE-CG 3.9Å; M265-P296 HydrophobicContact SD-CG 3.99Å; M265-I315 HydrophobicContact CE-CB 4.13Å; M265-I315 HydrophobicContact CE-CD1 4.23Å; M265-I315 HydrophobicContact CE-CG2 3.9Å; M265-I315 HydrophobicContact CG-CG2 4.2Å; M265-I315 HydrophobicContact SD-CG2 4.01Å
266	C	97.9	Very high	96	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-61.9	-40.8	171.1	-64.4	0	0	0	0	112	K206 A262 F263 E269 M270	K206-C266 VanDerWaalsContact CA-SG 3.52Å; A262-C266 PolarHBondContact O-N 3.37Å; A262-C266 PolarHBondContact O-SG 3.44Å; F263-C266 WeakPolarHBondContact O-CB 3.35Å; F263-C266 PolarHBondContact O-N 2.89Å; C266-E269 PolarHBondContact O-N 2.79Å; C266-M270 WeakPolarHBondContact O-CG 3.46Å; C266-M270 PolarHBondContact O-N 3.14Å
267	M	97.6	Very high	96.3	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-70.4	-33.1	178.9	-168.9	147.4	165.7	0	0	111.8	L179 S183 F263 G264 M265 A271 L307 I310 I311 F333 F334	L179-M267 HydrophobicContact CD2-CE 4.09Å; L179-M267 HydrophobicContact CD2-CG 4.17Å; S183-M267 PolarHBondContact OG-SD 2.94Å; F263-M267 HydrophobicContact CE1-SD 3.84Å; F263-M267 HydrophobicContact CE2-SD 4.39Å; F263-M267 HydrophobicContact CZ-SD 3.52Å; F263-M267 VanDerWaalsContact CZ-SD 3.52Å; F263-M267 WeakPolarHBondContact O-CB 3.44Å; F263-M267 PolarHBondContact O-N 3.08Å; G264-M267 PolarHBondContact O-N 3.06Å; M265-M267 VanDerWaalsContact C-N 3.33Å; M265-M267 PolarHBondContact O-N 2.64Å; M267-A271 WeakPolarHBondContact O-CB 3.17Å; M267-A271 PolarHBondContact O-N 3.27Å; M267-L307 HydrophobicContact CE-CD1 3.28Å; M267-L307 HydrophobicContact CG-CD1 3.8Å; M267-L307 HydrophobicContact SD-CD1 4.38Å; M267-I310 HydrophobicContact CE-CB 4.16Å; M267-I310 HydrophobicContact CE-CD1 3.86Å; M267-I310 HydrophobicContact CE-CG2 3.66Å; M267-I310 HydrophobicContact SD-CG2 3.96Å; M267-I311 HydrophobicContact CB-CG1 4.16Å; M267-I311 HydrophobicContact CG-CD1 4.35Å; M267-I311 HydrophobicContact CG-CG1 4.01Å; M267-F333 HydrophobicContact CE-CD1 3.96Å; M267-F333 HydrophobicContact CE-CE1 3.59Å; M267-F333 HydrophobicContact CE-CZ 4.34Å; M267-F334 HydrophobicContact CE-CE1 4.4Å; M267-F334 HydrophobicContact CE-CE2 4.27Å; M267-F334 HydrophobicContact CE-CZ 3.62Å; M267-F334 HydrophobicContact SD-CZ 3.85Å
268	L	97.6	Very high	96.4	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-66.7	-43.9	170.1	178.3	60.4	0	0	0	112.7	G264 M265 A271 T272 P296 F299 V302 I311	G264-L268 WeakPolarHBondContact O-CB 3.47Å; G264-L268 PolarHBondContact O-N 2.78Å; M265-L268 PolarHBondContact O-N 2.8Å; M265-L268 HydrophobicContact SD-CD2 4.04Å; L268-A271 PolarHBondContact O-N 3.09Å; L268-T272 HydrophobicContact CD1-CG2 3.68Å; L268-T272 WeakPolarHBondContact O-CB 3.21Å; L268-T272 PolarHBondContact O-N 3.04Å; L268-T272 PolarHBondContact O-OG1 3.4Å; L268-P296 HydrophobicContact CD2-CB 4.07Å; L268-P296 HydrophobicContact CD2-CG 3.86Å; L268-F299 HydrophobicContact CD1-CB 4.32Å; L268-F299 HydrophobicContact CD2-CB 4.36Å; L268-V302 HydrophobicContact CD1-CG2 3.61Å; L268-I311 HydrophobicContact CB-CD1 4.24Å; L268-I311 HydrophobicContact CB-CG2 4.07Å; L268-I311 HydrophobicContact CD1-CD1 4.42Å
269	E	96.9	Very high	96.5	Very high	4 Å²	4	16.7 Å²	16.7	2%	0.019	9%	0.092	C	C	.	.	H	α-helix	trans	-62.4	-45.1	175	-172.5	177.7	-172.7	0	0	110.9	V168 C207 M265 C266 A271 S273 E274 P276	V168-E269 HydrophobicContact CG1-CG 4.23Å; C207-E269 WeakPolarHBondContact CB-OE2 3.38Å; C207-E269 PolarHBondContact SG-OE2 3.05Å; M265-E269 PolarHBondContact O-N 3.07Å; C266-E269 PolarHBondContact O-N 2.79Å; E269-A271 PolarHBondContact O-N 3.23Å; E269-S273 WeakPolarHBondContact O-CA 3.29Å; E269-S273 PolarHBondContact O-N 3.4Å; E269-E274 WeakPolarHBondContact CA-O 3.44Å; E269-P276 HydrophobicContact CB-CG 4.45Å
270	M	96.1	Very high	96.6	Very high	1 Å²	1	17.8 Å²	17.8	1%	0.005	10%	0.1	C	C	.	.	H	α-helix	trans	-61.6	-40.2	173.7	-75.9	-170.4	-76	0	0	113.1	L164 V168 M174 L179 S183 I186 C266	L164-M270 HydrophobicContact CD1-CG 4.1Å; L164-M270 HydrophobicContact CD1-SD 3.82Å; L164-M270 HydrophobicContact CD2-CE 4.19Å; L164-M270 HydrophobicContact CD2-CG 4.14Å; L164-M270 HydrophobicContact CD2-SD 3.78Å; L164-M270 HydrophobicContact CG-CG 4.31Å; L164-M270 HydrophobicContact CG-SD 4.28Å; V168-M270 HydrophobicContact CG2-CG 3.97Å; M174-M270 HydrophobicContact CE-CG 4.12Å; M174-M270 HydrophobicContact CE-SD 4.29Å; M174-M270 HydrophobicContact SD-CB 3.9Å; M174-M270 HydrophobicContact SD-CG 3.92Å; M174-M270 HydrophobicContact SD-SD 3.92Å; L179-M270 HydrophobicContact CD1-CB 3.8Å; L179-M270 HydrophobicContact CG-CB 3.88Å; L179-M270 HydrophobicContact CG-SD 4.38Å; S183-M270 WeakPolarHBondContact OG-CE 3.42Å; I186-M270 HydrophobicContact CD1-CE 4.27Å; C266-M270 WeakPolarHBondContact O-CG 3.46Å; C266-M270 PolarHBondContact O-N 3.14Å
271	A	95.8	Very high	96.4	Very high	33 Å²	33	25.6 Å²	25.6	27%	0.273	14%	0.136	S	C	.	.	H	α-helix	trans	-70.3	-44.1	-176.6	0	0	0	0	0	113	L179 M267 L268 E269 V302 L307 I311	L179-A271 HydrophobicContact CD1-CB 4.06Å; M267-A271 WeakPolarHBondContact O-CB 3.17Å; M267-A271 PolarHBondContact O-N 3.27Å; L268-A271 PolarHBondContact O-N 3.09Å; E269-A271 PolarHBondContact O-N 3.23Å; A271-V302 HydrophobicContact CB-CG2 4.47Å; A271-L307 HydrophobicContact CB-CD1 4.41Å; A271-L307 HydrophobicContact CB-CD2 3.71Å; A271-L307 HydrophobicContact CB-CG 4.18Å; A271-I311 HydrophobicContact CB-CD1 4.19Å
272	T	95.3	Very high	96.1	Very high	25 Å²	25	28.8 Å²	28.8	15%	0.153	15%	0.154	C	C	.	.	H	α-helix	trans	-90.6	-20.6	-176.7	59.9	0	0	0	0	112.7	L268 E274 N298 K301 V302	L268-T272 HydrophobicContact CD1-CG2 3.68Å; L268-T272 WeakPolarHBondContact O-CB 3.21Å; L268-T272 PolarHBondContact O-N 3.04Å; L268-T272 PolarHBondContact O-OG1 3.4Å; T272-E274 PolarHBondContact O-N 2.96Å; T272-E274 PolarHBondContact OG1-N 3.45Å; T272-E274 VanDerWaalsContact OG1-N 3.09Å; T272-E274 PolarHBondContact OG1-O 3.07Å; T272-N298 HydrophobicContact CG2-CB 4.14Å; T272-N298 VanDerWaalsContact CG2-O 3.29Å; T272-N298 WeakPolarHBondContact CG2-O 3.35Å; T272-N298 PolarHBondContact OG1-ND2 3.07Å; T272-K301 HydrophobicContact CG2-CB 4.37Å; T272-V302 HydrophobicContact CG2-CG2 4.01Å
273	S	94.1	Very high	95.7	Very high	9 Å²	9	31.4 Å²	31.4	6%	0.063	18%	0.175	C	C	.	.	S	Bend	trans	59.2	11.8	-163	-53	0	0	0	0	114.6	R172 E269	R172-S273 PolarHBondContact NE-O 2.92Å; R172-S273 PolarHBondContact NH2-O 3.32Å; E269-S273 WeakPolarHBondContact O-CA 3.29Å; E269-S273 PolarHBondContact O-N 3.4Å
274	E	93.9	Very high	95.3	Very high	63 Å²	63	33.7 Å²	33.7	29%	0.294	19%	0.194	S	C	.	.	S	Bend	trans	-111.2	146.7	178.6	-66	178.2	174	0	0	110.7	E269 T272 N298 K301	E269-E274 WeakPolarHBondContact CA-O 3.44Å; T272-E274 PolarHBondContact O-N 2.96Å; T272-E274 PolarHBondContact OG1-N 3.45Å; T272-E274 VanDerWaalsContact OG1-N 3.09Å; T272-E274 PolarHBondContact OG1-O 3.07Å; E274-N298 HydrophobicContact CB-CB 4.27Å; E274-N298 PolarHBondContact O-ND2 3.47Å; E274-N298 WeakPolarHBondContact OE2-CB 3.32Å; E274-K301 IonicContact OE1-NZ 3.44Å; E274-K301 PolarHBondContact OE1-NZ 3.37Å; E274-K301 WeakPolarHBondContact OE2-CD 3.2Å; E274-K301 WeakPolarHBondContact OE2-CE 3.48Å; E274-K301 IonicContact OE2-NZ 2.66Å; E274-K301 PolarHBondContact OE2-NZ 3.06Å
275	Y	94.4	Very high	95.1	Very high	59 Å²	59	36.2 Å²	36.2	23%	0.231	21%	0.206	C	C	.	.			trans	-72.9	132.7	179.1	-165.8	-109.5	0	0	0	110.1	T241 E243 F244 S278	T241-Y275 WeakPolarHBondContact CG2-OH 3.38Å; E243-Y275 HydrophobicContact CB-CE1 4.12Å; E243-Y275 HydrophobicContact CG-CD1 4.33Å; E243-Y275 HydrophobicContact CG-CE1 3.59Å; E243-Y275 PolarHBondContact OE2-OH 3.39Å; F244-Y275 AromaticContact CE2-CE2 3.64Å; F244-Y275 HydrophobicContact CE2-CE2 3.64Å; F244-Y275 AromaticContact CE2-CZ 3.83Å; F244-Y275 HydrophobicContact CZ-CE2 4.01Å; Y275-S278 VanDerWaalsContact O-CB 3.27Å; Y275-S278 WeakPolarHBondContact O-CB 3.08Å; Y275-S278 PolarHBondContact O-N 3.3Å; Y275-S278 PolarHBondContact O-OG 2.64Å
276	P	96.9	Very high	95	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	145.7	178.5	-24.1	34.1	0	0	0	112.3	E243 M265 E269 S278 P296	E243-P276 HydrophobicContact CB-CB 4.46Å; M265-P276 HydrophobicContact CB-CG 4.28Å; M265-P276 HydrophobicContact SD-CB 4.05Å; M265-P276 HydrophobicContact SD-CG 4.37Å; E269-P276 HydrophobicContact CB-CG 4.45Å; P276-S278 PolarHBondContact O-N 2.99Å; P276-S278 VanDerWaalsContact O-N 3.12Å; P276-P296 HydrophobicContact CB-CG 4.3Å
277	Y	97.3	Very high	94.6	Very high	6 Å²	6	41.5 Å²	41.5	2%	0.024	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.4	26	-177.3	-61.7	-68.3	0	0	0	115.7	E243 M265 E279 C280 I286 K289 V290 I294 P296	E243-Y277 HydrophobicContact CB-CD2 4.46Å; M265-Y277 HydrophobicContact CE-CE2 3.82Å; Y277-E279 VanDerWaalsContact CA-OE2 3.27Å; Y277-E279 WeakPolarHBondContact CA-OE2 3.49Å; Y277-E279 WeakPolarHBondContact CD1-OE1 3.29Å; Y277-E279 PolarHBondContact O-N 2.97Å; Y277-E279 VanDerWaalsContact O-N 3.11Å; Y277-C280 VanDerWaalsContact O-CB 3.3Å; Y277-C280 WeakPolarHBondContact O-CB 3.41Å; Y277-C280 PolarHBondContact O-N 3Å; Y277-I286 HydrophobicContact CD2-CG2 3.83Å; Y277-I286 HydrophobicContact CE2-CG2 4.28Å; Y277-I286 HydrophobicContact CG-CG1 4.49Å; Y277-I286 HydrophobicContact CG-CG2 4.18Å; Y277-K289 HydrophobicContact CD1-CB 4.36Å; Y277-K289 HydrophobicContact CD1-CD 3.75Å; Y277-K289 HydrophobicContact CE1-CB 3.85Å; Y277-K289 HydrophobicContact CE1-CD 3.74Å; Y277-K289 HydrophobicContact CE1-CG 4.47Å; Y277-V290 HydrophobicContact CD2-CG2 4.48Å; Y277-V290 HydrophobicContact CE2-CG2 3.54Å; Y277-V290 WeakPolarHBondContact OH-CG2 3.41Å; Y277-I294 WeakPolarHBondContact CE1-O 3.31Å; Y277-I294 PolarHBondContact OH-O 3.07Å; Y277-I294 VanDerWaalsContact OH-O 3.07Å; Y277-P296 HydrophobicContact CD1-CB 4.06Å; Y277-P296 HydrophobicContact CD1-CG 3.96Å; Y277-P296 HydrophobicContact CD2-CG 3.96Å; Y277-P296 HydrophobicContact CE1-CB 4.15Å; Y277-P296 HydrophobicContact CE1-CG 3.71Å; Y277-P296 HydrophobicContact CE2-CG 3.73Å; Y277-P296 HydrophobicContact CG-CB 4.33Å; Y277-P296 HydrophobicContact CG-CG 4.08Å
278	S	95.3	Very high	94.4	Very high	74 Å²	74	48.4 Å²	48.4	52%	0.517	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-11	-180	44.7	0	0	0	0	114.8	Y275 P276 C280	Y275-S278 VanDerWaalsContact O-CB 3.27Å; Y275-S278 WeakPolarHBondContact O-CB 3.08Å; Y275-S278 PolarHBondContact O-N 3.3Å; Y275-S278 PolarHBondContact O-OG 2.64Å; P276-S278 PolarHBondContact O-N 2.99Å; P276-S278 VanDerWaalsContact O-N 3.12Å; S278-C280 VanDerWaalsContact C-N 3.27Å
279	E	95.4	Very high	94.4	Very high	63 Å²	63	50.2 Å²	50.2	29%	0.294	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-17.4	165.5	70.8	-81.1	-176.6	0	0	114.1	Y277 K289 D297	Y277-E279 VanDerWaalsContact CA-OE2 3.27Å; Y277-E279 WeakPolarHBondContact CA-OE2 3.49Å; Y277-E279 WeakPolarHBondContact CD1-OE1 3.29Å; Y277-E279 PolarHBondContact O-N 2.97Å; Y277-E279 VanDerWaalsContact O-N 3.11Å; E279-K289 IonicContact OE1-NZ 3.29Å; E279-K289 PolarHBondContact OE1-NZ 3.36Å; E279-D297 HydrophobicContact CG-CB 4.22Å; E279-D297 WeakPolarHBondContact CG-OD2 3.32Å; E279-D297 PolarHBondContact OE1-N 2.86Å
280	C	96	Very high	94.3	Very high	23 Å²	23	50.2 Å²	50.2	16%	0.155	26%	0.261	C	S	.	.			trans	-90.4	133.2	-178.2	-65.4	0	0	0	0	111.6	Y277 S278 Q285 I286	Y277-C280 VanDerWaalsContact O-CB 3.3Å; Y277-C280 WeakPolarHBondContact O-CB 3.41Å; Y277-C280 PolarHBondContact O-N 3Å; S278-C280 VanDerWaalsContact C-N 3.27Å; C280-Q285 HydrophobicContact CB-CB 3.95Å; C280-I286 HydrophobicContact CB-CD1 4.39Å; C280-I286 HydrophobicContact CB-CG1 3.61Å
281	Q	93.6	Very high	94	Very high	170 Å²	170	52.5 Å²	52.5	79%	0.794	28%	0.275	S	S	*	.	S	Bend	trans	-80.6	-15.9	-179.1	-61.9	175.7	-11.9	0	0	114
282	N	92.4	Very high	94	Very high	73 Å²	73	56.4 Å²	56.4	39%	0.39	29%	0.291	S	S	.	.	S	Bend	trans	-162.3	161.9	-178.2	57.6	73.1	0	0	0	113.1	A284 Q285 I286	N282-A284 PolarHBondContact O-N 3.25Å; N282-A284 VanDerWaalsContact O-N 3.14Å; N282-A284 WeakPolarHBondContact OD1-CB 3.24Å; N282-A284 PolarHBondContact OD1-N 3.49Å; N282-A284 VanDerWaalsContact OD1-N 3.15Å; N282-Q285 WeakPolarHBondContact O-CB 3.48Å; N282-Q285 PolarHBondContact O-N 2.88Å; N282-Q285 PolarHBondContact OD1-N 2.89Å; N282-I286 PolarHBondContact O-N 3.43Å
283	A	89	Confident	93.9	Very high	56 Å²	56	56.6 Å²	56.6	46%	0.463	30%	0.298	S	S	.	.	H	α-helix	trans	-54	-30.5	177.8	0	0	0	0	0	114.5	P242 I286 Y287	P242-A283 HydrophobicContact CB-CB 4.29Å; P242-A283 HydrophobicContact CG-CB 3.89Å; A283-I286 PolarHBondContact O-N 3.15Å; A283-Y287 VanDerWaalsContact O-CB 3.31Å; A283-Y287 WeakPolarHBondContact O-CB 3.44Å; A283-Y287 PolarHBondContact O-N 2.9Å
284	A	89.3	Confident	94	Very high	48 Å²	48	60 Å²	60	40%	0.397	32%	0.315	S	S	.	.	H	α-helix	trans	-78.9	-16	178.8	0	0	0	0	0	113.5	N282 R288	N282-A284 PolarHBondContact O-N 3.25Å; N282-A284 VanDerWaalsContact O-N 3.14Å; N282-A284 WeakPolarHBondContact OD1-CB 3.24Å; N282-A284 PolarHBondContact OD1-N 3.49Å; N282-A284 VanDerWaalsContact OD1-N 3.15Å; A284-R288 WeakPolarHBondContact O-CG 3.17Å; A284-R288 PolarHBondContact O-NE 3.4Å
285	Q	94.8	Very high	94.2	Very high	54 Å²	54	60.3 Å²	60.3	25%	0.252	32%	0.315	S	S	.	.	H	α-helix	trans	-79.7	-43.6	164.7	-70	172.6	1.3	0	0	110.3	C280 N282 R288 K289	C280-Q285 HydrophobicContact CB-CB 3.95Å; N282-Q285 WeakPolarHBondContact O-CB 3.48Å; N282-Q285 PolarHBondContact O-N 2.88Å; N282-Q285 PolarHBondContact OD1-N 2.89Å; Q285-R288 PolarHBondContact O-N 2.61Å; Q285-K289 PolarHBondContact O-N 3.05Å
286	I	94.1	Very high	94.3	Very high	4 Å²	4	57.7 Å²	57.7	2%	0.021	31%	0.305	C	S	.	.	H	α-helix	trans	-58.4	-53.1	176.4	-61.4	158.6	0	0	0	110.6	P242 E243 Y277 C280 N282 A283 R288 K289 V290	P242-I286 HydrophobicContact CB-CG2 4.26Å; P242-I286 HydrophobicContact CG-CD1 4.3Å; P242-I286 WeakPolarHBondContact O-CG2 3.31Å; E243-I286 HydrophobicContact CG-CD1 3.7Å; Y277-I286 HydrophobicContact CD2-CG2 3.83Å; Y277-I286 HydrophobicContact CE2-CG2 4.28Å; Y277-I286 HydrophobicContact CG-CG1 4.49Å; Y277-I286 HydrophobicContact CG-CG2 4.18Å; C280-I286 HydrophobicContact CB-CD1 4.39Å; C280-I286 HydrophobicContact CB-CG1 3.61Å; N282-I286 PolarHBondContact O-N 3.43Å; A283-I286 PolarHBondContact O-N 3.15Å; I286-R288 VanDerWaalsContact C-N 3.34Å; I286-R288 PolarHBondContact O-N 2.89Å; I286-K289 WeakPolarHBondContact O-CB 3.5Å; I286-K289 PolarHBondContact O-N 3.12Å; I286-V290 HydrophobicContact CG2-CG2 4.05Å; I286-V290 WeakPolarHBondContact O-CG2 3.49Å; I286-V290 PolarHBondContact O-N 3.31Å
287	Y	91.1	Very high	94.3	Very high	107 Å²	107	61.8 Å²	61.8	42%	0.42	33%	0.327	S	S	.	.	H	α-helix	trans	-48	-53.1	175.4	173.1	-95.5	0	0	0	111.8	Y250 A283 K289 V290 T291	Y250-Y287 AromaticContact CD1-CD2 3.98Å; Y250-Y287 HydrophobicContact CD1-CD2 3.98Å; Y250-Y287 HydrophobicContact CD1-CE2 4.04Å; Y250-Y287 AromaticContact CD2-CD2 3.71Å; Y250-Y287 HydrophobicContact CD2-CD2 3.71Å; Y250-Y287 AromaticContact CD2-CE2 3.71Å; Y250-Y287 HydrophobicContact CD2-CE2 3.71Å; Y250-Y287 AromaticContact CE1-CD2 3.95Å; Y250-Y287 HydrophobicContact CE1-CD2 3.95Å; Y250-Y287 HydrophobicContact CE1-CE2 4.48Å; Y250-Y287 AromaticContact CE2-CD2 3.71Å; Y250-Y287 HydrophobicContact CE2-CD2 3.71Å; Y250-Y287 HydrophobicContact CE2-CE2 4.21Å; Y250-Y287 AromaticContact CG-CD2 3.87Å; Y250-Y287 HydrophobicContact CG-CD2 3.87Å; Y250-Y287 AromaticContact CG-CE2 3.64Å; Y250-Y287 HydrophobicContact CG-CE2 3.64Å; Y250-Y287 AromaticContact CZ-CD2 3.84Å; A283-Y287 VanDerWaalsContact O-CB 3.31Å; A283-Y287 WeakPolarHBondContact O-CB 3.44Å; A283-Y287 PolarHBondContact O-N 2.9Å; Y287-K289 VanDerWaalsContact C-N 3.34Å; Y287-K289 PolarHBondContact O-N 2.8Å; Y287-V290 PolarHBondContact O-N 2.81Å; Y287-T291 HydrophobicContact CD1-CG2 4.44Å; Y287-T291 HydrophobicContact CD2-CG2 4.12Å; Y287-T291 HydrophobicContact CE1-CG2 4.1Å; Y287-T291 HydrophobicContact CE2-CG2 3.75Å; Y287-T291 HydrophobicContact CG-CG2 4.45Å; Y287-T291 WeakPolarHBondContact O-CG2 3.5Å; Y287-T291 PolarHBondContact O-N 2.92Å; Y287-T291 PolarHBondContact O-OG1 2.68Å
288	R	93.7	Very high	94.2	Very high	145 Å²	145	61.6 Å²	61.6	55%	0.547	33%	0.326	S	S	.	.	H	α-helix	trans	-66.9	-29.1	-179.6	-73	-178.4	-67.2	160.9	3.1	113.8	A284 Q285 I286 N292	A284-R288 WeakPolarHBondContact O-CG 3.17Å; A284-R288 PolarHBondContact O-NE 3.4Å; Q285-R288 PolarHBondContact O-N 2.61Å; I286-R288 VanDerWaalsContact C-N 3.34Å; I286-R288 PolarHBondContact O-N 2.89Å; R288-N292 VanDerWaalsContact O-CB 3.25Å; R288-N292 WeakPolarHBondContact O-CB 3.43Å; R288-N292 PolarHBondContact O-ND2 3.04Å; R288-N292 PolarHBondContact O-OD1 3.16Å
289	K	96.1	Very high	94.3	Very high	38 Å²	38	59 Å²	59	17%	0.165	31%	0.306	C	S	.	.	H	α-helix	trans	-68.6	-51.3	169.6	-86.4	-159.3	172.4	-162.7	0	110.4	Y277 E279 Q285 I286 Y287 N292 G293 I294 D297	Y277-K289 HydrophobicContact CD1-CB 4.36Å; Y277-K289 HydrophobicContact CD1-CD 3.75Å; Y277-K289 HydrophobicContact CE1-CB 3.85Å; Y277-K289 HydrophobicContact CE1-CD 3.74Å; Y277-K289 HydrophobicContact CE1-CG 4.47Å; E279-K289 IonicContact OE1-NZ 3.29Å; E279-K289 PolarHBondContact OE1-NZ 3.36Å; Q285-K289 PolarHBondContact O-N 3.05Å; I286-K289 WeakPolarHBondContact O-CB 3.5Å; I286-K289 PolarHBondContact O-N 3.12Å; Y287-K289 VanDerWaalsContact C-N 3.34Å; Y287-K289 PolarHBondContact O-N 2.8Å; K289-N292 CarbonylContact O-C 3.59Å; K289-N292 PolarHBondContact O-N 3.28Å; K289-G293 PolarHBondContact O-N 2.84Å; K289-I294 HydrophobicContact CB-CB 4.03Å; K289-I294 HydrophobicContact CB-CG2 4.43Å; K289-I294 HydrophobicContact CD-CB 4.39Å; K289-I294 HydrophobicContact CD-CG2 3.87Å; K289-I294 HydrophobicContact CG-CB 4Å; K289-I294 HydrophobicContact CG-CD1 4.47Å; K289-I294 HydrophobicContact CG-CG2 3.93Å; K289-I294 PolarHBondContact O-N 3.39Å; K289-D297 IonicContact NZ-OD1 2.78Å; K289-D297 PolarHBondContact NZ-OD1 2.88Å
290	V	94.6	Very high	94.3	Very high	3 Å²	3	60 Å²	60	2%	0.018	32%	0.32	C	S	.	.	H	α-helix	trans	-60.3	-50.1	-176.5	172	0	0	0	0	112.1	P247 Y277 I286 Y287 N292 G293	P247-V290 HydrophobicContact CB-CG1 4.03Å; P247-V290 HydrophobicContact CG-CG1 4.41Å; Y277-V290 HydrophobicContact CD2-CG2 4.48Å; Y277-V290 HydrophobicContact CE2-CG2 3.54Å; Y277-V290 WeakPolarHBondContact OH-CG2 3.41Å; I286-V290 HydrophobicContact CG2-CG2 4.05Å; I286-V290 WeakPolarHBondContact O-CG2 3.49Å; I286-V290 PolarHBondContact O-N 3.31Å; Y287-V290 PolarHBondContact O-N 2.81Å; V290-N292 PolarHBondContact O-N 2.9Å; V290-G293 PolarHBondContact O-N 2.86Å; V290-G293 VanDerWaalsContact O-N 3.12Å
291	T	91.5	Very high	94.3	Very high	49 Å²	49	64.1 Å²	64.1	30%	0.301	34%	0.335	S	S	.	.	H	α-helix	trans	-62.9	-31.3	178.6	57.1	0	0	0	0	112.6	Y287 G293	Y287-T291 HydrophobicContact CD1-CG2 4.44Å; Y287-T291 HydrophobicContact CD2-CG2 4.12Å; Y287-T291 HydrophobicContact CE1-CG2 4.1Å; Y287-T291 HydrophobicContact CE2-CG2 3.75Å; Y287-T291 HydrophobicContact CG-CG2 4.45Å; Y287-T291 WeakPolarHBondContact O-CG2 3.5Å; Y287-T291 PolarHBondContact O-N 2.92Å; Y287-T291 PolarHBondContact O-OG1 2.68Å; T291-G293 VanDerWaalsContact C-N 3.3Å
292	N	94.4	Very high	94.4	Very high	116 Å²	116	56.5 Å²	56.5	62%	0.62	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	7.3	-179.7	-62	11.2	0	0	0	112.6	R288 K289 V290 I294	R288-N292 VanDerWaalsContact O-CB 3.25Å; R288-N292 WeakPolarHBondContact O-CB 3.43Å; R288-N292 PolarHBondContact O-ND2 3.04Å; R288-N292 PolarHBondContact O-OD1 3.16Å; K289-N292 CarbonylContact O-C 3.59Å; K289-N292 PolarHBondContact O-N 3.28Å; V290-N292 PolarHBondContact O-N 2.9Å; N292-I294 HydrophobicContact CB-CD1 4.16Å; N292-I294 HydrophobicContact CB-CG1 4.1Å; N292-I294 PolarHBondContact O-N 3.37Å
293	G	93.6	Very high	94.2	Very high	28 Å²	28	62.4 Å²	62.4	29%	0.289	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.1	13.3	-179	0	0	0	0	0	115.4	K289 V290 T291 K295 T317	K289-G293 PolarHBondContact O-N 2.84Å; V290-G293 PolarHBondContact O-N 2.86Å; V290-G293 VanDerWaalsContact O-N 3.12Å; T291-G293 VanDerWaalsContact C-N 3.3Å; G293-K295 PolarHBondContact O-N 2.82Å; G293-T317 VanDerWaalsContact CA-OG1 3.23Å; G293-T317 WeakPolarHBondContact CA-OG1 3.22Å
294	I	96.9	Very high	94.1	Very high	82 Å²	82	62.2 Å²	62.2	42%	0.421	32%	0.317	S	S	.	.			trans	-77.3	106.5	179.5	-55.5	175.6	0	0	0	108.1	Y277 K289 N292	Y277-I294 WeakPolarHBondContact CE1-O 3.31Å; Y277-I294 PolarHBondContact OH-O 3.07Å; Y277-I294 VanDerWaalsContact OH-O 3.07Å; K289-I294 HydrophobicContact CB-CB 4.03Å; K289-I294 HydrophobicContact CB-CG2 4.43Å; K289-I294 HydrophobicContact CD-CB 4.39Å; K289-I294 HydrophobicContact CD-CG2 3.87Å; K289-I294 HydrophobicContact CG-CB 4Å; K289-I294 HydrophobicContact CG-CD1 4.47Å; K289-I294 HydrophobicContact CG-CG2 3.93Å; K289-I294 PolarHBondContact O-N 3.39Å; N292-I294 HydrophobicContact CB-CD1 4.16Å; N292-I294 HydrophobicContact CB-CG1 4.1Å; N292-I294 PolarHBondContact O-N 3.37Å
295	K	97.2	Very high	94	Very high	69 Å²	69	66.1 Å²	66.1	30%	0.3	33%	0.327	S	S	.	.			trans	-63	157.5	178.9	-62.1	-172.3	175.2	99	0	112	G293 F299 E312 I315	G293-K295 PolarHBondContact O-N 2.82Å; K295-F299 HydrophobicContact CB-CB 4.43Å; K295-F299 HydrophobicContact CB-CD1 4.26Å; K295-F299 HydrophobicContact CB-CG 4.48Å; K295-F299 HydrophobicContact CD-CD1 3.7Å; K295-F299 HydrophobicContact CD-CE1 3.7Å; K295-F299 HydrophobicContact CD-CG 4.21Å; K295-F299 HydrophobicContact CD-CZ 4.21Å; K295-E312 VanDerWaalsContact CE-OE1 3.31Å; K295-E312 WeakPolarHBondContact CE-OE1 3.33Å; K295-E312 IonicContact NZ-OE1 3.57Å; K295-E312 PolarHBondContact NZ-OE1 2.93Å; K295-I315 HydrophobicContact CD-CD1 4.09Å; K295-I315 HydrophobicContact CD-CG1 4.37Å; K295-I315 HydrophobicContact CG-CD1 4.23Å
296	P	97.2	Very high	93.7	Very high	4 Å²	4	66 Å²	66	3%	0.026	33%	0.326	C	S	.	.			trans	-56.7	145.7	173.4	-26.5	35.4	0	0	0	113.1	M265 L268 P276 Y277 N298 F299	M265-P296 HydrophobicContact CE-CG 3.9Å; M265-P296 HydrophobicContact SD-CG 3.99Å; L268-P296 HydrophobicContact CD2-CB 4.07Å; L268-P296 HydrophobicContact CD2-CG 3.86Å; P276-P296 HydrophobicContact CB-CG 4.3Å; Y277-P296 HydrophobicContact CD1-CB 4.06Å; Y277-P296 HydrophobicContact CD1-CG 3.96Å; Y277-P296 HydrophobicContact CD2-CG 3.96Å; Y277-P296 HydrophobicContact CE1-CB 4.15Å; Y277-P296 HydrophobicContact CE1-CG 3.71Å; Y277-P296 HydrophobicContact CE2-CG 3.73Å; Y277-P296 HydrophobicContact CG-CB 4.33Å; Y277-P296 HydrophobicContact CG-CG 4.08Å; P296-N298 WeakPolarHBondContact CB-OD1 3.22Å; P296-N298 PolarHBondContact O-N 3.29Å; P296-F299 VanDerWaalsContact O-CB 3.26Å; P296-F299 WeakPolarHBondContact O-CB 3.39Å; P296-F299 PolarHBondContact O-N 3.38Å
297	D	96.7	Very high	93.6	Very high	86 Å²	86	66.2 Å²	66.2	46%	0.46	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-61.5	-33.3	179.4	-71.4	13.6	0	0	0	111.7	E279 K289 F299 S300	E279-D297 HydrophobicContact CG-CB 4.22Å; E279-D297 WeakPolarHBondContact CG-OD2 3.32Å; E279-D297 PolarHBondContact OE1-N 2.86Å; K289-D297 IonicContact NZ-OD1 2.78Å; K289-D297 PolarHBondContact NZ-OD1 2.88Å; D297-F299 VanDerWaalsContact C-N 3.27Å; D297-F299 PolarHBondContact O-N 3.19Å; D297-S300 WeakPolarHBondContact O-CB 3.43Å; D297-S300 PolarHBondContact O-N 3.45Å; D297-S300 PolarHBondContact O-OG 3.38Å
298	N	95.8	Very high	93.8	Very high	1 Å²	1	63.6 Å²	63.6	1%	0.005	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-69.5	-15.6	176.8	72	-30.6	0	0	0	114.3	T272 E274 P296 S300 K301	T272-N298 HydrophobicContact CG2-CB 4.14Å; T272-N298 VanDerWaalsContact CG2-O 3.29Å; T272-N298 WeakPolarHBondContact CG2-O 3.35Å; T272-N298 PolarHBondContact OG1-ND2 3.07Å; E274-N298 HydrophobicContact CB-CB 4.27Å; E274-N298 PolarHBondContact O-ND2 3.47Å; E274-N298 WeakPolarHBondContact OE2-CB 3.32Å; P296-N298 WeakPolarHBondContact CB-OD1 3.22Å; P296-N298 PolarHBondContact O-N 3.29Å; N298-S300 PolarHBondContact O-N 3.31Å; N298-K301 HydrophobicContact CB-CD 4.27Å; N298-K301 WeakPolarHBondContact O-CB 3.48Å; N298-K301 PolarHBondContact O-N 3.41Å
299	F	97.4	Very high	93.8	Very high	20 Å²	20	61.2 Å²	61.2	9%	0.088	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-59.8	-30.7	171.2	174.1	-103.3	0	0	0	112.2	L268 K295 P296 D297 K301 V302 K308 I311 E312 I315	L268-F299 HydrophobicContact CD1-CB 4.32Å; L268-F299 HydrophobicContact CD2-CB 4.36Å; K295-F299 HydrophobicContact CB-CB 4.43Å; K295-F299 HydrophobicContact CB-CD1 4.26Å; K295-F299 HydrophobicContact CB-CG 4.48Å; K295-F299 HydrophobicContact CD-CD1 3.7Å; K295-F299 HydrophobicContact CD-CE1 3.7Å; K295-F299 HydrophobicContact CD-CG 4.21Å; K295-F299 HydrophobicContact CD-CZ 4.21Å; P296-F299 VanDerWaalsContact O-CB 3.26Å; P296-F299 WeakPolarHBondContact O-CB 3.39Å; P296-F299 PolarHBondContact O-N 3.38Å; D297-F299 VanDerWaalsContact C-N 3.27Å; D297-F299 PolarHBondContact O-N 3.19Å; F299-K301 PolarHBondContact O-N 3.46Å; F299-V302 PolarHBondContact O-N 2.9Å; F299-K308 HydrophobicContact CE2-CG 3.77Å; F299-K308 HydrophobicContact CZ-CD 4.38Å; F299-K308 HydrophobicContact CZ-CG 3.65Å; F299-I311 HydrophobicContact CD2-CG2 3.78Å; F299-I311 HydrophobicContact CE2-CB 4.31Å; F299-I311 HydrophobicContact CE2-CG2 3.92Å; F299-E312 HydrophobicContact CE2-CB 4.06Å; F299-E312 HydrophobicContact CZ-CB 3.82Å; F299-E312 HydrophobicContact CZ-CG 4.28Å; F299-I315 HydrophobicContact CD2-CD1 4.23Å
300	S	95.8	Very high	93.8	Very high	85 Å²	85	59.4 Å²	59.4	59%	0.594	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-61.8	-28.4	174.2	68.4	0	0	0	0	113.3	D297 N298 V302	D297-S300 WeakPolarHBondContact O-CB 3.43Å; D297-S300 PolarHBondContact O-N 3.45Å; D297-S300 PolarHBondContact O-OG 3.38Å; N298-S300 PolarHBondContact O-N 3.31Å; S300-V302 VanDerWaalsContact C-N 3.34Å; S300-V302 PolarHBondContact O-N 3.13Å
301	K	95.4	Very high	94	Very high	109 Å²	109	59.2 Å²	59.2	47%	0.474	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-82.6	-5.1	-173.8	-56.1	176.1	-178.9	172	0	113.9	T272 E274 N298 F299 Q303	T272-K301 HydrophobicContact CG2-CB 4.37Å; E274-K301 IonicContact OE1-NZ 3.44Å; E274-K301 PolarHBondContact OE1-NZ 3.37Å; E274-K301 WeakPolarHBondContact OE2-CD 3.2Å; E274-K301 WeakPolarHBondContact OE2-CE 3.48Å; E274-K301 IonicContact OE2-NZ 2.66Å; E274-K301 PolarHBondContact OE2-NZ 3.06Å; N298-K301 HydrophobicContact CB-CD 4.27Å; N298-K301 WeakPolarHBondContact O-CB 3.48Å; N298-K301 PolarHBondContact O-N 3.41Å; F299-K301 PolarHBondContact O-N 3.46Å; K301-Q303 PolarHBondContact O-N 3.24Å; K301-Q303 VanDerWaalsContact O-N 3.1Å
302	V	95	Very high	94.2	Very high	10 Å²	10	60.1 Å²	60.1	6%	0.061	31%	0.305	C	S	.	.			trans	-70.6	105.3	-179.9	-177.4	0	0	0	0	110.1	L268 A271 T272 F299 S300 L307 K308 I311	L268-V302 HydrophobicContact CD1-CG2 3.61Å; A271-V302 HydrophobicContact CB-CG2 4.47Å; T272-V302 HydrophobicContact CG2-CG2 4.01Å; F299-V302 PolarHBondContact O-N 2.9Å; S300-V302 VanDerWaalsContact C-N 3.34Å; S300-V302 PolarHBondContact O-N 3.13Å; V302-L307 HydrophobicContact CG1-CB 4.29Å; V302-L307 HydrophobicContact CG1-CD2 4.26Å; V302-L307 HydrophobicContact CG1-CG 3.91Å; V302-K308 HydrophobicContact CB-CB 4.28Å; V302-K308 HydrophobicContact CB-CG 4.33Å; V302-K308 HydrophobicContact CG1-CB 3.86Å; V302-K308 HydrophobicContact CG1-CG 4.44Å; V302-I311 HydrophobicContact CG1-CD1 4.31Å; V302-I311 HydrophobicContact CG2-CD1 4.14Å
303	Q	88.4	Confident	94.2	Very high	197 Å²	197	54.6 Å²	54.6	92%	0.921	28%	0.275	S	S	*	.			trans	-75.1	-26.9	-173.1	-63.3	179.9	-7.6	0	0	114.8	K301	K301-Q303 PolarHBondContact O-N 3.24Å; K301-Q303 VanDerWaalsContact O-N 3.1Å
304	N	87.9	Confident	94.4	Very high	51 Å²	51	53.2 Å²	53.2	27%	0.273	26%	0.262	S	S	.	.			trans	-94.5	124.4	-177.7	176	-66	0	0	0	110	E306 L307 K308	N304-E306 PolarHBondContact OD1-N 3.42Å; N304-E306 VanDerWaalsContact OD1-N 3.13Å; N304-L307 HydrophobicContact CB-CB 3.89Å; N304-L307 HydrophobicContact CB-CD2 4.32Å; N304-L307 WeakPolarHBondContact O-CB 3.32Å; N304-L307 PolarHBondContact O-N 2.86Å; N304-L307 WeakPolarHBondContact OD1-CB 3.37Å; N304-L307 PolarHBondContact OD1-N 2.89Å; N304-K308 WeakPolarHBondContact O-CB 3.45Å; N304-K308 PolarHBondContact O-N 2.93Å
305	Q	87	Confident	94.5	Very high	131 Å²	131	49.7 Å²	49.7	61%	0.612	24%	0.243	S	C	*	.	H	α-helix	trans	-70	-39.5	-172.7	-173	59.1	26.6	0	0	113.6	L307 K308 E309	Q305-L307 VanDerWaalsContact C-N 3.31Å; Q305-L307 PolarHBondContact O-N 3.48Å; Q305-K308 PolarHBondContact O-N 3.43Å; Q305-E309 WeakPolarHBondContact O-CB 3.37Å; Q305-E309 PolarHBondContact O-N 2.65Å
306	E	87.9	Confident	94.4	Very high	51 Å²	51	50.2 Å²	50.2	24%	0.238	24%	0.244	C	C	.	.	H	α-helix	trans	-61.5	-42	174.5	-59.8	-175.8	151.7	0	0	110.9	N304 K308 E309 I310 R332 F333	N304-E306 PolarHBondContact OD1-N 3.42Å; N304-E306 VanDerWaalsContact OD1-N 3.13Å; E306-K308 VanDerWaalsContact C-N 3.35Å; E306-E309 PolarHBondContact O-N 3.45Å; E306-I310 VanDerWaalsContact O-CD1 3.32Å; E306-I310 WeakPolarHBondContact O-CD1 3.36Å; E306-I310 WeakPolarHBondContact O-CG1 3.25Å; E306-I310 PolarHBondContact O-N 3.22Å; E306-R332 VanDerWaalsContact OE1-CD 3.29Å; E306-R332 WeakPolarHBondContact OE1-CD 3.18Å; E306-R332 IonicContact OE1-CZ 3.03Å; E306-R332 IonicContact OE1-NE 3.9Å; E306-R332 PolarHBondContact OE1-NE 3.43Å; E306-R332 IonicContact OE1-NH1 3.33Å; E306-F333 HydrophobicContact CB-CD2 4.32Å
307	L	92.5	Very high	94.1	Very high	8 Å²	8	52.9 Å²	52.9	4%	0.042	26%	0.26	C	S	.	.	H	α-helix	trans	-64.7	-39.4	176.8	177.8	54.2	0	0	0	111.6	L176 L179 M267 A271 V302 N304 Q305 I311 F333	L176-L307 HydrophobicContact CD1-CD2 3.95Å; L179-L307 HydrophobicContact CD1-CD2 4.18Å; L179-L307 HydrophobicContact CD2-CD1 3.97Å; M267-L307 HydrophobicContact CE-CD1 3.28Å; M267-L307 HydrophobicContact CG-CD1 3.8Å; M267-L307 HydrophobicContact SD-CD1 4.38Å; A271-L307 HydrophobicContact CB-CD1 4.41Å; A271-L307 HydrophobicContact CB-CD2 3.71Å; A271-L307 HydrophobicContact CB-CG 4.18Å; V302-L307 HydrophobicContact CG1-CB 4.29Å; V302-L307 HydrophobicContact CG1-CD2 4.26Å; V302-L307 HydrophobicContact CG1-CG 3.91Å; N304-L307 HydrophobicContact CB-CB 3.89Å; N304-L307 HydrophobicContact CB-CD2 4.32Å; N304-L307 WeakPolarHBondContact O-CB 3.32Å; N304-L307 PolarHBondContact O-N 2.86Å; N304-L307 WeakPolarHBondContact OD1-CB 3.37Å; N304-L307 PolarHBondContact OD1-N 2.89Å; Q305-L307 VanDerWaalsContact C-N 3.31Å; Q305-L307 PolarHBondContact O-N 3.48Å; L307-I311 HydrophobicContact CD1-CD1 3.9Å; L307-I311 HydrophobicContact CD1-CG1 4.4Å; L307-I311 HydrophobicContact CG-CD1 4.06Å; L307-I311 WeakPolarHBondContact O-CD1 3.34Å; L307-I311 VanDerWaalsContact O-CG1 3.26Å; L307-I311 WeakPolarHBondContact O-CG1 3.49Å; L307-I311 PolarHBondContact O-N 3.41Å; L307-F333 HydrophobicContact CD1-CZ 4.45Å
308	K	94.5	Very high	93.9	Very high	53 Å²	53	52.1 Å²	52.1	23%	0.23	26%	0.256	C	S	.	.	H	α-helix	trans	-67.1	-43.5	176.7	-167.8	173.5	-178.1	175.2	0	112	F299 V302 N304 Q305 E306 I311 E312	F299-K308 HydrophobicContact CE2-CG 3.77Å; F299-K308 HydrophobicContact CZ-CD 4.38Å; F299-K308 HydrophobicContact CZ-CG 3.65Å; V302-K308 HydrophobicContact CB-CB 4.28Å; V302-K308 HydrophobicContact CB-CG 4.33Å; V302-K308 HydrophobicContact CG1-CB 3.86Å; V302-K308 HydrophobicContact CG1-CG 4.44Å; N304-K308 WeakPolarHBondContact O-CB 3.45Å; N304-K308 PolarHBondContact O-N 2.93Å; Q305-K308 PolarHBondContact O-N 3.43Å; E306-K308 VanDerWaalsContact C-N 3.35Å; K308-I311 PolarHBondContact O-N 3.42Å; K308-E312 VanDerWaalsContact O-CB 3.27Å; K308-E312 WeakPolarHBondContact O-CB 3.47Å; K308-E312 PolarHBondContact O-N 3.41Å
309	E	94.4	Very high	93.8	Very high	94 Å²	94	54.1 Å²	54.1	44%	0.439	27%	0.27	S	S	.	.	H	α-helix	trans	-58.8	-46.5	174.3	-178.1	-174	170.9	0	0	111.8	Q305 E306 E312 G313	Q305-E309 WeakPolarHBondContact O-CB 3.37Å; Q305-E309 PolarHBondContact O-N 2.65Å; E306-E309 PolarHBondContact O-N 3.45Å; E309-E312 PolarHBondContact O-N 3.16Å; E309-G313 PolarHBondContact O-N 3.08Å
310	I	96.1	Very high	93.4	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-60.1	-50.7	176.8	-66.5	159.2	0	0	0	110.8	M267 E306 E312 G313 C314 L328 H331 F333 F334	M267-I310 HydrophobicContact CE-CB 4.16Å; M267-I310 HydrophobicContact CE-CD1 3.86Å; M267-I310 HydrophobicContact CE-CG2 3.66Å; M267-I310 HydrophobicContact SD-CG2 3.96Å; E306-I310 VanDerWaalsContact O-CD1 3.32Å; E306-I310 WeakPolarHBondContact O-CD1 3.36Å; E306-I310 WeakPolarHBondContact O-CG1 3.25Å; E306-I310 PolarHBondContact O-N 3.22Å; I310-E312 PolarHBondContact O-N 3.49Å; I310-G313 PolarHBondContact O-N 3.29Å; I310-C314 PolarHBondContact O-N 3.01Å; I310-C314 PolarHBondContact O-SG 2.92Å; I310-L328 HydrophobicContact CG2-CD2 3.96Å; I310-H331 WeakPolarHBondContact CD1-ND1 3.49Å; I310-H331 VanDerWaalsContact CG1-CE1 3.47Å; I310-H331 WeakPolarHBondContact CG1-CE1 3.31Å; I310-H331 WeakPolarHBondContact CG1-ND1 3.27Å; I310-F333 HydrophobicContact CD1-CB 3.44Å; I310-F333 VanDerWaalsContact CD1-CB 3.44Å; I310-F333 HydrophobicContact CD1-CD1 3.58Å; I310-F333 HydrophobicContact CD1-CD2 4.37Å; I310-F333 HydrophobicContact CD1-CE1 4.44Å; I310-F333 HydrophobicContact CD1-CG 3.55Å; I310-F334 HydrophobicContact CD1-CE2 4.16Å; I310-F334 HydrophobicContact CG2-CE2 4.33Å
311	I	97.9	Very high	93.2	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-59.9	-48.2	179.9	-69.3	162.7	0	0	0	109.6	M267 L268 A271 F299 V302 L307 K308 G313 C314 I315	M267-I311 HydrophobicContact CB-CG1 4.16Å; M267-I311 HydrophobicContact CG-CD1 4.35Å; M267-I311 HydrophobicContact CG-CG1 4.01Å; L268-I311 HydrophobicContact CB-CD1 4.24Å; L268-I311 HydrophobicContact CB-CG2 4.07Å; L268-I311 HydrophobicContact CD1-CD1 4.42Å; A271-I311 HydrophobicContact CB-CD1 4.19Å; F299-I311 HydrophobicContact CD2-CG2 3.78Å; F299-I311 HydrophobicContact CE2-CB 4.31Å; F299-I311 HydrophobicContact CE2-CG2 3.92Å; V302-I311 HydrophobicContact CG1-CD1 4.31Å; V302-I311 HydrophobicContact CG2-CD1 4.14Å; L307-I311 HydrophobicContact CD1-CD1 3.9Å; L307-I311 HydrophobicContact CD1-CG1 4.4Å; L307-I311 HydrophobicContact CG-CD1 4.06Å; L307-I311 WeakPolarHBondContact O-CD1 3.34Å; L307-I311 VanDerWaalsContact O-CG1 3.26Å; L307-I311 WeakPolarHBondContact O-CG1 3.49Å; L307-I311 PolarHBondContact O-N 3.41Å; K308-I311 PolarHBondContact O-N 3.42Å; I311-G313 PolarHBondContact O-N 3.44Å; I311-C314 WeakPolarHBondContact O-CB 3.29Å; I311-C314 PolarHBondContact O-N 3.27Å; I311-I315 HydrophobicContact CG2-CD1 3.99Å; I311-I315 HydrophobicContact CG2-CG1 4.46Å; I311-I315 WeakPolarHBondContact O-CG1 3.37Å; I311-I315 PolarHBondContact O-N 3.04Å
312	E	96.5	Very high	93.2	Very high	67 Å²	67	51.7 Å²	51.7	31%	0.313	26%	0.257	S	S	.	.	H	α-helix	trans	-58.9	-44.5	179.2	-176.9	142.3	-132.8	0	0	112.9	K295 F299 K308 E309 I310 C314 I315 R316	K295-E312 VanDerWaalsContact CE-OE1 3.31Å; K295-E312 WeakPolarHBondContact CE-OE1 3.33Å; K295-E312 IonicContact NZ-OE1 3.57Å; K295-E312 PolarHBondContact NZ-OE1 2.93Å; F299-E312 HydrophobicContact CE2-CB 4.06Å; F299-E312 HydrophobicContact CZ-CB 3.82Å; F299-E312 HydrophobicContact CZ-CG 4.28Å; K308-E312 VanDerWaalsContact O-CB 3.27Å; K308-E312 WeakPolarHBondContact O-CB 3.47Å; K308-E312 PolarHBondContact O-N 3.41Å; E309-E312 PolarHBondContact O-N 3.16Å; I310-E312 PolarHBondContact O-N 3.49Å; E312-C314 PolarHBondContact O-N 3.21Å; E312-I315 PolarHBondContact O-N 3.38Å; E312-R316 VanDerWaalsContact O-CG 3.29Å; E312-R316 WeakPolarHBondContact O-CG 3.44Å; E312-R316 PolarHBondContact O-N 2.8Å
313	G	94.9	Very high	93.1	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-73	-12.2	176	0	0	0	0	0	114.8	E309 I310 I311 R322 F323	E309-G313 PolarHBondContact O-N 3.08Å; I310-G313 PolarHBondContact O-N 3.29Å; I311-G313 PolarHBondContact O-N 3.44Å; G313-R322 VanDerWaalsContact O-CA 3.29Å; G313-R322 WeakPolarHBondContact O-CA 3.12Å; G313-F323 PolarHBondContact O-N 2.89Å
314	C	97.9	Very high	93.4	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-87.5	-40.5	168	-64.9	0	0	0	0	112	I260 Y261 I310 I311 E312 R316 R322	I260-C314 HydrophobicContact CG2-CB 3.94Å; Y261-C314 WeakPolarHBondContact CA-O 3.46Å; I310-C314 PolarHBondContact O-N 3.01Å; I310-C314 PolarHBondContact O-SG 2.92Å; I311-C314 WeakPolarHBondContact O-CB 3.29Å; I311-C314 PolarHBondContact O-N 3.27Å; E312-C314 PolarHBondContact O-N 3.21Å; C314-R316 PolarHBondContact O-N 3.15Å; C314-R322 VanDerWaalsContact O-CD 3.29Å; C314-R322 WeakPolarHBondContact O-CD 3.43Å
315	I	97.3	Very high	93.7	Very high	7 Å²	7	44.7 Å²	44.7	4%	0.036	23%	0.227	C	C	.	.	S	Bend	trans	-95	22.7	-172.4	74.3	178.5	0	0	0	114.6	Y261 M265 K295 F299 I311 E312	Y261-I315 HydrophobicContact CD2-CB 4.21Å; Y261-I315 HydrophobicContact CE2-CB 4.02Å; M265-I315 HydrophobicContact CE-CB 4.13Å; M265-I315 HydrophobicContact CE-CD1 4.23Å; M265-I315 HydrophobicContact CE-CG2 3.9Å; M265-I315 HydrophobicContact CG-CG2 4.2Å; M265-I315 HydrophobicContact SD-CG2 4.01Å; K295-I315 HydrophobicContact CD-CD1 4.09Å; K295-I315 HydrophobicContact CD-CG1 4.37Å; K295-I315 HydrophobicContact CG-CD1 4.23Å; F299-I315 HydrophobicContact CD2-CD1 4.23Å; I311-I315 HydrophobicContact CG2-CD1 3.99Å; I311-I315 HydrophobicContact CG2-CG1 4.46Å; I311-I315 WeakPolarHBondContact O-CG1 3.37Å; I311-I315 PolarHBondContact O-N 3.04Å; E312-I315 PolarHBondContact O-N 3.38Å
316	R	95.4	Very high	93.9	Very high	80 Å²	80	42.9 Å²	42.9	30%	0.302	22%	0.218	S	C	.	.			trans	-62.6	140.8	173	-63.3	-168.7	173.3	107.4	8.5	110.7	E312 C314 E321 R322	E312-R316 VanDerWaalsContact O-CG 3.29Å; E312-R316 WeakPolarHBondContact O-CG 3.44Å; E312-R316 PolarHBondContact O-N 2.8Å; C314-R316 PolarHBondContact O-N 3.15Å; R316-E321 HydrophobicContact CB-CB 4.45Å; R316-E321 PolarHBondContact NH1-O 3.46Å; R316-R322 HydrophobicContact CB-CG 4.1Å; R316-R322 PolarHBondContact O-NE 3.36Å; R316-R322 PolarHBondContact O-NH2 2.77Å
317	T	92.5	Very high	94	Very high	60 Å²	60	42.4 Å²	42.4	37%	0.368	22%	0.217	S	C	.	.	S	Bend	trans	-59.6	-54.6	179.2	-37.4	0	0	0	0	110.6	P247 G293 R322	P247-T317 HydrophobicContact CG-CG2 3.99Å; P247-T317 WeakPolarHBondContact CG-O 3.38Å; G293-T317 VanDerWaalsContact CA-OG1 3.23Å; G293-T317 WeakPolarHBondContact CA-OG1 3.22Å; T317-R322 PolarHBondContact O-NH2 3.02Å
318	N	91.3	Very high	94	Very high	71 Å²	71	42.1 Å²	42.1	38%	0.38	22%	0.216	S	C	.	.	S	Bend	trans	-66.7	132	174.1	-173.9	3	0	0	0	110.6	S320 E321	N318-S320 PolarHBondContact ND2-OG 3.48Å; N318-S320 PolarHBondContact OD1-N 3.47Å; N318-S320 PolarHBondContact OD1-OG 2.67Å; N318-E321 HydrophobicContact CB-CB 4.44Å; N318-E321 HydrophobicContact CB-CG 4.16Å; N318-E321 VanDerWaalsContact CB-OE1 3.29Å; N318-E321 WeakPolarHBondContact CB-OE1 3.45Å; N318-E321 PolarHBondContact ND2-OE1 2.85Å
319	S	92.9	Very high	93.8	Very high	42 Å²	42	41.6 Å²	41.6	29%	0.294	22%	0.215	S	C	.	.	S	Bend	trans	-73.2	-38.6	-176.9	54	0	0	0	0	113.1	E321 R322	S319-E321 VanDerWaalsContact C-N 3.29Å; S319-E321 PolarHBondContact O-N 2.9Å; S319-R322 WeakPolarHBondContact O-CB 3Å; S319-R322 PolarHBondContact O-N 2.87Å; S319-R322 VanDerWaalsContact O-N 3.12Å
320	S	89.9	Confident	93.3	Very high	59 Å²	59	38.6 Å²	38.6	41%	0.413	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-27.9	-176.9	63.6	0	0	0	0	113.5	N318 R322	N318-S320 PolarHBondContact ND2-OG 3.48Å; N318-S320 PolarHBondContact OD1-N 3.47Å; N318-S320 PolarHBondContact OD1-OG 2.67Å; S320-R322 VanDerWaalsContact C-N 3.29Å; S320-R322 PolarHBondContact O-N 3.44Å
321	E	91.1	Very high	92.8	Very high	99 Å²	99	40 Å²	40	46%	0.463	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-15.3	175.2	-68.5	171.9	-138.3	0	0	113.5	R316 N318 S319	R316-E321 HydrophobicContact CB-CB 4.45Å; R316-E321 PolarHBondContact NH1-O 3.46Å; N318-E321 HydrophobicContact CB-CB 4.44Å; N318-E321 HydrophobicContact CB-CG 4.16Å; N318-E321 VanDerWaalsContact CB-OE1 3.29Å; N318-E321 WeakPolarHBondContact CB-OE1 3.45Å; N318-E321 PolarHBondContact ND2-OE1 2.85Å; S319-E321 VanDerWaalsContact C-N 3.29Å; S319-E321 PolarHBondContact O-N 2.9Å
322	R	95.6	Very high	92	Very high	5 Å²	5	44.3 Å²	44.3	2%	0.019	23%	0.232	C	C	.	.	S	Bend	trans	-66.8	157	-178.4	-62.2	178.6	-164	146.4	16.8	111.2	E248 A257 I260 G313 C314 R316 T317 S319 S320 K426	E248-R322 IonicContact OE1-CZ 2.69Å; E248-R322 IonicContact OE1-NH1 2.77Å; E248-R322 PolarHBondContact OE1-NH1 2.86Å; E248-R322 IonicContact OE1-NH2 2.67Å; E248-R322 PolarHBondContact OE1-NH2 2.87Å; E248-R322 IonicContact OE2-CZ 2.73Å; E248-R322 IonicContact OE2-NH1 3.21Å; E248-R322 IonicContact OE2-NH2 2.7Å; E248-R322 PolarHBondContact OE2-NH2 2.99Å; A257-R322 VanDerWaalsContact C-NH1 3.35Å; A257-R322 PolarHBondContact O-NH1 3.07Å; I260-R322 HydrophobicContact CG2-CB 4.25Å; G313-R322 VanDerWaalsContact O-CA 3.29Å; G313-R322 WeakPolarHBondContact O-CA 3.12Å; C314-R322 VanDerWaalsContact O-CD 3.29Å; C314-R322 WeakPolarHBondContact O-CD 3.43Å; R316-R322 HydrophobicContact CB-CG 4.1Å; R316-R322 PolarHBondContact O-NE 3.36Å; R316-R322 PolarHBondContact O-NH2 2.77Å; T317-R322 PolarHBondContact O-NH2 3.02Å; S319-R322 WeakPolarHBondContact O-CB 3Å; S319-R322 PolarHBondContact O-N 2.87Å; S319-R322 VanDerWaalsContact O-N 3.12Å; S320-R322 VanDerWaalsContact C-N 3.29Å; S320-R322 PolarHBondContact O-N 3.44Å; R322-K426 PolarHBondContact O-NZ 2.84Å
323	F	94.1	Very high	91.5	Very high	40 Å²	40	41.6 Å²	41.6	18%	0.175	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-65.9	139.8	167.2	-70.5	-58.9	0	0	0	110.5	I260 G313 D327 L328	I260-F323 WeakPolarHBondContact CG1-O 3.15Å; I260-F323 WeakPolarHBondContact CG2-O 3.46Å; G313-F323 PolarHBondContact O-N 2.89Å; F323-D327 HydrophobicContact CB-CB 4.14Å; F323-D327 HydrophobicContact CD1-CB 3.88Å; F323-D327 HydrophobicContact CG-CB 4.43Å; F323-L328 HydrophobicContact CB-CD1 4.26Å; F323-L328 HydrophobicContact CB-CD2 3.68Å; F323-L328 HydrophobicContact CB-CG 3.7Å; F323-L328 HydrophobicContact CD2-CD2 3.7Å; F323-L328 HydrophobicContact CG-CD2 3.88Å; F323-L328 HydrophobicContact CG-CG 4.41Å
324	T	93	Very high	91.1	Very high	61 Å²	61	42 Å²	42	37%	0.374	22%	0.222	S	C	.	.	P	Polyproline II helix	trans	-76.5	162.6	166.3	67.7	0	0	0	0	110.2	Q326 D327 L328	T324-Q326 PolarHBondContact O-N 3.05Å; T324-Q326 VanDerWaalsContact O-N 3.15Å; T324-Q326 PolarHBondContact OG1-N 2.89Å; T324-D327 PolarHBondContact N-OD2 3.38Å; T324-D327 PolarHBondContact O-N 3.43Å; T324-D327 VanDerWaalsContact O-N 3.12Å; T324-D327 PolarHBondContact OG1-N 2.84Å; T324-D327 VanDerWaalsContact OG1-N 3.07Å; T324-D327 PolarHBondContact OG1-OD1 2.88Å; T324-D327 PolarHBondContact OG1-OD2 2.83Å; T324-L328 WeakPolarHBondContact O-CG 3.42Å; T324-L328 PolarHBondContact O-N 2.68Å
325	V	94.6	Very high	90	Very high	10 Å²	10	44.4 Å²	44.4	6%	0.061	23%	0.233	C	C	.	.	H	α-helix	trans	-56.8	-31.9	172.2	-168.1	0	0	0	0	111.1	L187 L190 H191 H194 I260 L328 L329	L187-V325 HydrophobicContact CB-CG1 4.37Å; L187-V325 HydrophobicContact CD2-CG1 4.12Å; L187-V325 VanDerWaalsContact O-CG1 3.31Å; L187-V325 WeakPolarHBondContact O-CG1 3.41Å; L190-V325 HydrophobicContact CB-CG2 4.26Å; H191-V325 HydrophobicContact CB-CG1 3.76Å; H194-V325 VanDerWaalsContact ND1-CG2 3.32Å; H194-V325 WeakPolarHBondContact ND1-CG2 3.17Å; I260-V325 HydrophobicContact CD1-CB 4.41Å; I260-V325 HydrophobicContact CD1-CG2 3.57Å; V325-L328 PolarHBondContact O-N 2.81Å; V325-L329 HydrophobicContact CG1-CD1 4.07Å; V325-L329 HydrophobicContact CG1-CG 4.3Å; V325-L329 WeakPolarHBondContact O-CB 3.38Å; V325-L329 VanDerWaalsContact O-CG 3.26Å; V325-L329 WeakPolarHBondContact O-CG 3.45Å; V325-L329 PolarHBondContact O-N 3.1Å
326	Q	90.7	Very high	88.4	Confident	94 Å²	94	50.7 Å²	50.7	44%	0.439	26%	0.262	S	S	.	.	H	α-helix	trans	-69.7	-42.9	178	-163.9	65.4	28.7	0	0	112.1	H191 T324 L328 L329 G330	H191-Q326 PolarHBondContact CE1-OE1 2.9Å; H191-Q326 VanDerWaalsContact CE1-OE1 3.24Å; T324-Q326 PolarHBondContact O-N 3.05Å; T324-Q326 VanDerWaalsContact O-N 3.15Å; T324-Q326 PolarHBondContact OG1-N 2.89Å; Q326-L328 VanDerWaalsContact C-N 3.3Å; Q326-L328 PolarHBondContact O-N 3.02Å; Q326-L329 PolarHBondContact O-N 3.39Å; Q326-G330 PolarHBondContact O-N 3.44Å
327	D	89.9	Confident	86.9	Confident	41 Å²	41	52.3 Å²	52.3	22%	0.219	27%	0.271	C	S	.	.	H	α-helix	trans	-59.5	-44.3	174.8	-56.4	-33	0	0	0	110.1	F323 T324 G330 H331 K426	F323-D327 HydrophobicContact CB-CB 4.14Å; F323-D327 HydrophobicContact CD1-CB 3.88Å; F323-D327 HydrophobicContact CG-CB 4.43Å; T324-D327 PolarHBondContact N-OD2 3.38Å; T324-D327 PolarHBondContact O-N 3.43Å; T324-D327 VanDerWaalsContact O-N 3.12Å; T324-D327 PolarHBondContact OG1-N 2.84Å; T324-D327 VanDerWaalsContact OG1-N 3.07Å; T324-D327 PolarHBondContact OG1-OD1 2.88Å; T324-D327 PolarHBondContact OG1-OD2 2.83Å; D327-G330 CarbonylContact O-C 3.59Å; D327-G330 PolarHBondContact O-N 3.11Å; D327-H331 PolarHBondContact O-N 2.89Å; D327-K426 IonicContact OD2-NZ 3.19Å
328	L	94.1	Very high	85.5	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-66.2	-44.5	178.3	-65.2	174.4	0	0	0	112.3	L187 I260 F263 I310 F323 T324 V325 Q326 G330 H331 F334	L187-L328 HydrophobicContact CD1-CB 3.82Å; L187-L328 HydrophobicContact CD2-CB 3.84Å; L187-L328 HydrophobicContact CD2-CD1 3.6Å; L187-L328 HydrophobicContact CD2-CG 4.36Å; L187-L328 HydrophobicContact CG-CB 4.49Å; I260-L328 HydrophobicContact CD1-CD1 4.07Å; I260-L328 HydrophobicContact CG2-CD1 4.38Å; F263-L328 HydrophobicContact CD1-CD1 4.03Å; F263-L328 HydrophobicContact CE1-CD1 3.94Å; I310-L328 HydrophobicContact CG2-CD2 3.96Å; F323-L328 HydrophobicContact CB-CD1 4.26Å; F323-L328 HydrophobicContact CB-CD2 3.68Å; F323-L328 HydrophobicContact CB-CG 3.7Å; F323-L328 HydrophobicContact CD2-CD2 3.7Å; F323-L328 HydrophobicContact CG-CD2 3.88Å; F323-L328 HydrophobicContact CG-CG 4.41Å; T324-L328 WeakPolarHBondContact O-CG 3.42Å; T324-L328 PolarHBondContact O-N 2.68Å; V325-L328 PolarHBondContact O-N 2.81Å; Q326-L328 VanDerWaalsContact C-N 3.3Å; Q326-L328 PolarHBondContact O-N 3.02Å; L328-G330 PolarHBondContact O-N 3.13Å; L328-H331 WeakPolarHBondContact O-CB 3.26Å; L328-H331 PolarHBondContact O-N 2.79Å; L328-H331 VanDerWaalsContact O-N 3.08Å; L328-F334 WeakPolarHBondContact O-CD2 3.43Å
329	L	90.8	Very high	84.5	Confident	43 Å²	43	48.6 Å²	48.6	23%	0.225	25%	0.253	C	S	.	.	H	α-helix	trans	-64.4	-26.3	174.9	-72.6	173.3	0	0	0	112.8	L184 L187 K188 H191 V325 Q326	L184-L329 HydrophobicContact CD1-CD2 3.56Å; L187-L329 HydrophobicContact CB-CD2 3.76Å; L187-L329 HydrophobicContact CB-CG 4.26Å; K188-L329 HydrophobicContact CG-CD2 4.23Å; H191-L329 HydrophobicContact CB-CD1 3.99Å; V325-L329 HydrophobicContact CG1-CD1 4.07Å; V325-L329 HydrophobicContact CG1-CG 4.3Å; V325-L329 WeakPolarHBondContact O-CB 3.38Å; V325-L329 VanDerWaalsContact O-CG 3.26Å; V325-L329 WeakPolarHBondContact O-CG 3.45Å; V325-L329 PolarHBondContact O-N 3.1Å; Q326-L329 PolarHBondContact O-N 3.39Å
330	G	83	Confident	83.8	Confident	31 Å²	31	47.1 Å²	47.1	32%	0.32	24%	0.241	S	C	.	.	H	α-helix	trans	-81.9	-17.7	171.9	0	0	0	0	0	114.7	Q326 D327 L328 Q335	Q326-G330 PolarHBondContact O-N 3.44Å; D327-G330 CarbonylContact O-C 3.59Å; D327-G330 PolarHBondContact O-N 3.11Å; L328-G330 PolarHBondContact O-N 3.13Å; G330-Q335 PolarHBondContact O-NE2 2.91Å
331	H	86	Confident	83.3	Confident	30 Å²	30	46.4 Å²	46.4	14%	0.139	23%	0.23	C	C	.	.	S	Bend	trans	-64.5	140	-171.6	-169.3	-99.6	0	0	0	112.8	I310 D327 L328 F333 F334 Q335	I310-H331 WeakPolarHBondContact CD1-ND1 3.49Å; I310-H331 VanDerWaalsContact CG1-CE1 3.47Å; I310-H331 WeakPolarHBondContact CG1-CE1 3.31Å; I310-H331 WeakPolarHBondContact CG1-ND1 3.27Å; D327-H331 PolarHBondContact O-N 2.89Å; L328-H331 WeakPolarHBondContact O-CB 3.26Å; L328-H331 PolarHBondContact O-N 2.79Å; L328-H331 VanDerWaalsContact O-N 3.08Å; H331-F333 VanDerWaalsContact C-N 3.26Å; H331-F333 WeakPolarHBondContact ND1-CB 3.4Å; H331-F333 PolarHBondContact ND1-N 3.48Å; H331-F333 PolarHBondContact O-N 2.86Å; H331-F333 VanDerWaalsContact O-N 3.12Å; H331-F334 HydrophobicContact CB-CD2 4.3Å; H331-F334 PolarHBondContact O-N 3.48Å; H331-Q335 PolarHBondContact O-N 3.31Å
332	R	80.8	Confident	83.2	Confident	89 Å²	89	42.2 Å²	42.2	34%	0.336	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-47.6	-46.4	-175	178.3	-173.5	-178.6	167.1	7.9	113	E306 F334 Q335 Y341 E343	E306-R332 VanDerWaalsContact OE1-CD 3.29Å; E306-R332 WeakPolarHBondContact OE1-CD 3.18Å; E306-R332 IonicContact OE1-CZ 3.03Å; E306-R332 IonicContact OE1-NE 3.9Å; E306-R332 PolarHBondContact OE1-NE 3.43Å; E306-R332 IonicContact OE1-NH1 3.33Å; R332-F334 PolarHBondContact O-N 3.21Å; R332-F334 VanDerWaalsContact O-N 3.13Å; R332-Q335 PolarHBondContact O-N 2.86Å; R332-Y341 VanDerWaalsContact NH2-CG 3.3Å; R332-Y341 VanDerWaalsContact NH2-CZ 3.35Å; R332-E343 IonicContact CZ-OE1 2.68Å; R332-E343 IonicContact NH1-OE1 2.67Å; R332-E343 PolarHBondContact NH1-OE1 3.06Å; R332-E343 IonicContact NH2-OE1 2.73Å; R332-E343 PolarHBondContact NH2-OE1 3.38Å
333	F	86.1	Confident	82.8	Confident	10 Å²	10	44.2 Å²	44.2	4%	0.044	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-54.9	-29.9	-180	-177.8	-99.1	0	0	0	113.7	L176 L179 Q180 M267 E306 L307 I310 H331	L176-F333 HydrophobicContact CD1-CE2 3.93Å; L176-F333 HydrophobicContact CD1-CZ 3.89Å; L176-F333 HydrophobicContact CG-CE2 4.37Å; L179-F333 HydrophobicContact CD2-CE1 4.23Å; L179-F333 HydrophobicContact CD2-CZ 4.13Å; Q180-F333 HydrophobicContact CB-CE1 4Å; Q180-F333 HydrophobicContact CB-CZ 4.02Å; Q180-F333 HydrophobicContact CG-CD1 4.33Å; Q180-F333 HydrophobicContact CG-CE1 4Å; Q180-F333 HydrophobicContact CG-CZ 4.26Å; Q180-F333 VanDerWaalsContact CG-O 3.3Å; Q180-F333 WeakPolarHBondContact CG-O 3.33Å; Q180-F333 PolarHBondContact NE2-O 3.41Å; M267-F333 HydrophobicContact CE-CD1 3.96Å; M267-F333 HydrophobicContact CE-CE1 3.59Å; M267-F333 HydrophobicContact CE-CZ 4.34Å; E306-F333 HydrophobicContact CB-CD2 4.32Å; L307-F333 HydrophobicContact CD1-CZ 4.45Å; I310-F333 HydrophobicContact CD1-CB 3.44Å; I310-F333 VanDerWaalsContact CD1-CB 3.44Å; I310-F333 HydrophobicContact CD1-CD1 3.58Å; I310-F333 HydrophobicContact CD1-CD2 4.37Å; I310-F333 HydrophobicContact CD1-CE1 4.44Å; I310-F333 HydrophobicContact CD1-CG 3.55Å; H331-F333 VanDerWaalsContact C-N 3.26Å; H331-F333 WeakPolarHBondContact ND1-CB 3.4Å; H331-F333 PolarHBondContact ND1-N 3.48Å; H331-F333 PolarHBondContact O-N 2.86Å; H331-F333 VanDerWaalsContact O-N 3.12Å
334	F	86.9	Confident	82.4	Confident	10 Å²	10	44.2 Å²	44.2	4%	0.044	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-95.5	-7.5	-179.1	-69.1	-62	0	0	0	114.2	L184 L187 F263 M267 I310 L328 H331 R332	L184-F334 HydrophobicContact CB-CD1 3.89Å; L184-F334 HydrophobicContact CB-CE1 4.38Å; L184-F334 HydrophobicContact CD1-CB 4.34Å; L187-F334 HydrophobicContact CD1-CD1 4.47Å; L187-F334 HydrophobicContact CD1-CD2 3.95Å; L187-F334 HydrophobicContact CD1-CE1 4.18Å; L187-F334 HydrophobicContact CD1-CE2 3.6Å; L187-F334 HydrophobicContact CD1-CG 4.35Å; L187-F334 HydrophobicContact CD1-CZ 3.7Å; F263-F334 HydrophobicContact CZ-CZ 4.1Å; M267-F334 HydrophobicContact CE-CE1 4.4Å; M267-F334 HydrophobicContact CE-CE2 4.27Å; M267-F334 HydrophobicContact CE-CZ 3.62Å; M267-F334 HydrophobicContact SD-CZ 3.85Å; I310-F334 HydrophobicContact CD1-CE2 4.16Å; I310-F334 HydrophobicContact CG2-CE2 4.33Å; L328-F334 WeakPolarHBondContact O-CD2 3.43Å; H331-F334 HydrophobicContact CB-CD2 4.3Å; H331-F334 PolarHBondContact O-N 3.48Å; R332-F334 PolarHBondContact O-N 3.21Å; R332-F334 VanDerWaalsContact O-N 3.13Å
335	Q	74.5	Confident	82.1	Confident	50 Å²	50	42.2 Å²	42.2	23%	0.234	21%	0.212	C	C	.	.	S	Bend	trans	-74.1	149.9	172.8	-56.6	-170.8	32.5	0	0	110.4	G330 H331 R332 N415	G330-Q335 PolarHBondContact O-NE2 2.91Å; H331-Q335 PolarHBondContact O-N 3.31Å; R332-Q335 PolarHBondContact O-N 2.86Å; Q335-N415 PolarHBondContact OE1-ND2 3.13Å
336	E	64.1	Low	81.6	Confident	138 Å²	138	46.2 Å²	46.2	65%	0.645	23%	0.23	S	C	*	.			trans	-60.5	137.6	173.2	-62.2	168.5	121.7	0	0	109.4	T338 K411	E336-T338 PolarHBondContact O-N 3.48Å; E336-T338 PolarHBondContact O-OG1 2.94Å; E336-K411 IonicContact OE2-NZ 3.25Å; E336-K411 PolarHBondContact OE2-NZ 2.88Å
337	K	63	Low	81	Confident	115 Å²	115	50.1 Å²	50.1	50%	0.5	25%	0.248	S	C	.	.			trans	-70.9	83.1	175	-76.4	-171.9	174.2	-72.8	0	110.6	G339 E362	K337-G339 PolarHBondContact O-N 3.29Å; K337-E362 IonicContact NZ-OE1 2.77Å; K337-E362 PolarHBondContact NZ-OE1 3.46Å; K337-E362 IonicContact NZ-OE2 3.38Å; K337-E362 PolarHBondContact NZ-OE2 3.38Å
338	T	63.8	Low	80.5	Confident	43 Å²	43	50.1 Å²	50.1	26%	0.264	25%	0.248	S	C	.	.			trans	-65.9	-4.5	179.8	33.2	0	0	0	0	114.6	E336 Y340 V408 V412	E336-T338 PolarHBondContact O-N 3.48Å; E336-T338 PolarHBondContact O-OG1 2.94Å; T338-Y340 WeakPolarHBondContact O-CD2 3.42Å; T338-Y340 PolarHBondContact O-N 2.98Å; T338-Y340 VanDerWaalsContact O-N 3.15Å; T338-Y340 PolarHBondContact OG1-O 2.83Å; T338-V408 VanDerWaalsContact CB-CG1 3.48Å; T338-V408 HydrophobicContact CG2-CG1 3.53Å; T338-V412 HydrophobicContact CG2-CG2 4.29Å
339	G	69.6	Low	79.7	Confident	10 Å²	10	54 Å²	54	10%	0.103	27%	0.269	C	S	.	.	S	Bend	trans	75.4	-13.9	-170.6	0	0	0	0	0	113.8	K337 V361 E362	K337-G339 PolarHBondContact O-N 3.29Å; G339-V361 CarbonylContact O-C 3.58Å; G339-V361 WeakPolarHBondContact O-CA 3.15Å; G339-E362 PolarHBondContact O-N 3.25Å
340	Y	78.3	Confident	79	Confident	10 Å²	10	53.3 Å²	53.3	4%	0.039	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	138.8	178.2	-63.8	-82.6	0	0	0	110.2	T338 L359 R360 V361 L367 Y371 D405 V408 I409	T338-Y340 WeakPolarHBondContact O-CD2 3.42Å; T338-Y340 PolarHBondContact O-N 2.98Å; T338-Y340 VanDerWaalsContact O-N 3.15Å; T338-Y340 PolarHBondContact OG1-O 2.83Å; Y340-L359 HydrophobicContact CD1-CD1 4.17Å; Y340-R360 WeakPolarHBondContact CA-O 3.26Å; Y340-V361 HydrophobicContact CD1-CG2 3.94Å; Y340-V361 HydrophobicContact CE1-CG2 3.73Å; Y340-L367 HydrophobicContact CE2-CD2 4.03Å; Y340-L367 VanDerWaalsContact OH-CD2 3.3Å; Y340-L367 WeakPolarHBondContact OH-CD2 3.42Å; Y340-Y371 PolarHBondContact OH-OH 3.46Å; Y340-D405 HydrophobicContact CE2-CB 3.8Å; Y340-D405 PolarHBondContact OH-OD2 3.44Å; Y340-V408 HydrophobicContact CD2-CG1 4.29Å; Y340-I409 HydrophobicContact CD1-CD1 3.83Å; Y340-I409 HydrophobicContact CD1-CG1 3.89Å; Y340-I409 HydrophobicContact CD2-CD1 4.18Å; Y340-I409 HydrophobicContact CD2-CG1 3.98Å; Y340-I409 HydrophobicContact CE1-CD1 3.71Å; Y340-I409 HydrophobicContact CE1-CG1 4.29Å; Y340-I409 HydrophobicContact CE2-CD1 4.09Å; Y340-I409 HydrophobicContact CE2-CG1 4.38Å; Y340-I409 HydrophobicContact CG-CD1 4.05Å; Y340-I409 HydrophobicContact CG-CG1 3.72Å
341	Y	80.4	Confident	78.7	Confident	44 Å²	44	57.6 Å²	57.6	17%	0.173	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	155.4	171	60.8	-89	0	0	0	110.8	R332 E343 R360 E362	R332-Y341 VanDerWaalsContact NH2-CG 3.3Å; R332-Y341 VanDerWaalsContact NH2-CZ 3.35Å; Y341-E343 HydrophobicContact CD2-CG 4.02Å; Y341-E343 VanDerWaalsContact CE2-CD 3.42Å; Y341-E343 HydrophobicContact CE2-CG 4.17Å; Y341-E343 WeakPolarHBondContact CE2-OE1 3.37Å; Y341-R360 HydrophobicContact CD1-CB 4.33Å; Y341-R360 HydrophobicContact CD2-CB 3.98Å; Y341-R360 HydrophobicContact CE1-CB 3.85Å; Y341-R360 HydrophobicContact CE2-CB 3.45Å; Y341-R360 VanDerWaalsContact CE2-CB 3.45Å; Y341-R360 HydrophobicContact CE2-CG 4.08Å; Y341-R360 HydrophobicContact CG-CB 4.4Å; Y341-R360 PolarHBondContact N-O 3.1Å; Y341-R360 PolarHBondContact O-N 2.98Å; Y341-E362 HydrophobicContact CD1-CB 4.02Å; Y341-E362 HydrophobicContact CD1-CG 4.43Å; Y341-E362 HydrophobicContact CE1-CB 3.94Å; Y341-E362 HydrophobicContact CE1-CG 4.17Å
342	V	87.6	Confident	78.6	Confident	12 Å²	12	60.9 Å²	60.9	7%	0.073	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	123	177.6	175.8	0	0	0	0	109.8	L357 W358 L359 F379 V412 I413 R416	V342-L357 HydrophobicContact CG1-CB 3.97Å; V342-L357 HydrophobicContact CG1-CD1 4.16Å; V342-L357 HydrophobicContact CG1-CD2 4.17Å; V342-L357 HydrophobicContact CG1-CG 4.33Å; V342-W358 VanDerWaalsContact CA-O 3.3Å; V342-W358 WeakPolarHBondContact CA-O 3.23Å; V342-L359 HydrophobicContact CG2-CB 4.15Å; V342-L359 HydrophobicContact CG2-CD1 3.71Å; V342-F379 HydrophobicContact CG1-CE1 4.18Å; V342-F379 HydrophobicContact CG1-CZ 4Å; V342-V412 HydrophobicContact CB-CG1 4Å; V342-V412 HydrophobicContact CG2-CG1 3.66Å; V342-I413 HydrophobicContact CG2-CG1 3.89Å; V342-R416 HydrophobicContact CB-CB 4.19Å; V342-R416 HydrophobicContact CB-CG 4.44Å; V342-R416 HydrophobicContact CG1-CB 4.17Å; V342-R416 HydrophobicContact CG1-CG 4.09Å; V342-R416 WeakPolarHBondContact O-CD 3.49Å; V342-R416 WeakPolarHBondContact O-CG 3.47Å
343	E	87.2	Confident	78.7	Confident	47 Å²	47	59.1 Å²	59.1	22%	0.22	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	166.1	176.9	-81.2	165	179.3	0	0	110.9	R332 Y341 L357 W358 R360	R332-E343 IonicContact CZ-OE1 2.68Å; R332-E343 IonicContact NH1-OE1 2.67Å; R332-E343 PolarHBondContact NH1-OE1 3.06Å; R332-E343 IonicContact NH2-OE1 2.73Å; R332-E343 PolarHBondContact NH2-OE1 3.38Å; Y341-E343 HydrophobicContact CD2-CG 4.02Å; Y341-E343 VanDerWaalsContact CE2-CD 3.42Å; Y341-E343 HydrophobicContact CE2-CG 4.17Å; Y341-E343 WeakPolarHBondContact CE2-OE1 3.37Å; E343-L357 CarbonylContact O-C 3.33Å; E343-L357 VanDerWaalsContact O-CA 3.3Å; E343-L357 WeakPolarHBondContact O-CA 3.49Å; E343-L357 WeakPolarHBondContact O-CD2 3.41Å; E343-W358 PolarHBondContact N-O 3.33Å; E343-W358 PolarHBondContact O-N 3.34Å; E343-R360 WeakPolarHBondContact OE2-CD 3.36Å; E343-R360 IonicContact OE2-CZ 2.67Å; E343-R360 IonicContact OE2-NE 3.02Å; E343-R360 IonicContact OE2-NH1 2.64Å
344	L	86.9	Confident	78.8	Confident	39 Å²	39	60.5 Å²	60.5	20%	0.204	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	134.9	163.1	-85.6	167.5	0	0	0	108.6	E346 D348 L355 L357 I420	L344-E346 WeakPolarHBondContact CB-O 3.05Å; L344-D348 HydrophobicContact CD1-CB 3.98Å; L344-L355 HydrophobicContact CD2-CD2 4.33Å; L344-L357 HydrophobicContact CD2-CD2 3.88Å; L344-L357 HydrophobicContact CG-CD2 4.32Å; L344-I420 HydrophobicContact CD1-CD1 4.12Å; L344-I420 HydrophobicContact CD2-CD1 3.98Å; L344-I420 HydrophobicContact CG-CD1 3.92Å
345	A	85.8	Confident	79	Confident	20 Å²	20	60.2 Å²	60.2	17%	0.165	32%	0.323	C	S	.	.	S	Bend	trans	-89.5	-21.1	175.1	0	0	0	0	0	112.5	K356 W358	A345-K356 HydrophobicContact CB-CB 4.37Å; A345-K356 HydrophobicContact CB-CD 4.28Å; A345-K356 HydrophobicContact CB-CG 3.99Å; A345-K356 PolarHBondContact N-O 3.02Å; A345-W358 HydrophobicContact CB-CD2 3.67Å; A345-W358 HydrophobicContact CB-CE3 4.28Å; A345-W358 HydrophobicContact CB-CG 3.79Å; A345-W358 HydrophobicContact CB-CZ2 4.23Å
346	E	84.6	Confident	79.8	Confident	93 Å²	93	60.6 Å²	60.6	44%	0.435	32%	0.323	S	S	.	.	S	Bend	trans	-136.6	152.8	172.5	-77.5	169.2	-157.3	0	0	108	L344 K356	L344-E346 WeakPolarHBondContact CB-O 3.05Å; E346-K356 VanDerWaalsContact CD-CD 3.41Å; E346-K356 HydrophobicContact CG-CD 3.94Å; E346-K356 WeakPolarHBondContact OE1-CD 3.46Å; E346-K356 WeakPolarHBondContact OE1-CE 3.42Å; E346-K356 IonicContact OE1-NZ 2.79Å; E346-K356 PolarHBondContact OE1-NZ 3.31Å
347	E	78.5	Confident	81.1	Confident	177 Å²	177	54 Å²	54	83%	0.827	29%	0.293	S	S	*	.			trans	-62.2	146.5	177.5	-63.5	-166.1	153.6	0	0	111.9	D349	E347-D349 PolarHBondContact O-N 3.21Å
348	D	79.1	Confident	82.4	Confident	40 Å²	40	51.9 Å²	51.9	21%	0.214	28%	0.282	C	S	.	.			trans	-87.9	98.2	-179.9	-174	17.7	0	0	0	111.6	L344 G350 I420 R424	L344-D348 HydrophobicContact CD1-CB 3.98Å; D348-G350 PolarHBondContact O-N 2.92Å; D348-G350 WeakPolarHBondContact OD1-CA 2.94Å; D348-G350 PolarHBondContact OD1-N 2.92Å; D348-I420 VanDerWaalsContact OD2-CG2 3.23Å; D348-I420 WeakPolarHBondContact OD2-CG2 3.36Å; D348-R424 IonicContact OD1-CZ 2.96Å; D348-R424 IonicContact OD1-NE 3.93Å; D348-R424 PolarHBondContact OD1-NE 3.05Å; D348-R424 IonicContact OD1-NH2 3.5Å; D348-R424 PolarHBondContact OD1-NH2 3.4Å; D348-R424 IonicContact OD2-CZ 2.68Å; D348-R424 IonicContact OD2-NE 2.68Å; D348-R424 PolarHBondContact OD2-NE 3.17Å; D348-R424 IonicContact OD2-NH2 3.27Å; D348-R424 PolarHBondContact OD2-NH2 2.73Å
349	D	76.1	Confident	83.6	Confident	83 Å²	83	49.9 Å²	49.9	44%	0.444	27%	0.27	S	S	.	.			trans	-54.6	-19.5	170.8	-56.7	-57.6	0	0	0	113.2	E347 T351 K352	E347-D349 PolarHBondContact O-N 3.21Å; D349-T351 PolarHBondContact O-N 2.99Å; D349-K352 VanDerWaalsContact OD2-CD 3.32Å; D349-K352 WeakPolarHBondContact OD2-CD 3.48Å; D349-K352 WeakPolarHBondContact OD2-CE 3.47Å; D349-K352 IonicContact OD2-NZ 3.61Å; D349-K352 PolarHBondContact OD2-NZ 3.21Å
350	G	75.9	Confident	84.3	Confident	29 Å²	29	53.2 Å²	53.2	30%	0.299	28%	0.279	S	S	.	.	S	Bend	trans	81.7	-21.9	-175.9	0	0	0	0	0	114	D348 R424	D348-G350 PolarHBondContact O-N 2.92Å; D348-G350 WeakPolarHBondContact OD1-CA 2.94Å; D348-G350 PolarHBondContact OD1-N 2.92Å; G350-R424 VanDerWaalsContact O-CZ 3.31Å; G350-R424 PolarHBondContact O-NH1 2.91Å
351	T	78.1	Confident	84.4	Confident	121 Å²	121	55.2 Å²	55.2	74%	0.742	29%	0.292	S	S	*	.			trans	-84.5	-39.6	-177.7	55.2	0	0	0	0	113.4	D349	D349-T351 PolarHBondContact O-N 2.99Å
352	K	83.3	Confident	83.6	Confident	99 Å²	99	57.3 Å²	57.3	43%	0.43	30%	0.304	S	S	.	.			trans	-64.2	132.8	-179.2	-68.2	167.6	177.7	156.4	0	111	D349 R424	D349-K352 VanDerWaalsContact OD2-CD 3.32Å; D349-K352 WeakPolarHBondContact OD2-CD 3.48Å; D349-K352 WeakPolarHBondContact OD2-CE 3.47Å; D349-K352 IonicContact OD2-NZ 3.61Å; D349-K352 PolarHBondContact OD2-NZ 3.21Å; K352-R424 VanDerWaalsContact O-CZ 3.28Å; K352-R424 PolarHBondContact O-NH1 3.41Å; K352-R424 PolarHBondContact O-NH2 3.26Å
353	A	83.4	Confident	82.2	Confident	51 Å²	51	59.3 Å²	59.3	42%	0.421	31%	0.314	S	S	.	.	S	Bend	trans	-78	-27.9	174.9	0	0	0	0	0	112.9	L383	A353-L383 WeakPolarHBondContact O-CB 3.39Å; A353-L383 PolarHBondContact O-N 3.12Å
354	A	88.3	Confident	80.7	Confident	39 Å²	39	62.6 Å²	62.6	32%	0.322	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	130.1	171.5	0	0	0	0	0	110.7	F381 E382	A354-F381 WeakPolarHBondContact CA-O 3.33Å; A354-E382 HydrophobicContact CB-CG 4.2Å
355	L	90	Very high	79	Confident	4 Å²	4	70.3 Å²	70.3	2%	0.021	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	143.3	164.7	-59.9	178.7	0	0	0	109.4	L344 L357 L380 F381 L383 V417 I420	L344-L355 HydrophobicContact CD2-CD2 4.33Å; L355-L357 HydrophobicContact CB-CD1 4.39Å; L355-L357 HydrophobicContact CB-CD2 4.27Å; L355-L357 HydrophobicContact CB-CG 4.08Å; L355-L357 HydrophobicContact CD1-CD2 4.49Å; L355-L380 WeakPolarHBondContact O-CA 3.41Å; L355-F381 PolarHBondContact N-O 2.52Å; L355-F381 PolarHBondContact O-N 2.96Å; L355-L383 HydrophobicContact CD1-CD1 3.46Å; L355-L383 VanDerWaalsContact CD1-CD1 3.46Å; L355-L383 HydrophobicContact CD2-CD1 4.43Å; L355-L383 HydrophobicContact CG-CD1 3.87Å; L355-V417 HydrophobicContact CD1-CG2 4.49Å; L355-I420 HydrophobicContact CD1-CB 4.27Å; L355-I420 HydrophobicContact CD1-CD1 3.66Å; L355-I420 HydrophobicContact CD1-CG2 3.95Å; L355-I420 HydrophobicContact CD2-CG2 3.94Å
356	K	91.3	Very high	77.2	Confident	58 Å²	58	75.9 Å²	75.9	25%	0.252	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	120.2	169	-161.7	-175.9	173	174.2	0	108.7	A345 E346 E378 L380	A345-K356 HydrophobicContact CB-CB 4.37Å; A345-K356 HydrophobicContact CB-CD 4.28Å; A345-K356 HydrophobicContact CB-CG 3.99Å; A345-K356 PolarHBondContact N-O 3.02Å; E346-K356 VanDerWaalsContact CD-CD 3.41Å; E346-K356 HydrophobicContact CG-CD 3.94Å; E346-K356 WeakPolarHBondContact OE1-CD 3.46Å; E346-K356 WeakPolarHBondContact OE1-CE 3.42Å; E346-K356 IonicContact OE1-NZ 2.79Å; E346-K356 PolarHBondContact OE1-NZ 3.31Å; K356-E378 WeakPolarHBondContact CE-OE1 3.41Å; K356-E378 HydrophobicContact CG-CG 4.43Å; K356-E378 IonicContact NZ-OE1 2.8Å; K356-E378 PolarHBondContact NZ-OE1 3.47Å; K356-L380 HydrophobicContact CB-CD2 4.14Å; K356-L380 HydrophobicContact CG-CD2 4.15Å
357	L	92.2	Very high	75.7	Confident	0 Å²	0	73 Å²	73	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	145.1	-167.2	-64.7	175.5	0	0	0	111.5	V342 E343 L344 L355 E378 F379 F381 R416 V417 I420	V342-L357 HydrophobicContact CG1-CB 3.97Å; V342-L357 HydrophobicContact CG1-CD1 4.16Å; V342-L357 HydrophobicContact CG1-CD2 4.17Å; V342-L357 HydrophobicContact CG1-CG 4.33Å; E343-L357 CarbonylContact O-C 3.33Å; E343-L357 VanDerWaalsContact O-CA 3.3Å; E343-L357 WeakPolarHBondContact O-CA 3.49Å; E343-L357 WeakPolarHBondContact O-CD2 3.41Å; L344-L357 HydrophobicContact CD2-CD2 3.88Å; L344-L357 HydrophobicContact CG-CD2 4.32Å; L355-L357 HydrophobicContact CB-CD1 4.39Å; L355-L357 HydrophobicContact CB-CD2 4.27Å; L355-L357 HydrophobicContact CB-CG 4.08Å; L355-L357 HydrophobicContact CD1-CD2 4.49Å; L357-E378 CarbonylContact O-C 3.56Å; L357-E378 WeakPolarHBondContact O-CA 3.48Å; L357-F379 HydrophobicContact CB-CD1 3.99Å; L357-F379 HydrophobicContact CB-CD2 4.39Å; L357-F379 HydrophobicContact CB-CE1 3.5Å; L357-F379 VanDerWaalsContact CB-CE1 3.5Å; L357-F379 HydrophobicContact CB-CE2 3.96Å; L357-F379 HydrophobicContact CB-CG 4.41Å; L357-F379 HydrophobicContact CB-CZ 3.48Å; L357-F379 VanDerWaalsContact CB-CZ 3.48Å; L357-F379 HydrophobicContact CD1-CE2 3.69Å; L357-F379 HydrophobicContact CD1-CZ 3.63Å; L357-F379 HydrophobicContact CG-CE2 4.42Å; L357-F379 HydrophobicContact CG-CZ 4.2Å; L357-F379 PolarHBondContact N-O 2.7Å; L357-F379 WeakPolarHBondContact O-CD1 3.41Å; L357-F379 PolarHBondContact O-N 3.15Å; L357-F381 HydrophobicContact CD1-CB 3.73Å; L357-F381 HydrophobicContact CD1-CG 4.27Å; L357-R416 HydrophobicContact CD2-CG 4.42Å; L357-V417 HydrophobicContact CD1-CG2 4.21Å; L357-I420 HydrophobicContact CD2-CD1 4.31Å
358	W	90.1	Very high	74.2	Confident	70 Å²	70	73.6 Å²	73.6	27%	0.265	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	114.6	170.5	-78.2	-29.3	0	0	0	110.3	V342 E343 A345 R360 I377 E378	V342-W358 VanDerWaalsContact CA-O 3.3Å; V342-W358 WeakPolarHBondContact CA-O 3.23Å; E343-W358 PolarHBondContact N-O 3.33Å; E343-W358 PolarHBondContact O-N 3.34Å; A345-W358 HydrophobicContact CB-CD2 3.67Å; A345-W358 HydrophobicContact CB-CE3 4.28Å; A345-W358 HydrophobicContact CB-CG 3.79Å; A345-W358 HydrophobicContact CB-CZ2 4.23Å; W358-R360 HydrophobicContact CB-CG 4.26Å; W358-I377 WeakPolarHBondContact CA-O 3.49Å; W358-E378 PolarHBondContact NE1-OE2 2.74Å
359	L	89.4	Confident	72.8	Confident	2 Å²	2	73.5 Å²	73.5	1%	0.01	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	119.7	162.3	172.4	65.8	0	0	0	108.6	Y340 V342 I377 F379 M395 V401 I409	Y340-L359 HydrophobicContact CD1-CD1 4.17Å; V342-L359 HydrophobicContact CG2-CB 4.15Å; V342-L359 HydrophobicContact CG2-CD1 3.71Å; L359-I377 HydrophobicContact CB-CB 4.26Å; L359-I377 HydrophobicContact CD2-CD1 4.09Å; L359-I377 PolarHBondContact N-O 3.41Å; L359-I377 PolarHBondContact O-N 2.87Å; L359-F379 HydrophobicContact CB-CD1 4.46Å; L359-F379 HydrophobicContact CB-CE1 3.99Å; L359-M395 HydrophobicContact CB-CE 4.36Å; L359-M395 HydrophobicContact CD2-CE 4Å; L359-M395 HydrophobicContact CD2-SD 3.52Å; L359-M395 VanDerWaalsContact CD2-SD 3.52Å; L359-V401 HydrophobicContact CD2-CG2 4.28Å; L359-I409 HydrophobicContact CD1-CG1 4.3Å; L359-I409 HydrophobicContact CD1-CG2 4.25Å; L359-I409 HydrophobicContact CD2-CD1 4.29Å; L359-I409 HydrophobicContact CD2-CG1 4.32Å; L359-I409 HydrophobicContact CD2-CG2 3.7Å
360	R	84.4	Confident	71.4	Confident	79 Å²	79	80 Å²	80	30%	0.298	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	149.8	-177.3	-71.7	176.6	171.7	-142.1	2.1	111.1	Y340 Y341 E343 W358 A376	Y340-R360 WeakPolarHBondContact CA-O 3.26Å; Y341-R360 HydrophobicContact CD1-CB 4.33Å; Y341-R360 HydrophobicContact CD2-CB 3.98Å; Y341-R360 HydrophobicContact CE1-CB 3.85Å; Y341-R360 HydrophobicContact CE2-CB 3.45Å; Y341-R360 VanDerWaalsContact CE2-CB 3.45Å; Y341-R360 HydrophobicContact CE2-CG 4.08Å; Y341-R360 HydrophobicContact CG-CB 4.4Å; Y341-R360 PolarHBondContact N-O 3.1Å; Y341-R360 PolarHBondContact O-N 2.98Å; E343-R360 WeakPolarHBondContact OE2-CD 3.36Å; E343-R360 IonicContact OE2-CZ 2.67Å; E343-R360 IonicContact OE2-NE 3.02Å; E343-R360 IonicContact OE2-NH1 2.64Å; W358-R360 HydrophobicContact CB-CG 4.26Å; R360-A376 HydrophobicContact CG-CB 3.89Å
361	V	80	Confident	70.4	Confident	52 Å²	52	82.3 Å²	82.3	32%	0.315	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	125.1	178.3	179.5	0	0	0	0	109.7	G339 Y340 L367	G339-V361 CarbonylContact O-C 3.58Å; G339-V361 WeakPolarHBondContact O-CA 3.15Å; Y340-V361 HydrophobicContact CD1-CG2 3.94Å; Y340-V361 HydrophobicContact CE1-CG2 3.73Å; V361-L367 HydrophobicContact CG1-CD1 3.72Å; V361-L367 HydrophobicContact CG1-CG 4.44Å; V361-L367 HydrophobicContact CG2-CD1 4.24Å
362	E	64.6	Low	69	Low	89 Å²	89	85 Å²	85	42%	0.416	41%	0.409	S	S	.	.	S	Bend	trans	-86.4	-37.3	178.8	-153.5	-168.2	140.7	0	0	112.4	K337 G339 Y341	K337-E362 IonicContact NZ-OE1 2.77Å; K337-E362 PolarHBondContact NZ-OE1 3.46Å; K337-E362 IonicContact NZ-OE2 3.38Å; K337-E362 PolarHBondContact NZ-OE2 3.38Å; G339-E362 PolarHBondContact O-N 3.25Å; Y341-E362 HydrophobicContact CD1-CB 4.02Å; Y341-E362 HydrophobicContact CD1-CG 4.43Å; Y341-E362 HydrophobicContact CE1-CB 3.94Å; Y341-E362 HydrophobicContact CE1-CG 4.17Å
363	D	56.3	Low	67.4	Low	53 Å²	53	85.6 Å²	85.6	28%	0.283	42%	0.417	S	S	.	.			trans	-125.9	69.1	-158.5	-147	-2.4	0	0	0	111.9	K365 K366	D363-K365 PolarHBondContact O-N 3.07Å; D363-K366 PolarHBondContact O-N 2.97Å; D363-K366 WeakPolarHBondContact OD2-CD 3.19Å; D363-K366 VanDerWaalsContact OD2-CE 3.23Å; D363-K366 WeakPolarHBondContact OD2-CE 3.35Å; D363-K366 IonicContact OD2-NZ 3.25Å; D363-K366 PolarHBondContact OD2-NZ 3.14Å
364	K	55.6	Low	66.1	Low	116 Å²	116	87.2 Å²	87.2	50%	0.504	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47	-23.5	-177	-70.8	-172.8	174	-171.1	0	115.1	D373 N374	K364-D373 WeakPolarHBondContact CD-OD1 3.3Å; K364-D373 VanDerWaalsContact CE-OD1 3.32Å; K364-D373 WeakPolarHBondContact CE-OD1 3.21Å; K364-D373 IonicContact NZ-OD1 2.65Å; K364-D373 PolarHBondContact NZ-OD1 3.18Å; K364-N374 PolarHBondContact NZ-OD1 2.98Å
365	K	52.7	Low	64.9	Low	202 Å²	202	88.9 Å²	88.9	88%	0.878	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-5.3	-176.2	-65.5	-178.8	178.9	176.8	0	115	D363	D363-K365 PolarHBondContact O-N 3.07Å
366	K	48.4	Very low	64.2	Low	136 Å²	136	89.5 Å²	89.5	59%	0.591	43%	0.428	S	S	*	.	S	Bend	trans	-107.9	-11.9	-178.3	-74.8	-178.9	-175.9	148.1	0	115.2	D363 L368	D363-K366 PolarHBondContact O-N 2.97Å; D363-K366 WeakPolarHBondContact OD2-CD 3.19Å; D363-K366 VanDerWaalsContact OD2-CE 3.23Å; D363-K366 WeakPolarHBondContact OD2-CE 3.35Å; D363-K366 IonicContact OD2-NZ 3.25Å; D363-K366 PolarHBondContact OD2-NZ 3.14Å; K366-L368 PolarHBondContact O-N 3.49Å
367	L	51.1	Low	63.9	Low	34 Å²	34	87.5 Å²	87.5	18%	0.178	42%	0.42	C	S	.	.			trans	-81.1	108.6	-178.5	-59.2	-169.8	0	0	0	110	Y340 V361 G369 Y371	Y340-L367 HydrophobicContact CE2-CD2 4.03Å; Y340-L367 VanDerWaalsContact OH-CD2 3.3Å; Y340-L367 WeakPolarHBondContact OH-CD2 3.42Å; V361-L367 HydrophobicContact CG1-CD1 3.72Å; V361-L367 HydrophobicContact CG1-CG 4.44Å; V361-L367 HydrophobicContact CG2-CD1 4.24Å; L367-G369 PolarHBondContact O-N 3.15Å; L367-Y371 HydrophobicContact CB-CD2 3.64Å; L367-Y371 HydrophobicContact CB-CE2 3.74Å; L367-Y371 HydrophobicContact CD1-CD2 3.58Å; L367-Y371 HydrophobicContact CD1-CE2 3.7Å; L367-Y371 HydrophobicContact CD1-CG 4.1Å; L367-Y371 HydrophobicContact CG-CD2 4.23Å; L367-Y371 HydrophobicContact CG-CE2 4.2Å
368	L	48.9	Very low	63.8	Low	188 Å²	188	88.6 Å²	88.6	98%	0.984	43%	0.425	S	S	*	.			trans	-72	20.1	174.2	-82.5	94.9	0	0	0	113.7	K366	K366-L368 PolarHBondContact O-N 3.49Å
369	G	49.5	Very low	63.9	Low	38 Å²	38	85.4 Å²	85.4	39%	0.392	41%	0.413	S	S	.	.	S	Bend	trans	-115.3	153.3	178.6	0	0	0	0	0	112	L367 Y371	L367-G369 PolarHBondContact O-N 3.15Å; G369-Y371 WeakPolarHBondContact O-CD2 3.13Å; G369-Y371 PolarHBondContact O-N 3.42Å
370	K	45.3	Very low	64	Low	221 Å²	221	89.3 Å²	89.3	96%	0.961	43%	0.434	S	S	*	.			trans	-74.7	53.2	176.5	-62.7	-177.5	179.9	179.5	0	112.3	K372	K370-K372 PolarHBondContact O-N 3.42Å
371	Y	55.6	Low	64.4	Low	76 Å²	76	85.6 Å²	85.6	30%	0.298	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-68.8	122.7	176	-64	-82.6	0	0	0	109.2	Y340 L367 G369 C402 D405	Y340-Y371 PolarHBondContact OH-OH 3.46Å; L367-Y371 HydrophobicContact CB-CD2 3.64Å; L367-Y371 HydrophobicContact CB-CE2 3.74Å; L367-Y371 HydrophobicContact CD1-CD2 3.58Å; L367-Y371 HydrophobicContact CD1-CE2 3.7Å; L367-Y371 HydrophobicContact CD1-CG 4.1Å; L367-Y371 HydrophobicContact CG-CD2 4.23Å; L367-Y371 HydrophobicContact CG-CE2 4.2Å; G369-Y371 WeakPolarHBondContact O-CD2 3.13Å; G369-Y371 PolarHBondContact O-N 3.42Å; Y371-C402 WeakPolarHBondContact OH-CB 3.06Å; Y371-C402 PolarHBondContact OH-N 2.87Å; Y371-D405 PolarHBondContact OH-OD2 3.23Å
372	K	48.9	Very low	65	Low	177 Å²	177	86.4 Å²	86.4	77%	0.77	42%	0.42	S	S	*	.	P	Polyproline II helix	trans	-62.3	138	171.9	-74.1	-174.4	176	-177	0	109.3	K370	K370-K372 PolarHBondContact O-N 3.42Å
373	D	50.4	Low	66.1	Low	112 Å²	112	82.2 Å²	82.2	60%	0.599	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	138.8	-179.9	-81	-79	0	0	0	112.7	K364	K364-D373 WeakPolarHBondContact CD-OD1 3.3Å; K364-D373 VanDerWaalsContact CE-OD1 3.32Å; K364-D373 WeakPolarHBondContact CE-OD1 3.21Å; K364-D373 IonicContact NZ-OD1 2.65Å; K364-D373 PolarHBondContact NZ-OD1 3.18Å
374	N	54.7	Low	67.5	Low	85 Å²	85	87.8 Å²	87.8	46%	0.455	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.9	13.1	165.1	-50.6	-17.3	0	0	0	118.5	K364 A376 S996	K364-N374 PolarHBondContact NZ-OD1 2.98Å; N374-A376 PolarHBondContact O-N 2.93Å; N374-S996 WeakPolarHBondContact CB-OG 3.28Å
375	N	63.3	Low	69.2	Low	74 Å²	74	89.4 Å²	89.4	40%	0.396	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	113.4	176.5	-69	-0.1	0	0	0	112.9	V993	N375-V993 HydrophobicContact CB-CG1 3.92Å; N375-V993 VanDerWaalsContact CG-CG1 3.47Å
376	A	75.1	Confident	71.2	Confident	18 Å²	18	81.1 Å²	81.1	15%	0.149	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	132.7	149.4	0	0	0	0	0	108.4	R360 N374	R360-A376 HydrophobicContact CG-CB 3.89Å; N374-A376 PolarHBondContact O-N 2.93Å
377	I	85.7	Confident	73.3	Confident	16 Å²	16	77.4 Å²	77.4	8%	0.082	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	110	176.5	-60.8	157.8	0	0	0	107.4	W358 L359 M395 F400 V401 F991	W358-I377 WeakPolarHBondContact CA-O 3.49Å; L359-I377 HydrophobicContact CB-CB 4.26Å; L359-I377 HydrophobicContact CD2-CD1 4.09Å; L359-I377 PolarHBondContact N-O 3.41Å; L359-I377 PolarHBondContact O-N 2.87Å; I377-M395 HydrophobicContact CG2-CE 4.34Å; I377-F400 HydrophobicContact CD1-CB 3.91Å; I377-V401 HydrophobicContact CD1-CG2 4.34Å; I377-F991 HydrophobicContact CG2-CD1 4.31Å
378	E	89.4	Confident	75.4	Confident	23 Å²	23	76.5 Å²	76.5	11%	0.107	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	134.9	174.8	-167.8	170.5	121.9	0	0	110.1	K356 L357 W358 F991 Q992	K356-E378 WeakPolarHBondContact CE-OE1 3.41Å; K356-E378 HydrophobicContact CG-CG 4.43Å; K356-E378 IonicContact NZ-OE1 2.8Å; K356-E378 PolarHBondContact NZ-OE1 3.47Å; L357-E378 CarbonylContact O-C 3.56Å; L357-E378 WeakPolarHBondContact O-CA 3.48Å; W358-E378 PolarHBondContact NE1-OE2 2.74Å; E378-F991 CarbonylContact O-C 3.58Å; E378-F991 VanDerWaalsContact O-CA 3.31Å; E378-F991 WeakPolarHBondContact O-CA 3.47Å; E378-Q992 WeakPolarHBondContact CA-O 3.29Å; E378-Q992 HydrophobicContact CB-CB 4.3Å; E378-Q992 WeakPolarHBondContact CB-O 3.38Å; E378-Q992 PolarHBondContact N-O 3.41Å; E378-Q992 PolarHBondContact O-N 3.12Å
379	F	91.6	Very high	77.6	Confident	2 Å²	2	69.6 Å²	69.6	1%	0.009	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	152.6	179.7	69.4	-77.8	0	0	0	112.7	V342 L357 L359 F381 V391 M395 I413 R990 F991	V342-F379 HydrophobicContact CG1-CE1 4.18Å; V342-F379 HydrophobicContact CG1-CZ 4Å; L357-F379 HydrophobicContact CB-CD1 3.99Å; L357-F379 HydrophobicContact CB-CD2 4.39Å; L357-F379 HydrophobicContact CB-CE1 3.5Å; L357-F379 VanDerWaalsContact CB-CE1 3.5Å; L357-F379 HydrophobicContact CB-CE2 3.96Å; L357-F379 HydrophobicContact CB-CG 4.41Å; L357-F379 HydrophobicContact CB-CZ 3.48Å; L357-F379 VanDerWaalsContact CB-CZ 3.48Å; L357-F379 HydrophobicContact CD1-CE2 3.69Å; L357-F379 HydrophobicContact CD1-CZ 3.63Å; L357-F379 HydrophobicContact CG-CE2 4.42Å; L357-F379 HydrophobicContact CG-CZ 4.2Å; L357-F379 PolarHBondContact N-O 2.7Å; L357-F379 WeakPolarHBondContact O-CD1 3.41Å; L357-F379 PolarHBondContact O-N 3.15Å; L359-F379 HydrophobicContact CB-CD1 4.46Å; L359-F379 HydrophobicContact CB-CE1 3.99Å; F379-F381 HydrophobicContact CD2-CB 4.46Å; F379-F381 HydrophobicContact CE2-CB 4.22Å; F379-F381 HydrophobicContact CE2-CD2 4.26Å; F379-V391 HydrophobicContact CD2-CG1 3.71Å; F379-V391 HydrophobicContact CE2-CG1 3.9Å; F379-M395 HydrophobicContact CB-CE 4.2Å; F379-M395 HydrophobicContact CD1-CE 3.45Å; F379-M395 VanDerWaalsContact CD1-CE 3.45Å; F379-M395 HydrophobicContact CD2-CE 4Å; F379-M395 HydrophobicContact CE1-CE 3.69Å; F379-M395 HydrophobicContact CE2-CE 4.19Å; F379-M395 HydrophobicContact CG-CE 3.62Å; F379-M395 HydrophobicContact CZ-CE 4.05Å; F379-I413 HydrophobicContact CE2-CD1 4.25Å; F379-I413 HydrophobicContact CE2-CG1 4.42Å; F379-I413 HydrophobicContact CE2-CG2 4.2Å; F379-I413 HydrophobicContact CZ-CD1 4.05Å; F379-I413 HydrophobicContact CZ-CG1 3.89Å; F379-I413 HydrophobicContact CZ-CG2 4.27Å; F379-R990 WeakPolarHBondContact CA-O 3.46Å; F379-F991 HydrophobicContact CB-CD1 3.53Å; F379-F991 HydrophobicContact CB-CE1 3.7Å; F379-F991 HydrophobicContact CG-CD1 4.49Å; F379-F991 HydrophobicContact CG-CE1 4.34Å
380	L	92.1	Very high	79.7	Confident	85 Å²	85	73.2 Å²	73.2	45%	0.445	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	136.3	172.7	-70.8	164.2	0	0	0	111	L355 K356 R990	L355-L380 WeakPolarHBondContact O-CA 3.41Å; K356-L380 HydrophobicContact CB-CD2 4.14Å; K356-L380 HydrophobicContact CG-CD2 4.15Å; L380-R990 PolarHBondContact N-O 2.85Å; L380-R990 VanDerWaalsContact O-CD 3.31Å; L380-R990 WeakPolarHBondContact O-CD 3.44Å; L380-R990 PolarHBondContact O-NH1 3.22Å; L380-R990 VanDerWaalsContact O-NH1 3.07Å
381	F	93.6	Very high	82	Confident	1 Å²	1	62.7 Å²	62.7	0%	0.004	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	109.1	179.4	-170.2	-75.3	0	0	0	110.6	A354 L355 L357 F379 L383 D386 P388 V391 I413 V417	A354-F381 WeakPolarHBondContact CA-O 3.33Å; L355-F381 PolarHBondContact N-O 2.52Å; L355-F381 PolarHBondContact O-N 2.96Å; L357-F381 HydrophobicContact CD1-CB 3.73Å; L357-F381 HydrophobicContact CD1-CG 4.27Å; F379-F381 HydrophobicContact CD2-CB 4.46Å; F379-F381 HydrophobicContact CE2-CB 4.22Å; F379-F381 HydrophobicContact CE2-CD2 4.26Å; F381-L383 PolarHBondContact O-N 2.86Å; F381-D386 WeakPolarHBondContact CA-OD2 3.34Å; F381-D386 HydrophobicContact CD1-CB 4.15Å; F381-D386 HydrophobicContact CD2-CB 3.91Å; F381-D386 HydrophobicContact CE1-CB 3.83Å; F381-D386 HydrophobicContact CE2-CB 3.6Å; F381-D386 HydrophobicContact CG-CB 4.16Å; F381-D386 HydrophobicContact CZ-CB 3.55Å; F381-D386 VanDerWaalsContact CZ-O 3.23Å; F381-D386 WeakPolarHBondContact CZ-O 3.28Å; F381-P388 HydrophobicContact CE2-CB 4.45Å; F381-P388 HydrophobicContact CE2-CG 4.04Å; F381-P388 HydrophobicContact CZ-CG 3.93Å; F381-V391 HydrophobicContact CD2-CG2 3.84Å; F381-V391 HydrophobicContact CE2-CG2 3.85Å; F381-I413 HydrophobicContact CD2-CG2 3.91Å; F381-I413 HydrophobicContact CE2-CG2 3.86Å; F381-V417 HydrophobicContact CD1-CG1 4.17Å; F381-V417 HydrophobicContact CD1-CG2 3.67Å; F381-V417 HydrophobicContact CD2-CG2 4.13Å; F381-V417 HydrophobicContact CE1-CB 4.24Å; F381-V417 HydrophobicContact CE1-CG1 3.54Å; F381-V417 HydrophobicContact CE1-CG2 3.67Å; F381-V417 HydrophobicContact CE2-CG2 4.11Å; F381-V417 HydrophobicContact CG-CG2 3.94Å; F381-V417 HydrophobicContact CZ-CB 4.46Å; F381-V417 HydrophobicContact CZ-CG1 4.02Å; F381-V417 HydrophobicContact CZ-CG2 3.89Å
382	E	92.5	Very high	83.8	Confident	68 Å²	68	59 Å²	59	32%	0.318	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	107.4	174.9	-70.4	-154.2	-122.5	0	0	111.2	A354 Y384 K385 D386	A354-E382 HydrophobicContact CB-CG 4.2Å; E382-Y384 PolarHBondContact O-N 2.83Å; E382-K385 HydrophobicContact CB-CB 4.06Å; E382-K385 HydrophobicContact CB-CD 4.41Å; E382-K385 HydrophobicContact CB-CG 4.4Å; E382-K385 PolarHBondContact O-N 3.03Å; E382-K385 IonicContact OE1-NZ 2.83Å; E382-K385 PolarHBondContact OE1-NZ 3Å; E382-K385 WeakPolarHBondContact OE2-CD 3.14Å; E382-K385 WeakPolarHBondContact OE2-CE 3.5Å; E382-K385 IonicContact OE2-NZ 2.78Å; E382-K385 PolarHBondContact OE2-NZ 3.5Å; E382-D386 PolarHBondContact N-OD2 2.9Å; E382-D386 PolarHBondContact O-N 2.84Å
383	L	87.2	Confident	85.9	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.005	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	-27.7	-166.4	-156.7	78.2	0	0	0	115	A353 L355 F381 V417 K421	A353-L383 WeakPolarHBondContact O-CB 3.39Å; A353-L383 PolarHBondContact O-N 3.12Å; L355-L383 HydrophobicContact CD1-CD1 3.46Å; L355-L383 VanDerWaalsContact CD1-CD1 3.46Å; L355-L383 HydrophobicContact CD2-CD1 4.43Å; L355-L383 HydrophobicContact CG-CD1 3.87Å; F381-L383 PolarHBondContact O-N 2.86Å; L383-V417 HydrophobicContact CD1-CG1 4.12Å; L383-K421 HydrophobicContact CD1-CG 4.02Å; L383-K421 HydrophobicContact CD2-CG 3.98Å; L383-K421 HydrophobicContact CG-CD 4.48Å; L383-K421 HydrophobicContact CG-CG 3.95Å; L383-K421 WeakPolarHBondContact O-CE 3.12Å; L383-K421 PolarHBondContact O-NZ 2.78Å
384	Y	85.4	Confident	87.9	Confident	170 Å²	170	51.3 Å²	51.3	67%	0.667	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-116.7	-0.4	-175.3	-57.8	-72.8	0	0	0	114.7	E382	E382-Y384 PolarHBondContact O-N 2.83Å
385	K	90.8	Very high	89.6	Confident	150 Å²	150	47.3 Å²	47.3	65%	0.652	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-117.8	-40.4	178.1	-59.4	-177.3	-165.7	154	0	112.7	E382	E382-K385 HydrophobicContact CB-CB 4.06Å; E382-K385 HydrophobicContact CB-CD 4.41Å; E382-K385 HydrophobicContact CB-CG 4.4Å; E382-K385 PolarHBondContact O-N 3.03Å; E382-K385 IonicContact OE1-NZ 2.83Å; E382-K385 PolarHBondContact OE1-NZ 3Å; E382-K385 WeakPolarHBondContact OE2-CD 3.14Å; E382-K385 WeakPolarHBondContact OE2-CE 3.5Å; E382-K385 IonicContact OE2-NZ 2.78Å; E382-K385 PolarHBondContact OE2-NZ 3.5Å
386	D	94.6	Very high	90.9	Very high	28 Å²	28	44.9 Å²	44.9	15%	0.15	22%	0.215	C	C	.	.			trans	-78.7	139.7	-174.5	-81.4	-53.1	0	0	0	112.9	F381 E382 V391 R990	F381-D386 WeakPolarHBondContact CA-OD2 3.34Å; F381-D386 HydrophobicContact CD1-CB 4.15Å; F381-D386 HydrophobicContact CD2-CB 3.91Å; F381-D386 HydrophobicContact CE1-CB 3.83Å; F381-D386 HydrophobicContact CE2-CB 3.6Å; F381-D386 HydrophobicContact CG-CB 4.16Å; F381-D386 HydrophobicContact CZ-CB 3.55Å; F381-D386 VanDerWaalsContact CZ-O 3.23Å; F381-D386 WeakPolarHBondContact CZ-O 3.28Å; E382-D386 PolarHBondContact N-OD2 2.9Å; E382-D386 PolarHBondContact O-N 2.84Å; D386-V391 HydrophobicContact CB-CG2 3.97Å; D386-R990 IonicContact OD1-CZ 3.58Å; D386-R990 VanDerWaalsContact OD1-CZ 3.25Å; D386-R990 IonicContact OD1-NH1 3.07Å; D386-R990 PolarHBondContact OD1-NH1 3.16Å; D386-R990 IonicContact OD1-NH2 2.68Å; D386-R990 PolarHBondContact OD1-NH2 3.07Å; D386-R990 IonicContact OD2-CZ 2.66Å; D386-R990 IonicContact OD2-NH1 2.67Å; D386-R990 PolarHBondContact OD2-NH1 3.23Å
387	V	94.3	Very high	91.5	Very high	58 Å²	58	50.1 Å²	50.1	35%	0.352	24%	0.239	S	C	.	.			trans	-99.8	125.8	168.2	-173.7	0	0	0	0	108.4	E389 E390 V391	V387-E389 HydrophobicContact CG1-CB 4.14Å; V387-E389 WeakPolarHBondContact CG1-OE2 3.41Å; V387-E389 PolarHBondContact O-N 3.43Å; V387-E389 VanDerWaalsContact O-N 3.09Å; V387-E390 HydrophobicContact CB-CB 4.21Å; V387-E390 HydrophobicContact CB-CG 3.95Å; V387-E390 HydrophobicContact CG1-CG 4.49Å; V387-E390 PolarHBondContact O-N 2.79Å; V387-V391 PolarHBondContact O-N 3.23Å; V387-V391 VanDerWaalsContact O-N 3.11Å
388	P	94	Very high	91.5	Very high	16 Å²	16	52.7 Å²	52.7	10%	0.104	25%	0.252	C	S	.	.	H	α-helix	trans	-53.7	-32.3	-179.4	-29.4	37.6	0	0	0	114.7	F381 A392 I413 R414	F381-P388 HydrophobicContact CE2-CB 4.45Å; F381-P388 HydrophobicContact CE2-CG 4.04Å; F381-P388 HydrophobicContact CZ-CG 3.93Å; P388-A392 VanDerWaalsContact O-CB 3.29Å; P388-A392 WeakPolarHBondContact O-CB 3.29Å; P388-A392 PolarHBondContact O-N 2.92Å; P388-I413 HydrophobicContact CB-CB 4.12Å; P388-I413 HydrophobicContact CB-CG2 3.86Å; P388-I413 HydrophobicContact CG-CG2 4.39Å; P388-R414 HydrophobicContact CB-CB 3.8Å; P388-R414 HydrophobicContact CG-CB 3.81Å; P388-R414 HydrophobicContact CG-CG 4.14Å
389	E	95.1	Very high	91.1	Very high	43 Å²	43	54.5 Å²	54.5	20%	0.201	28%	0.277	C	S	.	.	H	α-helix	trans	-68.5	-37.4	175.1	-71.1	63.2	-145.4	0	0	112.4	V387 Q393 Y406 A410 R414	V387-E389 HydrophobicContact CG1-CB 4.14Å; V387-E389 WeakPolarHBondContact CG1-OE2 3.41Å; V387-E389 PolarHBondContact O-N 3.43Å; V387-E389 VanDerWaalsContact O-N 3.09Å; E389-Q393 WeakPolarHBondContact O-CB 3.34Å; E389-Q393 PolarHBondContact O-N 3.4Å; E389-Y406 VanDerWaalsContact O-CE2 3.27Å; E389-Y406 WeakPolarHBondContact O-CE2 3.37Å; E389-Y406 PolarHBondContact O-OH 3.32Å; E389-Y406 VanDerWaalsContact O-OH 3.14Å; E389-A410 HydrophobicContact CG-CB 4.05Å; E389-R414 IonicContact OE1-CZ 3.84Å; E389-R414 VanDerWaalsContact OE1-CZ 3.27Å; E389-R414 IonicContact OE1-NE 3.29Å; E389-R414 PolarHBondContact OE1-NE 3.35Å; E389-R414 IonicContact OE1-NH2 2.65Å; E389-R414 PolarHBondContact OE1-NH2 2.89Å; E389-R414 IonicContact OE2-NE 3.54Å; E389-R414 IonicContact OE2-NH2 3.85Å; E389-R414 PolarHBondContact OE2-NH2 2.65Å
390	E	94.1	Very high	90.5	Very high	113 Å²	113	55.8 Å²	55.8	53%	0.528	28%	0.283	S	S	.	.	H	α-helix	trans	-72.4	-44.5	177.5	-67	172.7	170.6	0	0	110.8	V387 A392 Q393 E394	V387-E390 HydrophobicContact CB-CB 4.21Å; V387-E390 HydrophobicContact CB-CG 3.95Å; V387-E390 HydrophobicContact CG1-CG 4.49Å; V387-E390 PolarHBondContact O-N 2.79Å; E390-A392 VanDerWaalsContact C-N 3.33Å; E390-A392 PolarHBondContact O-N 3.01Å; E390-Q393 CarbonylContact O-C 3.6Å; E390-Q393 WeakPolarHBondContact O-CA 3.29Å; E390-Q393 WeakPolarHBondContact O-CB 2.92Å; E390-Q393 PolarHBondContact O-N 3.23Å; E390-E394 PolarHBondContact O-N 2.95Å
391	V	94.3	Very high	90.1	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-59.1	-43.2	175	-176.4	0	0	0	0	111.6	F379 F381 D386 V387 Q393 E394 M395 I413 F991	F379-V391 HydrophobicContact CD2-CG1 3.71Å; F379-V391 HydrophobicContact CE2-CG1 3.9Å; F381-V391 HydrophobicContact CD2-CG2 3.84Å; F381-V391 HydrophobicContact CE2-CG2 3.85Å; D386-V391 HydrophobicContact CB-CG2 3.97Å; V387-V391 PolarHBondContact O-N 3.23Å; V387-V391 VanDerWaalsContact O-N 3.11Å; V391-Q393 VanDerWaalsContact C-N 3.29Å; V391-Q393 PolarHBondContact O-N 2.81Å; V391-E394 PolarHBondContact O-N 2.95Å; V391-M395 HydrophobicContact CG1-CE 4.33Å; V391-M395 WeakPolarHBondContact O-CG 3.5Å; V391-M395 PolarHBondContact O-N 3.17Å; V391-M395 VanDerWaalsContact O-N 3.11Å; V391-I413 HydrophobicContact CG1-CD1 4.32Å; V391-F991 HydrophobicContact CG1-CE1 4.11Å; V391-F991 HydrophobicContact CG1-CZ 4.17Å
392	A	93.6	Very high	89.6	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-67.4	-28.9	174.8	0	0	0	0	0	112.8	P388 E390 V396 Y406 I409 A410 I413	P388-A392 VanDerWaalsContact O-CB 3.29Å; P388-A392 WeakPolarHBondContact O-CB 3.29Å; P388-A392 PolarHBondContact O-N 2.92Å; E390-A392 VanDerWaalsContact C-N 3.33Å; E390-A392 PolarHBondContact O-N 3.01Å; A392-V396 WeakPolarHBondContact O-CG2 3.47Å; A392-V396 PolarHBondContact O-N 2.85Å; A392-Y406 HydrophobicContact CB-CD2 3.85Å; A392-Y406 HydrophobicContact CB-CE2 3.76Å; A392-I409 HydrophobicContact CB-CG2 4.16Å; A392-A410 HydrophobicContact CB-CB 3.79Å; A392-I413 HydrophobicContact CB-CD1 4.3Å
393	Q	92.4	Very high	89.2	Confident	63 Å²	63	59.2 Å²	59.2	29%	0.294	30%	0.3	S	S	.	.	H	α-helix	trans	-76.8	-34.4	177.5	-173.3	53.3	90.4	0	0	111.3	E389 E390 V391 V396 I397 Y406	E389-Q393 WeakPolarHBondContact O-CB 3.34Å; E389-Q393 PolarHBondContact O-N 3.4Å; E390-Q393 CarbonylContact O-C 3.6Å; E390-Q393 WeakPolarHBondContact O-CA 3.29Å; E390-Q393 WeakPolarHBondContact O-CB 2.92Å; E390-Q393 PolarHBondContact O-N 3.23Å; V391-Q393 VanDerWaalsContact C-N 3.29Å; V391-Q393 PolarHBondContact O-N 2.81Å; Q393-V396 PolarHBondContact O-N 3.41Å; Q393-I397 HydrophobicContact CG-CD1 4.17Å; Q393-I397 WeakPolarHBondContact O-CD1 3.32Å; Q393-I397 VanDerWaalsContact O-CG1 3.28Å; Q393-I397 WeakPolarHBondContact O-CG1 3.29Å; Q393-I397 PolarHBondContact O-N 3.12Å; Q393-Y406 HydrophobicContact CB-CD2 4.44Å; Q393-Y406 HydrophobicContact CB-CE2 3.74Å
394	E	92.6	Very high	89.1	Confident	64 Å²	64	63 Å²	63	30%	0.299	33%	0.331	S	S	.	.	H	α-helix	trans	-59.9	-48.2	167.5	-71.9	173.6	-146.6	0	0	111.4	E390 V391 V396 I397 L398 R990 F991	E390-E394 PolarHBondContact O-N 2.95Å; V391-E394 PolarHBondContact O-N 2.95Å; E394-V396 PolarHBondContact O-N 3.44Å; E394-V396 VanDerWaalsContact O-N 3.13Å; E394-I397 PolarHBondContact O-N 2.99Å; E394-L398 WeakPolarHBondContact O-CG 3.39Å; E394-L398 PolarHBondContact O-N 3.29Å; E394-R990 IonicContact OE1-CZ 2.93Å; E394-R990 IonicContact OE1-NE 2.92Å; E394-R990 IonicContact OE1-NH2 3.97Å; E394-R990 PolarHBondContact OE1-NH2 3.09Å; E394-R990 IonicContact OE2-CZ 2.8Å; E394-R990 IonicContact OE2-NE 3.73Å; E394-R990 PolarHBondContact OE2-NE 3.22Å; E394-R990 IonicContact OE2-NH2 3.8Å; E394-R990 PolarHBondContact OE2-NH2 3.48Å; E394-F991 HydrophobicContact CB-CE2 3.74Å; E394-F991 HydrophobicContact CB-CZ 3.71Å; E394-F991 WeakPolarHBondContact OE2-CE2 3.3Å; E394-F991 WeakPolarHBondContact OE2-CZ 3.48Å
395	M	90.3	Very high	89	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-55.7	-32.2	176.3	-69.3	178.3	175.9	0	0	113.1	L359 I377 F379 V391 G399 F400 V401 I409 I413 F991	L359-M395 HydrophobicContact CB-CE 4.36Å; L359-M395 HydrophobicContact CD2-CE 4Å; L359-M395 HydrophobicContact CD2-SD 3.52Å; L359-M395 VanDerWaalsContact CD2-SD 3.52Å; I377-M395 HydrophobicContact CG2-CE 4.34Å; F379-M395 HydrophobicContact CB-CE 4.2Å; F379-M395 HydrophobicContact CD1-CE 3.45Å; F379-M395 VanDerWaalsContact CD1-CE 3.45Å; F379-M395 HydrophobicContact CD2-CE 4Å; F379-M395 HydrophobicContact CE1-CE 3.69Å; F379-M395 HydrophobicContact CE2-CE 4.19Å; F379-M395 HydrophobicContact CG-CE 3.62Å; F379-M395 HydrophobicContact CZ-CE 4.05Å; V391-M395 HydrophobicContact CG1-CE 4.33Å; V391-M395 WeakPolarHBondContact O-CG 3.5Å; V391-M395 PolarHBondContact O-N 3.17Å; V391-M395 VanDerWaalsContact O-N 3.11Å; M395-G399 PolarHBondContact O-N 2.66Å; M395-F400 PolarHBondContact O-N 2.82Å; M395-V401 HydrophobicContact CB-CB 4.17Å; M395-V401 HydrophobicContact CB-CG2 3.81Å; M395-V401 PolarHBondContact O-N 3.12Å; M395-V401 HydrophobicContact SD-CG2 4.37Å; M395-I409 HydrophobicContact SD-CG2 4.01Å; M395-I413 HydrophobicContact CE-CD1 4.05Å; M395-I413 HydrophobicContact SD-CD1 4.23Å; M395-F991 HydrophobicContact CE-CD1 4.13Å; M395-F991 HydrophobicContact CE-CE1 3.69Å; M395-F991 HydrophobicContact CG-CD1 3.96Å; M395-F991 HydrophobicContact CG-CE1 3.42Å; M395-F991 VanDerWaalsContact CG-CE1 3.42Å; M395-F991 HydrophobicContact CG-CZ 3.99Å; M395-F991 HydrophobicContact SD-CE1 4.4Å
396	V	89.4	Confident	88.9	Confident	23 Å²	23	51.7 Å²	51.7	14%	0.139	29%	0.286	C	S	.	.	H	α-helix	trans	-77.4	-40.4	175.1	170.9	0	0	0	0	112.2	A392 Q393 E394 L398 G399 V401 K403 Y406	A392-V396 WeakPolarHBondContact O-CG2 3.47Å; A392-V396 PolarHBondContact O-N 2.85Å; Q393-V396 PolarHBondContact O-N 3.41Å; E394-V396 PolarHBondContact O-N 3.44Å; E394-V396 VanDerWaalsContact O-N 3.13Å; V396-L398 VanDerWaalsContact C-N 3.32Å; V396-L398 PolarHBondContact O-N 2.85Å; V396-G399 PolarHBondContact O-N 3.32Å; V396-V401 WeakPolarHBondContact CA-O 3.46Å; V396-V401 HydrophobicContact CG2-CB 3.99Å; V396-V401 HydrophobicContact CG2-CG1 3.7Å; V396-K403 HydrophobicContact CG1-CB 4.01Å; V396-K403 HydrophobicContact CG1-CG 4.37Å; V396-Y406 HydrophobicContact CG2-CD2 4.28Å
397	I	88.7	Confident	88.7	Confident	129 Å²	129	58.2 Å²	58.2	66%	0.662	31%	0.313	S	S	*	.	H	α-helix	trans	-64.5	-38.9	177.6	-71.6	161.8	0	0	0	111	Q393 E394 G399	Q393-I397 HydrophobicContact CG-CD1 4.17Å; Q393-I397 WeakPolarHBondContact O-CD1 3.32Å; Q393-I397 VanDerWaalsContact O-CG1 3.28Å; Q393-I397 WeakPolarHBondContact O-CG1 3.29Å; Q393-I397 PolarHBondContact O-N 3.12Å; E394-I397 PolarHBondContact O-N 2.99Å; I397-G399 PolarHBondContact O-N 3.25Å
398	L	84.8	Confident	88.3	Confident	69 Å²	69	57.6 Å²	57.6	36%	0.361	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	0.2	177.4	-59.4	-179.1	0	0	0	113.5	E394 V396 F400 V988 F991	E394-L398 WeakPolarHBondContact O-CG 3.39Å; E394-L398 PolarHBondContact O-N 3.29Å; V396-L398 VanDerWaalsContact C-N 3.32Å; V396-L398 PolarHBondContact O-N 2.85Å; L398-F400 VanDerWaalsContact C-N 3.27Å; L398-F400 HydrophobicContact CB-CD2 3.67Å; L398-F400 HydrophobicContact CB-CE2 3.67Å; L398-F400 HydrophobicContact CD1-CD2 4.34Å; L398-F400 HydrophobicContact CD1-CE2 3.83Å; L398-F400 HydrophobicContact CG-CE2 4.42Å; L398-F400 PolarHBondContact O-N 3.16Å; L398-V988 HydrophobicContact CD1-CB 4.32Å; L398-V988 HydrophobicContact CD1-CG1 3.95Å; L398-V988 HydrophobicContact CD2-CG1 3.77Å; L398-V988 HydrophobicContact CG-CG1 4.39Å; L398-F991 HydrophobicContact CD1-CD2 3.38Å; L398-F991 HydrophobicContact CD1-CE2 3.74Å; L398-F991 HydrophobicContact CD1-CG 4.3Å
399	G	82.1	Confident	88	Confident	61 Å²	61	56.9 Å²	56.9	63%	0.629	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.4	7.4	175.5	0	0	0	0	0	115.6	M395 V396 I397 V401	M395-G399 PolarHBondContact O-N 2.66Å; V396-G399 PolarHBondContact O-N 3.32Å; I397-G399 PolarHBondContact O-N 3.25Å; G399-V401 PolarHBondContact O-N 3.35Å
400	F	79.7	Confident	87.9	Confident	29 Å²	29	55 Å²	55	13%	0.127	30%	0.296	C	S	.	.	S	Bend	trans	-69.1	-24.8	173.6	-61.7	-59.9	0	0	0	112.6	I377 M395 L398 V988 F991 V993	I377-F400 HydrophobicContact CD1-CB 3.91Å; M395-F400 PolarHBondContact O-N 2.82Å; L398-F400 VanDerWaalsContact C-N 3.27Å; L398-F400 HydrophobicContact CB-CD2 3.67Å; L398-F400 HydrophobicContact CB-CE2 3.67Å; L398-F400 HydrophobicContact CD1-CD2 4.34Å; L398-F400 HydrophobicContact CD1-CE2 3.83Å; L398-F400 HydrophobicContact CG-CE2 4.42Å; L398-F400 PolarHBondContact O-N 3.16Å; F400-V988 HydrophobicContact CE2-CB 4.47Å; F400-V988 HydrophobicContact CZ-CB 4.23Å; F400-V988 HydrophobicContact CZ-CG2 4.19Å; F400-F991 HydrophobicContact CD2-CB 4.29Å; F400-F991 HydrophobicContact CD2-CG 4.43Å; F400-F991 HydrophobicContact CE2-CB 3.58Å; F400-F991 HydrophobicContact CE2-CD2 4.42Å; F400-F991 HydrophobicContact CE2-CG 4.05Å; F400-F991 HydrophobicContact CZ-CB 4.15Å; F400-V993 HydrophobicContact CD1-CG2 3.9Å; F400-V993 HydrophobicContact CE1-CG2 3.49Å; F400-V993 VanDerWaalsContact CE1-CG2 3.49Å; F400-V993 HydrophobicContact CZ-CG2 4.26Å
401	V	82.3	Confident	87.6	Confident	7 Å²	7	53.8 Å²	53.8	4%	0.042	29%	0.29	C	S	.	.	S	Bend	trans	-136.8	139.3	-172.3	171.1	0	0	0	0	110	L359 I377 M395 V396 G399 D405 I409	L359-V401 HydrophobicContact CD2-CG2 4.28Å; I377-V401 HydrophobicContact CD1-CG2 4.34Å; M395-V401 HydrophobicContact CB-CB 4.17Å; M395-V401 HydrophobicContact CB-CG2 3.81Å; M395-V401 PolarHBondContact O-N 3.12Å; M395-V401 HydrophobicContact SD-CG2 4.37Å; V396-V401 WeakPolarHBondContact CA-O 3.46Å; V396-V401 HydrophobicContact CG2-CB 3.99Å; V396-V401 HydrophobicContact CG2-CG1 3.7Å; G399-V401 PolarHBondContact O-N 3.35Å; V401-D405 HydrophobicContact CG1-CB 4.17Å; V401-I409 HydrophobicContact CB-CD1 4.19Å; V401-I409 HydrophobicContact CG1-CD1 3.29Å; V401-I409 HydrophobicContact CG2-CD1 3.74Å
402	C	82.8	Confident	87.3	Confident	54 Å²	54	54.2 Å²	54.2	37%	0.365	29%	0.292	S	S	.	.			trans	-79.5	149.3	174.9	107.3	0	0	0	0	112.4	Y371 A404 D405 Y406	Y371-C402 WeakPolarHBondContact OH-CB 3.06Å; Y371-C402 PolarHBondContact OH-N 2.87Å; C402-A404 PolarHBondContact O-N 3.1Å; C402-D405 PolarHBondContact O-N 2.88Å; C402-D405 PolarHBondContact SG-OD2 3.49Å; C402-Y406 PolarHBondContact O-N 2.67Å
403	K	84.4	Confident	87.1	Confident	165 Å²	165	54.2 Å²	54.2	72%	0.717	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-18.4	-174.5	-170.1	171.2	-179.5	175.9	0	114.7	V396 Y406	V396-K403 HydrophobicContact CG1-CB 4.01Å; V396-K403 HydrophobicContact CG1-CG 4.37Å; K403-Y406 WeakPolarHBondContact O-CB 3.43Å
404	A	84.8	Confident	87	Confident	81 Å²	81	57.2 Å²	57.2	67%	0.669	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-40	173.8	0	0	0	0	0	112.2	C402 Y406	C402-A404 PolarHBondContact O-N 3.1Å; A404-Y406 VanDerWaalsContact C-N 3.29Å; A404-Y406 PolarHBondContact O-N 2.87Å
405	D	84.2	Confident	86.6	Confident	34 Å²	34	56.7 Å²	56.7	18%	0.182	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-16.4	-176.2	-56.6	-51.4	0	0	0	112.6	Y340 Y371 V401 C402 K407 V408 I409	Y340-D405 HydrophobicContact CE2-CB 3.8Å; Y340-D405 PolarHBondContact OH-OD2 3.44Å; Y371-D405 PolarHBondContact OH-OD2 3.23Å; V401-D405 HydrophobicContact CG1-CB 4.17Å; C402-D405 PolarHBondContact O-N 2.88Å; C402-D405 PolarHBondContact SG-OD2 3.49Å; D405-K407 PolarHBondContact O-N 3.17Å; D405-V408 WeakPolarHBondContact O-CA 3.42Å; D405-V408 VanDerWaalsContact O-CB 3.3Å; D405-V408 WeakPolarHBondContact O-CB 3.33Å; D405-V408 PolarHBondContact O-N 3.47Å; D405-I409 HydrophobicContact CB-CD1 3.92Å; D405-I409 PolarHBondContact O-N 3.37Å
406	Y	87.8	Confident	86.5	Confident	48 Å²	48	60.4 Å²	60.4	19%	0.188	31%	0.314	C	S	.	.	H	α-helix	trans	-35.4	-58.3	176.9	170.2	-118.7	0	0	0	114.6	E389 A392 Q393 V396 C402 K403 A404 V408 I409 A410	E389-Y406 VanDerWaalsContact O-CE2 3.27Å; E389-Y406 WeakPolarHBondContact O-CE2 3.37Å; E389-Y406 PolarHBondContact O-OH 3.32Å; E389-Y406 VanDerWaalsContact O-OH 3.14Å; A392-Y406 HydrophobicContact CB-CD2 3.85Å; A392-Y406 HydrophobicContact CB-CE2 3.76Å; Q393-Y406 HydrophobicContact CB-CD2 4.44Å; Q393-Y406 HydrophobicContact CB-CE2 3.74Å; V396-Y406 HydrophobicContact CG2-CD2 4.28Å; C402-Y406 PolarHBondContact O-N 2.67Å; K403-Y406 WeakPolarHBondContact O-CB 3.43Å; A404-Y406 VanDerWaalsContact C-N 3.29Å; A404-Y406 PolarHBondContact O-N 2.87Å; Y406-V408 VanDerWaalsContact C-N 3.27Å; Y406-V408 PolarHBondContact O-N 3.01Å; Y406-I409 PolarHBondContact O-N 2.9Å; Y406-A410 WeakPolarHBondContact O-CB 3.31Å; Y406-A410 PolarHBondContact O-N 2.94Å
407	K	90.1	Very high	86.5	Confident	165 Å²	165	59.5 Å²	59.5	72%	0.717	31%	0.309	S	S	*	.	H	α-helix	trans	-66.4	-30.4	-176.3	-65.7	-174.6	178.7	-178.2	0	112.7	D405 K411	D405-K407 PolarHBondContact O-N 3.17Å; K407-K411 WeakPolarHBondContact O-CB 3.49Å; K407-K411 PolarHBondContact O-N 3.21Å
408	V	86.6	Confident	86.4	Confident	46 Å²	46	56.4 Å²	56.4	28%	0.279	30%	0.296	S	S	.	.	H	α-helix	trans	-71.3	-46.4	178.1	-177.2	0	0	0	0	109.3	T338 Y340 D405 Y406 K411 V412	T338-V408 VanDerWaalsContact CB-CG1 3.48Å; T338-V408 HydrophobicContact CG2-CG1 3.53Å; Y340-V408 HydrophobicContact CD2-CG1 4.29Å; D405-V408 WeakPolarHBondContact O-CA 3.42Å; D405-V408 VanDerWaalsContact O-CB 3.3Å; D405-V408 WeakPolarHBondContact O-CB 3.33Å; D405-V408 PolarHBondContact O-N 3.47Å; Y406-V408 VanDerWaalsContact C-N 3.27Å; Y406-V408 PolarHBondContact O-N 3.01Å; V408-K411 WeakPolarHBondContact O-CB 3.31Å; V408-K411 PolarHBondContact O-N 2.91Å; V408-V412 VanDerWaalsContact O-CG2 3.3Å; V408-V412 WeakPolarHBondContact O-CG2 3.4Å; V408-V412 PolarHBondContact O-N 2.91Å
409	I	88.7	Confident	86.2	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-69.3	-41.7	-179.4	-72.2	157.2	0	0	0	111.4	Y340 L359 A392 M395 V401 D405 Y406 K411 V412 I413	Y340-I409 HydrophobicContact CD1-CD1 3.83Å; Y340-I409 HydrophobicContact CD1-CG1 3.89Å; Y340-I409 HydrophobicContact CD2-CD1 4.18Å; Y340-I409 HydrophobicContact CD2-CG1 3.98Å; Y340-I409 HydrophobicContact CE1-CD1 3.71Å; Y340-I409 HydrophobicContact CE1-CG1 4.29Å; Y340-I409 HydrophobicContact CE2-CD1 4.09Å; Y340-I409 HydrophobicContact CE2-CG1 4.38Å; Y340-I409 HydrophobicContact CG-CD1 4.05Å; Y340-I409 HydrophobicContact CG-CG1 3.72Å; L359-I409 HydrophobicContact CD1-CG1 4.3Å; L359-I409 HydrophobicContact CD1-CG2 4.25Å; L359-I409 HydrophobicContact CD2-CD1 4.29Å; L359-I409 HydrophobicContact CD2-CG1 4.32Å; L359-I409 HydrophobicContact CD2-CG2 3.7Å; A392-I409 HydrophobicContact CB-CG2 4.16Å; M395-I409 HydrophobicContact SD-CG2 4.01Å; V401-I409 HydrophobicContact CB-CD1 4.19Å; V401-I409 HydrophobicContact CG1-CD1 3.29Å; V401-I409 HydrophobicContact CG2-CD1 3.74Å; D405-I409 HydrophobicContact CB-CD1 3.92Å; D405-I409 PolarHBondContact O-N 3.37Å; Y406-I409 PolarHBondContact O-N 2.9Å; I409-K411 VanDerWaalsContact C-N 3.34Å; I409-K411 PolarHBondContact O-N 3.15Å; I409-V412 PolarHBondContact O-N 3.46Å; I409-V412 VanDerWaalsContact O-N 3.12Å; I409-I413 HydrophobicContact CG2-CD1 3.8Å; I409-I413 HydrophobicContact CG2-CG1 4.28Å; I409-I413 WeakPolarHBondContact O-CG1 3.4Å; I409-I413 PolarHBondContact O-N 3.39Å
410	A	91.9	Very high	86.3	Confident	3 Å²	3	51.8 Å²	51.8	3%	0.025	26%	0.261	C	S	.	.	H	α-helix	trans	-55.6	-46.7	171.7	0	0	0	0	0	112.1	E389 A392 Y406 V412 I413 R414	E389-A410 HydrophobicContact CG-CB 4.05Å; A392-A410 HydrophobicContact CB-CB 3.79Å; Y406-A410 WeakPolarHBondContact O-CB 3.31Å; Y406-A410 PolarHBondContact O-N 2.94Å; A410-V412 PolarHBondContact O-N 3.47Å; A410-I413 PolarHBondContact O-N 3.12Å; A410-R414 WeakPolarHBondContact O-CB 3.38Å; A410-R414 PolarHBondContact O-N 2.88Å
411	K	87.6	Confident	86.6	Confident	89 Å²	89	53.8 Å²	53.8	39%	0.387	27%	0.27	S	S	.	.	H	α-helix	trans	-57.7	-43.9	174.1	177.2	-175.6	173.1	-172.7	0	111.9	E336 K407 V408 I409 N415	E336-K411 IonicContact OE2-NZ 3.25Å; E336-K411 PolarHBondContact OE2-NZ 2.88Å; K407-K411 WeakPolarHBondContact O-CB 3.49Å; K407-K411 PolarHBondContact O-N 3.21Å; V408-K411 WeakPolarHBondContact O-CB 3.31Å; V408-K411 PolarHBondContact O-N 2.91Å; I409-K411 VanDerWaalsContact C-N 3.34Å; I409-K411 PolarHBondContact O-N 3.15Å; K411-N415 WeakPolarHBondContact O-CB 3.43Å; K411-N415 PolarHBondContact O-N 3.17Å; K411-N415 PolarHBondContact O-OD1 3.41Å
412	V	87.8	Confident	86.5	Confident	8 Å²	8	57 Å²	57	5%	0.048	28%	0.284	C	S	.	.	H	α-helix	trans	-69.6	-44.4	-179.2	174.7	0	0	0	0	112	T338 V342 V408 I409 A410 N415 R416	T338-V412 HydrophobicContact CG2-CG2 4.29Å; V342-V412 HydrophobicContact CB-CG1 4Å; V342-V412 HydrophobicContact CG2-CG1 3.66Å; V408-V412 VanDerWaalsContact O-CG2 3.3Å; V408-V412 WeakPolarHBondContact O-CG2 3.4Å; V408-V412 PolarHBondContact O-N 2.91Å; I409-V412 PolarHBondContact O-N 3.46Å; I409-V412 VanDerWaalsContact O-N 3.12Å; A410-V412 PolarHBondContact O-N 3.47Å; V412-N415 PolarHBondContact O-N 2.71Å; V412-R416 PolarHBondContact O-N 3.44Å; V412-R416 VanDerWaalsContact O-N 3.08Å
413	I	91	Very high	86.4	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-59.2	-49.2	174.1	-63.8	170.5	0	0	0	109.4	V342 F379 F381 P388 V391 A392 M395 I409 A410 N415 R416 V417	V342-I413 HydrophobicContact CG2-CG1 3.89Å; F379-I413 HydrophobicContact CE2-CD1 4.25Å; F379-I413 HydrophobicContact CE2-CG1 4.42Å; F379-I413 HydrophobicContact CE2-CG2 4.2Å; F379-I413 HydrophobicContact CZ-CD1 4.05Å; F379-I413 HydrophobicContact CZ-CG1 3.89Å; F379-I413 HydrophobicContact CZ-CG2 4.27Å; F381-I413 HydrophobicContact CD2-CG2 3.91Å; F381-I413 HydrophobicContact CE2-CG2 3.86Å; P388-I413 HydrophobicContact CB-CB 4.12Å; P388-I413 HydrophobicContact CB-CG2 3.86Å; P388-I413 HydrophobicContact CG-CG2 4.39Å; V391-I413 HydrophobicContact CG1-CD1 4.32Å; A392-I413 HydrophobicContact CB-CD1 4.3Å; M395-I413 HydrophobicContact CE-CD1 4.05Å; M395-I413 HydrophobicContact SD-CD1 4.23Å; I409-I413 HydrophobicContact CG2-CD1 3.8Å; I409-I413 HydrophobicContact CG2-CG1 4.28Å; I409-I413 WeakPolarHBondContact O-CG1 3.4Å; I409-I413 PolarHBondContact O-N 3.39Å; A410-I413 PolarHBondContact O-N 3.12Å; I413-N415 PolarHBondContact O-N 3.1Å; I413-R416 PolarHBondContact O-N 3.31Å; I413-V417 HydrophobicContact CG2-CG2 4.21Å; I413-V417 WeakPolarHBondContact O-CB 3.4Å; I413-V417 WeakPolarHBondContact O-CG2 3.4Å; I413-V417 PolarHBondContact O-N 2.7Å
414	R	90.2	Very high	86.4	Confident	126 Å²	126	53.9 Å²	53.9	48%	0.475	27%	0.266	S	S	.	.	H	α-helix	trans	-55.1	-50.7	177.3	-171.4	-163.4	-69.2	-150	1.5	111.4	P388 E389 A410 R416 V417 T418	P388-R414 HydrophobicContact CB-CB 3.8Å; P388-R414 HydrophobicContact CG-CB 3.81Å; P388-R414 HydrophobicContact CG-CG 4.14Å; E389-R414 IonicContact OE1-CZ 3.84Å; E389-R414 VanDerWaalsContact OE1-CZ 3.27Å; E389-R414 IonicContact OE1-NE 3.29Å; E389-R414 PolarHBondContact OE1-NE 3.35Å; E389-R414 IonicContact OE1-NH2 2.65Å; E389-R414 PolarHBondContact OE1-NH2 2.89Å; E389-R414 IonicContact OE2-NE 3.54Å; E389-R414 IonicContact OE2-NH2 3.85Å; E389-R414 PolarHBondContact OE2-NH2 2.65Å; A410-R414 WeakPolarHBondContact O-CB 3.38Å; A410-R414 PolarHBondContact O-N 2.88Å; R414-R416 PolarHBondContact O-N 3.08Å; R414-V417 PolarHBondContact O-N 3.16Å; R414-T418 WeakPolarHBondContact O-CB 3.26Å; R414-T418 PolarHBondContact O-N 2.93Å; R414-T418 PolarHBondContact O-OG1 3.22Å; R414-T418 VanDerWaalsContact O-OG1 3.14Å
415	N	83.9	Confident	86.2	Confident	54 Å²	54	52.9 Å²	52.9	29%	0.289	25%	0.249	S	C	.	.	H	α-helix	trans	-56.7	-47.3	179.1	-73.9	-0.4	0	0	0	111.9	Q335 K411 V412 I413 A419	Q335-N415 PolarHBondContact OE1-ND2 3.13Å; K411-N415 WeakPolarHBondContact O-CB 3.43Å; K411-N415 PolarHBondContact O-N 3.17Å; K411-N415 PolarHBondContact O-OD1 3.41Å; V412-N415 PolarHBondContact O-N 2.71Å; I413-N415 PolarHBondContact O-N 3.1Å; N415-A419 WeakPolarHBondContact O-CB 3.47Å; N415-A419 PolarHBondContact O-N 2.83Å
416	R	86.7	Confident	85.9	Confident	78 Å²	78	54.4 Å²	54.4	29%	0.294	25%	0.254	S	S	.	.	H	α-helix	trans	-67.2	-43.7	-179.4	-176	60.7	176.9	172.7	0.9	112.1	V342 L357 V412 I413 R414 A419 I420	V342-R416 HydrophobicContact CB-CB 4.19Å; V342-R416 HydrophobicContact CB-CG 4.44Å; V342-R416 HydrophobicContact CG1-CB 4.17Å; V342-R416 HydrophobicContact CG1-CG 4.09Å; V342-R416 WeakPolarHBondContact O-CD 3.49Å; V342-R416 WeakPolarHBondContact O-CG 3.47Å; L357-R416 HydrophobicContact CD2-CG 4.42Å; V412-R416 PolarHBondContact O-N 3.44Å; V412-R416 VanDerWaalsContact O-N 3.08Å; I413-R416 PolarHBondContact O-N 3.31Å; R414-R416 PolarHBondContact O-N 3.08Å; R416-A419 PolarHBondContact O-N 3.22Å; R416-I420 HydrophobicContact CG-CD1 3.95Å; R416-I420 WeakPolarHBondContact O-CG1 3.16Å; R416-I420 PolarHBondContact O-N 2.89Å
417	V	89.6	Confident	85.5	Confident	4 Å²	4	58.8 Å²	58.8	2%	0.024	27%	0.274	C	S	.	.	H	α-helix	trans	-63	-42.3	177.4	168.7	0	0	0	0	111.4	L355 L357 F381 L383 I413 R414 I420 K421	L355-V417 HydrophobicContact CD1-CG2 4.49Å; L357-V417 HydrophobicContact CD1-CG2 4.21Å; F381-V417 HydrophobicContact CD1-CG1 4.17Å; F381-V417 HydrophobicContact CD1-CG2 3.67Å; F381-V417 HydrophobicContact CD2-CG2 4.13Å; F381-V417 HydrophobicContact CE1-CB 4.24Å; F381-V417 HydrophobicContact CE1-CG1 3.54Å; F381-V417 HydrophobicContact CE1-CG2 3.67Å; F381-V417 HydrophobicContact CE2-CG2 4.11Å; F381-V417 HydrophobicContact CG-CG2 3.94Å; F381-V417 HydrophobicContact CZ-CB 4.46Å; F381-V417 HydrophobicContact CZ-CG1 4.02Å; F381-V417 HydrophobicContact CZ-CG2 3.89Å; L383-V417 HydrophobicContact CD1-CG1 4.12Å; I413-V417 HydrophobicContact CG2-CG2 4.21Å; I413-V417 WeakPolarHBondContact O-CB 3.4Å; I413-V417 WeakPolarHBondContact O-CG2 3.4Å; I413-V417 PolarHBondContact O-N 2.7Å; R414-V417 PolarHBondContact O-N 3.16Å; V417-I420 PolarHBondContact O-N 2.98Å; V417-K421 HydrophobicContact CG1-CD 4.41Å; V417-K421 WeakPolarHBondContact O-CG 3.31Å; V417-K421 PolarHBondContact O-N 3.41Å
418	T	86.3	Confident	85.1	Confident	64 Å²	64	56.3 Å²	56.3	39%	0.393	26%	0.261	S	S	.	.	H	α-helix	trans	-64.8	-41.7	176.6	-65.9	0	0	0	0	112	R414 I420 K421 Q422	R414-T418 WeakPolarHBondContact O-CB 3.26Å; R414-T418 PolarHBondContact O-N 2.93Å; R414-T418 PolarHBondContact O-OG1 3.22Å; R414-T418 VanDerWaalsContact O-OG1 3.14Å; T418-I420 VanDerWaalsContact C-N 3.34Å; T418-I420 PolarHBondContact O-N 3.28Å; T418-K421 PolarHBondContact O-N 3.04Å; T418-Q422 WeakPolarHBondContact O-CG 3.4Å; T418-Q422 PolarHBondContact O-N 2.98Å
419	A	80.9	Confident	84.6	Confident	32 Å²	32	62.3 Å²	62.3	26%	0.264	28%	0.278	S	S	.	.	H	α-helix	trans	-61.7	-41.2	175.3	0	0	0	0	0	112	N415 R416 Q422 Q423	N415-A419 WeakPolarHBondContact O-CB 3.47Å; N415-A419 PolarHBondContact O-N 2.83Å; R416-A419 PolarHBondContact O-N 3.22Å; A419-Q422 PolarHBondContact O-N 2.95Å; A419-Q423 WeakPolarHBondContact O-CB 3.23Å; A419-Q423 PolarHBondContact O-N 3.49Å
420	I	85.4	Confident	84.1	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-67	-40.3	177.3	-66.4	164.4	0	0	0	111.4	L344 D348 L355 L357 R416 V417 T418 Q422 Q423 R424	L344-I420 HydrophobicContact CD1-CD1 4.12Å; L344-I420 HydrophobicContact CD2-CD1 3.98Å; L344-I420 HydrophobicContact CG-CD1 3.92Å; D348-I420 VanDerWaalsContact OD2-CG2 3.23Å; D348-I420 WeakPolarHBondContact OD2-CG2 3.36Å; L355-I420 HydrophobicContact CD1-CB 4.27Å; L355-I420 HydrophobicContact CD1-CD1 3.66Å; L355-I420 HydrophobicContact CD1-CG2 3.95Å; L355-I420 HydrophobicContact CD2-CG2 3.94Å; L357-I420 HydrophobicContact CD2-CD1 4.31Å; R416-I420 HydrophobicContact CG-CD1 3.95Å; R416-I420 WeakPolarHBondContact O-CG1 3.16Å; R416-I420 PolarHBondContact O-N 2.89Å; V417-I420 PolarHBondContact O-N 2.98Å; T418-I420 VanDerWaalsContact C-N 3.34Å; T418-I420 PolarHBondContact O-N 3.28Å; I420-Q422 PolarHBondContact O-N 3.28Å; I420-Q423 PolarHBondContact O-N 3.19Å; I420-R424 WeakPolarHBondContact O-CG 3.4Å; I420-R424 PolarHBondContact O-N 3.26Å
421	K	85.6	Confident	83.4	Confident	71 Å²	71	70.8 Å²	70.8	31%	0.309	32%	0.322	S	S	.	.	H	α-helix	trans	-55.5	-50.3	171.3	-75.1	176.2	175.8	-178.2	0	111.3	L383 V417 T418 Q423 R424 D425	L383-K421 HydrophobicContact CD1-CG 4.02Å; L383-K421 HydrophobicContact CD2-CG 3.98Å; L383-K421 HydrophobicContact CG-CD 4.48Å; L383-K421 HydrophobicContact CG-CG 3.95Å; L383-K421 WeakPolarHBondContact O-CE 3.12Å; L383-K421 PolarHBondContact O-NZ 2.78Å; V417-K421 HydrophobicContact CG1-CD 4.41Å; V417-K421 WeakPolarHBondContact O-CG 3.31Å; V417-K421 PolarHBondContact O-N 3.41Å; T418-K421 PolarHBondContact O-N 3.04Å; K421-Q423 VanDerWaalsContact C-N 3.35Å; K421-Q423 PolarHBondContact O-N 3.14Å; K421-R424 PolarHBondContact O-N 2.76Å; K421-D425 PolarHBondContact O-N 2.92Å
422	Q	81.1	Confident	83	Confident	74 Å²	74	71.4 Å²	71.4	35%	0.346	33%	0.327	S	S	.	.	H	α-helix	trans	-62.3	-38.9	178.5	-71.5	170.8	-28.2	0	0	112.6	T418 A419 I420 D425 K426	T418-Q422 WeakPolarHBondContact O-CG 3.4Å; T418-Q422 PolarHBondContact O-N 2.98Å; A419-Q422 PolarHBondContact O-N 2.95Å; I420-Q422 PolarHBondContact O-N 3.28Å; Q422-D425 PolarHBondContact O-N 3.45Å; Q422-K426 WeakPolarHBondContact O-CB 3.14Å; Q422-K426 PolarHBondContact O-N 3.09Å
423	Q	79.5	Confident	82.3	Confident	126 Å²	126	76.8 Å²	76.8	59%	0.589	35%	0.351	S	S	*	.	H	α-helix	trans	-65	-42.4	176	-172.4	175.5	-0.9	0	0	112.1	A419 I420 K421 K426 K427	A419-Q423 WeakPolarHBondContact O-CB 3.23Å; A419-Q423 PolarHBondContact O-N 3.49Å; I420-Q423 PolarHBondContact O-N 3.19Å; K421-Q423 VanDerWaalsContact C-N 3.35Å; K421-Q423 PolarHBondContact O-N 3.14Å; Q423-K426 PolarHBondContact O-N 3.24Å; Q423-K427 WeakPolarHBondContact O-CB 3.36Å; Q423-K427 PolarHBondContact O-N 3.23Å
424	R	85	Confident	81.2	Confident	28 Å²	28	80.2 Å²	80.2	11%	0.106	37%	0.372	C	S	.	.	H	α-helix	trans	-63.6	-41.5	173	-71.2	-172.8	-177	-164.6	8.9	112	D348 G350 K352 I420 K421 K427 R428	D348-R424 IonicContact OD1-CZ 2.96Å; D348-R424 IonicContact OD1-NE 3.93Å; D348-R424 PolarHBondContact OD1-NE 3.05Å; D348-R424 IonicContact OD1-NH2 3.5Å; D348-R424 PolarHBondContact OD1-NH2 3.4Å; D348-R424 IonicContact OD2-CZ 2.68Å; D348-R424 IonicContact OD2-NE 2.68Å; D348-R424 PolarHBondContact OD2-NE 3.17Å; D348-R424 IonicContact OD2-NH2 3.27Å; D348-R424 PolarHBondContact OD2-NH2 2.73Å; G350-R424 VanDerWaalsContact O-CZ 3.31Å; G350-R424 PolarHBondContact O-NH1 2.91Å; K352-R424 VanDerWaalsContact O-CZ 3.28Å; K352-R424 PolarHBondContact O-NH1 3.41Å; K352-R424 PolarHBondContact O-NH2 3.26Å; I420-R424 WeakPolarHBondContact O-CG 3.4Å; I420-R424 PolarHBondContact O-N 3.26Å; K421-R424 PolarHBondContact O-N 2.76Å; R424-K427 PolarHBondContact O-N 2.79Å; R424-R428 WeakPolarHBondContact O-CB 3.39Å; R424-R428 PolarHBondContact O-N 3Å
425	D	80.6	Confident	80.3	Confident	60 Å²	60	77.7 Å²	77.7	32%	0.321	37%	0.371	S	S	.	.	H	α-helix	trans	-65.4	-40.7	176.5	-73.5	-31.8	0	0	0	112.5	K421 Q422 R428 R429	K421-D425 PolarHBondContact O-N 2.92Å; Q422-D425 PolarHBondContact O-N 3.45Å; D425-R428 PolarHBondContact O-N 3.09Å; D425-R428 IonicContact OD1-CZ 3.99Å; D425-R428 IonicContact OD1-NH1 2.67Å; D425-R428 PolarHBondContact OD1-NH1 2.92Å; D425-R428 IonicContact OD1-NH2 3.6Å; D425-R428 PolarHBondContact OD1-NH2 2.98Å; D425-R429 WeakPolarHBondContact O-CG 3.39Å; D425-R429 PolarHBondContact O-N 3.27Å
426	K	76.7	Confident	79.4	Confident	66 Å²	66	78.9 Å²	78.9	29%	0.287	39%	0.388	S	S	.	.	H	α-helix	trans	-64.3	-45.6	174.2	-168.1	175.3	-173.9	177.5	0	111.2	R322 D327 Q422 Q423 R428 R429 L430	R322-K426 PolarHBondContact O-NZ 2.84Å; D327-K426 IonicContact OD2-NZ 3.19Å; Q422-K426 WeakPolarHBondContact O-CB 3.14Å; Q422-K426 PolarHBondContact O-N 3.09Å; Q423-K426 PolarHBondContact O-N 3.24Å; K426-R428 VanDerWaalsContact C-N 3.34Å; K426-R428 PolarHBondContact O-N 3.25Å; K426-R429 PolarHBondContact O-N 3.47Å; K426-L430 HydrophobicContact CG-CD1 4.37Å; K426-L430 WeakPolarHBondContact O-CG 3.29Å; K426-L430 PolarHBondContact O-N 2.84Å; K426-L430 VanDerWaalsContact O-N 3.08Å
427	K	79.6	Confident	78	Confident	140 Å²	140	82.3 Å²	82.3	61%	0.609	41%	0.411	S	S	*	.	H	α-helix	trans	-62.2	-39.6	176.6	-171.2	178.1	-179	-177.2	0	111.9	Q423 R424 L431	Q423-K427 WeakPolarHBondContact O-CB 3.36Å; Q423-K427 PolarHBondContact O-N 3.23Å; R424-K427 PolarHBondContact O-N 2.79Å; K427-L431 WeakPolarHBondContact O-CB 3.4Å; K427-L431 PolarHBondContact O-N 3.46Å; K427-L431 VanDerWaalsContact O-N 3.1Å
428	R	81.6	Confident	76	Confident	113 Å²	113	89.4 Å²	89.4	43%	0.426	44%	0.444	S	S	.	.	H	α-helix	trans	-65.2	-46.2	176.5	-171.1	179.3	62.9	-98.7	-0.1	111.7	R424 D425 K426 L430 L431 E432	R424-R428 WeakPolarHBondContact O-CB 3.39Å; R424-R428 PolarHBondContact O-N 3Å; D425-R428 PolarHBondContact O-N 3.09Å; D425-R428 IonicContact OD1-CZ 3.99Å; D425-R428 IonicContact OD1-NH1 2.67Å; D425-R428 PolarHBondContact OD1-NH1 2.92Å; D425-R428 IonicContact OD1-NH2 3.6Å; D425-R428 PolarHBondContact OD1-NH2 2.98Å; K426-R428 VanDerWaalsContact C-N 3.34Å; K426-R428 PolarHBondContact O-N 3.25Å; R428-L430 PolarHBondContact O-N 3.27Å; R428-L431 CarbonylContact O-C 3.59Å; R428-L431 PolarHBondContact O-N 2.77Å; R428-L431 VanDerWaalsContact O-N 3.14Å; R428-E432 WeakPolarHBondContact CD-OE1 3.4Å; R428-E432 HydrophobicContact CG-CG 4.26Å; R428-E432 VanDerWaalsContact CG-OE1 3.3Å; R428-E432 WeakPolarHBondContact CG-OE1 3.28Å; R428-E432 IonicContact NE-OE1 3.89Å; R428-E432 PolarHBondContact NE-OE1 3.23Å; R428-E432 WeakPolarHBondContact O-CB 3.42Å; R428-E432 VanDerWaalsContact O-CG 3.31Å; R428-E432 WeakPolarHBondContact O-CG 3.45Å; R428-E432 PolarHBondContact O-N 2.88Å
429	R	77.6	Confident	73.6	Confident	172 Å²	172	90.1 Å²	90.1	65%	0.649	45%	0.452	S	S	*	.	H	α-helix	trans	-60.7	-42.8	177.4	-73.2	177.8	-175.2	-178.7	2.5	113.1	D425 K426 L431 E432 E433	D425-R429 WeakPolarHBondContact O-CG 3.39Å; D425-R429 PolarHBondContact O-N 3.27Å; K426-R429 PolarHBondContact O-N 3.47Å; R429-L431 VanDerWaalsContact C-N 3.3Å; R429-L431 PolarHBondContact O-N 3.04Å; R429-E432 PolarHBondContact O-N 3.4Å; R429-E433 WeakPolarHBondContact O-CB 3.4Å; R429-E433 PolarHBondContact O-N 2.75Å
430	L	77.3	Confident	71.8	Confident	69 Å²	69	93.4 Å²	93.4	36%	0.361	47%	0.47	S	S	.	.	H	α-helix	trans	-62.7	-37.8	175.4	-70.3	168.8	0	0	0	111.6	K426 R428 V434	K426-L430 HydrophobicContact CG-CD1 4.37Å; K426-L430 WeakPolarHBondContact O-CG 3.29Å; K426-L430 PolarHBondContact O-N 2.84Å; K426-L430 VanDerWaalsContact O-N 3.08Å; R428-L430 PolarHBondContact O-N 3.27Å; L430-V434 WeakPolarHBondContact O-CG2 3.43Å; L430-V434 PolarHBondContact O-N 3.09Å
431	L	78.2	Confident	69.3	Low	113 Å²	113	104.5 Å²	104.5	59%	0.592	51%	0.514	S	S	*	.	H	α-helix	trans	-71	-38.9	175.1	-173.8	63.2	0	0	0	112.4	K427 R428 R429 E433 T435	K427-L431 WeakPolarHBondContact O-CB 3.4Å; K427-L431 PolarHBondContact O-N 3.46Å; K427-L431 VanDerWaalsContact O-N 3.1Å; R428-L431 CarbonylContact O-C 3.59Å; R428-L431 PolarHBondContact O-N 2.77Å; R428-L431 VanDerWaalsContact O-N 3.14Å; R429-L431 VanDerWaalsContact C-N 3.3Å; R429-L431 PolarHBondContact O-N 3.04Å; L431-E433 VanDerWaalsContact C-N 3.33Å; L431-T435 VanDerWaalsContact O-CB 3.24Å; L431-T435 WeakPolarHBondContact O-CB 3.26Å; L431-T435 PolarHBondContact O-N 3.32Å; L431-T435 PolarHBondContact O-OG1 2.87Å
432	E	77.6	Confident	67	Low	102 Å²	102	107.5 Å²	107.5	48%	0.477	53%	0.532	S	S	.	.	H	α-helix	trans	-61.1	-41.5	172.8	-73.1	163.4	174.1	0	0	110.7	R428 R429 T435 A436	R428-E432 WeakPolarHBondContact CD-OE1 3.4Å; R428-E432 HydrophobicContact CG-CG 4.26Å; R428-E432 VanDerWaalsContact CG-OE1 3.3Å; R428-E432 WeakPolarHBondContact CG-OE1 3.28Å; R428-E432 IonicContact NE-OE1 3.89Å; R428-E432 PolarHBondContact NE-OE1 3.23Å; R428-E432 WeakPolarHBondContact O-CB 3.42Å; R428-E432 VanDerWaalsContact O-CG 3.31Å; R428-E432 WeakPolarHBondContact O-CG 3.45Å; R428-E432 PolarHBondContact O-N 2.88Å; R429-E432 PolarHBondContact O-N 3.4Å; E432-T435 PolarHBondContact O-N 3.06Å; E432-A436 VanDerWaalsContact O-CB 3.29Å; E432-A436 WeakPolarHBondContact O-CB 3.37Å; E432-A436 PolarHBondContact O-N 2.87Å
433	E	73	Confident	64.9	Low	120 Å²	120	109.4 Å²	109.4	56%	0.561	55%	0.55	S	S	*	*	H	α-helix	trans	-67.7	-43.8	177.9	-173.3	168.7	-156.9	0	0	112.7	R429 L431 A436 L437	R429-E433 WeakPolarHBondContact O-CB 3.4Å; R429-E433 PolarHBondContact O-N 2.75Å; L431-E433 VanDerWaalsContact C-N 3.33Å; E433-A436 PolarHBondContact O-N 2.93Å; E433-L437 WeakPolarHBondContact O-CG 3.45Å; E433-L437 PolarHBondContact O-N 3.43Å
434	V	69.8	Low	62.6	Low	73 Å²	73	108.5 Å²	108.5	44%	0.442	56%	0.558	S	S	.	*	H	α-helix	trans	-65.1	-44.4	172.9	171.1	0	0	0	0	111	L430 A436 L437 E438	L430-V434 WeakPolarHBondContact O-CG2 3.43Å; L430-V434 PolarHBondContact O-N 3.09Å; V434-A436 VanDerWaalsContact C-N 3.27Å; V434-A436 PolarHBondContact O-N 3.2Å; V434-L437 PolarHBondContact O-N 3.27Å; V434-E438 HydrophobicContact CG1-CG 4.47Å; V434-E438 PolarHBondContact O-N 2.91Å
435	T	70.4	Confident	60.2	Low	73 Å²	73	113.7 Å²	113.7	45%	0.448	59%	0.592	S	S	.	*	H	α-helix	trans	-65	-31.6	178.9	-52.8	0	0	0	0	111.6	L431 E432 L437 E438 S439	L431-T435 VanDerWaalsContact O-CB 3.24Å; L431-T435 WeakPolarHBondContact O-CB 3.26Å; L431-T435 PolarHBondContact O-N 3.32Å; L431-T435 PolarHBondContact O-OG1 2.87Å; E432-T435 PolarHBondContact O-N 3.06Å; T435-L437 VanDerWaalsContact C-N 3.28Å; T435-L437 PolarHBondContact O-N 2.9Å; T435-E438 PolarHBondContact O-N 3.23Å; T435-S439 WeakPolarHBondContact O-CB 3.48Å; T435-S439 PolarHBondContact O-N 3.34Å
436	A	64.9	Low	57.9	Low	78 Å²	78	118.8 Å²	118.8	65%	0.645	62%	0.616	S	S	*	*	H	α-helix	trans	-69.6	-23.8	174	0	0	0	0	0	113.3	E432 E433 V434	E432-A436 VanDerWaalsContact O-CB 3.29Å; E432-A436 WeakPolarHBondContact O-CB 3.37Å; E432-A436 PolarHBondContact O-N 2.87Å; E433-A436 PolarHBondContact O-N 2.93Å; V434-A436 VanDerWaalsContact C-N 3.27Å; V434-A436 PolarHBondContact O-N 3.2Å
437	L	57.2	Low	55.6	Low	150 Å²	150	124.4 Å²	124.4	79%	0.785	64%	0.643	S	S	*	*	H	α-helix	trans	-86.7	-27.4	172.7	-65.6	171	0	0	0	112.8	E433 V434 T435	E433-L437 WeakPolarHBondContact O-CG 3.45Å; E433-L437 PolarHBondContact O-N 3.43Å; V434-L437 PolarHBondContact O-N 3.27Å; T435-L437 VanDerWaalsContact C-N 3.28Å; T435-L437 PolarHBondContact O-N 2.9Å
438	E	46.9	Very low	53.1	Low	154 Å²	154	122.7 Å²	122.7	72%	0.72	65%	0.648	S	S	*	*	H	α-helix	trans	-92.7	-4.2	178.1	-66.5	-171.7	142.8	0	0	114.3	V434 T435 P440	V434-E438 HydrophobicContact CG1-CG 4.47Å; V434-E438 PolarHBondContact O-N 2.91Å; T435-E438 PolarHBondContact O-N 3.23Å; E438-P440 WeakPolarHBondContact O-CD 3.24Å
439	S	36.4	Very low	50.5	Low	79 Å²	79	123.9 Å²	123.9	55%	0.552	67%	0.668	S	S	*	*			trans	-69.3	119.1	-177.1	-165.2	0	0	0	0	112	T435	T435-S439 WeakPolarHBondContact O-CB 3.48Å; T435-S439 PolarHBondContact O-N 3.34Å
440	P	43.8	Very low	48.2	Very low	100 Å²	100	123 Å²	123	65%	0.649	68%	0.676	S	S	*	*			trans	-69.1	136.9	177	28.4	-34.1	0	0	0	110.9	E438 I442	E438-P440 WeakPolarHBondContact O-CD 3.24Å; P440-I442 PolarHBondContact O-N 2.77Å
441	Y	33.1	Very low	45.9	Very low	233 Å²	233	125.9 Å²	125.9	91%	0.914	70%	0.697	S	S	*	*			trans	-61.6	99.2	174.8	-103.6	-105.6	0	0	0	111.1	P443	Y441-P443 WeakPolarHBondContact O-CD 3.29Å
442	I	37.1	Very low	43.5	Very low	135 Å²	135	129.6 Å²	129.6	69%	0.692	71%	0.711	S	S	*	*			trans	-97.7	108.9	164.4	-60.6	178.4	0	0	0	107.5	P440 S444	P440-I442 PolarHBondContact O-N 2.77Å; I442-S444 VanDerWaalsContact C-N 3.33Å; I442-S444 PolarHBondContact O-N 3.34Å
443	P	37.3	Very low	41.3	Very low	113 Å²	113	129.1 Å²	129.1	73%	0.734	72%	0.724	S	S	*	*			trans	-77	81.9	-179.3	31.1	-34.7	0	0	0	111.2	Y441 V445	Y441-P443 WeakPolarHBondContact O-CD 3.29Å; P443-V445 PolarHBondContact O-N 2.92Å
444	S	30.9	Very low	39.7	Very low	107 Å²	107	129.1 Å²	129.1	75%	0.748	74%	0.735	S	S	*	*			trans	-70.7	108.3	170	-71.2	0	0	0	0	110.5	I442	I442-S444 VanDerWaalsContact C-N 3.33Å; I442-S444 PolarHBondContact O-N 3.34Å
445	V	34.8	Very low	38.1	Very low	137 Å²	137	131.1 Å²	131.1	83%	0.83	75%	0.749	S	S	*	*			trans	-62.9	140.9	178.6	178.1	0	0	0	0	110.9	P443 H447	P443-V445 PolarHBondContact O-N 2.92Å; V445-H447 PolarHBondContact O-N 3.07Å
446	M	31.4	Very low	36.2	Very low	167 Å²	167	133.7 Å²	133.7	82%	0.823	77%	0.765	S	S	*	*			trans	-61.3	132.3	172.7	-68.2	-179.1	176.2	0	0	111.3
447	H	29.1	Very low	34.6	Very low	184 Å²	184	134.1 Å²	134.1	85%	0.852	77%	0.769	S	S	*	*			trans	-128.7	113.4	147.7	-124.7	-72.5	0	0	0	109.4	V445	V445-H447 PolarHBondContact O-N 3.07Å
448	C	27.1	Very low	34	Very low	104 Å²	104	132.4 Å²	132.4	70%	0.703	77%	0.767	S	S	*	*			trans	-86	132.9	173.2	-57.4	0	0	0	0	109.8
449	T	27.8	Very low	33	Very low	139 Å²	139	130.6 Å²	130.6	85%	0.853	77%	0.771	S	S	*	*			trans	-151.3	153.7	149.9	8.3	0	0	0	0	110.5
450	N	28.6	Very low	33.6	Very low	152 Å²	152	132.2 Å²	132.2	81%	0.813	78%	0.779	S	S	*	*			trans	-106	125.1	-170.7	169.5	27.9	0	0	0	110.5
451	T	27.8	Very low	32.8	Very low	131 Å²	131	132.6 Å²	132.6	80%	0.804	79%	0.791	S	S	*	*			trans	-152.3	168.9	167.7	-13.1	0	0	0	0	112.4
452	Q	29.7	Very low	32.7	Very low	191 Å²	191	125 Å²	125	89%	0.893	78%	0.783	S	S	*	*			trans	-92.7	178.6	-153.5	-68.5	173.5	-36.9	0	0	116.8
453	A	30.3	Very low	32.3	Very low	91 Å²	91	126.7 Å²	126.7	75%	0.752	79%	0.791	S	S	*	*			trans	-61.8	163.7	-179	0	0	0	0	0	115.6
454	P	39.6	Very low	31.8	Very low	120 Å²	120	127.9 Å²	127.9	78%	0.779	79%	0.79	S	S	*	*			trans	-85.4	161.7	-175	35.4	-37.8	0	0	0	114.7
455	P	36.6	Very low	31.7	Very low	115 Å²	115	130.5 Å²	130.5	75%	0.747	80%	0.795	S	S	*	*				-124.2	135.7	125.2	34.5	-27.3	0	0	0	111.2
456	T	30.8	Very low	31.4	Very low	127 Å²	127	128 Å²	128	78%	0.779	79%	0.788	S	S	*	*				72	112	70.4	-47.2	0	0	0	0	113.3
457	A	30.1	Very low	31.1	Very low	87 Å²	87	125.6 Å²	125.6	72%	0.719	79%	0.788	S	S	*	*			trans	-88	-169	169.7	0	0	0	0	0	109.9
458	P	44.8	Very low	31.1	Very low	115 Å²	115	122.1 Å²	122.1	75%	0.747	78%	0.784	S	S	*	*			cis	-142.1	159.9	-1.9	41.6	-23.4	0	0	0	117.7
459	S	26.3	Very low	31.3	Very low	116 Å²	116	122.4 Å²	122.4	81%	0.811	79%	0.788	S	S	*	*			trans	60.5	176.5	148.9	-110.4	0	0	0	0	119.6
460	P	47.8	Very low	32	Very low	112 Å²	112	121.7 Å²	121.7	73%	0.727	79%	0.786	S	S	*	*			cis	-129.1	174.6	-19.5	36.2	-19.7	0	0	0	115.1
461	A	28.4	Very low	31.9	Very low	108 Å²	108	119.1 Å²	119.1	89%	0.893	79%	0.785	S	S	*	*			trans	72.4	148.7	150.5	0	0	0	0	0	122
462	G	29.6	Very low	31.8	Very low	73 Å²	73	120 Å²	120	75%	0.753	79%	0.785	S	S	*	*			trans	122.9	54.5	133.6	0	0	0	0	0	121.4
463	M	28.9	Very low	31.9	Very low	172 Å²	172	116.1 Å²	116.1	85%	0.847	78%	0.779	S	S	*	*			trans	24.1	107.5	152.8	-65.6	-176.2	65.9	0	0	121.3
464	L	27.3	Very low	31.6	Very low	138 Å²	138	115.1 Å²	115.1	72%	0.723	78%	0.778	S	S	*	*				50.1	114.8	127.9	-62.1	174.9	0	0	0	122.3
465	L	29	Very low	31.2	Very low	161 Å²	161	117 Å²	117	84%	0.843	78%	0.78	S	S	*	*			trans	68.1	141.4	136	-56.6	168	0	0	0	120.1
466	A	28.5	Very low	30.9	Very low	84 Å²	84	116.8 Å²	116.8	69%	0.694	78%	0.781	S	S	*	*			cis	-171	143.6	-19.8	0	0	0	0	0	110.5
467	S	24.9	Very low	30.7	Very low	118 Å²	118	116.7 Å²	116.7	83%	0.825	78%	0.78	S	S	*	*			trans	-163.9	162.2	157.1	-29.2	0	0	0	0	112.6
468	S	28.2	Very low	30.7	Very low	110 Å²	110	119.7 Å²	119.7	77%	0.769	78%	0.783	S	S	*	*			trans	54	78.6	164.9	53.9	0	0	0	0	119
469	S	31.6	Very low	30.4	Very low	110 Å²	110	118.3 Å²	118.3	77%	0.769	78%	0.776	S	S	*	*				-12.9	167.5	126.1	58.3	0	0	0	0	119.9
470	P	42.7	Very low	30.9	Very low	125 Å²	125	119.6 Å²	119.6	81%	0.812	77%	0.774	S	S	*	*			cis	-131.7	-179.8	-1.6	38.6	-21.7	0	0	0	115.1
471	A	27.6	Very low	30.3	Very low	98 Å²	98	119 Å²	119	81%	0.81	76%	0.76	S	S	*	*			trans	-130.2	146.5	153.6	0	0	0	0	0	109.1
472	D	26.1	Very low	30.5	Very low	150 Å²	150	118.5 Å²	118.5	80%	0.802	75%	0.746	S	S	*	*			trans	-172.2	153	135.8	-144.7	-33.4	0	0	0	112.6
473	S	31.1	Very low	31	Very low	108 Å²	108	120.7 Å²	120.7	76%	0.755	74%	0.737	S	S	*	*			trans	61.3	142.9	147	-73.5	0	0	0	0	122.4
474	G	24.6	Very low	31.3	Very low	71 Å²	71	119.3 Å²	119.3	73%	0.732	73%	0.728	S	S	*	*			trans	179.4	-19.3	163.6	0	0	0	0	0	126.5
475	I	29.3	Very low	31.7	Very low	159 Å²	159	120.1 Å²	120.1	82%	0.815	73%	0.733	S	S	*	*			trans	47.6	137	157	-66.9	165.9	0	0	0	121.9
476	S	30.4	Very low	31.9	Very low	110 Å²	110	115.3 Å²	115.3	77%	0.769	72%	0.722	S	S	*	*			trans	78.9	159	153	80.9	0	0	0	0	120.3
477	V	27.1	Very low	32.3	Very low	126 Å²	126	119.5 Å²	119.5	76%	0.764	73%	0.733	S	S	*	*			cis	-156	164.5	-1.6	99	0	0	0	0	114.5
478	L	30	Very low	32.8	Very low	150 Å²	150	122.9 Å²	122.9	79%	0.785	74%	0.736	S	S	*	*			trans	-5.5	166.9	154	-99.1	67.6	0	0	0	121.8
479	S	38.3	Very low	33.1	Very low	86 Å²	86	124.2 Å²	124.2	60%	0.601	73%	0.734	S	S	*	*			cis	-145.5	-148.7	8.6	-146.7	0	0	0	0	109.9
480	N	37.7	Very low	33.2	Very low	142 Å²	142	125.8 Å²	125.8	76%	0.759	73%	0.729	S	S	*	*			cis	-163.4	173.2	4.3	-130.9	18.2	0	0	0	106.5
481	K	34.8	Very low	32.3	Very low	99 Å²	99	124.6 Å²	124.6	43%	0.43	72%	0.716	S	S	.	*			cis	-163	-179.9	-8	-157.6	-130.7	176.6	-88.8	0	106.7	E483 E484	K481-E483 WeakPolarHBondContact CG-OE2 3.16Å; K481-E483 IonicContact NZ-OE2 3.29Å; K481-E483 PolarHBondContact NZ-OE2 3.47Å; K481-E484 IonicContact NZ-OE1 3.35Å; K481-E484 PolarHBondContact NZ-OE1 2.83Å; K481-E484 IonicContact NZ-OE2 3.44Å; K481-E484 PolarHBondContact NZ-OE2 2.84Å
482	T	33.2	Very low	32.3	Very low	98 Å²	98	127 Å²	127	60%	0.601	71%	0.708	S	S	*	*			trans	74	111.3	171.3	-60.6	0	0	0	0	112.7
483	E	39.8	Very low	32.6	Very low	120 Å²	120	125.1 Å²	125.1	56%	0.561	70%	0.703	S	S	*	*			cis	68.3	-172.6	24.9	-45.9	95.9	-123.4	0	0	112.4	K481	K481-E483 WeakPolarHBondContact CG-OE2 3.16Å; K481-E483 IonicContact NZ-OE2 3.29Å; K481-E483 PolarHBondContact NZ-OE2 3.47Å
484	E	35.3	Very low	32.6	Very low	142 Å²	142	126.1 Å²	126.1	66%	0.664	70%	0.704	S	S	*	*			cis	-166.2	95.9	16.5	-153.6	154.4	-160.7	0	0	109	K481	K481-E484 IonicContact NZ-OE1 3.35Å; K481-E484 PolarHBondContact NZ-OE1 2.83Å; K481-E484 IonicContact NZ-OE2 3.44Å; K481-E484 PolarHBondContact NZ-OE2 2.84Å
485	D	34.8	Very low	32.9	Very low	156 Å²	156	132.5 Å²	132.5	83%	0.834	71%	0.706	S	S	*	*			cis	-125.6	-76	0.1	-139.3	58.4	0	0	0	115
486	G	33.3	Very low	32.9	Very low	59 Å²	59	132.7 Å²	132.7	61%	0.608	70%	0.703	S	S	*	*			cis	146.8	136	-2.5	0	0	0	0	0	110
487	D	37.1	Very low	32.8	Very low	173 Å²	173	130.7 Å²	130.7	93%	0.925	69%	0.694	S	S	*	*			cis	-104.6	-112.4	0.1	-63.4	-48.9	0	0	0	112.4
488	E	35.3	Very low	33.1	Very low	188 Å²	188	130.3 Å²	130.3	88%	0.879	70%	0.696	S	S	*	*			cis	-154.3	154.5	3.5	-176.9	176.9	-139.3	0	0	109.7
489	D	35.6	Very low	33.6	Very low	138 Å²	138	130.4 Å²	130.4	74%	0.738	69%	0.692	S	S	*	*			trans	-87.8	141.6	-179.6	-91.1	-30.3	0	0	0	113.2
490	Q	32.5	Very low	33.5	Very low	144 Å²	144	131.8 Å²	131.8	67%	0.673	70%	0.702	S	S	*	*			cis	-169.8	176.2	-13	-136.7	-176.6	104.6	0	0	105.9
491	D	25.5	Very low	33.4	Very low	99 Å²	99	130.6 Å²	130.6	53%	0.529	71%	0.705	S	S	.	*			cis	-160.5	179.1	9.6	-165.6	20.2	0	0	0	112.6
492	K	27.6	Very low	33.4	Very low	148 Å²	148	130.3 Å²	130.3	64%	0.643	72%	0.721	S	S	*	*			trans	-6.5	148.7	157.2	-74.3	169	-145.9	71.5	0	120.7
493	T	30.7	Very low	33.1	Very low	112 Å²	112	129.9 Å²	129.9	69%	0.687	73%	0.727	S	S	*	*			cis	-177.7	144.8	-31.1	17.1	0	0	0	0	109.3
494	T	32.8	Very low	32.9	Very low	129 Å²	129	128.8 Å²	128.8	79%	0.791	73%	0.733	S	S	*	*			trans	63.8	152.5	164	52.2	0	0	0	0	117.6
495	R	29.9	Very low	32.8	Very low	205 Å²	205	129.2 Å²	129.2	77%	0.774	74%	0.74	S	S	*	*			cis	-160.1	147.7	12.3	-136.5	179.8	171.9	152.3	-0.1	112.1
496	H	29	Very low	32.6	Very low	162 Å²	162	127.4 Å²	127.4	75%	0.75	74%	0.738	S	S	*	*			trans	55	157.6	152	-64.5	-48.8	0	0	0	124.3
497	A	29.3	Very low	32.4	Very low	69 Å²	69	129.5 Å²	129.5	57%	0.57	73%	0.732	S	S	*	*			trans	95.8	108.7	137.1	0	0	0	0	0	122.7
498	S	33.8	Very low	32.1	Very low	117 Å²	117	126 Å²	126	82%	0.818	72%	0.717	S	S	*	*				57.5	-163.6	110.5	-49.5	0	0	0	0	121.9
499	H	38.8	Very low	31.9	Very low	152 Å²	152	120 Å²	120	70%	0.704	71%	0.706	S	S	*	*			trans	93.9	124.6	178	-55.2	-69.9	0	0	0	117
500	S	36.7	Very low	31.5	Very low	116 Å²	116	118.7 Å²	118.7	81%	0.811	70%	0.702	S	S	*	*			cis	58.2	118.6	-4.6	-67	0	0	0	0	120.5
501	S	34.9	Very low	31.3	Very low	117 Å²	117	119.3 Å²	119.3	82%	0.818	70%	0.703	S	S	*	*			trans	172.8	161.9	158.6	-101.3	0	0	0	0	109.1
502	A	34.8	Very low	31.3	Very low	93 Å²	93	122.8 Å²	122.8	77%	0.769	71%	0.714	S	S	*	*			cis	-163.6	179.2	-12.9	0	0	0	0	0	106.9
503	A	27.4	Very low	31.2	Very low	88 Å²	88	121.4 Å²	121.4	73%	0.727	71%	0.713	S	S	*	*			cis	-146.2	169.5	15.9	0	0	0	0	0	111
504	S	35	Very low	31.2	Very low	97 Å²	97	121.6 Å²	121.6	68%	0.678	72%	0.715	S	S	*	*			cis	79.7	145.1	27.3	-97.6	0	0	0	0	115.8
505	D	33.5	Very low	31.5	Very low	152 Å²	152	120.7 Å²	120.7	81%	0.813	71%	0.711	S	S	*	*			cis	-125.2	-147.5	-1.6	-72.5	-60	0	0	0	110.9
506	C	31.9	Very low	32.4	Very low	117 Å²	117	116 Å²	116	79%	0.791	71%	0.707	S	S	*	*			cis	-160	-169.5	6.2	58	0	0	0	0	109.3
507	E	29.4	Very low	32.3	Very low	104 Å²	104	113.1 Å²	113.1	49%	0.486	71%	0.711	S	S	.	*			cis	-158.3	-161.8	1.5	-136.8	-65.8	74.1	0	0	110	N881	E507-N881 PolarHBondContact OE2-ND2 2.82Å
508	T	30.7	Very low	32.2	Very low	99 Å²	99	114.1 Å²	114.1	61%	0.607	72%	0.72	S	S	*	*			trans	-124	165.7	-161.4	-45.7	0	0	0	0	112.6
509	G	30.3	Very low	33.2	Very low	62 Å²	62	114.3 Å²	114.3	64%	0.639	72%	0.718	S	S	*	*			cis	-153.5	-130.3	2.1	0	0	0	0	0	110.7
510	V	27.9	Very low	32.4	Very low	110 Å²	110	116.4 Å²	116.4	67%	0.667	73%	0.728	S	S	*	*			cis	-156.3	125.6	7.2	147.6	0	0	0	0	109.5
511	F	27.2	Very low	31.9	Very low	158 Å²	158	117.1 Å²	117.1	69%	0.693	73%	0.728	S	S	*	*			trans	49.4	165.4	154	-70.3	-112.3	0	0	0	121
512	F	26.7	Very low	31.8	Very low	171 Å²	171	119 Å²	119	75%	0.75	73%	0.728	S	S	*	*			cis	-136.5	131	6.6	-99.8	-86	0	0	0	107.5
513	N	25.3	Very low	32.8	Very low	119 Å²	119	120.2 Å²	120.2	64%	0.636	73%	0.728	S	S	*	*				76.7	137.7	86.2	-83.2	26.7	0	0	0	116.6
514	T	29	Very low	33.9	Very low	117 Å²	117	121 Å²	121	72%	0.718	73%	0.725	S	S	*	*			cis	-156.5	-156.2	-10.9	-20.4	0	0	0	0	111.5
515	P	40.6	Very low	33.7	Very low	109 Å²	109	121.3 Å²	121.3	71%	0.708	73%	0.728	S	S	*	*			trans	-126	-132.8	-141.9	43.8	-18.7	0	0	0	112.8
516	P	48.8	Very low	33.4	Very low	106 Å²	106	122.1 Å²	122.1	69%	0.688	73%	0.731	S	S	*	*			cis	-137.9	175.2	-26.4	37.6	-18.6	0	0	0	117
517	A	26.9	Very low	33.2	Very low	102 Å²	102	121.9 Å²	121.9	84%	0.843	73%	0.731	S	S	*	*			trans	49.1	163	135.2	0	0	0	0	0	124.6
518	A	26.3	Very low	33.2	Very low	91 Å²	91	122.2 Å²	122.2	75%	0.752	75%	0.745	S	S	*	*			trans	-102.3	-159.9	165.9	0	0	0	0	0	109.3
519	P	55.2	Low	33.2	Very low	121 Å²	121	121.9 Å²	121.9	79%	0.786	75%	0.752	S	S	*	*			cis	-127.7	168.5	-20.8	40.8	-27.1	0	0	0	113.3
520	E	22.7	Very low	34.1	Very low	196 Å²	196	124.8 Å²	124.8	92%	0.916	76%	0.76	S	S	*	*			trans	-162.3	-172.1	157.2	-128.7	178.5	-172.2	0	0	117.2
521	T	24.6	Very low	34.3	Very low	130 Å²	130	126.9 Å²	126.9	80%	0.798	77%	0.767	S	S	*	*			trans	-111.9	159.9	-161.2	-39.9	0	0	0	0	112.5
522	L	33	Very low	35.2	Very low	158 Å²	158	125.6 Å²	125.6	83%	0.827	77%	0.774	S	S	*	*			trans	-64	163.3	167.9	-64.7	172.9	0	0	0	111.7
523	P	55.8	Low	35.2	Very low	117 Å²	117	121.2 Å²	121.2	76%	0.76	78%	0.777	S	S	*	*			cis	-137.2	-142.6	30.8	40.7	-17.2	0	0	0	111.5
524	P	50.9	Low	35.5	Very low	104 Å²	104	122.2 Å²	122.2	68%	0.675	79%	0.788	S	S	*	*			cis	-137.6	174.9	-14.1	40.8	-22.7	0	0	0	117.9
525	S	30	Very low	36.4	Very low	104 Å²	104	122.3 Å²	122.3	73%	0.727	79%	0.791	S	S	*	*			trans	73.4	141.5	151.9	77	0	0	0	0	119.6
526	L	28.6	Very low	37.3	Very low	169 Å²	169	122.6 Å²	122.6	89%	0.885	79%	0.792	S	S	*	*			cis	-110.6	-174.7	-5.6	-66.7	166.7	0	0	0	109.2
527	S	28	Very low	37.5	Very low	112 Å²	112	122.8 Å²	122.8	78%	0.783	79%	0.794	S	S	*	*			cis	-152	-169.6	12.3	62	0	0	0	0	108.3
528	S	28.8	Very low	37.8	Very low	112 Å²	112	125 Å²	125	78%	0.783	79%	0.791	S	S	*	*			cis	-152.2	-173	7.5	65.1	0	0	0	0	110.7
529	A	30.5	Very low	38.1	Very low	91 Å²	91	131.4 Å²	131.4	75%	0.752	80%	0.796	S	S	*	*			trans	-159.1	169	178	0	0	0	0	0	110.8
530	P	48.7	Very low	36.7	Very low	124 Å²	124	137.2 Å²	137.2	81%	0.805	80%	0.802	S	S	*	*			cis	-135.6	174.8	7.5	41.7	-24.1	0	0	0	118
531	N	32.3	Very low	37.2	Very low	153 Å²	153	134 Å²	134	82%	0.818	80%	0.796	S	S	*	*			trans	-66.7	176.2	163.7	-83.8	-30.1	0	0	0	112.7
532	P	46.9	Very low	38.3	Very low	131 Å²	131	132.9 Å²	132.9	85%	0.851	79%	0.791	S	S	*	*			cis	-151.6	-175	31	44.4	-23.1	0	0	0	119.4
533	G	26.1	Very low	38.3	Very low	79 Å²	79	130.8 Å²	130.8	81%	0.814	79%	0.789	S	S	*	*			trans	140	121.8	148	0	0	0	0	0	120
534	T	31.6	Very low	37	Very low	141 Å²	141	135.2 Å²	135.2	87%	0.865	80%	0.797	S	S	*	*			trans	-107.5	173.9	161.3	15.1	0	0	0	0	110
535	P	47.3	Very low	35.9	Very low	118 Å²	118	135.1 Å²	135.1	77%	0.766	80%	0.804	S	S	*	*			cis	-131.2	178.8	-2.5	28.9	-4.3	0	0	0	116.1
536	P	60	Low	36.8	Very low	115 Å²	115	136 Å²	136	75%	0.747	81%	0.808	S	S	*	*			trans	-87.5	-164.5	174.3	39.6	-40.2	0	0	0	113.2
537	P	52.7	Low	38.1	Very low	111 Å²	111	133.7 Å²	133.7	72%	0.721	80%	0.803	S	S	*	*			cis	-152.3	-163.7	14.7	44.4	-20.2	0	0	0	120.1
538	L	33.6	Very low	38.2	Very low	148 Å²	148	137.5 Å²	137.5	78%	0.775	81%	0.806	S	S	*	*			trans	98.6	131.7	147.7	-80.5	169.8	0	0	0	126.3
539	R	33.3	Very low	39	Very low	226 Å²	226	138.1 Å²	138.1	85%	0.853	81%	0.807	S	S	*	*			trans	75.9	152.8	155.2	-72	-178.6	171.8	-169.7	-2.9	119.2
540	R	25.6	Very low	38.9	Very low	242 Å²	242	141.7 Å²	141.7	91%	0.913	81%	0.81	S	S	*	*			cis	-130.9	-174.7	24.9	-70.2	-179.9	174.2	-176.7	-2	115.8
541	T	34	Very low	38	Very low	129 Å²	129	142.7 Å²	142.7	79%	0.791	81%	0.808	S	S	*	*			trans	-118.3	-170.4	-164.1	52.3	0	0	0	0	112.3
542	P	45.8	Very low	37.7	Very low	106 Å²	106	145.4 Å²	145.4	69%	0.688	81%	0.807	S	S	*	*			cis	-150	160	11.4	42.6	-20.5	0	0	0	122.6
543	S	33.4	Very low	37.2	Very low	115 Å²	115	147.8 Å²	147.8	80%	0.804	80%	0.804	S	S	*	*			trans	69	159.4	149.8	80.6	0	0	0	0	119.6
544	K	27.9	Very low	37.8	Very low	210 Å²	210	150.1 Å²	150.1	91%	0.913	81%	0.805	S	S	*	*			cis	-160.7	145	5.1	-155.9	176.6	-177.3	179.3	0	109.5
545	A	29.4	Very low	37.7	Very low	101 Å²	101	152.7 Å²	152.7	84%	0.835	80%	0.804	S	S	*	*			trans	-153.6	153.8	-179.5	0	0	0	0	0	117.7
546	P	48.2	Very low	37	Very low	123 Å²	123	151.9 Å²	151.9	80%	0.799	80%	0.801	S	S	*	*			trans	-126.3	-173.6	175.3	40.7	-23.5	0	0	0	115.9
547	P	55.4	Low	35.6	Very low	120 Å²	120	154.2 Å²	154.2	78%	0.779	81%	0.805	S	S	*	*			trans	-115.6	-168.9	-161.8	42	-31.7	0	0	0	117.8
548	F	29.7	Very low	34.2	Very low	193 Å²	193	153.3 Å²	153.3	85%	0.846	81%	0.808	S	S	*	*			trans	-140.9	169.2	-159.2	43.4	-105.1	0	0	0	116.9
549	P	47.2	Very low	34	Very low	125 Å²	125	152.4 Å²	152.4	81%	0.812	81%	0.808	S	S	*	*			trans	-126.5	-169.7	-165.1	43.7	-28.6	0	0	0	117.8
550	M	28.4	Very low	33.5	Very low	166 Å²	166	147.6 Å²	147.6	82%	0.818	81%	0.809	S	S	*	*			trans	-140.1	172.9	173.8	-70.7	169.4	47.1	0	0	112.7
551	L	29.1	Very low	33.6	Very low	144 Å²	144	144.8 Å²	144.8	75%	0.754	81%	0.806	S	S	*	*			trans	98	131.8	151.6	-65.3	170.4	0	0	0	123.5
552	R	26.5	Very low	33.1	Very low	211 Å²	211	143.6 Å²	143.6	80%	0.796	80%	0.803	S	S	*	*			trans	42.1	131	139.9	-76.1	-178.1	170.3	167.1	-1.8	124.9
553	F	36	Very low	32.1	Very low	181 Å²	181	143.4 Å²	143.4	79%	0.794	80%	0.804	S	S	*	*			trans	52.9	144.5	137.2	-65.3	-55.7	0	0	0	121.7
554	P	38.5	Very low	31.7	Very low	128 Å²	128	145.1 Å²	145.1	83%	0.831	80%	0.799	S	S	*	*				-146.1	-171.6	94.5	39.4	-22.6	0	0	0	115.4
555	K	30.1	Very low	31.5	Very low	195 Å²	195	143.6 Å²	143.6	85%	0.848	79%	0.793	S	S	*	*			trans	-115.4	152	173.4	-74.8	-176.9	174.1	-179.5	0	111.8
556	S	32.8	Very low	31.2	Very low	100 Å²	100	147.6 Å²	147.6	70%	0.699	79%	0.794	S	S	*	*			trans	51.2	133	143.9	61.8	0	0	0	0	122
557	I	29.2	Very low	30.9	Very low	164 Å²	164	146.3 Å²	146.3	84%	0.841	79%	0.786	S	S	*	*				-179.9	150.9	113.4	-96.6	166.4	0	0	0	113.8
558	A	25	Very low	29.6	Very low	93 Å²	93	146 Å²	146	77%	0.769	78%	0.781	S	S	*	*			trans	49.4	127.1	157.6	0	0	0	0	0	125.1
559	V	28.7	Very low	29.3	Very low	129 Å²	129	143.4 Å²	143.4	78%	0.782	78%	0.777	S	S	*	*			trans	-47.7	150.9	150	170.2	0	0	0	0	115.5
560	S	23.5	Very low	28.4	Very low	124 Å²	124	142.9 Å²	142.9	87%	0.867	78%	0.776	S	S	*	*			trans	-160.3	151	140.2	-88.6	0	0	0	0	112
561	Q	26.8	Very low	28.3	Very low	183 Å²	183	139.8 Å²	139.8	86%	0.855	77%	0.77	S	S	*	*			trans	-119	153.2	172.4	-61	176.1	-4.9	0	0	109.5
562	S	23	Very low	28.1	Very low	105 Å²	105	138.4 Å²	138.4	73%	0.734	77%	0.772	S	S	*	*			trans	174.3	134.8	137.6	57.5	0	0	0	0	113.2
563	S	25.9	Very low	28.1	Very low	101 Å²	101	131.7 Å²	131.7	71%	0.706	77%	0.768	S	S	*	*			trans	46.4	142.9	133.1	74.6	0	0	0	0	121.1
564	E	23.7	Very low	27.6	Very low	151 Å²	151	131.8 Å²	131.8	71%	0.706	77%	0.768	S	S	*	*			cis	-172.3	176.7	13.8	-138.1	-177.7	-156.9	0	0	113.8
565	K	25.2	Very low	26.9	Very low	179 Å²	179	130.1 Å²	130.1	78%	0.778	76%	0.76	S	S	*	*			trans	86.4	130.4	156.3	-72.2	174.4	176.1	79	0	121
566	H	22.3	Very low	26.7	Very low	184 Å²	184	125.9 Å²	125.9	85%	0.852	76%	0.755	S	S	*	*			trans	-100.2	-168	175.5	-117.2	-109.9	0	0	0	109.1
567	P	41.7	Very low	27.7	Very low	97 Å²	97	126.1 Å²	126.1	63%	0.63	75%	0.754	S	S	*	*			cis	-140.8	-167.7	11.2	40.3	-18.5	0	0	0	117.3
568	T	27.5	Very low	27.4	Very low	112 Å²	112	124 Å²	124	69%	0.687	75%	0.748	S	S	*	*			trans	69.5	139.4	159.3	57	0	0	0	0	119.6
569	D	24.2	Very low	27.4	Very low	140 Å²	140	126.3 Å²	126.3	75%	0.749	75%	0.748	S	S	*	*			cis	-162.1	166.2	-11.1	-117.9	-20.7	0	0	0	114.4
570	S	27.3	Very low	27.4	Very low	114 Å²	114	124.5 Å²	124.5	80%	0.797	74%	0.741	S	S	*	*			trans	68.3	143.3	167.3	-59.8	0	0	0	0	118.2
571	S	27.6	Very low	27.5	Very low	100 Å²	100	129.1 Å²	129.1	70%	0.699	74%	0.741	S	S	*	*			cis	-151	115.3	-1	51.7	0	0	0	0	110.6
572	C	24.4	Very low	27.5	Very low	116 Å²	116	124.8 Å²	124.8	78%	0.784	73%	0.731	S	S	*	*				49.7	143.7	111.4	81.1	0	0	0	0	118.8
573	G	27	Very low	27.9	Very low	70 Å²	70	123.6 Å²	123.6	72%	0.722	72%	0.723	S	S	*	*			cis	-175.2	-168.7	-0.2	0	0	0	0	0	108.8
574	F	24.8	Very low	28.2	Very low	182 Å²	182	125.6 Å²	125.6	80%	0.798	73%	0.725	S	S	*	*			cis	-144.3	140.2	1.9	-92.9	-104.4	0	0	0	107
575	S	24.6	Very low	28.3	Very low	93 Å²	93	125.6 Å²	125.6	65%	0.65	73%	0.729	S	S	*	*				53.5	116.9	87.1	-46	0	0	0	0	113.7
576	S	25	Very low	28.4	Very low	107 Å²	107	122.3 Å²	122.3	75%	0.748	72%	0.724	S	S	*	*				68.5	149.6	53.5	89.4	0	0	0	0	114.2
577	P	53.5	Low	28.9	Very low	104 Å²	104	118.1 Å²	118.1	68%	0.675	72%	0.715	S	S	*	*			cis	-140.6	-158.1	2.8	39.6	-17.3	0	0	0	114.4
578	V	24.6	Very low	28.3	Very low	119 Å²	119	117.9 Å²	117.9	72%	0.721	72%	0.715	S	S	*	*			trans	67.2	151.8	159.8	-62.8	0	0	0	0	121.9
579	D	24.6	Very low	28.5	Very low	142 Å²	142	120.7 Å²	120.7	76%	0.759	73%	0.725	S	S	*	*			trans	61.7	159	163.6	-76.1	-58.8	0	0	0	117.5
580	S	27.3	Very low	28.9	Very low	92 Å²	92	119.3 Å²	119.3	64%	0.643	73%	0.727	S	S	*	*			cis	166.8	170.3	-23.2	-92	0	0	0	0	104.2
581	Y	27.5	Very low	29.3	Very low	221 Å²	221	121.4 Å²	121.4	87%	0.867	73%	0.729	S	S	*	*			trans	67.5	129.9	-177.3	-98.9	-128.6	0	0	0	114.5
582	S	25.2	Very low	29.5	Very low	91 Å²	91	119.6 Å²	119.6	64%	0.636	73%	0.727	S	S	*	*				68.9	142.2	68.2	-111.4	0	0	0	0	113.8
583	S	31.6	Very low	29.9	Very low	81 Å²	81	121.2 Å²	121.2	57%	0.566	73%	0.727	S	S	*	*			cis	174.3	140.5	-22.9	43.7	0	0	0	0	108.4
584	D	32.4	Very low	30.4	Very low	143 Å²	143	124.5 Å²	124.5	77%	0.765	73%	0.728	S	S	*	*			trans	62.2	174.5	158.6	-54.8	-44.3	0	0	0	119.4
585	I	26.9	Very low	30.8	Very low	151 Å²	151	118.8 Å²	118.8	77%	0.774	72%	0.721	S	S	*	*			trans	70.2	131.3	155.7	-68	148	0	0	0	117.7
586	T	27.1	Very low	31.1	Very low	110 Å²	110	123.3 Å²	123.3	68%	0.675	73%	0.732	S	S	*	*			cis	-157.3	-170.8	-26.2	39.4	0	0	0	0	107.8
587	S	32.6	Very low	31.6	Very low	96 Å²	96	123.1 Å²	123.1	67%	0.671	73%	0.73	S	S	*	*			trans	14.2	145.4	134.7	69	0	0	0	0	119.8
588	S	28.7	Very low	30.4	Very low	91 Å²	91	123.9 Å²	123.9	64%	0.636	73%	0.729	S	S	*	*			cis	167.6	156.4	-1.8	51	0	0	0	0	107.9
589	L	32.5	Very low	30.5	Very low	171 Å²	171	128.2 Å²	128.2	90%	0.895	73%	0.733	S	S	*	*			trans	59.1	130.9	156.5	-62	161.8	0	0	0	118.6
590	S	32.4	Very low	30.8	Very low	111 Å²	111	124.4 Å²	124.4	78%	0.776	72%	0.717	S	S	*	*				-174.5	154.1	122.4	-171.2	0	0	0	0	111.2
591	D	35.7	Very low	30.8	Very low	158 Å²	158	129 Å²	129	85%	0.845	73%	0.725	S	S	*	*			trans	-69.3	172.9	172.7	-42.6	-67.8	0	0	0	112
592	G	31.1	Very low	30.9	Very low	63 Å²	63	127.3 Å²	127.3	65%	0.649	73%	0.726	S	S	*	*			cis	-159.8	174.8	9.2	0	0	0	0	0	111.7
593	N	32.6	Very low	31.1	Very low	149 Å²	149	131.8 Å²	131.8	80%	0.797	74%	0.736	S	S	*	*				70.8	126.2	78.7	-143.3	66.7	0	0	0	112.1
594	D	37.2	Very low	31.1	Very low	139 Å²	139	133.1 Å²	133.1	74%	0.743	75%	0.752	S	S	*	*			cis	-160.6	167.4	16.2	-145.2	-28	0	0	0	113.8
595	G	34.4	Very low	31.2	Very low	63 Å²	63	131 Å²	131	65%	0.649	76%	0.755	S	S	*	*			trans	85.2	149.5	148.8	0	0	0	0	0	120.8
596	Q	29.8	Very low	31.6	Very low	187 Å²	187	133.5 Å²	133.5	87%	0.874	76%	0.76	S	S	*	*			cis	-164.7	163.9	-12.8	-141.2	173.7	18.3	0	0	112.2
597	S	35.9	Very low	32	Very low	103 Å²	103	138.4 Å²	138.4	72%	0.72	77%	0.766	S	S	*	*			trans	66.7	148	178.4	76.3	0	0	0	0	117.2
598	D	27.6	Very low	32	Very low	121 Å²	121	141.1 Å²	141.1	65%	0.647	77%	0.768	S	S	*	*			cis	-166.6	161.1	-26.2	-103.5	-10.1	0	0	0	108.4
599	W	26.5	Very low	32.3	Very low	210 Å²	210	141.5 Å²	141.5	80%	0.795	78%	0.777	S	S	*	*			cis	-153.5	-176.1	-1	-130.8	150.7	0	0	0	114.5
600	S	30.7	Very low	32.8	Very low	62 Å²	62	139.3 Å²	139.3	43%	0.434	77%	0.771	S	S	.	*			trans	-61.9	161.6	168.4	-74.3	0	0	0	0	116.2
601	K	28.8	Very low	33.3	Very low	188 Å²	188	141.9 Å²	141.9	82%	0.817	77%	0.768	S	S	*	*			cis	-156.9	155.7	-4.6	-95.2	147.4	-167.3	157.7	0	105.5
602	Q	28.5	Very low	33.3	Very low	186 Å²	186	143.3 Å²	143.3	87%	0.869	77%	0.77	S	S	*	*	S	Bend		-175.1	114.1	63.8	166.3	-177.2	-18.7	0	0	110.2
603	E	30.2	Very low	33.3	Very low	185 Å²	185	147.7 Å²	147.7	86%	0.864	77%	0.771	S	S	*	*			trans	-173.8	37.6	149.5	-114	-163.7	160.3	0	0	113.9	A605	E603-A605 PolarHBondContact O-N 2.82Å
604	A	31.7	Very low	33.7	Very low	109 Å²	109	151.8 Å²	151.8	90%	0.901	78%	0.775	S	S	*	*			trans	-102.3	68.9	-176.1	0	0	0	0	0	112.7
605	A	33.9	Very low	34	Very low	99 Å²	99	157.1 Å²	157.1	82%	0.818	79%	0.785	S	S	*	*	S	Bend	trans	-145.1	4.6	-176.5	0	0	0	0	0	116.9	E603	E603-A605 PolarHBondContact O-N 2.82Å
606	K	35.8	Very low	34.4	Very low	203 Å²	203	163.2 Å²	163.2	88%	0.883	79%	0.788	S	S	*	*	S	Bend	trans	-146.3	27	-171.4	-137.1	169.4	-172.7	173.5	0	117.3
607	R	36.1	Very low	35.2	Very low	213 Å²	213	156.7 Å²	156.7	80%	0.804	77%	0.766	S	S	*	*	S	Bend	trans	-126.9	-6.6	178.6	-75.7	-171.3	172.7	106.5	1.1	117
608	E	32.6	Very low	36.2	Very low	152 Å²	152	161.9 Å²	161.9	71%	0.71	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	12	-178.5	-143.6	52.8	-125.1	0	0	114.5
609	A	33.8	Very low	37.8	Very low	99 Å²	99	156.1 Å²	156.1	82%	0.818	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	7.6	176.4	0	0	0	0	0	113.9
610	T	43.4	Very low	40	Very low	125 Å²	125	153 Å²	153	77%	0.767	73%	0.728	S	S	*	*	S	Bend	trans	-129.2	14.3	-169.5	-23	0	0	0	0	114.6
611	K	43.2	Very low	42.7	Very low	165 Å²	165	151.2 Å²	151.2	72%	0.717	71%	0.713	S	S	*	*	S	Bend	trans	-114.4	-5	178.1	-79.3	179.5	-179.9	168.2	0	115.8
612	Q	35.8	Very low	45.4	Very low	189 Å²	189	148.9 Å²	148.9	88%	0.883	70%	0.699	S	S	*	*	S	Bend	trans	-105.2	54.6	175.3	-65.7	-164.6	2.8	0	0	113.6
613	F	30.9	Very low	48.1	Very low	155 Å²	155	142 Å²	142	68%	0.68	67%	0.668	S	S	*	*			trans	-145.3	52.7	166.7	-131.8	-85.2	0	0	0	114.3	R616	F613-R616 HydrophobicContact CE1-CG 4.08Å
614	R	41.8	Very low	50.7	Low	235 Å²	235	137.2 Å²	137.2	89%	0.887	65%	0.651	S	S	*	*			trans	-106.5	141.2	165.7	-79.7	-172.9	170.2	-169.6	-1.7	110.4
615	R	43	Very low	53.2	Low	250 Å²	250	133.2 Å²	133.2	94%	0.943	62%	0.62	S	S	*	*			trans	77.3	51.2	177.5	-51.1	-179.9	178.2	172.3	-0.1	117.3
616	R	43.3	Very low	55.5	Low	192 Å²	192	130.6 Å²	130.6	73%	0.725	59%	0.594	S	S	*	*			trans	-73.5	145.4	136.1	-82.1	-169.9	176.2	157.8	-0.4	108.8	F613 R618	F613-R616 HydrophobicContact CE1-CG 4.08Å; R616-R618 PolarHBondContact O-N 2.89Å
617	A	45.1	Very low	57.6	Low	50 Å²	50	123.2 Å²	123.2	41%	0.413	57%	0.568	S	S	.	*			trans	-71	113	176.7	0	0	0	0	0	109.3	N643	A617-N643 WeakPolarHBondContact CB-OD1 3.23Å
618	R	57.4	Low	59.2	Low	211 Å²	211	117.2 Å²	117.2	80%	0.796	55%	0.552	S	S	*	*			trans	-64.1	136.8	169.4	-69.8	178.5	173.9	174.6	-4.2	108.6	R616 R620	R616-R618 PolarHBondContact O-N 2.89Å; R618-R620 WeakPolarHBondContact O-CG 3.42Å; R618-R620 PolarHBondContact O-N 2.9Å
619	A	62.5	Low	60.5	Low	1 Å²	1	118 Å²	118	1%	0.008	55%	0.553	C	S	.	*			trans	-54.7	136	176.1	0	0	0	0	0	110.8	L638 Q639 E674 R681	A619-L638 HydrophobicContact CB-CD1 3.97Å; A619-Q639 CarbonylContact C-O 3.56Å; A619-Q639 WeakPolarHBondContact CA-O 3.23Å; A619-Q639 VanDerWaalsContact CB-O 3.24Å; A619-Q639 WeakPolarHBondContact CB-O 3.23Å; A619-E674 PolarHBondContact N-OE1 3.06Å; A619-R681 PolarHBondContact O-NH1 2.8Å
620	R	72.5	Confident	61.7	Low	143 Å²	143	119.6 Å²	119.6	54%	0.54	55%	0.552	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.5	110.2	-175.1	-55.3	-176.8	71.2	-178.1	3.3	111.1	R618 Q639	R618-R620 WeakPolarHBondContact O-CG 3.42Å; R618-R620 PolarHBondContact O-N 2.9Å; R620-Q639 HydrophobicContact CB-CB 4Å; R620-Q639 PolarHBondContact N-O 2.88Å; R620-Q639 PolarHBondContact O-N 2.92Å
621	L	85.9	Confident	63	Low	25 Å²	25	118.9 Å²	118.9	13%	0.131	54%	0.544	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	140.1	179.4	-169.7	62.4	0	0	0	110.9	C636 Q637 L638 F648 F678 M682 I685	L621-C636 HydrophobicContact CD1-CB 4.08Å; L621-Q637 CarbonylContact C-O 3.58Å; L621-Q637 WeakPolarHBondContact CA-O 3.5Å; L621-L638 HydrophobicContact CB-CD1 4.28Å; L621-L638 HydrophobicContact CD1-CB 3.89Å; L621-L638 HydrophobicContact CD1-CD1 4.22Å; L621-F648 HydrophobicContact CD1-CE1 3.65Å; L621-F648 HydrophobicContact CD1-CZ 3.94Å; L621-F678 HydrophobicContact CD1-CE2 4.36Å; L621-F678 HydrophobicContact CD2-CD2 4.43Å; L621-F678 HydrophobicContact CD2-CE2 3.95Å; L621-F678 HydrophobicContact CD2-CZ 4.47Å; L621-M682 HydrophobicContact CD2-CG 4.47Å; L621-M682 HydrophobicContact CD2-SD 3.54Å; L621-M682 VanDerWaalsContact CD2-SD 3.54Å; L621-I685 HydrophobicContact CB-CD1 4.25Å; L621-I685 HydrophobicContact CD2-CD1 3.58Å; L621-I685 HydrophobicContact CG-CD1 3.51Å
622	R	85.2	Confident	65	Low	140 Å²	140	116.3 Å²	116.3	53%	0.528	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	149.2	176.8	-55.7	-173.1	-169.1	-164	7.2	110.6	C636 Q637	R622-C636 CarbonylContact O-C 3.58Å; R622-C636 VanDerWaalsContact O-CA 3.31Å; R622-C636 WeakPolarHBondContact O-CA 3.48Å; R622-Q637 PolarHBondContact N-O 3.49Å; R622-Q637 PolarHBondContact O-N 2.76Å
623	I	86.9	Confident	67.5	Low	41 Å²	41	108.6 Å²	108.6	21%	0.21	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	134.1	164.5	-57.6	170.7	0	0	0	107.8	V626 V634 I685 R688 A689	I623-V626 HydrophobicContact CG2-CG2 3.76Å; I623-V634 HydrophobicContact CG2-CG1 4.42Å; I623-I685 HydrophobicContact CD1-CG1 4.31Å; I623-I685 HydrophobicContact CD1-CG2 4.12Å; I623-I685 HydrophobicContact CG1-CB 4.46Å; I623-I685 HydrophobicContact CG1-CD1 4.32Å; I623-I685 HydrophobicContact CG1-CG1 4.06Å; I623-I685 HydrophobicContact CG1-CG2 3.86Å; I623-R688 HydrophobicContact CD1-CB 4.15Å; I623-R688 HydrophobicContact CD1-CG 4.05Å; I623-A689 HydrophobicContact CD1-CB 4.41Å
624	V	84.9	Confident	70.4	Confident	85 Å²	85	101.2 Å²	101.2	52%	0.515	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	-35.3	174.6	172.7	0	0	0	0	110.9	E635 Q637	V624-E635 HydrophobicContact CB-CG 4.39Å; V624-E635 PolarHBondContact N-O 2.83Å; V624-Q637 HydrophobicContact CG2-CB 3.47Å; V624-Q637 VanDerWaalsContact CG2-CB 3.47Å
625	G	82.8	Confident	72.7	Confident	24 Å²	24	92.7 Å²	92.7	25%	0.247	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	158.7	174.3	0	0	0	0	0	112.1	E635	G625-E635 PolarHBondContact N-O 3.27Å; G625-E635 PolarHBondContact O-N 3.36Å
626	V	82	Confident	75.1	Confident	45 Å²	45	80.8 Å²	80.8	27%	0.273	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	126.3	169.9	-177.3	0	0	0	0	106.6	I623 V634 A689 M693	I623-V626 HydrophobicContact CG2-CG2 3.76Å; V626-V634 HydrophobicContact CG1-CG2 4.18Å; V626-V634 HydrophobicContact CG2-CG2 4.32Å; V626-A689 HydrophobicContact CG1-CB 4.42Å; V626-A689 HydrophobicContact CG2-CB 4Å; V626-M693 HydrophobicContact CG1-CG 3.64Å; V626-M693 HydrophobicContact CG1-SD 3.73Å
627	S	79.9	Confident	77.4	Confident	48 Å²	48	74.3 Å²	74.3	34%	0.336	37%	0.366	S	S	.	.			trans	-96.1	112	178.8	-172	0	0	0	0	110.3	K629 R632 V633	S627-K629 VanDerWaalsContact C-N 3.26Å; S627-R632 WeakPolarHBondContact O-CA 3.38Å; S627-V633 PolarHBondContact N-O 3.33Å
628	D	70.1	Confident	79.6	Confident	86 Å²	86	71.9 Å²	71.9	46%	0.46	35%	0.346	S	S	.	.			trans	-81.4	-6.7	175.1	-162.1	52	0	0	0	113.1	V630 M693	D628-V630 PolarHBondContact O-N 2.89Å; D628-M693 VanDerWaalsContact OD1-CE 3.23Å; D628-M693 WeakPolarHBondContact OD1-CE 3.34Å
629	K	59.9	Low	81	Confident	169 Å²	169	64.1 Å²	64.1	74%	0.735	32%	0.319	S	S	*	.	S	Bend	trans	-85.4	103.2	179.8	-66.9	-175.2	179.6	-177.9	0	110.9	S627 D631	S627-K629 VanDerWaalsContact C-N 3.26Å; K629-D631 PolarHBondContact O-N 3.15Å
630	V	59	Low	82.1	Confident	132 Å²	132	64.1 Å²	64.1	80%	0.8	32%	0.319	S	S	*	.	S	Bend	trans	61.2	-54.8	164.9	-173.4	0	0	0	0	116	D628	D628-V630 PolarHBondContact O-N 2.89Å
631	D	70.7	Confident	82.2	Confident	110 Å²	110	60.1 Å²	60.1	59%	0.588	31%	0.306	S	S	*	.	S	Bend	trans	-88	-6.6	-166.6	-49.6	-36.2	0	0	0	113.2	K629 V633	K629-D631 PolarHBondContact O-N 3.15Å; D631-V633 HydrophobicContact CB-CG2 3.65Å; D631-V633 PolarHBondContact O-N 2.78Å; D631-V633 VanDerWaalsContact O-N 3.1Å
632	R	85.4	Confident	81.8	Confident	111 Å²	111	62.5 Å²	62.5	42%	0.419	32%	0.319	S	S	.	.			trans	47.7	37.6	177.7	-60.2	-153.6	-73.7	-179.5	-12.9	115.5	S627 L652 D653 M693	S627-R632 WeakPolarHBondContact O-CA 3.38Å; R632-L652 HydrophobicContact CB-CB 4.4Å; R632-L652 HydrophobicContact CB-CD1 4.47Å; R632-L652 WeakPolarHBondContact O-CB 3.48Å; R632-L652 WeakPolarHBondContact O-CD1 3.36Å; R632-L652 WeakPolarHBondContact O-CG 3.3Å; R632-L652 PolarHBondContact O-N 2.93Å; R632-D653 IonicContact CZ-OD1 2.7Å; R632-D653 VanDerWaalsContact CZ-OD1 3.25Å; R632-D653 IonicContact CZ-OD2 2.97Å; R632-D653 IonicContact NE-OD1 3.95Å; R632-D653 IonicContact NE-OD2 3.7Å; R632-D653 PolarHBondContact NE-OD2 3.02Å; R632-D653 IonicContact NH1-OD1 3.62Å; R632-D653 IonicContact NH2-OD1 3.41Å; R632-D653 PolarHBondContact NH2-OD1 2.91Å; R632-D653 IonicContact NH2-OD2 3.49Å; R632-D653 PolarHBondContact NH2-OD2 2.81Å; R632-M693 HydrophobicContact CB-CE 4.38Å; R632-M693 HydrophobicContact CG-CE 4.01Å
633	V	87.8	Confident	81.5	Confident	27 Å²	27	60.5 Å²	60.5	16%	0.164	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	134.8	-177.2	-163.6	0	0	0	0	112.1	S627 D631 K649 D651	S627-V633 PolarHBondContact N-O 3.33Å; D631-V633 HydrophobicContact CB-CG2 3.65Å; D631-V633 PolarHBondContact O-N 2.78Å; D631-V633 VanDerWaalsContact O-N 3.1Å; V633-K649 HydrophobicContact CG1-CB 3.74Å; V633-K649 HydrophobicContact CG1-CD 4.32Å; V633-K649 HydrophobicContact CG1-CG 4.48Å; V633-D651 WeakPolarHBondContact CG2-OD1 3.48Å
634	V	91.7	Very high	81.3	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	128.9	169.8	174.7	0	0	0	0	110.3	I623 V626 K649 F650 L652 I685 A689	I623-V634 HydrophobicContact CG2-CG1 4.42Å; V626-V634 HydrophobicContact CG1-CG2 4.18Å; V626-V634 HydrophobicContact CG2-CG2 4.32Å; V634-K649 WeakPolarHBondContact O-CA 3.42Å; V634-F650 HydrophobicContact CB-CD1 4.3Å; V634-F650 HydrophobicContact CB-CE1 3.7Å; V634-F650 HydrophobicContact CB-CE2 4.26Å; V634-F650 HydrophobicContact CB-CZ 3.67Å; V634-F650 HydrophobicContact CG1-CE1 3.64Å; V634-F650 HydrophobicContact CG1-CZ 3.79Å; V634-F650 HydrophobicContact CG2-CZ 4.32Å; V634-F650 PolarHBondContact N-O 2.64Å; V634-F650 PolarHBondContact O-N 3.17Å; V634-F650 VanDerWaalsContact O-N 3.15Å; V634-L652 HydrophobicContact CG2-CD1 3.81Å; V634-L652 HydrophobicContact CG2-CD2 3.82Å; V634-L652 HydrophobicContact CG2-CG 3.7Å; V634-I685 HydrophobicContact CG1-CG2 4.44Å; V634-A689 HydrophobicContact CG1-CB 4.43Å; V634-A689 HydrophobicContact CG2-CB 3.48Å; V634-A689 VanDerWaalsContact CG2-CB 3.48Å
635	E	91.8	Very high	81.3	Confident	57 Å²	57	65.6 Å²	65.6	27%	0.266	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	113.9	174.7	179.7	161.8	-151.8	0	0	110.2	V624 G625 T647 K649	V624-E635 HydrophobicContact CB-CG 4.39Å; V624-E635 PolarHBondContact N-O 2.83Å; G625-E635 PolarHBondContact N-O 3.27Å; G625-E635 PolarHBondContact O-N 3.36Å; E635-T647 HydrophobicContact CG-CG2 3.58Å; E635-T647 WeakPolarHBondContact OE1-CG2 3.2Å; E635-K649 HydrophobicContact CB-CD 4.44Å; E635-K649 HydrophobicContact CB-CG 4.16Å; E635-K649 HydrophobicContact CG-CG 4.19Å; E635-K649 WeakPolarHBondContact OE1-CE 3.27Å; E635-K649 IonicContact OE1-NZ 3.7Å; E635-K649 PolarHBondContact OE1-NZ 3.18Å; E635-K649 WeakPolarHBondContact OE2-CE 3.1Å; E635-K649 IonicContact OE2-NZ 2.76Å; E635-K649 PolarHBondContact OE2-NZ 2.79Å
636	C	93.4	Very high	81.6	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	140	-175.6	-94.2	0	0	0	0	112.2	L621 R622 T647 F648 F650 I685	L621-C636 HydrophobicContact CD1-CB 4.08Å; R622-C636 CarbonylContact O-C 3.58Å; R622-C636 VanDerWaalsContact O-CA 3.31Å; R622-C636 WeakPolarHBondContact O-CA 3.48Å; C636-T647 CarbonylContact O-C 3.54Å; C636-T647 WeakPolarHBondContact O-CA 3.48Å; C636-F648 HydrophobicContact CB-CD1 4.49Å; C636-F648 HydrophobicContact CB-CE1 3.99Å; C636-F648 HydrophobicContact CB-CE2 4.24Å; C636-F648 HydrophobicContact CB-CZ 3.85Å; C636-F648 PolarHBondContact N-O 2.76Å; C636-F648 WeakPolarHBondContact O-CD1 3.01Å; C636-F648 PolarHBondContact O-N 3.25Å; C636-F648 VanDerWaalsContact O-O 3.11Å; C636-F650 HydrophobicContact CB-CE1 4.32Å; C636-I685 VanDerWaalsContact SG-CG2 3.57Å
637	Q	89.9	Confident	81.9	Confident	55 Å²	55	66.6 Å²	66.6	26%	0.257	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	118.2	178.5	-175.5	176.2	82.6	0	0	110.7	L621 R622 V624 M645 V646 T647	L621-Q637 CarbonylContact C-O 3.58Å; L621-Q637 WeakPolarHBondContact CA-O 3.5Å; R622-Q637 PolarHBondContact N-O 3.49Å; R622-Q637 PolarHBondContact O-N 2.76Å; V624-Q637 HydrophobicContact CG2-CB 3.47Å; V624-Q637 VanDerWaalsContact CG2-CB 3.47Å; Q637-M645 HydrophobicContact CG-CE 3.75Å; Q637-V646 WeakPolarHBondContact CA-O 3.47Å; Q637-T647 PolarHBondContact NE2-OG1 2.81Å
638	L	92	Very high	82.4	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	114.7	177.1	178.2	63.9	0	0	0	109.7	A619 L621 T640 V646 F648 M664 F669 I670 F678	A619-L638 HydrophobicContact CB-CD1 3.97Å; L621-L638 HydrophobicContact CB-CD1 4.28Å; L621-L638 HydrophobicContact CD1-CB 3.89Å; L621-L638 HydrophobicContact CD1-CD1 4.22Å; L638-T640 HydrophobicContact CD2-CG2 4.45Å; L638-T640 HydrophobicContact CG-CG2 4.45Å; L638-T640 PolarHBondContact O-N 2.68Å; L638-V646 HydrophobicContact CB-CB 4.48Å; L638-V646 PolarHBondContact N-O 3.21Å; L638-V646 PolarHBondContact O-N 2.69Å; L638-F648 HydrophobicContact CB-CE1 4.19Å; L638-M664 HydrophobicContact CD2-SD 4.26Å; L638-F669 HydrophobicContact CD2-CB 4.05Å; L638-I670 HydrophobicContact CD1-CG2 4.45Å; L638-I670 HydrophobicContact CD2-CG2 3.81Å; L638-F678 HydrophobicContact CD1-CD2 4.27Å; L638-F678 HydrophobicContact CD1-CE2 4.03Å; L638-F678 HydrophobicContact CD2-CE2 4.03Å
639	Q	87.2	Confident	83.4	Confident	48 Å²	48	67.3 Å²	67.3	22%	0.224	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	118.8	154.6	-171.6	168.3	30.5	0	0	107.8	A619 R620 K644 M645	A619-Q639 CarbonylContact C-O 3.56Å; A619-Q639 WeakPolarHBondContact CA-O 3.23Å; A619-Q639 VanDerWaalsContact CB-O 3.24Å; A619-Q639 WeakPolarHBondContact CB-O 3.23Å; R620-Q639 HydrophobicContact CB-CB 4Å; R620-Q639 PolarHBondContact N-O 2.88Å; R620-Q639 PolarHBondContact O-N 2.92Å; Q639-K644 CarbonylContact C-O 3.57Å; Q639-K644 WeakPolarHBondContact CA-O 3.26Å; Q639-M645 HydrophobicContact CB-CE 4.22Å; Q639-M645 HydrophobicContact CB-SD 3.55Å; Q639-M645 VanDerWaalsContact CB-SD 3.55Å; Q639-M645 HydrophobicContact CG-SD 3.67Å
640	T	84.7	Confident	85	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.295	C	S	.	.			trans	-79.1	172.1	-178.2	62.3	0	0	0	0	112.2	L638 N642 N643 K644 V646 F669	L638-T640 HydrophobicContact CD2-CG2 4.45Å; L638-T640 HydrophobicContact CG-CG2 4.45Å; L638-T640 PolarHBondContact O-N 2.68Å; T640-N642 PolarHBondContact O-N 2.77Å; T640-N642 VanDerWaalsContact O-N 3.17Å; T640-N642 PolarHBondContact OG1-N 3.29Å; T640-N642 PolarHBondContact OG1-OD1 2.99Å; T640-N643 PolarHBondContact O-N 2.96Å; T640-N643 VanDerWaalsContact O-N 3.11Å; T640-K644 HydrophobicContact CG2-CB 4.46Å; T640-K644 PolarHBondContact N-O 3.27Å; T640-K644 PolarHBondContact OG1-N 3.49Å; T640-K644 VanDerWaalsContact OG1-N 3.07Å; T640-K644 PolarHBondContact OG1-O 2.8Å; T640-V646 HydrophobicContact CG2-CB 4.39Å; T640-V646 HydrophobicContact CG2-CG2 3.64Å; T640-F669 VanDerWaalsContact CB-O 3.24Å; T640-F669 WeakPolarHBondContact CB-O 3.14Å; T640-F669 HydrophobicContact CG2-CB 3.96Å; T640-F669 HydrophobicContact CG2-CD1 4.17Å; T640-F669 HydrophobicContact CG2-CG 4.39Å; T640-F669 WeakPolarHBondContact CG2-O 3.48Å
641	H	75.8	Confident	86.4	Confident	60 Å²	60	56.6 Å²	56.6	28%	0.278	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-22	173.3	77.8	-96.4	0	0	0	113.7	D668 L671	H641-D668 PolarHBondContact CE1-O 2.74Å; H641-D668 PolarHBondContact ND1-O 3.25Å; H641-L671 HydrophobicContact CB-CD1 4.14Å; H641-L671 HydrophobicContact CB-CG 4.06Å
642	N	77.8	Confident	87.2	Confident	74 Å²	74	52.6 Å²	52.6	40%	0.396	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	23.9	178.2	59.1	34.3	0	0	0	112.9	T640 K644	T640-N642 PolarHBondContact O-N 2.77Å; T640-N642 VanDerWaalsContact O-N 3.17Å; T640-N642 PolarHBondContact OG1-N 3.29Å; T640-N642 PolarHBondContact OG1-OD1 2.99Å; N642-K644 PolarHBondContact O-N 3.42Å; N642-K644 WeakPolarHBondContact OD1-CD 3.49Å; N642-K644 WeakPolarHBondContact OD1-CG 3.34Å
643	N	78.9	Confident	87	Confident	99 Å²	99	52.8 Å²	52.8	53%	0.529	26%	0.263	S	S	.	.	S	Bend	trans	59.4	7.3	178.3	-71.6	-9.8	0	0	0	116.3	A617 T640	A617-N643 WeakPolarHBondContact CB-OD1 3.23Å; T640-N643 PolarHBondContact O-N 2.96Å; T640-N643 VanDerWaalsContact O-N 3.11Å
644	K	82.6	Confident	86.7	Confident	139 Å²	139	54.4 Å²	54.4	60%	0.604	29%	0.286	S	S	*	.			trans	-69.3	151.3	169.4	-64.5	178.6	-178.1	178.9	0	109.7	Q639 T640 N642	Q639-K644 CarbonylContact C-O 3.57Å; Q639-K644 WeakPolarHBondContact CA-O 3.26Å; T640-K644 HydrophobicContact CG2-CB 4.46Å; T640-K644 PolarHBondContact N-O 3.27Å; T640-K644 PolarHBondContact OG1-N 3.49Å; T640-K644 VanDerWaalsContact OG1-N 3.07Å; T640-K644 PolarHBondContact OG1-O 2.8Å; N642-K644 PolarHBondContact O-N 3.42Å; N642-K644 WeakPolarHBondContact OD1-CD 3.49Å; N642-K644 WeakPolarHBondContact OD1-CG 3.34Å
645	M	84.1	Confident	86.7	Confident	94 Å²	94	57.9 Å²	57.9	46%	0.463	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	117.9	173.9	-58.8	-60	-72.9	0	0	108.4	Q637 Q639	Q637-M645 HydrophobicContact CG-CE 3.75Å; Q639-M645 HydrophobicContact CB-CE 4.22Å; Q639-M645 HydrophobicContact CB-SD 3.55Å; Q639-M645 VanDerWaalsContact CB-SD 3.55Å; Q639-M645 HydrophobicContact CG-SD 3.67Å
646	V	88	Confident	86.7	Confident	24 Å²	24	58.4 Å²	58.4	15%	0.145	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	111.5	178.7	175.7	0	0	0	0	107.7	Q637 L638 T640 F669	Q637-V646 WeakPolarHBondContact CA-O 3.47Å; L638-V646 HydrophobicContact CB-CB 4.48Å; L638-V646 PolarHBondContact N-O 3.21Å; L638-V646 PolarHBondContact O-N 2.69Å; T640-V646 HydrophobicContact CG2-CB 4.39Å; T640-V646 HydrophobicContact CG2-CG2 3.64Å; V646-F669 HydrophobicContact CG1-CD2 3.98Å; V646-F669 HydrophobicContact CG1-CE2 3.84Å; V646-F669 HydrophobicContact CG1-CG 4.41Å; V646-F669 HydrophobicContact CG1-CZ 4.17Å; V646-F669 HydrophobicContact CG2-CD1 3.71Å; V646-F669 HydrophobicContact CG2-CD2 4.39Å; V646-F669 HydrophobicContact CG2-CE1 3.73Å; V646-F669 HydrophobicContact CG2-CE2 4.41Å; V646-F669 HydrophobicContact CG2-CG 4.05Å; V646-F669 HydrophobicContact CG2-CZ 4.09Å
647	T	88.5	Confident	86.6	Confident	65 Å²	65	58.8 Å²	58.8	40%	0.399	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	129.5	168.6	-52.4	0	0	0	0	108.7	E635 C636 Q637	E635-T647 HydrophobicContact CG-CG2 3.58Å; E635-T647 WeakPolarHBondContact OE1-CG2 3.2Å; C636-T647 CarbonylContact O-C 3.54Å; C636-T647 WeakPolarHBondContact O-CA 3.48Å; Q637-T647 PolarHBondContact NE2-OG1 2.81Å
648	F	91.6	Very high	86.8	Confident	23 Å²	23	59.5 Å²	59.5	10%	0.101	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	160.8	174.4	68.6	-85	0	0	0	110.1	L621 C636 L638 F650 I660 M664 F678 M682	L621-F648 HydrophobicContact CD1-CE1 3.65Å; L621-F648 HydrophobicContact CD1-CZ 3.94Å; C636-F648 HydrophobicContact CB-CD1 4.49Å; C636-F648 HydrophobicContact CB-CE1 3.99Å; C636-F648 HydrophobicContact CB-CE2 4.24Å; C636-F648 HydrophobicContact CB-CZ 3.85Å; C636-F648 PolarHBondContact N-O 2.76Å; C636-F648 WeakPolarHBondContact O-CD1 3.01Å; C636-F648 PolarHBondContact O-N 3.25Å; C636-F648 VanDerWaalsContact O-O 3.11Å; L638-F648 HydrophobicContact CB-CE1 4.19Å; F648-F650 HydrophobicContact CD2-CD1 4.21Å; F648-F650 AromaticContact CE2-CD1 3.76Å; F648-F650 HydrophobicContact CE2-CD1 3.76Å; F648-F650 HydrophobicContact CE2-CE1 4.35Å; F648-I660 HydrophobicContact CE2-CG2 3.92Å; F648-I660 HydrophobicContact CZ-CG2 4.47Å; F648-M664 HydrophobicContact CB-CE 3.82Å; F648-M664 HydrophobicContact CD1-CE 3.6Å; F648-M664 HydrophobicContact CD1-SD 4.39Å; F648-M664 HydrophobicContact CD2-CE 3.68Å; F648-M664 HydrophobicContact CE1-CE 4.01Å; F648-M664 HydrophobicContact CE2-CE 4.08Å; F648-M664 HydrophobicContact CG-CE 3.42Å; F648-M664 VanDerWaalsContact CG-CE 3.42Å; F648-M664 HydrophobicContact CZ-CE 4.23Å; F648-F678 HydrophobicContact CE1-CZ 4.46Å; F648-F678 HydrophobicContact CZ-CZ 4.04Å; F648-M682 HydrophobicContact CE2-CE 4.02Å; F648-M682 HydrophobicContact CE2-SD 4.26Å; F648-M682 HydrophobicContact CZ-CE 4.17Å; F648-M682 HydrophobicContact CZ-SD 3.81Å
649	K	91	Very high	86.8	Confident	126 Å²	126	64 Å²	64	55%	0.548	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	148.9	177.1	-58	-166	-173.9	-135.3	0	108.8	V633 V634 E635	V633-K649 HydrophobicContact CG1-CB 3.74Å; V633-K649 HydrophobicContact CG1-CD 4.32Å; V633-K649 HydrophobicContact CG1-CG 4.48Å; V634-K649 WeakPolarHBondContact O-CA 3.42Å; E635-K649 HydrophobicContact CB-CD 4.44Å; E635-K649 HydrophobicContact CB-CG 4.16Å; E635-K649 HydrophobicContact CG-CG 4.19Å; E635-K649 WeakPolarHBondContact OE1-CE 3.27Å; E635-K649 IonicContact OE1-NZ 3.7Å; E635-K649 PolarHBondContact OE1-NZ 3.18Å; E635-K649 WeakPolarHBondContact OE2-CE 3.1Å; E635-K649 IonicContact OE2-NZ 2.76Å; E635-K649 PolarHBondContact OE2-NZ 2.79Å
650	F	93.1	Very high	87	Confident	2 Å²	2	62.4 Å²	62.4	1%	0.009	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	152.1	176.7	72	-86.4	0	0	0	109.9	V634 C636 F648 L652 D655 I660 M682 I685 I686	V634-F650 HydrophobicContact CB-CD1 4.3Å; V634-F650 HydrophobicContact CB-CE1 3.7Å; V634-F650 HydrophobicContact CB-CE2 4.26Å; V634-F650 HydrophobicContact CB-CZ 3.67Å; V634-F650 HydrophobicContact CG1-CE1 3.64Å; V634-F650 HydrophobicContact CG1-CZ 3.79Å; V634-F650 HydrophobicContact CG2-CZ 4.32Å; V634-F650 PolarHBondContact N-O 2.64Å; V634-F650 PolarHBondContact O-N 3.17Å; V634-F650 VanDerWaalsContact O-N 3.15Å; C636-F650 HydrophobicContact CB-CE1 4.32Å; F648-F650 HydrophobicContact CD2-CD1 4.21Å; F648-F650 AromaticContact CE2-CD1 3.76Å; F648-F650 HydrophobicContact CE2-CD1 3.76Å; F648-F650 HydrophobicContact CE2-CE1 4.35Å; F650-L652 HydrophobicContact CE2-CD2 4.25Å; F650-D655 WeakPolarHBondContact CA-OD2 3.28Å; F650-D655 HydrophobicContact CB-CB 4.01Å; F650-D655 WeakPolarHBondContact CB-OD2 3.31Å; F650-D655 HydrophobicContact CD2-CB 4.44Å; F650-I660 HydrophobicContact CB-CD1 3.73Å; F650-I660 HydrophobicContact CD1-CD1 4.46Å; F650-I660 HydrophobicContact CD2-CD1 3.91Å; F650-I660 HydrophobicContact CG-CD1 3.78Å; F650-M682 HydrophobicContact CD1-CE 3.86Å; F650-M682 HydrophobicContact CD2-CE 4.4Å; F650-M682 HydrophobicContact CE1-CE 3.54Å; F650-M682 HydrophobicContact CE2-CE 4.14Å; F650-M682 HydrophobicContact CG-CE 4.27Å; F650-M682 HydrophobicContact CZ-CE 3.7Å; F650-I685 HydrophobicContact CE1-CG2 4.44Å; F650-I685 HydrophobicContact CZ-CG2 4.15Å; F650-I686 HydrophobicContact CE2-CD1 4.36Å; F650-I686 HydrophobicContact CE2-CG1 3.74Å; F650-I686 HydrophobicContact CZ-CG1 4.06Å
651	D	89.2	Confident	87.4	Confident	74 Å²	74	62.4 Å²	62.4	40%	0.396	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	125.5	-173.8	-61.7	-13.3	0	0	0	109.9	V633 D653 G654 D655	V633-D651 WeakPolarHBondContact CG2-OD1 3.48Å; D651-D653 PolarHBondContact O-N 3.35Å; D651-G654 PolarHBondContact O-N 2.77Å; D651-D655 PolarHBondContact N-OD2 3.06Å; D651-D655 PolarHBondContact O-N 3.32Å; D651-D655 VanDerWaalsContact O-N 3.08Å
652	L	87.3	Confident	88.2	Confident	27 Å²	27	61.2 Å²	61.2	14%	0.141	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-23.5	-170.7	-81.6	169.6	0	0	0	115.1	R632 V634 F650 I686 A689 M693	R632-L652 HydrophobicContact CB-CB 4.4Å; R632-L652 HydrophobicContact CB-CD1 4.47Å; R632-L652 WeakPolarHBondContact O-CB 3.48Å; R632-L652 WeakPolarHBondContact O-CD1 3.36Å; R632-L652 WeakPolarHBondContact O-CG 3.3Å; R632-L652 PolarHBondContact O-N 2.93Å; V634-L652 HydrophobicContact CG2-CD1 3.81Å; V634-L652 HydrophobicContact CG2-CD2 3.82Å; V634-L652 HydrophobicContact CG2-CG 3.7Å; F650-L652 HydrophobicContact CE2-CD2 4.25Å; L652-I686 HydrophobicContact CD2-CB 4.26Å; L652-I686 HydrophobicContact CD2-CG1 4.23Å; L652-I686 HydrophobicContact CD2-CG2 3.93Å; L652-A689 HydrophobicContact CD1-CB 4.45Å; L652-A689 HydrophobicContact CD2-CB 4.37Å; L652-M693 HydrophobicContact CD1-SD 3.64Å
653	D	80.6	Confident	88.8	Confident	114 Å²	114	61.6 Å²	61.6	61%	0.61	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.8	-22.6	-178	-56.3	-64.7	0	0	0	114.1	R632 D651	R632-D653 IonicContact CZ-OD1 2.7Å; R632-D653 VanDerWaalsContact CZ-OD1 3.25Å; R632-D653 IonicContact CZ-OD2 2.97Å; R632-D653 IonicContact NE-OD1 3.95Å; R632-D653 IonicContact NE-OD2 3.7Å; R632-D653 PolarHBondContact NE-OD2 3.02Å; R632-D653 IonicContact NH1-OD1 3.62Å; R632-D653 IonicContact NH2-OD1 3.41Å; R632-D653 PolarHBondContact NH2-OD1 2.91Å; R632-D653 IonicContact NH2-OD2 3.49Å; R632-D653 PolarHBondContact NH2-OD2 2.81Å; D651-D653 PolarHBondContact O-N 3.35Å
654	G	81.4	Confident	89.4	Confident	62 Å²	62	57.5 Å²	57.5	64%	0.639	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.5	-39.9	-169.8	0	0	0	0	0	113.6	D651	D651-G654 PolarHBondContact O-N 2.77Å
655	D	92	Very high	89.7	Confident	72 Å²	72	52.6 Å²	52.6	39%	0.385	29%	0.293	S	S	.	.			trans	-90.3	114	-171.4	-73.3	-47.7	0	0	0	112.9	F650 D651 I660	F650-D655 WeakPolarHBondContact CA-OD2 3.28Å; F650-D655 HydrophobicContact CB-CB 4.01Å; F650-D655 WeakPolarHBondContact CB-OD2 3.31Å; F650-D655 HydrophobicContact CD2-CB 4.44Å; D651-D655 PolarHBondContact N-OD2 3.06Å; D651-D655 PolarHBondContact O-N 3.32Å; D651-D655 VanDerWaalsContact O-N 3.08Å; D655-I660 HydrophobicContact CB-CD1 3.83Å; D655-I660 HydrophobicContact CB-CG1 4.09Å
656	N	90.8	Very high	90	Very high	69 Å²	69	54.9 Å²	54.9	37%	0.369	31%	0.307	S	S	.	.			trans	-71.8	123.1	174.5	178.9	14.3	0	0	0	111	E658 D659 I660	N656-E658 VanDerWaalsContact C-N 3.27Å; N656-E658 PolarHBondContact O-N 3.02Å; N656-E658 PolarHBondContact OD1-N 3.22Å; N656-E658 PolarHBondContact OD1-OE2 3.46Å; N656-D659 HydrophobicContact CB-CB 4.2Å; N656-D659 WeakPolarHBondContact CB-OD2 3.49Å; N656-D659 PolarHBondContact ND2-OD2 3.26Å; N656-D659 WeakPolarHBondContact O-CA 3.44Å; N656-D659 PolarHBondContact O-N 2.66Å; N656-I660 PolarHBondContact O-N 3.16Å
657	P	92.3	Very high	90	Very high	8 Å²	8	61.9 Å²	61.9	5%	0.052	33%	0.33	C	S	.	.	H	α-helix	trans	-63.9	-26.1	-176.6	23.7	-33.3	0	0	0	114.5	D659 A661 M682 Y683 I686	P657-D659 VanDerWaalsContact C-N 3.32Å; P657-A661 VanDerWaalsContact O-CB 3.28Å; P657-A661 WeakPolarHBondContact O-CB 3.36Å; P657-A661 PolarHBondContact O-N 2.75Å; P657-M682 HydrophobicContact CB-CB 3.58Å; P657-M682 HydrophobicContact CB-CG 4.3Å; P657-Y683 HydrophobicContact CB-CE2 4.47Å; P657-Y683 HydrophobicContact CG-CD1 4.07Å; P657-Y683 HydrophobicContact CG-CD2 4.12Å; P657-Y683 HydrophobicContact CG-CE1 3.59Å; P657-Y683 HydrophobicContact CG-CE2 3.68Å; P657-Y683 HydrophobicContact CG-CG 4.32Å; P657-I686 HydrophobicContact CB-CD1 4.31Å; P657-I686 HydrophobicContact CG-CD1 4.14Å
658	E	93.5	Very high	89.9	Confident	70 Å²	70	64.2 Å²	64.2	33%	0.327	34%	0.34	S	S	.	.	H	α-helix	trans	-63.6	-36	169.5	-89.1	69.3	-174.8	0	0	112.1	N656 S662 I679 Y683	N656-E658 VanDerWaalsContact C-N 3.27Å; N656-E658 PolarHBondContact O-N 3.02Å; N656-E658 PolarHBondContact OD1-N 3.22Å; N656-E658 PolarHBondContact OD1-OE2 3.46Å; E658-S662 PolarHBondContact O-N 2.76Å; E658-S662 VanDerWaalsContact O-N 3.13Å; E658-S662 PolarHBondContact O-OG 2.64Å; E658-I679 HydrophobicContact CG-CD1 4.19Å; E658-I679 HydrophobicContact CG-CG2 4.46Å; E658-I679 WeakPolarHBondContact OE1-CG2 3.21Å; E658-Y683 PolarHBondContact OE2-OH 3.07Å; E658-Y683 VanDerWaalsContact OE2-OH 3.04Å
659	D	92.8	Very high	89.7	Confident	93 Å²	93	66.1 Å²	66.1	50%	0.497	35%	0.349	S	S	.	.	H	α-helix	trans	-81.5	-40.2	179.3	-65.8	-44.8	0	0	0	111.1	N656 P657 A661 S662 V663	N656-D659 HydrophobicContact CB-CB 4.2Å; N656-D659 WeakPolarHBondContact CB-OD2 3.49Å; N656-D659 PolarHBondContact ND2-OD2 3.26Å; N656-D659 WeakPolarHBondContact O-CA 3.44Å; N656-D659 PolarHBondContact O-N 2.66Å; P657-D659 VanDerWaalsContact C-N 3.32Å; D659-A661 VanDerWaalsContact C-N 3.27Å; D659-A661 PolarHBondContact O-N 3.2Å; D659-S662 WeakPolarHBondContact O-CA 3.15Å; D659-S662 WeakPolarHBondContact O-CB 3.27Å; D659-S662 PolarHBondContact O-N 3.37Å; D659-V663 PolarHBondContact O-N 2.71Å
660	I	91.4	Very high	89.6	Confident	15 Å²	15	60.2 Å²	60.2	8%	0.077	32%	0.323	C	S	.	.	H	α-helix	trans	-53.1	-48	167.2	-60	173.3	0	0	0	109.8	F648 F650 D655 N656 S662 V663 M664 F678 M682	F648-I660 HydrophobicContact CE2-CG2 3.92Å; F648-I660 HydrophobicContact CZ-CG2 4.47Å; F650-I660 HydrophobicContact CB-CD1 3.73Å; F650-I660 HydrophobicContact CD1-CD1 4.46Å; F650-I660 HydrophobicContact CD2-CD1 3.91Å; F650-I660 HydrophobicContact CG-CD1 3.78Å; D655-I660 HydrophobicContact CB-CD1 3.83Å; D655-I660 HydrophobicContact CB-CG1 4.09Å; N656-I660 PolarHBondContact O-N 3.16Å; I660-S662 PolarHBondContact O-N 3.23Å; I660-V663 PolarHBondContact O-N 3.01Å; I660-M664 HydrophobicContact CG2-CE 4.28Å; I660-M664 HydrophobicContact CG2-CG 4.18Å; I660-M664 WeakPolarHBondContact O-CB 3.44Å; I660-M664 WeakPolarHBondContact O-CG 3.39Å; I660-M664 PolarHBondContact O-N 2.87Å; I660-F678 HydrophobicContact CG2-CE1 4.09Å; I660-F678 HydrophobicContact CG2-CZ 4.31Å; I660-M682 HydrophobicContact CD1-CE 3.65Å; I660-M682 HydrophobicContact CG2-CE 4.27Å
661	A	92.5	Very high	89.4	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-62	-32.8	177.9	0	0	0	0	0	112.9	P657 D659 L665 R675 F678 I679	P657-A661 VanDerWaalsContact O-CB 3.28Å; P657-A661 WeakPolarHBondContact O-CB 3.36Å; P657-A661 PolarHBondContact O-N 2.75Å; D659-A661 VanDerWaalsContact C-N 3.27Å; D659-A661 PolarHBondContact O-N 3.2Å; A661-L665 WeakPolarHBondContact O-CG 3.43Å; A661-L665 PolarHBondContact O-N 3.31Å; A661-R675 HydrophobicContact CB-CG 4.33Å; A661-F678 HydrophobicContact CB-CD1 3.72Å; A661-F678 HydrophobicContact CB-CE1 4.13Å; A661-I679 HydrophobicContact CB-CD1 3.92Å; A661-I679 HydrophobicContact CB-CG1 3.35Å
662	S	92.1	Very high	89.4	Confident	36 Å²	36	63.9 Å²	63.9	25%	0.252	35%	0.348	S	S	.	.	H	α-helix	trans	-72.5	-38.2	177.5	-56.1	0	0	0	0	111.8	E658 D659 I660 L665 L666 R675	E658-S662 PolarHBondContact O-N 2.76Å; E658-S662 VanDerWaalsContact O-N 3.13Å; E658-S662 PolarHBondContact O-OG 2.64Å; D659-S662 WeakPolarHBondContact O-CA 3.15Å; D659-S662 WeakPolarHBondContact O-CB 3.27Å; D659-S662 PolarHBondContact O-N 3.37Å; I660-S662 PolarHBondContact O-N 3.23Å; S662-L665 PolarHBondContact O-N 3.05Å; S662-L666 WeakPolarHBondContact O-CB 3.16Å; S662-L666 PolarHBondContact O-N 3.34Å; S662-R675 PolarHBondContact OG-NH2 3.49Å
663	V	91.4	Very high	89.4	Confident	81 Å²	81	67.6 Å²	67.6	49%	0.491	38%	0.376	S	S	.	.	H	α-helix	trans	-66.8	-40.6	170.6	176.2	0	0	0	0	111.5	D659 I660 L665 L666 R667	D659-V663 PolarHBondContact O-N 2.71Å; I660-V663 PolarHBondContact O-N 3.01Å; V663-L665 VanDerWaalsContact C-N 3.29Å; V663-L665 PolarHBondContact O-N 2.9Å; V663-L666 PolarHBondContact O-N 3.47Å; V663-R667 WeakPolarHBondContact O-CG 3.46Å; V663-R667 PolarHBondContact O-N 2.76Å; V663-R667 VanDerWaalsContact O-N 3.14Å
664	M	90.6	Very high	89.6	Confident	14 Å²	14	63.7 Å²	63.7	7%	0.069	35%	0.354	C	S	.	.	H	α-helix	trans	-67.6	-27.8	178.4	-66.7	-72.3	157.5	0	0	112.9	L638 F648 I660 F669 I670 F678	L638-M664 HydrophobicContact CD2-SD 4.26Å; F648-M664 HydrophobicContact CB-CE 3.82Å; F648-M664 HydrophobicContact CD1-CE 3.6Å; F648-M664 HydrophobicContact CD1-SD 4.39Å; F648-M664 HydrophobicContact CD2-CE 3.68Å; F648-M664 HydrophobicContact CE1-CE 4.01Å; F648-M664 HydrophobicContact CE2-CE 4.08Å; F648-M664 HydrophobicContact CG-CE 3.42Å; F648-M664 VanDerWaalsContact CG-CE 3.42Å; F648-M664 HydrophobicContact CZ-CE 4.23Å; I660-M664 HydrophobicContact CG2-CE 4.28Å; I660-M664 HydrophobicContact CG2-CG 4.18Å; I660-M664 WeakPolarHBondContact O-CB 3.44Å; I660-M664 WeakPolarHBondContact O-CG 3.39Å; I660-M664 PolarHBondContact O-N 2.87Å; M664-F669 PolarHBondContact O-N 2.85Å; M664-F669 HydrophobicContact SD-CB 4.3Å; M664-F669 HydrophobicContact SD-CD2 3.74Å; M664-I670 HydrophobicContact CB-CD1 3.89Å; M664-I670 HydrophobicContact CB-CG1 4Å; M664-I670 PolarHBondContact O-N 2.82Å; M664-F678 HydrophobicContact CB-CE1 4.4Å; M664-F678 HydrophobicContact CB-CZ 4.42Å; M664-F678 HydrophobicContact CG-CE1 4.04Å; M664-F678 HydrophobicContact CG-CZ 3.81Å
665	L	90.1	Very high	90	Very high	36 Å²	36	64.9 Å²	64.9	19%	0.188	34%	0.339	C	S	.	.	H	α-helix	trans	-71.3	-48.6	167.2	-77.3	172.7	0	0	0	112	A661 S662 V663 R667 D668 I670 P672 R675	A661-L665 WeakPolarHBondContact O-CG 3.43Å; A661-L665 PolarHBondContact O-N 3.31Å; S662-L665 PolarHBondContact O-N 3.05Å; V663-L665 VanDerWaalsContact C-N 3.29Å; V663-L665 PolarHBondContact O-N 2.9Å; L665-R667 PolarHBondContact O-N 2.99Å; L665-D668 PolarHBondContact O-N 3.06Å; L665-I670 HydrophobicContact CD2-CD1 4.41Å; L665-I670 HydrophobicContact CD2-CG1 3.88Å; L665-I670 HydrophobicContact CG-CD1 4.22Å; L665-I670 HydrophobicContact CG-CG1 4.05Å; L665-P672 HydrophobicContact CD2-CB 4.38Å; L665-P672 HydrophobicContact CD2-CG 4.19Å; L665-R675 HydrophobicContact CD1-CB 4.04Å; L665-R675 HydrophobicContact CD1-CG 3.63Å; L665-R675 HydrophobicContact CG-CG 4.4Å
666	L	90.6	Very high	89.9	Confident	142 Å²	142	66.9 Å²	66.9	74%	0.743	35%	0.346	S	S	*	.	H	α-helix	trans	-62.9	-11.4	-179.2	-172.2	60.8	0	0	0	113.6	S662 V663	S662-L666 WeakPolarHBondContact O-CB 3.16Å; S662-L666 PolarHBondContact O-N 3.34Å; V663-L666 PolarHBondContact O-N 3.47Å
667	R	87.6	Confident	89.7	Confident	170 Å²	170	65.3 Å²	65.3	64%	0.642	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.3	11.9	175.6	-59.2	-63.1	-171.3	166.3	1.7	113.8	V663 L665 F669	V663-R667 WeakPolarHBondContact O-CG 3.46Å; V663-R667 PolarHBondContact O-N 2.76Å; V663-R667 VanDerWaalsContact O-N 3.14Å; L665-R667 PolarHBondContact O-N 2.99Å; R667-F669 HydrophobicContact CB-CD2 3.64Å; R667-F669 HydrophobicContact CB-CE1 4.45Å; R667-F669 HydrophobicContact CB-CE2 3.55Å; R667-F669 HydrophobicContact CB-CG 4.15Å; R667-F669 HydrophobicContact CB-CZ 3.99Å; R667-F669 HydrophobicContact CG-CE2 4.2Å; R667-F669 VanDerWaalsContact O-CD1 3.32Å; R667-F669 WeakPolarHBondContact O-CD1 3.27Å; R667-F669 PolarHBondContact O-N 3.03Å; R667-F669 VanDerWaalsContact O-N 3.08Å
668	D	86.6	Confident	89.6	Confident	114 Å²	114	65 Å²	65	61%	0.61	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	22.8	-179.3	-66.7	-55.2	0	0	0	115.3	H641 L665	H641-D668 PolarHBondContact CE1-O 2.74Å; H641-D668 PolarHBondContact ND1-O 3.25Å; L665-D668 PolarHBondContact O-N 3.06Å
669	F	87.3	Confident	89.6	Confident	64 Å²	64	62.4 Å²	62.4	28%	0.281	33%	0.333	S	S	.	.	S	Bend	trans	-78.7	-31.2	179.9	-62.9	-33.5	0	0	0	112.2	L638 T640 V646 M664 R667	L638-F669 HydrophobicContact CD2-CB 4.05Å; T640-F669 VanDerWaalsContact CB-O 3.24Å; T640-F669 WeakPolarHBondContact CB-O 3.14Å; T640-F669 HydrophobicContact CG2-CB 3.96Å; T640-F669 HydrophobicContact CG2-CD1 4.17Å; T640-F669 HydrophobicContact CG2-CG 4.39Å; T640-F669 WeakPolarHBondContact CG2-O 3.48Å; V646-F669 HydrophobicContact CG1-CD2 3.98Å; V646-F669 HydrophobicContact CG1-CE2 3.84Å; V646-F669 HydrophobicContact CG1-CG 4.41Å; V646-F669 HydrophobicContact CG1-CZ 4.17Å; V646-F669 HydrophobicContact CG2-CD1 3.71Å; V646-F669 HydrophobicContact CG2-CD2 4.39Å; V646-F669 HydrophobicContact CG2-CE1 3.73Å; V646-F669 HydrophobicContact CG2-CE2 4.41Å; V646-F669 HydrophobicContact CG2-CG 4.05Å; V646-F669 HydrophobicContact CG2-CZ 4.09Å; M664-F669 PolarHBondContact O-N 2.85Å; M664-F669 HydrophobicContact SD-CB 4.3Å; M664-F669 HydrophobicContact SD-CD2 3.74Å; R667-F669 HydrophobicContact CB-CD2 3.64Å; R667-F669 HydrophobicContact CB-CE1 4.45Å; R667-F669 HydrophobicContact CB-CE2 3.55Å; R667-F669 HydrophobicContact CB-CG 4.15Å; R667-F669 HydrophobicContact CB-CZ 3.99Å; R667-F669 HydrophobicContact CG-CE2 4.2Å; R667-F669 VanDerWaalsContact O-CD1 3.32Å; R667-F669 WeakPolarHBondContact O-CD1 3.27Å; R667-F669 PolarHBondContact O-N 3.03Å; R667-F669 VanDerWaalsContact O-N 3.08Å
670	I	88.8	Confident	89.4	Confident	1 Å²	1	63.9 Å²	63.9	1%	0.005	34%	0.34	C	S	.	.	S	Bend	trans	-123	152.1	169.3	63.4	-179.2	0	0	0	109.8	L638 M664 L665 E674 F678	L638-I670 HydrophobicContact CD1-CG2 4.45Å; L638-I670 HydrophobicContact CD2-CG2 3.81Å; M664-I670 HydrophobicContact CB-CD1 3.89Å; M664-I670 HydrophobicContact CB-CG1 4Å; M664-I670 PolarHBondContact O-N 2.82Å; L665-I670 HydrophobicContact CD2-CD1 4.41Å; L665-I670 HydrophobicContact CD2-CG1 3.88Å; L665-I670 HydrophobicContact CG-CD1 4.22Å; L665-I670 HydrophobicContact CG-CG1 4.05Å; I670-E674 HydrophobicContact CB-CB 4.44Å; I670-F678 HydrophobicContact CD1-CB 3.71Å; I670-F678 HydrophobicContact CD1-CD1 3.79Å; I670-F678 HydrophobicContact CD1-CD2 4.25Å; I670-F678 HydrophobicContact CD1-CE1 4.48Å; I670-F678 HydrophobicContact CD1-CG 3.66Å; I670-F678 HydrophobicContact CG2-CD2 3.81Å; I670-F678 HydrophobicContact CG2-CE2 4.31Å; I670-F678 HydrophobicContact CG2-CG 4.23Å
671	L	88.6	Confident	89.2	Confident	55 Å²	55	66.3 Å²	66.3	29%	0.288	35%	0.348	S	S	.	.			trans	-80.8	155.4	174.3	-63.6	173.7	0	0	0	111.2	H641 S673 E674 R675	H641-L671 HydrophobicContact CB-CD1 4.14Å; H641-L671 HydrophobicContact CB-CG 4.06Å; L671-S673 PolarHBondContact O-N 3.14Å; L671-S673 VanDerWaalsContact O-N 3.15Å; L671-E674 HydrophobicContact CB-CG 4.34Å; L671-E674 PolarHBondContact N-OE2 3.27Å; L671-E674 WeakPolarHBondContact O-CA 3.3Å; L671-E674 WeakPolarHBondContact O-CB 3.29Å; L671-E674 PolarHBondContact O-N 3Å; L671-R675 PolarHBondContact O-N 3.24Å
672	P	88.6	Confident	89.2	Confident	99 Å²	99	66.3 Å²	66.3	64%	0.643	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-51.7	-36.5	173.5	-29.7	36.4	0	0	0	114	L665 E674 R675	L665-P672 HydrophobicContact CD2-CB 4.38Å; L665-P672 HydrophobicContact CD2-CG 4.19Å; P672-E674 VanDerWaalsContact C-N 3.28Å; P672-E674 PolarHBondContact O-N 3.22Å; P672-R675 WeakPolarHBondContact O-CB 3.37Å; P672-R675 PolarHBondContact O-N 3.09Å
673	S	86.9	Confident	89.2	Confident	105 Å²	105	69.8 Å²	69.8	73%	0.734	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-77.8	-4.3	176.1	52.8	0	0	0	0	115	L671	L671-S673 PolarHBondContact O-N 3.14Å; L671-S673 VanDerWaalsContact O-N 3.15Å
674	E	86.4	Confident	89	Confident	31 Å²	31	71.9 Å²	71.9	15%	0.145	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-102.6	-6.4	171.6	-67.9	-172.4	118.4	0	0	112.8	A619 I670 L671 P672 G677 F678	A619-E674 PolarHBondContact N-OE1 3.06Å; I670-E674 HydrophobicContact CB-CB 4.44Å; L671-E674 HydrophobicContact CB-CG 4.34Å; L671-E674 PolarHBondContact N-OE2 3.27Å; L671-E674 WeakPolarHBondContact O-CA 3.3Å; L671-E674 WeakPolarHBondContact O-CB 3.29Å; L671-E674 PolarHBondContact O-N 3Å; P672-E674 VanDerWaalsContact C-N 3.28Å; P672-E674 PolarHBondContact O-N 3.22Å; E674-G677 CarbonylContact O-C 3.5Å; E674-G677 PolarHBondContact O-N 2.85Å; E674-F678 WeakPolarHBondContact O-CB 3.48Å; E674-F678 PolarHBondContact O-N 2.86Å
675	R	89.8	Confident	88.9	Confident	87 Å²	87	71.9 Å²	71.9	33%	0.328	36%	0.362	S	S	.	.	H	α-helix	trans	-54.7	-58.7	-173.1	-171.7	-164.3	-163.4	175.3	4.5	113.1	A661 S662 L665 L671 P672 G677 F678 I679	A661-R675 HydrophobicContact CB-CG 4.33Å; S662-R675 PolarHBondContact OG-NH2 3.49Å; L665-R675 HydrophobicContact CD1-CB 4.04Å; L665-R675 HydrophobicContact CD1-CG 3.63Å; L665-R675 HydrophobicContact CG-CG 4.4Å; L671-R675 PolarHBondContact O-N 3.24Å; P672-R675 WeakPolarHBondContact O-CB 3.37Å; P672-R675 PolarHBondContact O-N 3.09Å; R675-G677 PolarHBondContact O-N 3Å; R675-F678 WeakPolarHBondContact O-CA 3.25Å; R675-F678 WeakPolarHBondContact O-CB 3.39Å; R675-F678 PolarHBondContact O-N 3.43Å; R675-I679 HydrophobicContact CG-CD1 3.97Å; R675-I679 WeakPolarHBondContact O-CG1 3.44Å; R675-I679 PolarHBondContact O-N 3.18Å
676	E	88.9	Confident	88.9	Confident	114 Å²	114	71.3 Å²	71.3	53%	0.533	36%	0.358	S	S	.	.	H	α-helix	trans	-63.3	-34.3	-178.1	-65.9	66.3	-144.4	0	0	110.8	L680	E676-L680 WeakPolarHBondContact O-CG 3.28Å; E676-L680 PolarHBondContact O-N 3.23Å
677	G	86.9	Confident	88.8	Confident	37 Å²	37	71 Å²	71	38%	0.381	35%	0.351	S	S	.	.	H	α-helix	trans	-69	-30.2	173.5	0	0	0	0	0	113.4	E674 R675 R681	E674-G677 CarbonylContact O-C 3.5Å; E674-G677 PolarHBondContact O-N 2.85Å; R675-G677 PolarHBondContact O-N 3Å; G677-R681 WeakPolarHBondContact O-CG 3.42Å; G677-R681 PolarHBondContact O-NE 2.69Å
678	F	90.9	Very high	88.8	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-74.9	-48	174	178.5	-92.1	0	0	0	111.4	L621 L638 F648 I660 A661 M664 I670 E674 R675 L680 R681 M682	L621-F678 HydrophobicContact CD1-CE2 4.36Å; L621-F678 HydrophobicContact CD2-CD2 4.43Å; L621-F678 HydrophobicContact CD2-CE2 3.95Å; L621-F678 HydrophobicContact CD2-CZ 4.47Å; L638-F678 HydrophobicContact CD1-CD2 4.27Å; L638-F678 HydrophobicContact CD1-CE2 4.03Å; L638-F678 HydrophobicContact CD2-CE2 4.03Å; F648-F678 HydrophobicContact CE1-CZ 4.46Å; F648-F678 HydrophobicContact CZ-CZ 4.04Å; I660-F678 HydrophobicContact CG2-CE1 4.09Å; I660-F678 HydrophobicContact CG2-CZ 4.31Å; A661-F678 HydrophobicContact CB-CD1 3.72Å; A661-F678 HydrophobicContact CB-CE1 4.13Å; M664-F678 HydrophobicContact CB-CE1 4.4Å; M664-F678 HydrophobicContact CB-CZ 4.42Å; M664-F678 HydrophobicContact CG-CE1 4.04Å; M664-F678 HydrophobicContact CG-CZ 3.81Å; I670-F678 HydrophobicContact CD1-CB 3.71Å; I670-F678 HydrophobicContact CD1-CD1 3.79Å; I670-F678 HydrophobicContact CD1-CD2 4.25Å; I670-F678 HydrophobicContact CD1-CE1 4.48Å; I670-F678 HydrophobicContact CD1-CG 3.66Å; I670-F678 HydrophobicContact CG2-CD2 3.81Å; I670-F678 HydrophobicContact CG2-CE2 4.31Å; I670-F678 HydrophobicContact CG2-CG 4.23Å; E674-F678 WeakPolarHBondContact O-CB 3.48Å; E674-F678 PolarHBondContact O-N 2.86Å; R675-F678 WeakPolarHBondContact O-CA 3.25Å; R675-F678 WeakPolarHBondContact O-CB 3.39Å; R675-F678 PolarHBondContact O-N 3.43Å; F678-L680 VanDerWaalsContact C-N 3.35Å; F678-L680 PolarHBondContact O-N 2.87Å; F678-R681 WeakPolarHBondContact O-CA 3.33Å; F678-R681 PolarHBondContact O-N 3.12Å; F678-M682 HydrophobicContact CD1-CG 3.94Å; F678-M682 HydrophobicContact CE1-CG 3.51Å; F678-M682 HydrophobicContact CE1-SD 3.88Å; F678-M682 HydrophobicContact CE2-SD 4.3Å; F678-M682 HydrophobicContact CZ-CG 3.89Å; F678-M682 HydrophobicContact CZ-SD 3.63Å; F678-M682 PolarHBondContact O-N 3.2Å
679	I	92.5	Very high	88.8	Confident	16 Å²	16	64.9 Å²	64.9	8%	0.082	32%	0.319	C	S	.	.	H	α-helix	trans	-52.6	-50.4	177.2	-67.5	165	0	0	0	111.1	E658 A661 R675 R681 M682 Y683	E658-I679 HydrophobicContact CG-CD1 4.19Å; E658-I679 HydrophobicContact CG-CG2 4.46Å; E658-I679 WeakPolarHBondContact OE1-CG2 3.21Å; A661-I679 HydrophobicContact CB-CD1 3.92Å; A661-I679 HydrophobicContact CB-CG1 3.35Å; R675-I679 HydrophobicContact CG-CD1 3.97Å; R675-I679 WeakPolarHBondContact O-CG1 3.44Å; R675-I679 PolarHBondContact O-N 3.18Å; I679-R681 PolarHBondContact O-N 3.3Å; I679-R681 VanDerWaalsContact O-N 3.17Å; I679-M682 WeakPolarHBondContact O-CB 3.46Å; I679-M682 PolarHBondContact O-N 2.75Å; I679-M682 VanDerWaalsContact O-N 3.07Å; I679-Y683 HydrophobicContact CG2-CD2 3.89Å; I679-Y683 HydrophobicContact CG2-CE2 3.69Å; I679-Y683 WeakPolarHBondContact O-CD2 3.28Å; I679-Y683 PolarHBondContact O-N 2.86Å; I679-Y683 VanDerWaalsContact O-N 3.08Å
680	L	89	Confident	88.7	Confident	125 Å²	125	66 Å²	66	65%	0.654	33%	0.326	S	S	*	.	H	α-helix	trans	-59.8	-29.6	178.9	-71.5	171.1	0	0	0	113.5	E676 F678 E684	E676-L680 WeakPolarHBondContact O-CG 3.28Å; E676-L680 PolarHBondContact O-N 3.23Å; F678-L680 VanDerWaalsContact C-N 3.35Å; F678-L680 PolarHBondContact O-N 2.87Å; L680-E684 PolarHBondContact O-N 2.87Å
681	R	87.7	Confident	88.5	Confident	65 Å²	65	70.7 Å²	70.7	25%	0.245	35%	0.35	C	S	.	.	H	α-helix	trans	-83.5	-27.6	176.7	-71.9	176.8	-67.8	164.2	-0.1	113	A619 G677 F678 I679 E684 I685	A619-R681 PolarHBondContact O-NH1 2.8Å; G677-R681 WeakPolarHBondContact O-CG 3.42Å; G677-R681 PolarHBondContact O-NE 2.69Å; F678-R681 WeakPolarHBondContact O-CA 3.33Å; F678-R681 PolarHBondContact O-N 3.12Å; I679-R681 PolarHBondContact O-N 3.3Å; I679-R681 VanDerWaalsContact O-N 3.17Å; R681-E684 PolarHBondContact O-N 3.25Å; R681-I685 WeakPolarHBondContact O-CB 3.37Å; R681-I685 WeakPolarHBondContact O-CG1 3.49Å; R681-I685 PolarHBondContact O-N 3.12Å
682	M	91.4	Very high	87.9	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-62.1	-47.4	167.6	-69.2	-59.2	-56.2	0	0	110.3	L621 F648 F650 P657 I660 F678 I679 E684 I685 I686	L621-M682 HydrophobicContact CD2-CG 4.47Å; L621-M682 HydrophobicContact CD2-SD 3.54Å; L621-M682 VanDerWaalsContact CD2-SD 3.54Å; F648-M682 HydrophobicContact CE2-CE 4.02Å; F648-M682 HydrophobicContact CE2-SD 4.26Å; F648-M682 HydrophobicContact CZ-CE 4.17Å; F648-M682 HydrophobicContact CZ-SD 3.81Å; F650-M682 HydrophobicContact CD1-CE 3.86Å; F650-M682 HydrophobicContact CD2-CE 4.4Å; F650-M682 HydrophobicContact CE1-CE 3.54Å; F650-M682 HydrophobicContact CE2-CE 4.14Å; F650-M682 HydrophobicContact CG-CE 4.27Å; F650-M682 HydrophobicContact CZ-CE 3.7Å; P657-M682 HydrophobicContact CB-CB 3.58Å; P657-M682 HydrophobicContact CB-CG 4.3Å; I660-M682 HydrophobicContact CD1-CE 3.65Å; I660-M682 HydrophobicContact CG2-CE 4.27Å; F678-M682 HydrophobicContact CD1-CG 3.94Å; F678-M682 HydrophobicContact CE1-CG 3.51Å; F678-M682 HydrophobicContact CE1-SD 3.88Å; F678-M682 HydrophobicContact CE2-SD 4.3Å; F678-M682 HydrophobicContact CZ-CG 3.89Å; F678-M682 HydrophobicContact CZ-SD 3.63Å; F678-M682 PolarHBondContact O-N 3.2Å; I679-M682 WeakPolarHBondContact O-CB 3.46Å; I679-M682 PolarHBondContact O-N 2.75Å; I679-M682 VanDerWaalsContact O-N 3.07Å; M682-E684 VanDerWaalsContact C-N 3.35Å; M682-E684 PolarHBondContact O-N 3.29Å; M682-I685 PolarHBondContact O-N 2.87Å; M682-I685 VanDerWaalsContact O-N 3.08Å; M682-I686 WeakPolarHBondContact O-CG1 3.3Å; M682-I686 PolarHBondContact O-N 3.11Å
683	Y	91.6	Very high	87.2	Confident	109 Å²	109	68.7 Å²	68.7	43%	0.427	33%	0.332	S	S	.	.	H	α-helix	trans	-60	-39.1	174.3	-78.9	-66.2	0	0	0	113.6	P657 E658 I679 I685 K687	P657-Y683 HydrophobicContact CB-CE2 4.47Å; P657-Y683 HydrophobicContact CG-CD1 4.07Å; P657-Y683 HydrophobicContact CG-CD2 4.12Å; P657-Y683 HydrophobicContact CG-CE1 3.59Å; P657-Y683 HydrophobicContact CG-CE2 3.68Å; P657-Y683 HydrophobicContact CG-CG 4.32Å; E658-Y683 PolarHBondContact OE2-OH 3.07Å; E658-Y683 VanDerWaalsContact OE2-OH 3.04Å; I679-Y683 HydrophobicContact CG2-CD2 3.89Å; I679-Y683 HydrophobicContact CG2-CE2 3.69Å; I679-Y683 WeakPolarHBondContact O-CD2 3.28Å; I679-Y683 PolarHBondContact O-N 2.86Å; I679-Y683 VanDerWaalsContact O-N 3.08Å; Y683-I685 VanDerWaalsContact C-N 3.32Å; Y683-K687 WeakPolarHBondContact O-CB 3.27Å; Y683-K687 PolarHBondContact O-N 2.69Å
684	E	88.4	Confident	86.4	Confident	125 Å²	125	71.2 Å²	71.2	58%	0.584	33%	0.332	S	S	*	.	H	α-helix	trans	-63.1	-38.8	173.1	-169.8	-174	166.3	0	0	111.9	L680 R681 M682 R688	L680-E684 PolarHBondContact O-N 2.87Å; R681-E684 PolarHBondContact O-N 3.25Å; M682-E684 VanDerWaalsContact C-N 3.35Å; M682-E684 PolarHBondContact O-N 3.29Å; E684-R688 VanDerWaalsContact O-CB 3.32Å; E684-R688 WeakPolarHBondContact O-CB 3.44Å; E684-R688 PolarHBondContact O-N 3.49Å
685	I	89	Confident	85.2	Confident	15 Å²	15	77.4 Å²	77.4	8%	0.077	36%	0.361	C	S	.	.	H	α-helix	trans	-74.3	-42.2	-178.8	-86.5	175.6	0	0	0	113	L621 I623 V634 C636 F650 R681 M682 Y683 K687 R688 A689	L621-I685 HydrophobicContact CB-CD1 4.25Å; L621-I685 HydrophobicContact CD2-CD1 3.58Å; L621-I685 HydrophobicContact CG-CD1 3.51Å; I623-I685 HydrophobicContact CD1-CG1 4.31Å; I623-I685 HydrophobicContact CD1-CG2 4.12Å; I623-I685 HydrophobicContact CG1-CB 4.46Å; I623-I685 HydrophobicContact CG1-CD1 4.32Å; I623-I685 HydrophobicContact CG1-CG1 4.06Å; I623-I685 HydrophobicContact CG1-CG2 3.86Å; V634-I685 HydrophobicContact CG1-CG2 4.44Å; C636-I685 VanDerWaalsContact SG-CG2 3.57Å; F650-I685 HydrophobicContact CE1-CG2 4.44Å; F650-I685 HydrophobicContact CZ-CG2 4.15Å; R681-I685 WeakPolarHBondContact O-CB 3.37Å; R681-I685 WeakPolarHBondContact O-CG1 3.49Å; R681-I685 PolarHBondContact O-N 3.12Å; M682-I685 PolarHBondContact O-N 2.87Å; M682-I685 VanDerWaalsContact O-N 3.08Å; Y683-I685 VanDerWaalsContact C-N 3.32Å; I685-K687 VanDerWaalsContact C-N 3.34Å; I685-K687 PolarHBondContact O-N 2.66Å; I685-R688 CarbonylContact O-C 3.58Å; I685-R688 PolarHBondContact O-N 3.32Å; I685-R688 VanDerWaalsContact O-N 3.12Å; I685-A689 WeakPolarHBondContact O-CB 3.23Å; I685-A689 PolarHBondContact O-N 2.85Å
686	I	89.7	Confident	83.5	Confident	23 Å²	23	80 Å²	80	12%	0.118	38%	0.377	C	S	.	.	H	α-helix	trans	-52.7	-56.3	172.8	-72.8	162.9	0	0	0	108.6	F650 L652 P657 M682 R688 A689 E690	F650-I686 HydrophobicContact CE2-CD1 4.36Å; F650-I686 HydrophobicContact CE2-CG1 3.74Å; F650-I686 HydrophobicContact CZ-CG1 4.06Å; L652-I686 HydrophobicContact CD2-CB 4.26Å; L652-I686 HydrophobicContact CD2-CG1 4.23Å; L652-I686 HydrophobicContact CD2-CG2 3.93Å; P657-I686 HydrophobicContact CB-CD1 4.31Å; P657-I686 HydrophobicContact CG-CD1 4.14Å; M682-I686 WeakPolarHBondContact O-CG1 3.3Å; M682-I686 PolarHBondContact O-N 3.11Å; I686-R688 PolarHBondContact O-N 3.12Å; I686-A689 PolarHBondContact O-N 3.48Å; I686-A689 VanDerWaalsContact O-N 3.08Å; I686-E690 WeakPolarHBondContact O-CG 3.11Å; I686-E690 PolarHBondContact O-N 2.79Å
687	K	88.1	Confident	81.3	Confident	136 Å²	136	82.5 Å²	82.5	59%	0.591	39%	0.388	S	S	*	.	H	α-helix	trans	-59.4	-31.8	178.5	-173.3	172.7	-177.6	174.9	0	113.8	Y683 I685 E690 L691	Y683-K687 WeakPolarHBondContact O-CB 3.27Å; Y683-K687 PolarHBondContact O-N 2.69Å; I685-K687 VanDerWaalsContact C-N 3.34Å; I685-K687 PolarHBondContact O-N 2.66Å; K687-E690 WeakPolarHBondContact CA-OE2 3.49Å; K687-L691 WeakPolarHBondContact O-CD1 3.07Å; K687-L691 VanDerWaalsContact O-CG 3.28Å; K687-L691 WeakPolarHBondContact O-CG 3.47Å; K687-L691 PolarHBondContact O-N 3.41Å
688	R	86.6	Confident	79.1	Confident	155 Å²	155	86.4 Å²	86.4	59%	0.585	41%	0.407	S	S	*	.	H	α-helix	trans	-75.9	-37.8	176.6	-175.1	173.9	-179	144.3	3.5	112.3	I623 E684 I685 I686 L691 M692	I623-R688 HydrophobicContact CD1-CB 4.15Å; I623-R688 HydrophobicContact CD1-CG 4.05Å; E684-R688 VanDerWaalsContact O-CB 3.32Å; E684-R688 WeakPolarHBondContact O-CB 3.44Å; E684-R688 PolarHBondContact O-N 3.49Å; I685-R688 CarbonylContact O-C 3.58Å; I685-R688 PolarHBondContact O-N 3.32Å; I685-R688 VanDerWaalsContact O-N 3.12Å; I686-R688 PolarHBondContact O-N 3.12Å; R688-L691 PolarHBondContact O-N 3.39Å; R688-M692 HydrophobicContact CG-SD 4.39Å; R688-M692 WeakPolarHBondContact O-CG 3.48Å; R688-M692 PolarHBondContact O-N 3.07Å; R688-M692 VanDerWaalsContact O-N 3.09Å
689	A	86.8	Confident	76.5	Confident	0 Å²	0	91.5 Å²	91.5	0%	0	45%	0.448	C	S	.	.	H	α-helix	trans	-67.4	-45.8	175.8	0	0	0	0	0	111.2	I623 V626 V634 L652 I685 I686 L691 M692 M693	I623-A689 HydrophobicContact CD1-CB 4.41Å; V626-A689 HydrophobicContact CG1-CB 4.42Å; V626-A689 HydrophobicContact CG2-CB 4Å; V634-A689 HydrophobicContact CG1-CB 4.43Å; V634-A689 HydrophobicContact CG2-CB 3.48Å; V634-A689 VanDerWaalsContact CG2-CB 3.48Å; L652-A689 HydrophobicContact CD1-CB 4.45Å; L652-A689 HydrophobicContact CD2-CB 4.37Å; I685-A689 WeakPolarHBondContact O-CB 3.23Å; I685-A689 PolarHBondContact O-N 2.85Å; I686-A689 PolarHBondContact O-N 3.48Å; I686-A689 VanDerWaalsContact O-N 3.08Å; A689-L691 VanDerWaalsContact C-N 3.29Å; A689-L691 PolarHBondContact O-N 3.14Å; A689-M692 PolarHBondContact O-N 3.07Å; A689-M693 WeakPolarHBondContact O-CG 3.41Å; A689-M693 PolarHBondContact O-N 2.86Å
690	E	86.6	Confident	73.5	Confident	89 Å²	89	94.6 Å²	94.6	42%	0.416	48%	0.484	S	S	.	.	H	α-helix	trans	-49.2	-49.7	171.5	-71.4	174	158.1	0	0	111.6	I686 K687 M692 M693 H694	I686-E690 WeakPolarHBondContact O-CG 3.11Å; I686-E690 PolarHBondContact O-N 2.79Å; K687-E690 WeakPolarHBondContact CA-OE2 3.49Å; E690-M692 VanDerWaalsContact C-N 3.33Å; E690-M692 PolarHBondContact O-N 2.57Å; E690-M693 PolarHBondContact O-N 3.26Å; E690-H694 PolarHBondContact O-N 2.9Å; E690-H694 VanDerWaalsContact O-N 3.08Å; E690-H694 PolarHBondContact O-ND1 3.4Å
691	L	83.4	Confident	71	Confident	99 Å²	99	93.3 Å²	93.3	52%	0.518	49%	0.492	S	S	.	.	H	α-helix	trans	-66.9	-30.6	179.3	-73.7	170.6	0	0	0	113.4	K687 R688 A689 Q695	K687-L691 WeakPolarHBondContact O-CD1 3.07Å; K687-L691 VanDerWaalsContact O-CG 3.28Å; K687-L691 WeakPolarHBondContact O-CG 3.47Å; K687-L691 PolarHBondContact O-N 3.41Å; R688-L691 PolarHBondContact O-N 3.39Å; A689-L691 VanDerWaalsContact C-N 3.29Å; A689-L691 PolarHBondContact O-N 3.14Å; L691-Q695 WeakPolarHBondContact O-CG 3.44Å; L691-Q695 PolarHBondContact O-N 3.47Å
692	M	76.5	Confident	68.5	Low	86 Å²	86	97.4 Å²	97.4	42%	0.424	52%	0.518	S	S	.	.	H	α-helix	trans	-73	-35.7	176	-75.3	176	60.2	0	0	112.2	R688 A689 E690	R688-M692 HydrophobicContact CG-SD 4.39Å; R688-M692 WeakPolarHBondContact O-CG 3.48Å; R688-M692 PolarHBondContact O-N 3.07Å; R688-M692 VanDerWaalsContact O-N 3.09Å; A689-M692 PolarHBondContact O-N 3.07Å; E690-M692 VanDerWaalsContact C-N 3.33Å; E690-M692 PolarHBondContact O-N 2.57Å
693	M	73.4	Confident	65.7	Low	26 Å²	26	108.4 Å²	108.4	13%	0.128	56%	0.56	C	S	.	*	H	α-helix	trans	-67.4	-46.8	173.9	-62.5	169.1	77.5	0	0	110.9	V626 D628 R632 L652 A689 E690 Q695 Q696	V626-M693 HydrophobicContact CG1-CG 3.64Å; V626-M693 HydrophobicContact CG1-SD 3.73Å; D628-M693 VanDerWaalsContact OD1-CE 3.23Å; D628-M693 WeakPolarHBondContact OD1-CE 3.34Å; R632-M693 HydrophobicContact CB-CE 4.38Å; R632-M693 HydrophobicContact CG-CE 4.01Å; L652-M693 HydrophobicContact CD1-SD 3.64Å; A689-M693 WeakPolarHBondContact O-CG 3.41Å; A689-M693 PolarHBondContact O-N 2.86Å; E690-M693 PolarHBondContact O-N 3.26Å; M693-Q695 PolarHBondContact O-N 3.3Å; M693-Q696 PolarHBondContact O-N 3.33Å
694	H	69.9	Low	62.7	Low	158 Å²	158	109.6 Å²	109.6	73%	0.731	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	-8.7	179.7	-75.1	82.8	0	0	0	114.9	E690	E690-H694 PolarHBondContact O-N 2.9Å; E690-H694 VanDerWaalsContact O-N 3.08Å; E690-H694 PolarHBondContact O-ND1 3.4Å
695	Q	62.4	Low	60.7	Low	160 Å²	160	109.8 Å²	109.8	75%	0.748	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	-5.8	179.4	-80.1	-178.3	2.8	0	0	114.9	L691 M693 H697	L691-Q695 WeakPolarHBondContact O-CG 3.44Å; L691-Q695 PolarHBondContact O-N 3.47Å; M693-Q695 PolarHBondContact O-N 3.3Å; Q695-H697 PolarHBondContact O-N 3.21Å
696	Q	53.6	Low	57.7	Low	143 Å²	143	114.9 Å²	114.9	67%	0.668	61%	0.613	S	S	*	*	S	Bend	trans	-87.3	4.4	-175.5	-61.1	-158.6	-0.8	0	0	115.6	M693	M693-Q696 PolarHBondContact O-N 3.33Å
697	H	42.4	Very low	54.8	Low	165 Å²	165	120.8 Å²	120.8	76%	0.764	64%	0.643	S	S	*	*			trans	-120.4	101.1	-179.3	-77.3	-57	0	0	0	114.4	Q695	Q695-H697 PolarHBondContact O-N 3.21Å
698	P	42.1	Very low	51.8	Low	120 Å²	120	120.6 Å²	120.6	78%	0.779	65%	0.654	S	S	*	*			trans	-82.2	153.2	159.9	33.3	-31.9	0	0	0	111.8
699	A	34.4	Very low	48.9	Very low	106 Å²	106	117.1 Å²	117.1	88%	0.876	66%	0.659	S	S	*	*			trans	-73.5	147.9	-166.1	0	0	0	0	0	115.8
700	G	30.3	Very low	46	Very low	81 Å²	81	123.2 Å²	123.2	84%	0.835	70%	0.701	S	S	*	*			trans	-116.3	134.5	159.3	0	0	0	0	0	110.5
701	A	37.1	Very low	43.1	Very low	98 Å²	98	123 Å²	123	81%	0.81	72%	0.715	S	S	*	*			trans	-140.8	150.6	-173	0	0	0	0	0	113.6
702	N	35.5	Very low	40.3	Very low	151 Å²	151	126 Å²	126	81%	0.807	73%	0.73	S	S	*	*			trans	-150	143.7	172	-100.1	-50.3	0	0	0	107.1
703	R	32.4	Very low	38.3	Very low	232 Å²	232	126.5 Å²	126.5	88%	0.875	74%	0.74	S	S	*	*			cis	-152.6	172.3	1.1	-151.8	171	-172.3	-154.9	3	111
704	L	28.2	Very low	36	Very low	134 Å²	134	133.5 Å²	133.5	70%	0.702	77%	0.772	S	S	*	*			trans	-66.5	165.4	-177.1	-127.8	65.9	0	0	0	114.3	N706	L704-N706 HydrophobicContact CD2-CB 3.75Å; L704-N706 HydrophobicContact CG-CB 4.15Å
705	P	45.4	Very low	34	Very low	128 Å²	128	130.3 Å²	130.3	83%	0.831	77%	0.768	S	S	*	*				-130.7	147.4	68	36.7	-23	0	0	0	114.6
706	N	27.1	Very low	32.3	Very low	123 Å²	123	131.2 Å²	131.2	66%	0.658	77%	0.772	S	S	*	*			cis	98.4	103.9	36.2	-156.8	31.2	0	0	0	113	L704	L704-N706 HydrophobicContact CD2-CB 3.75Å; L704-N706 HydrophobicContact CG-CB 4.15Å
707	L	27.9	Very low	30.9	Very low	146 Å²	146	132 Å²	132	76%	0.764	78%	0.78	S	S	*	*			trans	175.6	131	131.3	-94.8	167.6	0	0	0	113.2
708	T	26.5	Very low	30.2	Very low	132 Å²	132	131.5 Å²	131.5	81%	0.81	78%	0.783	S	S	*	*			trans	56.7	147.6	154.5	53.7	0	0	0	0	122.5
709	A	25.5	Very low	29.5	Very low	83 Å²	83	134.5 Å²	134.5	69%	0.686	79%	0.787	S	S	*	*			cis	177.7	154.7	-43.5	0	0	0	0	0	110.4
710	S	25.2	Very low	29.3	Very low	127 Å²	127	134.4 Å²	134.4	89%	0.888	79%	0.786	S	S	*	*			trans	64.9	148.4	173.7	76.2	0	0	0	0	116.5
711	A	25.4	Very low	29.3	Very low	85 Å²	85	136.5 Å²	136.5	70%	0.702	78%	0.777	S	S	*	*			cis	-143.1	142.9	-10.5	0	0	0	0	0	106.8
712	L	24.1	Very low	29.1	Very low	162 Å²	162	141.6 Å²	141.6	85%	0.848	78%	0.78	S	S	*	*				49.5	141.6	84.7	-77.2	174.4	0	0	0	114.5
713	P	35	Very low	28.9	Very low	97 Å²	97	137.8 Å²	137.8	63%	0.63	78%	0.777	S	S	*	*			cis	-135.5	174.8	33.2	44.6	-29.4	0	0	0	117.3
714	E	24.6	Very low	29.1	Very low	173 Å²	173	135 Å²	135	81%	0.808	78%	0.778	S	S	*	*			trans	61.4	150.1	138.4	-78.6	162.6	152.8	0	0	121.4
715	S	27.9	Very low	28.8	Very low	90 Å²	90	132.9 Å²	132.9	63%	0.629	78%	0.775	S	S	*	*			cis	-158.3	153.1	-1.5	47.7	0	0	0	0	111.1
716	Q	27.1	Very low	27.7	Very low	180 Å²	180	138 Å²	138	84%	0.841	78%	0.778	S	S	*	*			trans	44.9	122	147.9	-60.4	176.7	24.2	0	0	118
717	L	24.2	Very low	27.5	Very low	159 Å²	159	137.9 Å²	137.9	83%	0.832	78%	0.781	S	S	*	*				-145.5	149.8	61.4	-158.1	77.6	0	0	0	112.7
718	N	27.6	Very low	27.3	Very low	155 Å²	155	138.4 Å²	138.4	83%	0.829	78%	0.784	S	S	*	*			trans	-72.6	156.7	164.4	-94.7	-1.8	0	0	0	111.3
719	E	27.2	Very low	27.4	Very low	183 Å²	183	137.6 Å²	137.6	86%	0.855	78%	0.784	S	S	*	*			trans	-65.7	144.9	167.1	-61.3	175.8	107.9	0	0	111.6
720	A	30.5	Very low	27.6	Very low	104 Å²	104	138.4 Å²	138.4	86%	0.86	78%	0.784	S	S	*	*			trans	-136.9	137.9	167.8	0	0	0	0	0	109.1
721	I	31.9	Very low	28.1	Very low	125 Å²	125	137 Å²	137	64%	0.641	77%	0.774	S	S	*	*			trans	-123.6	128.2	-149.1	-68.2	175.1	0	0	0	112.2
722	K	31.1	Very low	28.6	Very low	205 Å²	205	138.3 Å²	138.3	89%	0.891	78%	0.779	S	S	*	*			trans	57.4	139.8	163.3	-61.2	162.6	-168.8	172	0	117.3
723	G	32.6	Very low	28.9	Very low	71 Å²	71	137.8 Å²	137.8	73%	0.732	78%	0.776	S	S	*	*			cis	170.1	158.1	-7.9	0	0	0	0	0	112.6
724	L	35.3	Very low	29.2	Very low	173 Å²	173	138 Å²	138	91%	0.906	78%	0.777	S	S	*	*			trans	66.3	168.3	173.7	-95.4	166.2	0	0	0	118.6
725	S	23.3	Very low	29.3	Very low	90 Å²	90	135.7 Å²	135.7	63%	0.629	77%	0.771	S	S	*	*			trans	71	147.3	174.8	-55.6	0	0	0	0	114.6
726	R	21.9	Very low	29.5	Very low	236 Å²	236	138.7 Å²	138.7	89%	0.891	78%	0.778	S	S	*	*	S	Bend	cis	58.4	40.6	24.5	-145.5	-170.9	-160.8	-170.1	7.2	114.7
727	T	22.9	Very low	29.6	Very low	119 Å²	119	136 Å²	136	73%	0.73	77%	0.769	S	S	*	*	S	Bend	trans	54.9	127.5	157.2	55.5	0	0	0	0	118.3
728	L	23.9	Very low	30.1	Very low	157 Å²	157	134 Å²	134	82%	0.822	76%	0.759	S	S	*	*			trans	82.1	117.1	171.2	-46.1	172.3	0	0	0	116
729	S	27.3	Very low	30.3	Very low	116 Å²	116	133.7 Å²	133.7	81%	0.811	76%	0.758	S	S	*	*			trans	62.7	143.1	150.7	-55.3	0	0	0	0	119.8
730	S	30.5	Very low	30.7	Very low	99 Å²	99	131.9 Å²	131.9	69%	0.692	75%	0.754	S	S	*	*			cis	-167.4	171.2	-12	49.2	0	0	0	0	110.7
731	S	35.6	Very low	31.6	Very low	97 Å²	97	132.3 Å²	132.3	68%	0.678	75%	0.748	S	S	*	*			trans	64.2	110.2	153.1	52	0	0	0	0	121.7
732	S	37	Very low	31.6	Very low	114 Å²	114	131.3 Å²	131.3	80%	0.797	75%	0.752	S	S	*	*				89.9	126.9	115.4	-59.2	0	0	0	0	123.3
733	L	28.6	Very low	32.5	Very low	150 Å²	150	126.7 Å²	126.7	79%	0.785	74%	0.743	S	S	*	*			trans	-66.6	143.2	133.3	-93.4	168.3	0	0	0	108.8
734	P	42.5	Very low	32.4	Very low	101 Å²	101	129.9 Å²	129.9	66%	0.656	74%	0.743	S	S	*	*				-132.6	155.9	77.9	11	13.8	0	0	0	113.1
735	D	27.2	Very low	32.2	Very low	126 Å²	126	130.7 Å²	130.7	67%	0.674	74%	0.739	S	S	*	*				72.1	154.6	77.5	-50.2	-44	0	0	0	115.7
736	I	31.4	Very low	32.5	Very low	152 Å²	152	130.1 Å²	130.1	78%	0.779	74%	0.739	S	S	*	*			trans	72.2	130.5	160.4	-68.1	160	0	0	0	115.9
737	D	29.7	Very low	33	Very low	123 Å²	123	124.7 Å²	124.7	66%	0.658	73%	0.732	S	S	*	*			cis	-163.8	171.9	-10.3	-120.6	-5.3	0	0	0	112.8
738	N	33.8	Very low	33.5	Very low	117 Å²	117	125.2 Å²	125.2	63%	0.626	73%	0.731	S	S	*	*			trans	13	135.8	142.3	-52.7	-46.6	0	0	0	118.8
739	N	32.6	Very low	33.8	Very low	150 Å²	150	125.5 Å²	125.5	80%	0.802	73%	0.726	S	S	*	*				-159.2	152.9	57.6	-85	-85.2	0	0	0	115.7
740	D	34.4	Very low	33.9	Very low	144 Å²	144	130.1 Å²	130.1	77%	0.77	73%	0.725	S	S	*	*			trans	-17.3	169.5	134	-105	-29.8	0	0	0	119.2
741	P	49.6	Very low	34.1	Very low	113 Å²	113	131.5 Å²	131.5	73%	0.734	72%	0.723	S	S	*	*			cis	-137.8	-166.9	-2.5	32.6	-8.9	0	0	0	116.1
742	S	33.5	Very low	33.9	Very low	104 Å²	104	133.1 Å²	133.1	73%	0.727	72%	0.724	S	S	*	*			trans	-57.4	-178.7	159.3	-64.2	0	0	0	0	113.2
743	P	48	Very low	34.1	Very low	109 Å²	109	133.9 Å²	133.9	71%	0.708	73%	0.725	S	S	*	*			cis	-155.8	168.1	24	45.7	-23.5	0	0	0	122.1
744	L	31.4	Very low	34.3	Very low	138 Å²	138	134.1 Å²	134.1	72%	0.723	72%	0.722	S	S	*	*			trans	44.8	140.2	134.5	-64.3	171.9	0	0	0	125.3
745	K	30.8	Very low	33.8	Very low	189 Å²	189	133.4 Å²	133.4	82%	0.822	72%	0.724	S	S	*	*			trans	71.5	161.4	142.6	-72.5	169.4	-177	-179.8	0	118.2
746	A	30.4	Very low	33.9	Very low	78 Å²	78	133.1 Å²	133.1	65%	0.645	73%	0.727	S	S	*	*			cis	-173.3	147.5	-24.1	0	0	0	0	0	113.6
747	V	31.9	Very low	34.9	Very low	122 Å²	122	131.1 Å²	131.1	74%	0.739	72%	0.724	S	S	*	*				73.1	132.3	129.9	169	0	0	0	0	123.4
748	D	32.4	Very low	35	Very low	130 Å²	130	132.1 Å²	132.1	70%	0.695	73%	0.729	S	S	*	*			trans	67.8	157.3	150.8	-71.2	3.5	0	0	0	123
749	F	32.2	Very low	34.8	Very low	164 Å²	164	133.2 Å²	133.2	72%	0.719	74%	0.74	S	S	*	*			cis	-167.9	165	-20.1	-128.4	-54.8	0	0	0	112.1
750	R	28.9	Very low	34.8	Very low	213 Å²	213	136.3 Å²	136.3	80%	0.804	74%	0.74	S	S	*	*			trans	74.3	162.9	149.4	-73.2	-180	-174.3	-163.1	1.4	121.7
751	I	34.8	Very low	35	Very low	127 Å²	127	134.7 Å²	134.7	65%	0.651	74%	0.737	S	S	*	*			cis	-170.6	146.2	-43	-133.7	172.5	0	0	0	112.1
752	D	31.4	Very low	33.9	Very low	131 Å²	131	136.4 Å²	136.4	70%	0.701	74%	0.74	S	S	*	*			trans	56.3	172.5	157.6	-58.1	-22.6	0	0	0	120.3
753	T	39.6	Very low	33.5	Very low	131 Å²	131	140.1 Å²	140.1	80%	0.804	74%	0.737	S	S	*	*			cis	-169.4	178	-31.7	37.2	0	0	0	0	107.3
754	E	33.1	Very low	32.6	Very low	155 Å²	155	138 Å²	138	72%	0.724	73%	0.725	S	S	*	*			cis	-164.7	145.7	-49.9	-156.5	-48.3	90.3	0	0	106.6	T756	E754-T756 PolarHBondContact OE2-N 3.39Å
755	A	32.5	Very low	32.6	Very low	85 Å²	85	139.3 Å²	139.3	70%	0.702	73%	0.728	S	S	*	*			trans	-160.2	84.9	168.2	0	0	0	0	0	117.1
756	T	30.1	Very low	32.7	Very low	120 Å²	120	135.5 Å²	135.5	74%	0.736	73%	0.725	S	S	*	*			trans	46.6	95.8	138.2	-35.9	0	0	0	0	120.8	E754	E754-T756 PolarHBondContact OE2-N 3.39Å
757	P	51.8	Low	32.5	Very low	111 Å²	111	139.1 Å²	139.1	72%	0.721	73%	0.727	S	S	*	*			trans	-82.1	-163.3	160.8	35.8	-34.8	0	0	0	111.9
758	L	32.4	Very low	32.5	Very low	143 Å²	143	142 Å²	142	75%	0.749	73%	0.732	S	S	*	*			cis	-170.8	155.1	30.4	171.3	144.3	0	0	0	111.9
759	V	28.3	Very low	32.2	Very low	141 Å²	141	141.8 Å²	141.8	86%	0.855	74%	0.736	S	S	*	*			trans	-112.1	133.3	157.1	176.2	0	0	0	0	110.8
760	R	34.3	Very low	32.9	Very low	214 Å²	214	139.7 Å²	139.7	81%	0.808	74%	0.738	S	S	*	*			trans	-41.5	173.4	179.4	-55.3	165.6	177.2	149.7	-1.6	117
761	P	36.9	Very low	32.9	Very low	110 Å²	110	135.2 Å²	135.2	71%	0.714	74%	0.74	S	S	*	*			cis	-125.8	149.6	-26.3	19.4	4	0	0	0	113
762	L	26.7	Very low	32.5	Very low	150 Å²	150	135.8 Å²	135.8	79%	0.785	75%	0.749	S	S	*	*				61.3	144.3	76.2	-63.3	175.7	0	0	0	114.6
763	R	26.3	Very low	33.2	Very low	181 Å²	181	135.4 Å²	135.4	68%	0.683	75%	0.753	S	S	*	*			cis	-164.2	-177.9	11	-115.8	-163.3	133.6	92.4	0.8	107.6
764	S	29.2	Very low	32.9	Very low	64 Å²	64	134.8 Å²	134.8	45%	0.448	76%	0.755	S	S	.	*			cis	178.9	150.3	-46.7	61.7	0	0	0	0	111.9
765	Q	30	Very low	32.5	Very low	166 Å²	166	136.1 Å²	136.1	78%	0.776	76%	0.76	S	S	*	*			trans	47.3	144.5	132.9	-65.4	177.2	-16.2	0	0	123.6
766	S	33.9	Very low	32.2	Very low	110 Å²	110	143.4 Å²	143.4	77%	0.769	77%	0.77	S	S	*	*			trans	-47	161.7	150.8	178.3	0	0	0	0	114.3
767	F	25.1	Very low	32.3	Very low	154 Å²	154	145.5 Å²	145.5	68%	0.675	78%	0.775	S	S	*	*			trans	-126.3	132	167.7	-87.4	-86.5	0	0	0	112.8
768	Q	32.3	Very low	31.7	Very low	183 Å²	183	146.5 Å²	146.5	86%	0.855	78%	0.782	S	S	*	*			trans	-117.6	155.4	146.2	-68	178.4	-13.6	0	0	107.2
769	T	27	Very low	31.6	Very low	125 Å²	125	144.8 Å²	144.8	77%	0.767	79%	0.789	S	S	*	*			trans	-163.9	158.7	157.8	35.8	0	0	0	0	109.9
770	P	45.8	Very low	31.5	Very low	119 Å²	119	142 Å²	142	77%	0.773	79%	0.788	S	S	*	*			cis	-126.1	-172.4	-11.9	30.1	-9.1	0	0	0	113.1
771	S	30.7	Very low	31.4	Very low	120 Å²	120	144.4 Å²	144.4	84%	0.839	80%	0.797	S	S	*	*			trans	-139.2	161.1	173.3	-46.5	0	0	0	0	110.9
772	V	26.2	Very low	30.9	Very low	138 Å²	138	142.6 Å²	142.6	84%	0.836	80%	0.799	S	S	*	*			trans	-115.5	137.6	174.7	-179	0	0	0	0	108.7
773	P	44.6	Very low	31.1	Very low	123 Å²	123	143.9 Å²	143.9	80%	0.799	81%	0.806	S	S	*	*			trans	-90.1	160.4	-159.7	34.7	-37.6	0	0	0	116.3
774	S	33.3	Very low	31.2	Very low	119 Å²	119	138.3 Å²	138.3	83%	0.832	81%	0.806	S	S	*	*			trans	-97.4	164.9	-174.6	-41.8	0	0	0	0	114.6
775	H	26.1	Very low	31.3	Very low	183 Å²	183	146 Å²	146	85%	0.847	83%	0.826	S	S	*	*			trans	-119.7	120.5	169.1	-99.5	-98.5	0	0	0	113.5
776	R	26.4	Very low	31.3	Very low	237 Å²	237	145.5 Å²	145.5	89%	0.894	83%	0.828	S	S	*	*			trans	23.1	131.9	155.1	-67.7	-173.1	175.5	-175.1	-1.9	122.6
777	L	31.3	Very low	31	Very low	164 Å²	164	148.1 Å²	148.1	86%	0.859	83%	0.833	S	S	*	*			trans	-73.4	165.7	150.5	-58.4	166.2	0	0	0	111.2
778	P	39.4	Very low	31.1	Very low	132 Å²	132	148.2 Å²	148.2	86%	0.857	84%	0.839	S	S	*	*				-143.1	174	88.4	37.9	-21.3	0	0	0	115.6
779	A	29.3	Very low	30.8	Very low	108 Å²	108	144 Å²	144	89%	0.893	83%	0.828	S	S	*	*			trans	-87.5	167	-165.3	0	0	0	0	0	116.9
780	G	27.4	Very low	30.9	Very low	81 Å²	81	147 Å²	147	84%	0.835	83%	0.831	S	S	*	*			trans	-142.8	152.1	164.6	0	0	0	0	0	111.4
781	R	31.4	Very low	29.9	Very low	265 Å²	265	149.4 Å²	149.4	100%	1	84%	0.836	S	S	*	*			trans	-94.1	154.4	-178.3	-72.1	176.7	168.1	179.4	-5.3	112.4
782	G	27.8	Very low	29.8	Very low	73 Å²	73	148.4 Å²	148.4	75%	0.753	83%	0.829	S	S	*	*			trans	169.6	122.9	160.8	0	0	0	0	0	113.1
783	D	29.8	Very low	29.9	Very low	176 Å²	176	147.8 Å²	147.8	94%	0.941	83%	0.829	S	S	*	*			trans	-72.5	151.7	-175.6	-50.2	-82.2	0	0	0	113.9
784	G	28.8	Very low	29.1	Very low	65 Å²	65	146.5 Å²	146.5	67%	0.67	83%	0.828	S	S	*	*			trans	164.8	73.6	169.3	0	0	0	0	0	119.7
785	Y	30.7	Very low	28.6	Very low	225 Å²	225	148.7 Å²	148.7	88%	0.882	83%	0.829	S	S	*	*			trans	59.2	143.1	151.9	-71.3	-87.8	0	0	0	123.3
786	L	29.7	Very low	28.7	Very low	156 Å²	156	148.1 Å²	148.1	82%	0.817	83%	0.832	S	S	*	*			trans	78.5	98.7	152.9	-109.3	69.5	0	0	0	121.9
787	L	27.1	Very low	28.9	Very low	165 Å²	165	147.9 Å²	147.9	86%	0.864	83%	0.831	S	S	*	*			trans	72.8	86.7	132.5	-143.8	70.4	0	0	0	119.8
788	I	27.6	Very low	28.7	Very low	156 Å²	156	143.8 Å²	143.8	80%	0.8	82%	0.816	S	S	*	*			trans	-72.5	125.9	159.6	-76.6	169.7	0	0	0	110.8
789	C	26.8	Very low	28.1	Very low	93 Å²	93	145.8 Å²	145.8	63%	0.628	82%	0.816	S	S	*	*			trans	58.3	154.9	146.6	-69.4	0	0	0	0	123.8
790	F	28.2	Very low	28.1	Very low	188 Å²	188	148.1 Å²	148.1	83%	0.825	81%	0.808	S	S	*	*			trans	31.6	133.2	147.7	-58.8	-57.5	0	0	0	121.2
791	I	26.1	Very low	28	Very low	171 Å²	171	149.9 Å²	149.9	88%	0.877	81%	0.806	S	S	*	*				-157.5	150	115.4	-107	159.1	0	0	0	110.9
792	S	27.4	Very low	27.7	Very low	99 Å²	99	147.4 Å²	147.4	69%	0.692	80%	0.797	S	S	*	*			trans	-91.5	151.2	178.3	-57.2	0	0	0	0	112.6
793	C	28.4	Very low	27.7	Very low	124 Å²	124	149.9 Å²	149.9	84%	0.838	80%	0.797	S	S	*	*			trans	70.5	155.5	151.6	-68.5	0	0	0	0	121.4
794	A	27.1	Very low	27.4	Very low	96 Å²	96	147 Å²	147	79%	0.793	78%	0.782	S	S	*	*			trans	67.7	106.7	151	0	0	0	0	0	120.6
795	I	24.7	Very low	27.4	Very low	166 Å²	166	151 Å²	151	85%	0.851	79%	0.787	S	S	*	*			trans	-127.1	130.7	134.2	-63.1	-178.7	0	0	0	108.3
796	L	28.1	Very low	27.1	Very low	171 Å²	171	148.6 Å²	148.6	90%	0.895	79%	0.789	S	S	*	*			trans	-144.4	87.5	163.2	-159.5	161.1	0	0	0	109.4
797	R	28.9	Very low	26.9	Very low	232 Å²	232	147.6 Å²	147.6	88%	0.875	79%	0.789	S	S	*	*			trans	-155	122.4	171.4	-139.2	176.3	-170.5	178.5	3.7	112.9
798	S	28.2	Very low	27	Very low	78 Å²	78	144.6 Å²	144.6	55%	0.545	78%	0.782	S	S	.	*			trans	44.6	112.3	154.7	-155	0	0	0	0	120.8
799	M	26	Very low	26.8	Very low	174 Å²	174	143 Å²	143	86%	0.857	79%	0.785	S	S	*	*				-136.1	122.6	106.7	-78.7	-65.7	109	0	0	105.5
800	Q	29.8	Very low	26.9	Very low	156 Å²	156	148.4 Å²	148.4	73%	0.729	79%	0.793	S	S	*	*				74.5	123.2	58.7	-152.4	69.4	16.6	0	0	112.6
801	C	26	Very low	26.7	Very low	118 Å²	118	148.7 Å²	148.7	80%	0.797	80%	0.797	S	S	*	*			trans	-78.7	151	-170.1	-49.4	0	0	0	0	113.6
802	R	25.2	Very low	26.8	Very low	213 Å²	213	148.9 Å²	148.9	80%	0.804	79%	0.794	S	S	*	*			trans	-135.8	133.2	133.2	-102.4	-173.4	-178.1	-113.8	5.4	110.4	D804	R802-D804 WeakPolarHBondContact CD-OD2 3.31Å; R802-D804 IonicContact CZ-OD2 2.68Å; R802-D804 IonicContact NE-OD2 2.61Å; R802-D804 IonicContact NH1-OD1 3.73Å; R802-D804 IonicContact NH1-OD2 2.71Å; R802-D804 PolarHBondContact NH1-OD2 3.14Å
803	V	26.4	Very low	27.4	Very low	125 Å²	125	150.2 Å²	150.2	76%	0.758	80%	0.8	S	S	*	*			trans	-110.8	129.9	156.2	172.9	0	0	0	0	104.5	L805	V803-L805 HydrophobicContact CG1-CD1 4.4Å
804	D	24.3	Very low	27.3	Very low	117 Å²	117	152.4 Å²	152.4	63%	0.626	80%	0.798	S	S	*	*			trans	-138.3	131.3	166.8	-80.7	-62.6	0	0	0	107.6	R802	R802-D804 WeakPolarHBondContact CD-OD2 3.31Å; R802-D804 IonicContact CZ-OD2 2.68Å; R802-D804 IonicContact NE-OD2 2.61Å; R802-D804 IonicContact NH1-OD1 3.73Å; R802-D804 IonicContact NH1-OD2 2.71Å; R802-D804 PolarHBondContact NH1-OD2 3.14Å
805	L	28.1	Very low	27.2	Very low	147 Å²	147	158 Å²	158	77%	0.77	81%	0.805	S	S	*	*			trans	-81.4	145.5	179.6	-75.1	65.7	0	0	0	109.9	V803	V803-L805 HydrophobicContact CG1-CD1 4.4Å
806	L	25.8	Very low	27.2	Very low	176 Å²	176	155 Å²	155	92%	0.921	80%	0.799	S	S	*	*			trans	-144.2	126.1	150.8	-77.5	-177.1	0	0	0	111.1
807	T	24.3	Very low	27.1	Very low	134 Å²	134	154.3 Å²	154.3	82%	0.822	80%	0.795	S	S	*	*			trans	-136.5	112.1	171.2	-55.5	0	0	0	0	110.2
808	S	28.7	Very low	26.9	Very low	103 Å²	103	151.7 Å²	151.7	72%	0.72	79%	0.793	S	S	*	*			trans	62.3	120.9	159.5	-161.9	0	0	0	0	120.8
809	S	25	Very low	27	Very low	122 Å²	122	157.5 Å²	157.5	85%	0.853	80%	0.804	S	S	*	*				-162.2	157.5	122.7	10.7	0	0	0	0	111.2
810	Y	27.5	Very low	27.8	Very low	207 Å²	207	155.1 Å²	155.1	81%	0.812	80%	0.802	S	S	*	*			trans	-92.2	148.2	-179.5	-84.5	-123.4	0	0	0	112
811	Q	24.5	Very low	27.7	Very low	194 Å²	194	155.4 Å²	155.4	91%	0.907	80%	0.802	S	S	*	*				177.5	166.1	105.4	-95.7	-174.1	-16.7	0	0	114.2
812	H	28.8	Very low	28.5	Very low	174 Å²	174	155.3 Å²	155.3	81%	0.806	80%	0.8	S	S	*	*			trans	-88.9	160.8	-176.9	-89.8	-68	0	0	0	112.7
813	P	40.1	Very low	28.5	Very low	127 Å²	127	152.1 Å²	152.1	83%	0.825	80%	0.799	S	S	*	*				-144.2	176.4	82.9	37.3	-18.7	0	0	0	116
814	Q	25.5	Very low	28.7	Very low	171 Å²	171	150.3 Å²	150.3	80%	0.799	79%	0.792	S	S	*	*			trans	-90.8	159.6	166	-66.1	-175.7	-14	0	0	111.4
815	F	26	Very low	28.8	Very low	212 Å²	212	152.2 Å²	152.2	93%	0.93	80%	0.803	S	S	*	*				-167.7	157.7	123.7	-109.6	-72.1	0	0	0	110.7
816	S	24.4	Very low	28.8	Very low	104 Å²	104	149.8 Å²	149.8	73%	0.727	80%	0.798	S	S	*	*			trans	-109.4	144	-178.8	-57.7	0	0	0	0	111.9
817	L	26.4	Very low	29	Very low	157 Å²	157	147.7 Å²	147.7	82%	0.822	79%	0.792	S	S	*	*				171.1	159.7	121.6	-95.2	163.2	0	0	0	115.2
818	H	23.9	Very low	30.2	Very low	177 Å²	177	146.4 Å²	146.4	82%	0.819	79%	0.787	S	S	*	*			trans	93.8	151	154.5	-89.6	45.9	0	0	0	122.2
819	Y	31.4	Very low	30.3	Very low	200 Å²	200	148.6 Å²	148.6	78%	0.784	79%	0.785	S	S	*	*			trans	-112.9	167.6	-163.6	-117.8	-100.8	0	0	0	109.5
820	P	41.7	Very low	31.7	Very low	124 Å²	124	147.6 Å²	147.6	81%	0.805	78%	0.776	S	S	*	*				-149.9	-173.1	90.5	38.8	-18.6	0	0	0	116.6
821	H	28	Very low	31.9	Very low	161 Å²	161	144.8 Å²	144.8	75%	0.745	77%	0.77	S	S	*	*			trans	-74.5	166.8	-170.8	-103.5	-112.8	0	0	0	117.2
822	P	42.8	Very low	32	Very low	116 Å²	116	143.4 Å²	143.4	75%	0.753	77%	0.768	S	S	*	*			trans	-98.3	151.6	160	38	-31.8	0	0	0	114.2
823	D	26	Very low	33.6	Very low	146 Å²	146	140.3 Å²	140.3	78%	0.781	76%	0.763	S	S	*	*			trans	-161.7	162.7	176.3	-104.5	-55.1	0	0	0	108.3
824	S	29.6	Very low	33.3	Very low	87 Å²	87	142.8 Å²	142.8	61%	0.608	76%	0.763	S	S	*	*			cis	-168.5	-175.7	-43.2	48	0	0	0	0	109
825	N	26.5	Very low	33.6	Very low	158 Å²	158	138.2 Å²	138.2	85%	0.845	75%	0.754	S	S	*	*			trans	80.4	146.2	-176.6	-65.2	-37.4	0	0	0	118.3
826	S	27.6	Very low	34	Very low	95 Å²	95	132 Å²	132	66%	0.664	74%	0.743	S	S	*	*			cis	-165.2	125.1	-10.7	48	0	0	0	0	114.3
827	T	30.6	Very low	34.2	Very low	132 Å²	132	134.8 Å²	134.8	81%	0.81	74%	0.744	S	S	*	*			trans	30.6	166.1	130.2	27.4	0	0	0	0	124.5
828	P	50.3	Low	34.2	Very low	108 Å²	108	136.1 Å²	136.1	70%	0.701	74%	0.74	S	S	*	*			cis	-146.3	162.9	-16.5	37.9	-18	0	0	0	119.5
829	Q	29.1	Very low	34.3	Very low	148 Å²	148	135 Å²	135	69%	0.692	74%	0.735	S	S	*	*			trans	65.2	168	140	-79.1	-71.4	-70.6	0	0	120.7	H831	Q829-H831 PolarHBondContact OE1-CE1 3.39Å; Q829-H831 VanDerWaalsContact OE1-N 3.11Å; Q829-H831 PolarHBondContact OE1-ND1 3.37Å
830	P	54.5	Low	34.1	Very low	101 Å²	101	131.5 Å²	131.5	66%	0.656	73%	0.729	S	S	*	*			cis	-135.3	147.8	17.9	29.9	-5.7	0	0	0	122.1
831	H	32.1	Very low	33.3	Very low	148 Å²	148	133.1 Å²	133.1	69%	0.685	73%	0.726	S	S	*	*			trans	64.8	153.8	144.5	-47	-17.8	0	0	0	119.8	Q829	Q829-H831 PolarHBondContact OE1-CE1 3.39Å; Q829-H831 VanDerWaalsContact OE1-N 3.11Å; Q829-H831 PolarHBondContact OE1-ND1 3.37Å
832	L	27.8	Very low	33.1	Very low	166 Å²	166	130.1 Å²	130.1	87%	0.869	72%	0.719	S	S	*	*			cis	-114.2	152	13.7	-92.6	75.6	0	0	0	114.9
833	P	60.7	Low	32.2	Very low	108 Å²	108	132.7 Å²	132.7	70%	0.701	72%	0.721	S	S	*	*			trans	-88.6	-168.9	175.4	42	-39.3	0	0	0	111.9
834	H	34.2	Very low	33.3	Very low	180 Å²	180	131.7 Å²	131.7	83%	0.833	72%	0.722	S	S	*	*			cis	-154.5	-161.3	16.2	-154.6	32.8	0	0	0	109
835	A	32.9	Very low	33.2	Very low	74 Å²	74	138 Å²	138	61%	0.612	73%	0.734	S	S	*	*			cis	-161.6	166.9	10.4	0	0	0	0	0	113.6
836	A	32.9	Very low	33.3	Very low	83 Å²	83	135.1 Å²	135.1	69%	0.686	73%	0.726	S	S	*	*			trans	56.5	141.4	150.5	0	0	0	0	0	122.4
837	Q	29.6	Very low	33.2	Very low	162 Å²	162	136.5 Å²	136.5	76%	0.757	73%	0.731	S	S	*	*			cis	-162	152.7	-11.9	-111.2	-179.9	-8.9	0	0	110.3
838	Y	27.3	Very low	33	Very low	184 Å²	184	139.9 Å²	139.9	72%	0.722	73%	0.73	S	S	*	*			trans	22.8	149.6	154.6	-52.2	-56.7	0	0	0	122.7
839	Q	26	Very low	32	Very low	153 Å²	153	140.7 Å²	140.7	72%	0.715	73%	0.733	S	S	*	*			cis	-167.4	157.5	-0.7	-120.8	172.9	-22	0	0	113
840	L	25.8	Very low	31.8	Very low	128 Å²	128	138.6 Å²	138.6	67%	0.67	74%	0.741	S	S	*	*			trans	57.3	123.2	144.2	-71.2	162.7	0	0	0	125.2
841	Q	24.2	Very low	30.5	Very low	158 Å²	158	138.5 Å²	138.5	74%	0.738	74%	0.743	S	S	*	*				76	114.2	127.8	-84	-178.7	-36.3	0	0	126.1
842	T	24.1	Very low	30.4	Very low	97 Å²	97	140.6 Å²	140.6	60%	0.595	75%	0.75	S	S	*	*				63.9	122.2	127.6	56.7	0	0	0	0	125.5
843	H	23.8	Very low	31.4	Very low	171 Å²	171	138 Å²	138	79%	0.792	74%	0.743	S	S	*	*			trans	65.9	170.9	133.3	-63.9	-43.3	0	0	0	120.1
844	P	49.3	Very low	29.8	Very low	124 Å²	124	138.5 Å²	138.5	81%	0.805	75%	0.745	S	S	*	*			cis	-129.5	-144.5	-47.4	39.2	-22.9	0	0	0	112.3
845	Y	28.3	Very low	29.4	Very low	220 Å²	220	137.8 Å²	137.8	86%	0.863	74%	0.744	S	S	*	*			trans	-83.2	148.8	-172.5	-84	-97.8	0	0	0	116.4
846	S	27.7	Very low	30.3	Very low	98 Å²	98	139 Å²	139	69%	0.685	75%	0.745	S	S	*	*			trans	82.3	156.2	137	-73.8	0	0	0	0	124.2
847	T	25.3	Very low	30.8	Very low	124 Å²	124	140.5 Å²	140.5	76%	0.761	75%	0.748	S	S	*	*			trans	83.3	112.1	153.6	43.8	0	0	0	0	123.1
848	Y	26.3	Very low	30.8	Very low	203 Å²	203	140 Å²	140	80%	0.796	75%	0.749	S	S	*	*			trans	66	107.8	133	-82.9	-101.7	0	0	0	124.4
849	T	30.4	Very low	30.8	Very low	124 Å²	124	135.8 Å²	135.8	76%	0.761	75%	0.747	S	S	*	*				47.1	119.9	127.6	63	0	0	0	0	122.6
850	A	25.4	Very low	30.9	Very low	104 Å²	104	138.8 Å²	138.8	86%	0.86	75%	0.751	S	S	*	*			trans	-142.7	165.4	139.7	0	0	0	0	0	108.8
851	S	27	Very low	30.9	Very low	99 Å²	99	138.9 Å²	138.9	69%	0.692	75%	0.752	S	S	*	*			trans	-147.1	151.1	-156.1	52.1	0	0	0	0	117.4
852	F	29.8	Very low	30.9	Very low	192 Å²	192	135.9 Å²	135.9	84%	0.842	75%	0.748	S	S	*	*			trans	62.6	172.9	159.8	-66.6	-55.1	0	0	0	118.4
853	P	49	Very low	31.2	Very low	112 Å²	112	142 Å²	142	73%	0.727	76%	0.761	S	S	*	*			cis	-103.9	173.2	-11.8	38.2	-26	0	0	0	112.2
854	T	26.4	Very low	31.1	Very low	118 Å²	118	139.1 Å²	139.1	72%	0.724	76%	0.755	S	S	*	*			cis	-163.6	116.9	49.4	-59.1	0	0	0	0	108.9
855	M	24.9	Very low	29.9	Very low	166 Å²	166	141.8 Å²	141.8	82%	0.818	76%	0.756	S	S	*	*				51.3	101.9	101.5	-78.4	-72.3	108.5	0	0	117.6
856	P	52.7	Low	29.7	Very low	98 Å²	98	136.1 Å²	136.1	64%	0.636	75%	0.749	S	S	*	*			trans	-116.7	172.9	172	41.2	-31.9	0	0	0	114.7
857	P	43.1	Very low	29.7	Very low	116 Å²	116	138.4 Å²	138.4	75%	0.753	75%	0.753	S	S	*	*			trans	-63.5	156.4	165.9	-20.5	33.9	0	0	0	112.9
858	I	29.8	Very low	30	Very low	150 Å²	150	138 Å²	138	77%	0.769	75%	0.753	S	S	*	*			cis	88.1	121.9	20	-58.1	-179.4	0	0	0	115.5
859	S	28.2	Very low	30.4	Very low	97 Å²	97	132.8 Å²	132.8	68%	0.678	75%	0.746	S	S	*	*			cis	178.6	-177.7	-25	-96.8	0	0	0	0	109.4
860	R	27.7	Very low	30.4	Very low	216 Å²	216	133.7 Å²	133.7	82%	0.815	75%	0.746	S	S	*	*			trans	88.4	149.6	151.5	-59	-170.4	179.4	-123.6	-2.7	117.9
861	L	25.2	Very low	30.6	Very low	130 Å²	130	137.1 Å²	137.1	68%	0.681	74%	0.741	S	S	*	*			cis	-168.2	146.9	-26.3	-113.3	171.4	0	0	0	109.5
862	S	25	Very low	30.7	Very low	95 Å²	95	138 Å²	138	66%	0.664	74%	0.743	S	S	*	*			trans	61.7	172.2	141.8	80.2	0	0	0	0	122.2
863	R	29.1	Very low	31.5	Very low	226 Å²	226	133.9 Å²	133.9	85%	0.853	74%	0.736	S	S	*	*			trans	74.4	132.6	174.1	-66.4	-171.6	168.7	159.3	-1.7	116.5
864	V	23.4	Very low	30.4	Very low	110 Å²	110	134.9 Å²	134.9	67%	0.667	74%	0.74	S	S	*	*			cis	105.8	132.6	23.8	166.2	0	0	0	0	112.2
865	Q	23.4	Very low	30.6	Very low	179 Å²	179	134.7 Å²	134.7	84%	0.836	74%	0.743	S	S	*	*			trans	76.3	159.1	162.4	-85.1	161	-17.8	0	0	121
866	S	25	Very low	30.5	Very low	102 Å²	102	132.1 Å²	132.1	71%	0.713	74%	0.742	S	S	*	*			trans	63.2	95.8	158.5	52.1	0	0	0	0	119.4
867	N	27.5	Very low	29.8	Very low	145 Å²	145	132.9 Å²	132.9	78%	0.775	75%	0.746	S	S	*	*				-71.7	128.6	127.5	-159.6	33.1	0	0	0	108.2
868	P	30.4	Very low	29	Very low	116 Å²	116	133 Å²	133	75%	0.753	75%	0.75	S	S	*	*			trans	-105.5	80.2	172.8	35.6	-28.2	0	0	0	111.3
869	S	34.7	Very low	29.2	Very low	94 Å²	94	130.6 Å²	130.6	66%	0.657	75%	0.752	S	S	*	*			trans	-95.8	102.5	171.1	56.5	0	0	0	0	111
870	L	31.8	Very low	29.5	Very low	142 Å²	142	132 Å²	132	74%	0.743	76%	0.759	S	S	*	*			trans	-140.5	140.8	169.3	-68.2	174.2	0	0	0	107.1
871	F	28.6	Very low	29.5	Very low	176 Å²	176	127 Å²	127	77%	0.772	75%	0.749	S	S	*	*			cis	-131.9	170.2	15.1	-68.4	-96.6	0	0	0	109
872	T	29.9	Very low	30.1	Very low	119 Å²	119	125 Å²	125	73%	0.73	74%	0.744	S	S	*	*			cis	-170.9	172.3	11.2	6.1	0	0	0	0	107.2
873	P	45.7	Very low	30.3	Very low	105 Å²	105	127 Å²	127	68%	0.682	74%	0.742	S	S	*	*			cis	-135.9	160.3	-46.8	35.5	-16.7	0	0	0	115
874	T	25.1	Very low	30.1	Very low	132 Å²	132	124.9 Å²	124.9	81%	0.81	74%	0.742	S	S	*	*			trans	32	118.3	137.1	-46.9	0	0	0	0	121.5
875	S	31.2	Very low	30.2	Very low	115 Å²	115	131.1 Å²	131.1	80%	0.804	75%	0.754	S	S	*	*				-177.5	150.9	106.9	43.5	0	0	0	0	115
876	S	23	Very low	31	Very low	112 Å²	112	127.2 Å²	127.2	78%	0.783	74%	0.744	S	S	*	*			trans	-89.1	176.2	161.6	-43.3	0	0	0	0	109
877	P	38.7	Very low	30.9	Very low	113 Å²	113	127.5 Å²	127.5	73%	0.734	75%	0.746	S	S	*	*			cis	-144.3	-178.8	15.7	43.9	-24.1	0	0	0	117.7
878	S	26.8	Very low	31.2	Very low	119 Å²	119	126.1 Å²	126.1	83%	0.832	75%	0.745	S	S	*	*			trans	38.3	137.9	146.9	-56.3	0	0	0	0	123.6
879	A	33.2	Very low	31	Very low	99 Å²	99	128.7 Å²	128.7	82%	0.818	75%	0.752	S	S	*	*			trans	-64.5	161.6	180	0	0	0	0	0	115.7
880	P	35.4	Very low	30.8	Very low	126 Å²	126	131.2 Å²	131.2	82%	0.818	75%	0.754	S	S	*	*				-144.5	178.8	86.7	41.1	-25.9	0	0	0	116.3
881	N	27.4	Very low	30.8	Very low	113 Å²	113	130 Å²	130	60%	0.604	75%	0.754	S	S	*	*			trans	-76.7	177.7	165.4	-137.8	16.7	0	0	0	110.4	E507	E507-N881 PolarHBondContact OE2-ND2 2.82Å
882	P	38.1	Very low	30.9	Very low	87 Å²	87	130.5 Å²	130.5	57%	0.565	75%	0.752	S	S	*	*			cis	-146.7	-171.1	13.5	43.3	-21.5	0	0	0	118.7
883	H	28.2	Very low	30.8	Very low	138 Å²	138	135.6 Å²	135.6	64%	0.639	77%	0.765	S	S	*	*			trans	89	135.5	145.8	-75.7	-33.7	0	0	0	125
884	Q	26	Very low	30	Very low	181 Å²	181	134.6 Å²	134.6	85%	0.846	76%	0.76	S	S	*	*			trans	88.3	148.2	147.2	-76.3	178.5	-0.9	0	0	122.5
885	W	25.2	Very low	30.4	Very low	240 Å²	240	136.1 Å²	136.1	91%	0.909	76%	0.763	S	S	*	*			trans	-111.6	-170.9	-167	-55.9	22	0	0	0	111
886	P	38.6	Very low	30.2	Very low	98 Å²	98	136 Å²	136	64%	0.636	77%	0.768	S	S	*	*			cis	-136	176.8	-10.8	41.4	-24.6	0	0	0	116.7
887	S	23.6	Very low	30.6	Very low	108 Å²	108	137.6 Å²	137.6	76%	0.755	77%	0.768	S	S	*	*			trans	70.2	167.3	151.7	81.2	0	0	0	0	119.3
888	P	33.1	Very low	30	Very low	115 Å²	115	138.4 Å²	138.4	75%	0.747	77%	0.771	S	S	*	*			cis	-129.3	130.6	-12.2	34.4	-16.6	0	0	0	114.6	Q890	P888-Q890 PolarHBondContact O-N 3.36Å
889	D	26.4	Very low	29.9	Very low	170 Å²	170	140.2 Å²	140.2	91%	0.909	77%	0.769	S	S	*	*			trans	-88.2	106	172.2	-91.4	-49.8	0	0	0	113.4
890	Q	30.8	Very low	29.6	Very low	147 Å²	147	141.2 Å²	141.2	69%	0.687	77%	0.77	S	S	*	*			trans	-142.9	141.7	146.9	-82.3	-159	-1.8	0	0	109.4	P888	P888-Q890 PolarHBondContact O-N 3.36Å
891	P	31.8	Very low	29.2	Very low	117 Å²	117	141.9 Å²	141.9	76%	0.76	77%	0.772	S	S	*	*				-126.1	117.4	117.4	34	-29.8	0	0	0	113.2
892	Y	30.4	Very low	29.3	Very low	186 Å²	186	140.3 Å²	140.3	73%	0.729	78%	0.775	S	S	*	*			trans	18.6	105.7	135.4	-65.8	-87.6	0	0	0	118.1	S894	Y892-S894 PolarHBondContact O-N 3.14Å; Y892-S894 VanDerWaalsContact O-N 3.12Å
893	F	27.4	Very low	29.1	Very low	227 Å²	227	143.4 Å²	143.4	100%	0.996	78%	0.784	S	S	*	*			trans	-58.5	111.1	143.1	-86.2	-90.2	0	0	0	108.6
894	S	29	Very low	29.3	Very low	84 Å²	84	142.1 Å²	142.1	59%	0.587	79%	0.79	S	S	*	*			trans	-139.8	120	178.5	-167.5	0	0	0	0	112.3	Y892 A896	Y892-S894 PolarHBondContact O-N 3.14Å; Y892-S894 VanDerWaalsContact O-N 3.12Å; S894-A896 PolarHBondContact O-N 2.98Å
895	L	33.6	Very low	29.3	Very low	164 Å²	164	139.7 Å²	139.7	86%	0.859	79%	0.787	S	S	*	*			trans	55.7	42.2	151.5	-58.9	175.1	0	0	0	118.7	N897	L895-N897 PolarHBondContact O-N 3.23Å
896	A	28.5	Very low	29.5	Very low	111 Å²	111	131 Å²	131	92%	0.917	77%	0.766	S	S	*	*			trans	-89.1	36.6	158.6	0	0	0	0	0	112.8	S894	S894-A896 PolarHBondContact O-N 2.98Å
897	N	31.6	Very low	29.3	Very low	146 Å²	146	131.2 Å²	131.2	78%	0.781	76%	0.759	S	S	*	*			trans	-143.3	83.8	-177.8	-161.7	1	0	0	0	111.6	L895	L895-N897 PolarHBondContact O-N 3.23Å
898	V	25.8	Very low	29.5	Very low	131 Å²	131	130.6 Å²	130.6	79%	0.794	75%	0.754	S	S	*	*			trans	-168.4	144.4	161.9	129.9	0	0	0	0	109.4
899	I	24.2	Very low	29.5	Very low	156 Å²	156	131.5 Å²	131.5	80%	0.8	75%	0.752	S	S	*	*			trans	82	84.2	-175	-48.4	166.9	0	0	0	115.8
900	S	26.9	Very low	29.8	Very low	120 Å²	120	131.1 Å²	131.1	84%	0.839	75%	0.749	S	S	*	*				-172.8	48.1	126.7	-80.7	0	0	0	0	113.3
901	V	27.3	Very low	30.9	Very low	140 Å²	140	129.3 Å²	129.3	85%	0.848	75%	0.751	S	S	*	*			trans	-142.4	128.6	166.7	176.7	0	0	0	0	105.5
902	A	28.4	Very low	30.8	Very low	80 Å²	80	133.1 Å²	133.1	66%	0.661	76%	0.758	S	S	*	*			cis	-140.6	-152.2	-6.4	0	0	0	0	0	107.6
903	M	34.3	Very low	30.7	Very low	153 Å²	153	129.8 Å²	129.8	75%	0.754	76%	0.762	S	S	*	*			trans	-169.3	86.3	131.9	-99.5	-87	-87.7	0	0	114	A906	M903-A906 HydrophobicContact CE-CB 3.76Å; M903-A906 HydrophobicContact SD-CB 3.76Å
904	S	31.6	Very low	30.6	Very low	111 Å²	111	122.7 Å²	122.7	78%	0.776	75%	0.753	S	S	*	*	S	Bend		-134.8	128.7	111.6	-167.7	0	0	0	0	104.4
905	V	27.5	Very low	30.8	Very low	130 Å²	130	123.4 Å²	123.4	79%	0.788	76%	0.764	S	S	*	*			cis	-133.1	155.8	36.1	-178.8	0	0	0	0	111.8
906	A	29	Very low	31.1	Very low	57 Å²	57	121 Å²	121	47%	0.471	76%	0.758	S	S	.	*			trans	-135.9	151.3	166.5	0	0	0	0	0	109.3	M903	M903-A906 HydrophobicContact CE-CB 3.76Å; M903-A906 HydrophobicContact SD-CB 3.76Å
907	Q	34.6	Very low	31	Very low	102 Å²	102	123 Å²	123	48%	0.477	75%	0.753	S	S	.	*			cis	-163.8	152.8	1.8	-126.9	175.3	35.5	0	0	108.9	R1152	Q907-R1152 PolarHBondContact O-NH1 2.85Å
908	S	26.7	Very low	30.7	Very low	95 Å²	95	124.9 Å²	124.9	66%	0.664	76%	0.758	S	S	*	*			trans	-169.2	118.5	141	-122.9	0	0	0	0	111.7	R1152	S908-R1152 PolarHBondContact OG-NH2 3.3Å; S908-R1152 VanDerWaalsContact OG-NH2 3.08Å
909	L	34.5	Very low	30.7	Very low	134 Å²	134	122.1 Å²	122.1	70%	0.702	76%	0.755	S	S	*	*			trans	-149.9	127.3	167	-91.4	176.5	0	0	0	107.9	R1154	L909-R1154 PolarHBondContact O-NH2 3.37Å
910	L	32.3	Very low	30.7	Very low	162 Å²	162	121.2 Å²	121.2	85%	0.848	75%	0.751	S	S	*	*			trans	-152.8	122.8	159.8	-94.7	-178.1	0	0	0	110.6
911	P	53.8	Low	30.8	Very low	110 Å²	110	125.1 Å²	125.1	71%	0.714	75%	0.749	S	S	*	*			trans	-96.1	166.6	158.5	38	-31.8	0	0	0	110.8
912	Q	28.9	Very low	31.8	Very low	197 Å²	197	122.8 Å²	122.8	92%	0.921	74%	0.737	S	S	*	*			trans	-147.5	168.8	152.6	-88.8	-139.9	-34.6	0	0	111.5
913	S	28.1	Very low	31.7	Very low	115 Å²	115	127.6 Å²	127.6	80%	0.804	75%	0.745	S	S	*	*			trans	-130.5	158.6	-158.2	53.4	0	0	0	0	112.6
914	G	25.9	Very low	31.3	Very low	78 Å²	78	126.1 Å²	126.1	80%	0.804	75%	0.745	S	S	*	*			trans	117.2	115.8	151.9	0	0	0	0	0	115.9
915	A	33.5	Very low	32.4	Very low	99 Å²	99	126.3 Å²	126.3	82%	0.818	74%	0.744	S	S	*	*			trans	-89.6	166.1	152.9	0	0	0	0	0	109.5
916	P	39.2	Very low	33.7	Very low	114 Å²	114	124.7 Å²	124.7	74%	0.74	74%	0.736	S	S	*	*				-146.1	155.8	113.3	37.2	-23.2	0	0	0	115.5
917	N	26.7	Very low	33.6	Very low	152 Å²	152	129.1 Å²	129.1	81%	0.813	75%	0.751	S	S	*	*			trans	28.3	144.1	145.2	-54	-12.6	0	0	0	120.6
918	Q	26.1	Very low	33.4	Very low	187 Å²	187	129.2 Å²	129.2	87%	0.874	76%	0.763	S	S	*	*			cis	-159.3	145.9	43.1	-68.8	177.1	5.6	0	0	113.8
919	G	24.7	Very low	34.9	Very low	72 Å²	72	130.2 Å²	130.2	74%	0.742	77%	0.767	S	S	*	*			trans	65.7	170.1	144.8	0	0	0	0	0	120.4
920	L	25.1	Very low	35.8	Very low	137 Å²	137	128.3 Å²	128.3	72%	0.717	76%	0.763	S	S	*	*			cis	-167.7	154.4	-24.9	-125.9	175.3	0	0	0	109.2
921	Y	28.8	Very low	35.6	Very low	202 Å²	202	129.5 Å²	129.5	79%	0.792	76%	0.762	S	S	*	*			trans	69.2	156.7	167.2	-64.1	-58.1	0	0	0	119
922	P	47.8	Very low	34.4	Very low	92 Å²	92	130.7 Å²	130.7	60%	0.597	77%	0.767	S	S	*	*			cis	-143.5	177	-31.8	40	-23.1	0	0	0	117.1
923	H	26	Very low	34.4	Very low	180 Å²	180	128.3 Å²	128.3	83%	0.833	76%	0.761	S	S	*	*			trans	76.9	108.8	150.8	-62	-44.2	0	0	0	122.4
924	T	25.9	Very low	35.6	Very low	123 Å²	123	127.5 Å²	127.5	76%	0.755	75%	0.752	S	S	*	*			trans	-81.4	-165.7	144.5	62.3	0	0	0	0	109.6
925	P	55.1	Low	35.8	Very low	114 Å²	114	132.8 Å²	132.8	74%	0.74	76%	0.756	S	S	*	*			cis	-128.9	-119.4	-15.4	28.1	-2.9	0	0	0	114
926	P	56.1	Low	35.9	Very low	97 Å²	97	134.3 Å²	134.3	63%	0.63	76%	0.755	S	S	*	*				-122.3	-176.7	-95.4	29.7	-8.4	0	0	0	116.3
927	L	26.6	Very low	35.8	Very low	149 Å²	149	134.1 Å²	134.1	78%	0.78	75%	0.754	S	S	*	*				146.4	113.2	125.1	-76.4	159.8	0	0	0	117.5
928	S	28.7	Very low	35.7	Very low	105 Å²	105	134.6 Å²	134.6	73%	0.734	76%	0.756	S	S	*	*				75.5	160.8	125.6	-58.3	0	0	0	0	124.2
929	P	59.1	Low	35.9	Very low	115 Å²	115	130.8 Å²	130.8	75%	0.747	75%	0.75	S	S	*	*			trans	-120.5	-144.1	-166	42.2	-22.2	0	0	0	111.3
930	P	53.6	Low	36	Very low	94 Å²	94	132 Å²	132	61%	0.61	75%	0.747	S	S	*	*			cis	-137.8	-166.2	-10.9	27.8	-0.5	0	0	0	116.1
931	F	28.8	Very low	36.1	Very low	188 Å²	188	131 Å²	131	83%	0.825	75%	0.751	S	S	*	*			trans	71.2	163.1	172.1	-57.4	-76.6	0	0	0	116.3
932	T	26.8	Very low	35.9	Very low	135 Å²	135	125.1 Å²	125.1	83%	0.828	75%	0.752	S	S	*	*			cis	-151.2	174.4	11.5	-25.1	0	0	0	0	112
933	N	30.3	Very low	35	Very low	147 Å²	147	125.9 Å²	125.9	79%	0.786	76%	0.76	S	S	*	*			trans	-106.5	176.2	167.8	-158.3	22.8	0	0	0	109
934	P	52.2	Low	35.3	Very low	97 Å²	97	123.6 Å²	123.6	63%	0.63	76%	0.761	S	S	*	*			cis	-126.4	-179.6	-21.4	42.1	-28.2	0	0	0	113.8
935	Q	30.8	Very low	35.3	Very low	189 Å²	189	122.9 Å²	122.9	88%	0.883	76%	0.761	S	S	*	*			trans	-175.5	161.8	145.2	-112.3	172.8	42.2	0	0	116.4
936	T	36	Very low	34.1	Very low	131 Å²	131	125.6 Å²	125.6	80%	0.804	77%	0.768	S	S	*	*			trans	-144.6	147.6	160.2	58	0	0	0	0	107.2
937	P	36.3	Very low	32.5	Very low	111 Å²	111	126.2 Å²	126.2	72%	0.721	78%	0.775	S	S	*	*				-153.5	-173.3	73.6	41.8	-20.6	0	0	0	116.9
938	L	25.9	Very low	32.5	Very low	161 Å²	161	124.2 Å²	124.2	84%	0.843	77%	0.774	S	S	*	*			trans	-5.3	148.5	156.5	-78.4	70.3	0	0	0	118.4
939	S	28.6	Very low	32.4	Very low	107 Å²	107	125.7 Å²	125.7	75%	0.748	78%	0.778	S	S	*	*			cis	-161.3	-133.7	-0.1	44.2	0	0	0	0	106.9
940	S	27.4	Very low	30.8	Very low	98 Å²	98	124.6 Å²	124.6	69%	0.685	78%	0.779	S	S	*	*			cis	-165.3	161.5	-1.7	118.4	0	0	0	0	106.5
941	S	27.9	Very low	29.8	Very low	115 Å²	115	128.2 Å²	128.2	80%	0.804	79%	0.793	S	S	*	*			cis	-172	169.6	-16.6	52.5	0	0	0	0	107.1
942	G	24.8	Very low	29.6	Very low	79 Å²	79	126.2 Å²	126.2	81%	0.814	80%	0.796	S	S	*	*			trans	175.2	58	-175.8	0	0	0	0	0	116.7
943	S	27.6	Very low	29.8	Very low	109 Å²	109	125.4 Å²	125.4	76%	0.762	79%	0.791	S	S	*	*			trans	-162.1	139.7	178.5	58.1	0	0	0	0	112.8
944	P	33	Very low	29.6	Very low	132 Å²	132	127 Å²	127	86%	0.857	79%	0.791	S	S	*	*			trans	-108.1	145.1	157.3	35.8	-27.4	0	0	0	111.9
945	S	26	Very low	28.3	Very low	108 Å²	108	129.2 Å²	129.2	76%	0.755	80%	0.796	S	S	*	*			trans	-136.8	173.5	169.1	61.9	0	0	0	0	109.8
946	L	29.3	Very low	28	Very low	170 Å²	170	125.4 Å²	125.4	89%	0.89	79%	0.786	S	S	*	*			trans	98.1	112.7	170.2	-57.5	166.8	0	0	0	118.6
947	S	23.9	Very low	27.5	Very low	111 Å²	111	128.5 Å²	128.5	78%	0.776	79%	0.785	S	S	*	*				-168.8	149.5	122	47.7	0	0	0	0	108.8
948	S	25.1	Very low	28	Very low	107 Å²	107	128.8 Å²	128.8	75%	0.748	79%	0.786	S	S	*	*			cis	-153.7	161.1	-19.6	-94.8	0	0	0	0	111.3
949	T	26	Very low	28	Very low	135 Å²	135	128.4 Å²	128.4	83%	0.828	78%	0.78	S	S	*	*			trans	-27	151.9	161.6	14.8	0	0	0	0	116.4
950	A	26.5	Very low	28.8	Very low	93 Å²	93	128.6 Å²	128.6	77%	0.769	78%	0.778	S	S	*	*				-169.9	162.6	63.8	0	0	0	0	0	116.2
951	L	32.6	Very low	28.9	Very low	170 Å²	170	131.2 Å²	131.2	89%	0.89	78%	0.784	S	S	*	*			trans	-111.2	142.9	159.7	-74.3	165.1	0	0	0	109.6
952	T	24.2	Very low	28.9	Very low	145 Å²	145	130.6 Å²	130.6	89%	0.89	78%	0.776	S	S	*	*			trans	-163.3	162.4	160.4	-75.2	0	0	0	0	109.4
953	V	31.8	Very low	29	Very low	119 Å²	119	132.9 Å²	132.9	72%	0.721	77%	0.773	S	S	*	*			trans	-137.4	147	-160.7	165.9	0	0	0	0	112.7
954	K	25	Very low	28.8	Very low	180 Å²	180	135.6 Å²	135.6	78%	0.783	77%	0.774	S	S	*	*			trans	83.1	129.7	158.7	-88.6	172.6	177.3	-179.2	0	122.8
955	L	26	Very low	28.6	Very low	143 Å²	143	135.9 Å²	135.9	75%	0.749	77%	0.773	S	S	*	*			trans	89.9	118	130.9	-73.3	166.1	0	0	0	124.4
956	T	23.6	Very low	28.5	Very low	110 Å²	110	135.9 Å²	135.9	68%	0.675	77%	0.773	S	S	*	*			trans	86.4	108.5	133.7	-52.7	0	0	0	0	122.3
957	Y	25.3	Very low	29.6	Very low	196 Å²	196	133.3 Å²	133.3	77%	0.769	77%	0.767	S	S	*	*			trans	28.8	156.1	130.3	-71.1	-67.2	0	0	0	123
958	P	48	Very low	30.6	Very low	116 Å²	116	133.2 Å²	133.2	75%	0.753	76%	0.763	S	S	*	*			cis	-138	173.4	27.5	40.4	-20.7	0	0	0	120
959	H	26.2	Very low	30.9	Very low	154 Å²	154	134.5 Å²	134.5	71%	0.713	77%	0.766	S	S	*	*			trans	-12.3	154.9	154.5	-74.1	-46.3	0	0	0	120.5
960	P	45	Very low	31.5	Very low	110 Å²	110	133.1 Å²	133.1	71%	0.714	76%	0.762	S	S	*	*				-149.8	162.7	52.8	39.1	-17.4	0	0	0	122.1
961	L	29.2	Very low	32.4	Very low	154 Å²	154	134.1 Å²	134.1	81%	0.806	76%	0.761	S	S	*	*			trans	58.9	120.6	150.9	-65.6	162.7	0	0	0	120.1
962	T	27.3	Very low	32.2	Very low	102 Å²	102	131.5 Å²	131.5	63%	0.626	76%	0.757	S	S	*	*			cis	-135.1	-113.7	-13.2	-36.8	0	0	0	0	110.4
963	V	27.4	Very low	32.5	Very low	126 Å²	126	128.5 Å²	128.5	76%	0.764	76%	0.755	S	S	*	*			cis	-150.1	116.5	-10.4	-151.6	0	0	0	0	104.4
964	Q	24	Very low	32.3	Very low	167 Å²	167	134.8 Å²	134.8	78%	0.78	77%	0.766	S	S	*	*				45	129.7	87.2	-66.5	-161.7	-15.1	0	0	116.1
965	V	27.7	Very low	32.6	Very low	137 Å²	137	134.4 Å²	134.4	83%	0.83	77%	0.768	S	S	*	*			cis	-124.9	161.9	18.8	177.1	0	0	0	0	112.5
966	S	24.4	Very low	32.9	Very low	109 Å²	109	132.7 Å²	132.7	76%	0.762	77%	0.768	S	S	*	*			trans	-104.9	-135.4	-176.5	-58.8	0	0	0	0	114.4
967	P	51.6	Low	33.8	Very low	116 Å²	116	133.4 Å²	133.4	75%	0.753	78%	0.775	S	S	*	*			trans	-114.6	-149.6	-131.7	42.7	-22.1	0	0	0	111.2
968	P	45.8	Very low	33.7	Very low	108 Å²	108	129.6 Å²	129.6	70%	0.701	78%	0.777	S	S	*	*			cis	-136.4	-152.5	-7.9	28.3	-1.2	0	0	0	113.7
969	V	31.8	Very low	32.8	Very low	134 Å²	134	131.9 Å²	131.9	81%	0.812	78%	0.782	S	S	*	*			trans	102	130.3	154.3	-178.2	0	0	0	0	118.6
970	S	38.5	Very low	33	Very low	107 Å²	107	131.3 Å²	131.3	75%	0.748	79%	0.79	S	S	*	*			trans	-88.6	172.8	173.1	-44.4	0	0	0	0	110.9
971	P	44.1	Very low	32.1	Very low	114 Å²	114	132.3 Å²	132.3	74%	0.74	79%	0.794	S	S	*	*			cis	-146.9	-164.3	23.6	43.1	-20.9	0	0	0	116.6
972	S	30.1	Very low	32.2	Very low	115 Å²	115	134.3 Å²	134.3	80%	0.804	80%	0.796	S	S	*	*			trans	71.2	91.4	154.1	-62.5	0	0	0	0	120.7
973	G	29.2	Very low	32.4	Very low	82 Å²	82	138.3 Å²	138.3	85%	0.845	81%	0.807	S	S	*	*				91	116.3	120.4	0	0	0	0	0	120.8
974	R	29	Very low	32.9	Very low	251 Å²	251	138.1 Å²	138.1	95%	0.947	81%	0.809	S	S	*	*				-160.1	162.5	126.7	-136.4	172.6	-178.6	173.9	-0	111.5
975	M	31	Very low	33.8	Very low	171 Å²	171	131.6 Å²	131.6	84%	0.842	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-92.3	169.3	-179.3	-69.9	-99	72.2	0	0	113.1
976	S	31.5	Very low	35.1	Very low	107 Å²	107	132 Å²	132	75%	0.748	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-61.2	159.1	-168.1	-45.1	0	0	0	0	116.8
977	P	42.2	Very low	36.5	Very low	125 Å²	125	130.6 Å²	130.6	81%	0.812	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-90.5	143.8	-174.5	34.8	-35.5	0	0	0	116.1
978	S	24.4	Very low	37	Very low	117 Å²	117	127.1 Å²	127.1	82%	0.818	74%	0.74	S	S	*	*			trans	47.3	106.4	145.7	-150.2	0	0	0	0	120.9
979	L	29.3	Very low	38.4	Very low	164 Å²	164	125.5 Å²	125.5	86%	0.859	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-75.7	146.1	154.2	-72.1	163.7	0	0	0	111
980	T	28.6	Very low	40.8	Very low	142 Å²	142	122.2 Å²	122.2	87%	0.871	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-86.8	120.5	167.4	-28	0	0	0	0	109.7
981	V	28	Very low	43	Very low	131 Å²	131	117.3 Å²	117.3	79%	0.794	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-78.7	124.8	-177	176.7	0	0	0	0	110.7
982	K	30.2	Very low	44.6	Very low	195 Å²	195	115.4 Å²	115.4	85%	0.848	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-78.9	135	157.6	-72	-175.5	176.1	-177.3	0	108.4
983	E	32.3	Very low	46.4	Very low	187 Å²	187	110.7 Å²	110.7	87%	0.874	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-61.6	137.1	168.4	-71	-163.6	137	0	0	110.4
984	P	36.9	Very low	47.7	Very low	122 Å²	122	108.6 Å²	108.6	79%	0.792	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-73.6	132.6	173.2	30.1	-32.8	0	0	0	110.4
985	G	44.2	Very low	48.4	Very low	30 Å²	30	101.8 Å²	101.8	31%	0.309	59%	0.59	S	S	.	*	P	Polyproline II helix	trans	-59.9	144.1	168.2	0	0	0	0	0	111	T987 V993	G985-T987 PolarHBondContact O-N 3.04Å; G985-V993 WeakPolarHBondContact CA-O 3.37Å
986	F	54.6	Low	48.7	Very low	145 Å²	145	97.4 Å²	97.4	64%	0.636	58%	0.577	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-77.8	116.4	-178.2	-170.1	-117.2	0	0	0	110	V988 V993	F986-V988 HydrophobicContact CD1-CG2 3.72Å; F986-V988 HydrophobicContact CE1-CG2 3.25Å; F986-V988 HydrophobicContact CE2-CG2 4.47Å; F986-V988 HydrophobicContact CZ-CG2 3.68Å; F986-V993 PolarHBondContact O-N 3.26Å; F986-V993 VanDerWaalsContact O-N 3.09Å
987	T	52.8	Low	48.9	Very low	80 Å²	80	97.7 Å²	97.7	49%	0.491	58%	0.578	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.9	128.2	-179.6	-56.8	0	0	0	0	110.2	G985 F991	G985-T987 PolarHBondContact O-N 3.04Å; T987-F991 CarbonylContact C-O 3.51Å; T987-F991 WeakPolarHBondContact CA-O 3.25Å
988	V	62.9	Low	48.5	Very low	42 Å²	42	95 Å²	95	26%	0.255	57%	0.573	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-135.4	108.6	177.6	-171.4	0	0	0	0	109.4	L398 F400 F986 R990 F991	L398-V988 HydrophobicContact CD1-CB 4.32Å; L398-V988 HydrophobicContact CD1-CG1 3.95Å; L398-V988 HydrophobicContact CD2-CG1 3.77Å; L398-V988 HydrophobicContact CG-CG1 4.39Å; F400-V988 HydrophobicContact CE2-CB 4.47Å; F400-V988 HydrophobicContact CZ-CB 4.23Å; F400-V988 HydrophobicContact CZ-CG2 4.19Å; F986-V988 HydrophobicContact CD1-CG2 3.72Å; F986-V988 HydrophobicContact CE1-CG2 3.25Å; F986-V988 HydrophobicContact CE2-CG2 4.47Å; F986-V988 HydrophobicContact CZ-CG2 3.68Å; V988-R990 PolarHBondContact O-N 3.15Å; V988-F991 PolarHBondContact N-O 2.99Å; V988-F991 PolarHBondContact O-N 3.05Å; V988-F991 VanDerWaalsContact O-N 3.08Å
989	G	75.6	Confident	48.7	Very low	75 Å²	75	97.3 Å²	97.3	77%	0.773	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	58.5	-125.4	-173.9	0	0	0	0	0	111.2	F991	G989-F991 VanDerWaalsContact C-N 3.3Å; G989-F991 PolarHBondContact O-N 3.44Å
990	R	82	Confident	48.9	Very low	65 Å²	65	95.3 Å²	95.3	25%	0.245	57%	0.573	C	S	.	*	T	Hydrogen-bonded Turn	trans	-83.4	3.9	177.5	61.6	154	137.5	-149.6	-8.6	115.2	F379 L380 D386 E394 V988	F379-R990 WeakPolarHBondContact CA-O 3.46Å; L380-R990 PolarHBondContact N-O 2.85Å; L380-R990 VanDerWaalsContact O-CD 3.31Å; L380-R990 WeakPolarHBondContact O-CD 3.44Å; L380-R990 PolarHBondContact O-NH1 3.22Å; L380-R990 VanDerWaalsContact O-NH1 3.07Å; D386-R990 IonicContact OD1-CZ 3.58Å; D386-R990 VanDerWaalsContact OD1-CZ 3.25Å; D386-R990 IonicContact OD1-NH1 3.07Å; D386-R990 PolarHBondContact OD1-NH1 3.16Å; D386-R990 IonicContact OD1-NH2 2.68Å; D386-R990 PolarHBondContact OD1-NH2 3.07Å; D386-R990 IonicContact OD2-CZ 2.66Å; D386-R990 IonicContact OD2-NH1 2.67Å; D386-R990 PolarHBondContact OD2-NH1 3.23Å; E394-R990 IonicContact OE1-CZ 2.93Å; E394-R990 IonicContact OE1-NE 2.92Å; E394-R990 IonicContact OE1-NH2 3.97Å; E394-R990 PolarHBondContact OE1-NH2 3.09Å; E394-R990 IonicContact OE2-CZ 2.8Å; E394-R990 IonicContact OE2-NE 3.73Å; E394-R990 PolarHBondContact OE2-NE 3.22Å; E394-R990 IonicContact OE2-NH2 3.8Å; E394-R990 PolarHBondContact OE2-NH2 3.48Å; V988-R990 PolarHBondContact O-N 3.15Å
991	F	83.8	Confident	48.8	Very low	3 Å²	3	93.9 Å²	93.9	1%	0.013	57%	0.569	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.2	134.7	-175.3	-55	-85.4	0	0	0	111	I377 E378 F379 V391 E394 M395 L398 F400 T987 V988 G989	I377-F991 HydrophobicContact CG2-CD1 4.31Å; E378-F991 CarbonylContact O-C 3.58Å; E378-F991 VanDerWaalsContact O-CA 3.31Å; E378-F991 WeakPolarHBondContact O-CA 3.47Å; F379-F991 HydrophobicContact CB-CD1 3.53Å; F379-F991 HydrophobicContact CB-CE1 3.7Å; F379-F991 HydrophobicContact CG-CD1 4.49Å; F379-F991 HydrophobicContact CG-CE1 4.34Å; V391-F991 HydrophobicContact CG1-CE1 4.11Å; V391-F991 HydrophobicContact CG1-CZ 4.17Å; E394-F991 HydrophobicContact CB-CE2 3.74Å; E394-F991 HydrophobicContact CB-CZ 3.71Å; E394-F991 WeakPolarHBondContact OE2-CE2 3.3Å; E394-F991 WeakPolarHBondContact OE2-CZ 3.48Å; M395-F991 HydrophobicContact CE-CD1 4.13Å; M395-F991 HydrophobicContact CE-CE1 3.69Å; M395-F991 HydrophobicContact CG-CD1 3.96Å; M395-F991 HydrophobicContact CG-CE1 3.42Å; M395-F991 VanDerWaalsContact CG-CE1 3.42Å; M395-F991 HydrophobicContact CG-CZ 3.99Å; M395-F991 HydrophobicContact SD-CE1 4.4Å; L398-F991 HydrophobicContact CD1-CD2 3.38Å; L398-F991 HydrophobicContact CD1-CE2 3.74Å; L398-F991 HydrophobicContact CD1-CG 4.3Å; F400-F991 HydrophobicContact CD2-CB 4.29Å; F400-F991 HydrophobicContact CD2-CG 4.43Å; F400-F991 HydrophobicContact CE2-CB 3.58Å; F400-F991 HydrophobicContact CE2-CD2 4.42Å; F400-F991 HydrophobicContact CE2-CG 4.05Å; F400-F991 HydrophobicContact CZ-CB 4.15Å; T987-F991 CarbonylContact C-O 3.51Å; T987-F991 WeakPolarHBondContact CA-O 3.25Å; V988-F991 PolarHBondContact N-O 2.99Å; V988-F991 PolarHBondContact O-N 3.05Å; V988-F991 VanDerWaalsContact O-N 3.08Å; G989-F991 VanDerWaalsContact C-N 3.3Å; G989-F991 PolarHBondContact O-N 3.44Å
992	Q	77.8	Confident	48.8	Very low	74 Å²	74	93.8 Å²	93.8	35%	0.346	57%	0.569	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-130.6	138.7	176.5	178	173.2	-28.7	0	0	109.7	E378	E378-Q992 WeakPolarHBondContact CA-O 3.29Å; E378-Q992 HydrophobicContact CB-CB 4.3Å; E378-Q992 WeakPolarHBondContact CB-O 3.38Å; E378-Q992 PolarHBondContact N-O 3.41Å; E378-Q992 PolarHBondContact O-N 3.12Å
993	V	67.9	Low	48.5	Very low	16 Å²	16	89.5 Å²	89.5	10%	0.097	56%	0.563	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-112.4	119.7	176.4	179.9	0	0	0	0	109.9	N375 F400 G985 F986	N375-V993 HydrophobicContact CB-CG1 3.92Å; N375-V993 VanDerWaalsContact CG-CG1 3.47Å; F400-V993 HydrophobicContact CD1-CG2 3.9Å; F400-V993 HydrophobicContact CE1-CG2 3.49Å; F400-V993 VanDerWaalsContact CE1-CG2 3.49Å; F400-V993 HydrophobicContact CZ-CG2 4.26Å; G985-V993 WeakPolarHBondContact CA-O 3.37Å; F986-V993 PolarHBondContact O-N 3.26Å; F986-V993 VanDerWaalsContact O-N 3.09Å
994	S	56.4	Low	48.3	Very low	39 Å²	39	89.1 Å²	89.1	27%	0.273	56%	0.561	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-111.3	124.9	-177.4	-64.5	0	0	0	0	110.5
995	P	43.6	Very low	47.8	Very low	107 Å²	107	92.5 Å²	92.5	70%	0.695	57%	0.566	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-72.4	132.9	175.5	29.6	-33.5	0	0	0	110.6	S997	P995-S997 PolarHBondContact O-N 3.21Å
996	S	36.8	Very low	46.8	Very low	80 Å²	80	94.9 Å²	94.9	56%	0.559	59%	0.591	S	S	*	*			trans	-75.7	107.9	-174.4	68.9	0	0	0	0	113.4	N374	N374-S996 WeakPolarHBondContact CB-OG 3.28Å
997	S	36.1	Very low	45.4	Very low	112 Å²	112	93.4 Å²	93.4	78%	0.783	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-78.2	146.8	150.6	53.7	0	0	0	0	110.1	P995	P995-S997 PolarHBondContact O-N 3.21Å
998	G	33.3	Very low	44.1	Very low	68 Å²	68	94.5 Å²	94.5	70%	0.701	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-68.4	165.6	-178.5	0	0	0	0	0	114.8
999	D	29.3	Very low	42.5	Very low	167 Å²	167	98.6 Å²	98.6	89%	0.893	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-64.4	137	-172.2	-55.1	-65.8	0	0	0	113.9
1000	P	33.3	Very low	40.1	Very low	121 Å²	121	103.8 Å²	103.8	79%	0.786	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-87.5	127.6	167.6	33.4	-30.6	0	0	0	111.4
1001	S	26.8	Very low	37.5	Very low	112 Å²	112	106.6 Å²	106.6	78%	0.783	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-72.6	131.4	171	54.8	0	0	0	0	111.7	S1003	S1001-S1003 PolarHBondContact O-N 2.92Å
1002	V	28.8	Very low	34.7	Very low	130 Å²	130	112.8 Å²	112.8	79%	0.788	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-72.3	123.5	176.4	179	0	0	0	0	111
1003	S	24	Very low	32.2	Very low	105 Å²	105	114.2 Å²	114.2	73%	0.734	71%	0.706	S	S	*	*			trans	-120.1	114.8	172	59.6	0	0	0	0	110.6	S1001	S1001-S1003 PolarHBondContact O-N 2.92Å
1004	H	28.2	Very low	30.2	Very low	179 Å²	179	119.9 Å²	119.9	83%	0.829	74%	0.741	S	S	*	*			trans	-82.2	123.3	171.2	-78.9	-76.9	0	0	0	111.1
1005	Q	25	Very low	28.7	Very low	192 Å²	192	121.8 Å²	121.8	90%	0.897	76%	0.759	S	S	*	*			trans	-114.9	146.2	152.8	-75.4	-172.9	-18.5	0	0	108.3
1006	G	23.6	Very low	27.8	Very low	81 Å²	81	122.9 Å²	122.9	84%	0.835	76%	0.764	S	S	*	*			trans	-108.1	164.8	172.3	0	0	0	0	0	111.5
1007	S	25.8	Very low	27.2	Very low	113 Å²	113	124.4 Å²	124.4	79%	0.79	77%	0.77	S	S	*	*			trans	-138.1	101	-178.3	58.1	0	0	0	0	113
1008	S	26.1	Very low	26.7	Very low	104 Å²	104	127.3 Å²	127.3	73%	0.727	77%	0.771	S	S	*	*			trans	12.5	115.3	141.3	54.9	0	0	0	0	120.6
1009	T	27.3	Very low	26.2	Very low	127 Å²	127	128.9 Å²	128.9	78%	0.779	77%	0.771	S	S	*	*				30.7	133.5	119.6	57.4	0	0	0	0	122
1010	Q	26.8	Very low	26	Very low	184 Å²	184	124.8 Å²	124.8	86%	0.86	76%	0.761	S	S	*	*			trans	177.6	154.6	134.5	-99	-175.7	-12.4	0	0	109.2
1011	D	26.9	Very low	25.5	Very low	125 Å²	125	125.5 Å²	125.5	67%	0.668	76%	0.763	S	S	*	*			cis	-166.7	178.1	-32.3	-134.1	-37.5	0	0	0	110.6
1012	N	25.7	Very low	26.4	Very low	133 Å²	133	125.6 Å²	125.6	71%	0.711	76%	0.761	S	S	*	*			trans	69.3	150.5	159.1	-68.8	-19.2	0	0	0	121.2
1013	T	25	Very low	26.1	Very low	104 Å²	104	124.7 Å²	124.7	64%	0.638	76%	0.76	S	S	*	*			cis	-173	143.6	-36.2	25.1	0	0	0	0	110.5
1014	T	25.4	Very low	26.2	Very low	134 Å²	134	126.1 Å²	126.1	82%	0.822	76%	0.76	S	S	*	*			trans	60	156.2	149.5	56	0	0	0	0	121.7
1015	A	25.2	Very low	26.1	Very low	79 Å²	79	126.2 Å²	126.2	65%	0.653	76%	0.758	S	S	*	*			cis	-175.2	168.1	-26.8	0	0	0	0	0	111.5
1016	T	23.8	Very low	26.1	Very low	130 Å²	130	124.1 Å²	124.1	80%	0.798	75%	0.753	S	S	*	*			trans	79.3	148.2	148.6	-55.4	0	0	0	0	120.2
1017	T	24.3	Very low	26	Very low	112 Å²	112	127.6 Å²	127.6	69%	0.687	75%	0.747	S	S	*	*			cis	-172.1	168.3	-40.1	-63.1	0	0	0	0	107.4
1018	Q	26.1	Very low	26.6	Very low	173 Å²	173	128 Å²	128	81%	0.808	75%	0.747	S	S	*	*			trans	86.4	147.1	161.1	-51	-173.2	49.6	0	0	117.5
1019	S	23.4	Very low	26.6	Very low	102 Å²	102	129.1 Å²	129.1	71%	0.713	74%	0.741	S	S	*	*			cis	-166.6	135.2	-14.9	45	0	0	0	0	116.1
1020	A	23.9	Very low	26.6	Very low	81 Å²	81	130.5 Å²	130.5	67%	0.669	74%	0.738	S	S	*	*				70.5	104.6	126.8	0	0	0	0	0	127.2
1021	T	22.5	Very low	26.6	Very low	136 Å²	136	128 Å²	128	83%	0.834	74%	0.736	S	S	*	*				64.6	172.6	122.3	62	0	0	0	0	121.9
1022	P	46.3	Very low	26.5	Very low	113 Å²	113	125.5 Å²	125.5	73%	0.734	74%	0.739	S	S	*	*			cis	-136	-172.2	4.1	42.7	-24.1	0	0	0	118.5
1023	S	22.8	Very low	26.4	Very low	111 Å²	111	124.4 Å²	124.4	78%	0.776	74%	0.742	S	S	*	*			trans	89	135.2	166.3	-74.7	0	0	0	0	119.6
1024	N	26.5	Very low	26.3	Very low	136 Å²	136	124.2 Å²	124.2	73%	0.727	75%	0.745	S	S	*	*			cis	-165	164.2	-11.5	-156.9	-12.8	0	0	0	113
1025	K	25	Very low	26.3	Very low	180 Å²	180	123.9 Å²	123.9	78%	0.783	74%	0.743	S	S	*	*			trans	83.5	92.5	160.9	-62.3	-172.8	176.8	-178.6	0	123.3
1026	N	24.8	Very low	26.2	Very low	149 Å²	149	128.5 Å²	128.5	80%	0.797	75%	0.751	S	S	*	*				51.5	102.5	120.4	-57.6	18.5	0	0	0	124
1027	Q	22.7	Very low	26.2	Very low	153 Å²	153	127.6 Å²	127.6	72%	0.715	75%	0.746	S	S	*	*				4.7	169.3	106.8	-97.1	-161.2	-26.1	0	0	121.6	E1029	Q1027-E1029 PolarHBondContact NE2-OE1 3.42Å; Q1027-E1029 VanDerWaalsContact NE2-OE1 3.09Å
1028	P	38.1	Very low	26.2	Very low	121 Å²	121	126.5 Å²	126.5	79%	0.786	74%	0.742	S	S	*	*			cis	-137.7	-169.3	23	35.3	-11.4	0	0	0	119.2
1029	E	25.5	Very low	26.2	Very low	129 Å²	129	126.9 Å²	126.9	60%	0.603	74%	0.744	S	S	*	*			trans	-73.6	173.6	-169.1	-53.8	169.6	-159.2	0	0	115.4	Q1027	Q1027-E1029 PolarHBondContact NE2-OE1 3.42Å; Q1027-E1029 VanDerWaalsContact NE2-OE1 3.09Å
1030	H	28.1	Very low	26.3	Very low	156 Å²	156	126.2 Å²	126.2	72%	0.722	74%	0.74	S	S	*	*				-175.3	155	67.4	-91.2	-56.1	0	0	0	116.6
1031	T	26	Very low	26.3	Very low	131 Å²	131	130.8 Å²	130.8	80%	0.804	75%	0.747	S	S	*	*			trans	16.7	142	147.7	64	0	0	0	0	124.5
1032	G	24.7	Very low	26.5	Very low	72 Å²	72	129.4 Å²	129.4	74%	0.742	74%	0.743	S	S	*	*				123.5	104.3	109.8	0	0	0	0	0	122.3
1033	S	23.7	Very low	25.5	Very low	110 Å²	110	129.6 Å²	129.6	77%	0.769	75%	0.747	S	S	*	*			trans	46.4	111.5	134.8	-179.8	0	0	0	0	123.8
1034	S	24.4	Very low	25.6	Very low	100 Å²	100	131.6 Å²	131.6	70%	0.699	75%	0.749	S	S	*	*				78.1	132.9	130	-49.8	0	0	0	0	124.2
1035	T	23.9	Very low	26.4	Very low	128 Å²	128	130.4 Å²	130.4	79%	0.785	75%	0.749	S	S	*	*			trans	74.5	129.4	140.5	41.7	0	0	0	0	124.5
1036	E	24.3	Very low	26.3	Very low	176 Å²	176	128 Å²	128	82%	0.822	75%	0.749	S	S	*	*			trans	93.7	107.4	135.6	-79	-168.8	-165.2	0	0	124.5
1037	T	23.4	Very low	26.3	Very low	111 Å²	111	126.5 Å²	126.5	68%	0.681	75%	0.745	S	S	*	*				68.8	120.3	127.6	-24.9	0	0	0	0	122.6
1038	S	24.8	Very low	26.3	Very low	88 Å²	88	124.8 Å²	124.8	62%	0.615	75%	0.745	S	S	*	*				145.7	130.1	116.4	-66.5	0	0	0	0	116.6
1039	Q	24.9	Very low	25.6	Very low	182 Å²	182	126.5 Å²	126.5	85%	0.85	75%	0.746	S	S	*	*			trans	62.5	154	135.3	-65.3	172.8	8.3	0	0	120.3
1040	S	25.1	Very low	25.7	Very low	88 Å²	88	125.5 Å²	125.5	62%	0.615	75%	0.753	S	S	*	*			cis	-171.9	154.3	-15.9	48.6	0	0	0	0	112
1041	E	24.6	Very low	27.2	Very low	177 Å²	177	124 Å²	124	83%	0.827	76%	0.757	S	S	*	*			trans	60.6	120.1	149.8	-70.5	175	-177.9	0	0	120.6
1042	S	26.9	Very low	28.2	Very low	107 Å²	107	123.1 Å²	123.1	75%	0.748	75%	0.754	S	S	*	*				85	149.3	89.1	97	0	0	0	0	114.2
1043	S	24.7	Very low	28.2	Very low	116 Å²	116	122.7 Å²	122.7	81%	0.811	75%	0.749	S	S	*	*			cis	-163.2	-174.3	34	49.1	0	0	0	0	113.8
1044	N	26.4	Very low	28.5	Very low	154 Å²	154	123.4 Å²	123.4	82%	0.824	74%	0.744	S	S	*	*			trans	-100.7	167.4	-174.5	-124.7	1.3	0	0	0	111.9
1045	P	42.1	Very low	28.7	Very low	111 Å²	111	128.6 Å²	128.6	72%	0.721	75%	0.75	S	S	*	*				-163.9	-171	76.8	43.6	-21.2	0	0	0	119.3
1046	T	22.9	Very low	28.8	Very low	129 Å²	129	128.9 Å²	128.9	79%	0.791	75%	0.747	S	S	*	*			trans	83.3	149.1	148.9	-85	0	0	0	0	121.7
1047	V	25.8	Very low	29	Very low	117 Å²	117	123.4 Å²	123.4	71%	0.709	74%	0.738	S	S	*	*			cis	-169.3	157.3	-36.6	102.2	0	0	0	0	114
1048	T	22	Very low	29.2	Very low	118 Å²	118	125.5 Å²	125.5	72%	0.724	74%	0.744	S	S	*	*			trans	18.3	139	157.4	-37.6	0	0	0	0	125.5
1049	I	23	Very low	29.2	Very low	157 Å²	157	127 Å²	127	81%	0.805	75%	0.754	S	S	*	*				166.1	153.7	125.7	-84.5	169.4	0	0	0	113.8
1050	S	27.7	Very low	29.2	Very low	108 Å²	108	121.3 Å²	121.3	76%	0.755	75%	0.745	S	S	*	*			trans	-160.7	-165.8	178.5	-46.2	0	0	0	0	109.5
1051	P	59.3	Low	29.2	Very low	123 Å²	123	125.5 Å²	125.5	80%	0.799	76%	0.755	S	S	*	*			cis	-114.8	-111.8	-22.2	23.2	3.5	0	0	0	109.5
1052	P	46.8	Very low	29.1	Very low	114 Å²	114	123.5 Å²	123.5	74%	0.74	75%	0.745	S	S	*	*			cis	-132.8	-174.6	-39.4	41.3	-23.3	0	0	0	116.1
1053	G	26.3	Very low	29	Very low	62 Å²	62	124.8 Å²	124.8	64%	0.639	74%	0.74	S	S	*	*			trans	118.6	107.8	159.7	0	0	0	0	0	115.9
1054	N	29	Very low	29.1	Very low	125 Å²	125	128.6 Å²	128.6	67%	0.668	74%	0.736	S	S	*	*			cis	73	137	18.4	-42.6	103.4	0	0	0	114.3
1055	Y	28.3	Very low	28.9	Very low	209 Å²	209	126.8 Å²	126.8	82%	0.82	73%	0.731	S	S	*	*			cis	-143.9	-163.7	12.5	-53.1	-104.2	0	0	0	109.5
1056	D	27.6	Very low	28.2	Very low	134 Å²	134	128.2 Å²	128.2	72%	0.717	74%	0.738	S	S	*	*			cis	-162.6	-170	-1.9	-151.6	-96.2	0	0	0	111
1057	G	27.1	Very low	28.3	Very low	61 Å²	61	125.4 Å²	125.4	63%	0.629	74%	0.735	S	S	*	*			trans	114.4	96.1	163.6	0	0	0	0	0	116.5
1058	L	27.1	Very low	28.3	Very low	155 Å²	155	125.2 Å²	125.2	81%	0.812	74%	0.738	S	S	*	*				68.5	136.7	62.8	-57.3	176.1	0	0	0	114.6
1059	S	25.2	Very low	28.5	Very low	120 Å²	120	130.4 Å²	130.4	84%	0.839	75%	0.745	S	S	*	*			cis	-167.4	179.9	-11.7	60.9	0	0	0	0	107.9
1060	G	25.5	Very low	28.7	Very low	63 Å²	63	133.6 Å²	133.6	65%	0.649	75%	0.747	S	S	*	*			cis	172.3	-174.1	3.4	0	0	0	0	0	111.5
1061	Q	24	Very low	28.5	Very low	175 Å²	175	135.1 Å²	135.1	82%	0.818	75%	0.746	S	S	*	*			trans	68.7	132	178.2	-53.7	-171.9	-83.3	0	0	117.1
1062	E	23.3	Very low	26.9	Very low	135 Å²	135	134.2 Å²	134.2	63%	0.631	74%	0.742	S	S	*	*			cis	92.8	149.6	16.1	-148.4	-135.5	146.9	0	0	116.5	R1064	E1062-R1064 IonicContact OE1-CZ 2.64Å; E1062-R1064 IonicContact OE1-NE 3.58Å; E1062-R1064 PolarHBondContact OE1-NE 2.88Å; E1062-R1064 IonicContact OE1-NH2 3.64Å
1063	Q	25.8	Very low	25.9	Very low	135 Å²	135	134.9 Å²	134.9	63%	0.631	74%	0.744	S	S	*	*			trans	98.4	115.3	172.9	-55.9	-162.1	18.4	0	0	116
1064	R	25.2	Very low	26	Very low	195 Å²	195	137.3 Å²	137.3	74%	0.736	75%	0.751	S	S	*	*				83.4	147.9	64	-73.9	178.4	-165.3	-156.3	3.4	111.6	E1062	E1062-R1064 IonicContact OE1-CZ 2.64Å; E1062-R1064 IonicContact OE1-NE 3.58Å; E1062-R1064 PolarHBondContact OE1-NE 2.88Å; E1062-R1064 IonicContact OE1-NH2 3.64Å
1065	T	23.8	Very low	25.8	Very low	116 Å²	116	139.3 Å²	139.3	71%	0.712	76%	0.761	S	S	*	*			cis	-161.2	176.8	10.6	-1.9	0	0	0	0	113.2
1066	T	25.9	Very low	25.7	Very low	142 Å²	142	139.6 Å²	139.6	87%	0.871	76%	0.76	S	S	*	*			trans	77.9	137	164.9	72.9	0	0	0	0	118
1067	G	25.2	Very low	25.6	Very low	70 Å²	70	141.6 Å²	141.6	72%	0.722	77%	0.765	S	S	*	*			cis	168.1	153.4	-15	0	0	0	0	0	115.2
1068	S	26.6	Very low	25.5	Very low	113 Å²	113	141.9 Å²	141.9	79%	0.79	77%	0.768	S	S	*	*			trans	56.9	147.7	160.5	-80.7	0	0	0	0	121
1069	R	26.8	Very low	25.5	Very low	226 Å²	226	141 Å²	141	85%	0.853	78%	0.775	S	S	*	*			cis	-167.4	136.1	-20.8	-123.1	178.9	-174.3	-168.1	3.8	109.3
1070	R	25.5	Very low	25.6	Very low	225 Å²	225	138.7 Å²	138.7	85%	0.849	77%	0.77	S	S	*	*			trans	46.7	128.4	148	-89.4	-170.9	174	-170.9	-1.4	122.7
1071	L	25	Very low	25.9	Very low	140 Å²	140	141.3 Å²	141.3	73%	0.733	78%	0.779	S	S	*	*			trans	94.9	104.8	133.8	-70	168.4	0	0	0	122.1
1072	S	24.3	Very low	26.2	Very low	103 Å²	103	137.8 Å²	137.8	72%	0.72	77%	0.774	S	S	*	*				92.6	124.3	113.7	71.9	0	0	0	0	123
1073	V	25.7	Very low	26.6	Very low	128 Å²	128	140.6 Å²	140.6	78%	0.776	79%	0.787	S	S	*	*			trans	77.5	79	149.5	-173.7	0	0	0	0	119.3
1074	S	28.3	Very low	26.7	Very low	113 Å²	113	139.6 Å²	139.6	79%	0.79	80%	0.795	S	S	*	*				24.6	129.5	124.5	58.4	0	0	0	0	122.1
1075	L	25.8	Very low	27	Very low	167 Å²	167	141.5 Å²	141.5	87%	0.874	80%	0.802	S	S	*	*			trans	-128	177	161.4	-174.5	54.1	0	0	0	110.1
1076	W	26.6	Very low	27.1	Very low	216 Å²	216	141 Å²	141	82%	0.818	80%	0.803	S	S	*	*			trans	-78.1	171.5	-172.5	-70.4	-0.8	0	0	0	116.8
1077	E	24.9	Very low	27.4	Very low	176 Å²	176	145.3 Å²	145.3	82%	0.822	80%	0.803	S	S	*	*			trans	74	138.2	147.5	-82.9	166.8	-160.3	0	0	122.2
1078	G	25.9	Very low	27.4	Very low	67 Å²	67	147.2 Å²	147.2	69%	0.691	81%	0.806	S	S	*	*			trans	113.9	81.1	133	0	0	0	0	0	121.1
1079	S	27	Very low	27.6	Very low	135 Å²	135	146.1 Å²	146.1	94%	0.944	80%	0.803	S	S	*	*			trans	62.4	161.1	146.7	-58.7	0	0	0	0	120.5
1080	G	27.4	Very low	27.7	Very low	72 Å²	72	141.7 Å²	141.7	74%	0.742	80%	0.802	S	S	*	*			trans	160.6	-27.7	146.3	0	0	0	0	0	125.5
1081	S	29.9	Very low	28.5	Very low	119 Å²	119	141.6 Å²	141.6	83%	0.832	80%	0.803	S	S	*	*			trans	69.2	165.4	174.3	-167.9	0	0	0	0	120.3
1082	S	31.8	Very low	28.7	Very low	101 Å²	101	139.6 Å²	139.6	71%	0.706	80%	0.801	S	S	*	*			trans	92.3	84.4	149	-56.3	0	0	0	0	122.8
1083	Q	30.2	Very low	29.8	Very low	194 Å²	194	139.3 Å²	139.3	91%	0.907	80%	0.799	S	S	*	*				35.4	123.5	127.9	-56.2	-178.1	9.4	0	0	123
1084	S	28.3	Very low	30.3	Very low	114 Å²	114	139 Å²	139	80%	0.797	79%	0.793	S	S	*	*				167.8	113.7	121	-174	0	0	0	0	110.4
1085	R	31.2	Very low	31.1	Very low	234 Å²	234	142.1 Å²	142.1	88%	0.883	80%	0.795	S	S	*	*				79.6	133.7	71.4	-110.9	-174.5	-179.8	-170.2	1.1	116.3
1086	S	27.3	Very low	32.2	Very low	107 Å²	107	137.7 Å²	137.7	75%	0.748	78%	0.778	S	S	*	*			trans	88.8	144.2	172.4	-44	0	0	0	0	115.6
1087	R	31	Very low	33.1	Very low	231 Å²	231	134.3 Å²	134.3	87%	0.872	77%	0.771	S	S	*	*			cis	-159.1	177.6	-3.6	-124.9	173.1	-174.4	-179.8	0.9	111.8
1088	S	26.3	Very low	34.4	Very low	111 Å²	111	128.3 Å²	128.3	78%	0.776	76%	0.756	S	S	*	*			trans	-14	155.2	155.9	-58	0	0	0	0	119
1089	A	30.5	Very low	35.9	Very low	89 Å²	89	132.2 Å²	132.2	74%	0.736	76%	0.756	S	S	*	*			cis	-161.2	177.3	-5.7	0	0	0	0	0	107.5
1090	T	29.7	Very low	37.9	Very low	133 Å²	133	132.3 Å²	132.3	82%	0.816	74%	0.742	S	S	*	*				175.4	163.4	73.3	-60.4	0	0	0	0	108.4	S1092	T1090-S1092 PolarHBondContact O-N 3.49Å
1091	Y	40.8	Very low	39.9	Very low	223 Å²	223	134 Å²	134	88%	0.875	73%	0.733	S	S	*	*			trans	-64	123.3	174.1	-154.8	-94	0	0	0	111.5
1092	S	30.2	Very low	41.4	Very low	99 Å²	99	136.2 Å²	136.2	69%	0.692	72%	0.723	S	S	*	*			trans	-137.5	144.7	163.4	-171.4	0	0	0	0	107.9	T1090	T1090-S1092 PolarHBondContact O-N 3.49Å
1093	S	46.3	Very low	43.5	Very low	97 Å²	97	138.5 Å²	138.5	68%	0.678	72%	0.723	S	S	*	*			trans	-105.7	94.6	-175.2	-170.5	0	0	0	0	109.6
1094	D	36.6	Very low	45.9	Very low	122 Å²	122	135.1 Å²	135.1	65%	0.652	71%	0.707	S	S	*	*			trans	-103.4	120.9	171.6	-80	-59.8	0	0	0	110.1	S1096	D1094-S1096 PolarHBondContact O-N 3.34Å
1095	E	46.5	Very low	48	Very low	178 Å²	178	134.4 Å²	134.4	83%	0.832	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	6.7	175.2	-66.8	-91	116.8	0	0	112.9
1096	S	47.7	Very low	50.1	Low	74 Å²	74	126 Å²	126	52%	0.517	67%	0.665	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.1	-29.1	-174.8	-167.8	0	0	0	0	114.1	D1094 G1098 E1099 E1100	D1094-S1096 PolarHBondContact O-N 3.34Å; S1096-G1098 PolarHBondContact O-N 3.44Å; S1096-E1099 PolarHBondContact O-N 3.44Å; S1096-E1100 PolarHBondContact O-N 2.87Å
1097	E	46.3	Very low	52.8	Low	145 Å²	145	126 Å²	126	68%	0.678	65%	0.653	S	S	*	*	H	α-helix	trans	-61.8	-30.9	178.6	-65.4	-170	166.9	0	0	111.3	E1099 I1101	E1097-E1099 VanDerWaalsContact C-N 3.35Å; E1097-E1099 PolarHBondContact O-N 3.37Å; E1097-I1101 WeakPolarHBondContact O-CB 3.43Å; E1097-I1101 WeakPolarHBondContact O-CD1 3.39Å; E1097-I1101 WeakPolarHBondContact O-CG1 3.35Å; E1097-I1101 PolarHBondContact O-N 3.01Å; E1097-I1101 VanDerWaalsContact O-N 3.07Å
1098	G	50.7	Low	55.2	Low	49 Å²	49	119.4 Å²	119.4	51%	0.505	64%	0.635	S	S	.	*	H	α-helix	trans	-66.9	-32.2	179.5	0	0	0	0	0	113.9	S1096 W1102	S1096-G1098 PolarHBondContact O-N 3.44Å; G1098-W1102 PolarHBondContact O-N 3.28Å
1099	E	58	Low	57.4	Low	149 Å²	149	122.5 Å²	122.5	70%	0.696	63%	0.629	S	S	*	*	H	α-helix	trans	-81.6	-43.3	177.2	-61.8	-163	144	0	0	111.3	S1096 E1097 I1101 W1102 E1103	S1096-E1099 PolarHBondContact O-N 3.44Å; E1097-E1099 VanDerWaalsContact C-N 3.35Å; E1097-E1099 PolarHBondContact O-N 3.37Å; E1099-I1101 PolarHBondContact O-N 2.98Å; E1099-W1102 CarbonylContact O-C 3.16Å; E1099-W1102 WeakPolarHBondContact O-CA 3.32Å; E1099-W1102 WeakPolarHBondContact O-CB 3.4Å; E1099-W1102 PolarHBondContact O-N 2.85Å; E1099-E1103 PolarHBondContact O-N 3.25Å
1100	E	69.8	Low	59.9	Low	138 Å²	138	125 Å²	125	65%	0.645	63%	0.625	S	S	*	*	H	α-helix	trans	-59.1	-43.7	176.9	-173.8	173.7	-161.2	0	0	111.9	S1096 W1102 E1103 E1104	S1096-E1100 PolarHBondContact O-N 2.87Å; E1100-W1102 VanDerWaalsContact C-N 3.26Å; E1100-W1102 PolarHBondContact O-N 3.21Å; E1100-E1103 PolarHBondContact O-N 2.63Å; E1100-E1104 PolarHBondContact O-N 2.72Å
1101	I	69.2	Low	62.6	Low	107 Å²	107	124.5 Å²	124.5	55%	0.549	61%	0.609	S	S	.	*	H	α-helix	trans	-63.5	-31.5	174.1	-68.9	167.7	0	0	0	111.6	E1097 E1099 L1105	E1097-I1101 WeakPolarHBondContact O-CB 3.43Å; E1097-I1101 WeakPolarHBondContact O-CD1 3.39Å; E1097-I1101 WeakPolarHBondContact O-CG1 3.35Å; E1097-I1101 PolarHBondContact O-N 3.01Å; E1097-I1101 VanDerWaalsContact O-N 3.07Å; E1099-I1101 PolarHBondContact O-N 2.98Å; I1101-L1105 WeakPolarHBondContact O-CB 3.22Å; I1101-L1105 PolarHBondContact O-N 3.25Å
1102	W	61.1	Low	64.5	Low	166 Å²	166	119.3 Å²	119.3	63%	0.629	59%	0.592	S	S	*	*	H	α-helix	trans	-75.3	-38.4	177.5	-136.3	93.6	0	0	0	112.2	G1098 E1099 E1100 L1105 M1106	G1098-W1102 PolarHBondContact O-N 3.28Å; E1099-W1102 CarbonylContact O-C 3.16Å; E1099-W1102 WeakPolarHBondContact O-CA 3.32Å; E1099-W1102 WeakPolarHBondContact O-CB 3.4Å; E1099-W1102 PolarHBondContact O-N 2.85Å; E1100-W1102 VanDerWaalsContact C-N 3.26Å; E1100-W1102 PolarHBondContact O-N 3.21Å; W1102-L1105 PolarHBondContact O-N 3.09Å; W1102-M1106 HydrophobicContact CD2-CE 4.44Å; W1102-M1106 HydrophobicContact CE3-CE 4.01Å; W1102-M1106 HydrophobicContact CE3-CG 3.5Å; W1102-M1106 VanDerWaalsContact CE3-CG 3.5Å; W1102-M1106 HydrophobicContact CE3-SD 4.26Å; W1102-M1106 HydrophobicContact CH2-CE 3.78Å; W1102-M1106 HydrophobicContact CH2-CG 4.37Å; W1102-M1106 HydrophobicContact CH2-SD 4.09Å; W1102-M1106 HydrophobicContact CZ2-CE 4.22Å; W1102-M1106 HydrophobicContact CZ3-CE 3.67Å; W1102-M1106 HydrophobicContact CZ3-CG 3.38Å; W1102-M1106 HydrophobicContact CZ3-SD 3.64Å; W1102-M1106 WeakPolarHBondContact O-CG 3.38Å; W1102-M1106 PolarHBondContact O-N 3.43Å
1103	E	76.3	Confident	66.8	Low	149 Å²	149	118.1 Å²	118.1	70%	0.696	58%	0.578	S	S	*	*	H	α-helix	trans	-66.4	-46	173.3	-66.9	-154.9	140.3	0	0	111.5	E1099 E1100 L1105 M1106 E1107	E1099-E1103 PolarHBondContact O-N 3.25Å; E1100-E1103 PolarHBondContact O-N 2.63Å; E1103-L1105 VanDerWaalsContact C-N 3.31Å; E1103-L1105 PolarHBondContact O-N 3.07Å; E1103-M1106 PolarHBondContact O-N 3.44Å; E1103-M1106 VanDerWaalsContact O-N 3.14Å; E1103-E1107 PolarHBondContact O-N 3.43Å
1104	E	79.2	Confident	68.8	Low	122 Å²	122	115 Å²	115	57%	0.57	56%	0.56	S	S	*	*	H	α-helix	trans	-59.6	-42.5	174.4	-168.1	-173.7	-161.9	0	0	110.9	E1100 M1106 E1107 L1108	E1100-E1104 PolarHBondContact O-N 2.72Å; E1104-M1106 VanDerWaalsContact C-N 3.33Å; E1104-M1106 PolarHBondContact O-N 3.02Å; E1104-E1107 PolarHBondContact O-N 2.96Å; E1104-L1108 WeakPolarHBondContact O-CB 3.4Å; E1104-L1108 PolarHBondContact O-N 3.33Å
1105	L	74.1	Confident	70.9	Confident	99 Å²	99	115.1 Å²	115.1	52%	0.518	56%	0.557	S	S	.	*	H	α-helix	trans	-63.6	-36.7	176.9	-175.9	63.6	0	0	0	112.5	I1101 W1102 E1103 R1109	I1101-L1105 WeakPolarHBondContact O-CB 3.22Å; I1101-L1105 PolarHBondContact O-N 3.25Å; W1102-L1105 PolarHBondContact O-N 3.09Å; E1103-L1105 VanDerWaalsContact C-N 3.31Å; E1103-L1105 PolarHBondContact O-N 3.07Å; L1105-R1109 WeakPolarHBondContact O-CB 3.33Å; L1105-R1109 PolarHBondContact O-N 3.42Å
1106	M	74.4	Confident	72.5	Confident	58 Å²	58	108.2 Å²	108.2	29%	0.286	53%	0.527	S	S	.	.	H	α-helix	trans	-71.9	-39.7	174.3	-74.6	-53.7	109.8	0	0	112.5	W1102 E1103 E1104 R1109 H1110	W1102-M1106 HydrophobicContact CD2-CE 4.44Å; W1102-M1106 HydrophobicContact CE3-CE 4.01Å; W1102-M1106 HydrophobicContact CE3-CG 3.5Å; W1102-M1106 VanDerWaalsContact CE3-CG 3.5Å; W1102-M1106 HydrophobicContact CE3-SD 4.26Å; W1102-M1106 HydrophobicContact CH2-CE 3.78Å; W1102-M1106 HydrophobicContact CH2-CG 4.37Å; W1102-M1106 HydrophobicContact CH2-SD 4.09Å; W1102-M1106 HydrophobicContact CZ2-CE 4.22Å; W1102-M1106 HydrophobicContact CZ3-CE 3.67Å; W1102-M1106 HydrophobicContact CZ3-CG 3.38Å; W1102-M1106 HydrophobicContact CZ3-SD 3.64Å; W1102-M1106 WeakPolarHBondContact O-CG 3.38Å; W1102-M1106 PolarHBondContact O-N 3.43Å; E1103-M1106 PolarHBondContact O-N 3.44Å; E1103-M1106 VanDerWaalsContact O-N 3.14Å; E1104-M1106 VanDerWaalsContact C-N 3.33Å; E1104-M1106 PolarHBondContact O-N 3.02Å; M1106-R1109 WeakPolarHBondContact O-CB 3.49Å; M1106-R1109 PolarHBondContact O-N 3.04Å; M1106-H1110 WeakPolarHBondContact O-CB 3.2Å; M1106-H1110 PolarHBondContact O-N 3.01Å
1107	E	85	Confident	73.8	Confident	108 Å²	108	109.3 Å²	109.3	51%	0.505	52%	0.524	S	S	.	.	H	α-helix	trans	-69.7	-40.3	178.5	-157	-136.8	-160.7	0	0	111.3	E1103 E1104 R1109 H1110 R1111	E1103-E1107 PolarHBondContact O-N 3.43Å; E1104-E1107 PolarHBondContact O-N 2.96Å; E1107-R1109 VanDerWaalsContact C-N 3.33Å; E1107-R1109 PolarHBondContact O-N 3.23Å; E1107-H1110 CarbonylContact O-C 3.31Å; E1107-H1110 WeakPolarHBondContact O-CB 3.21Å; E1107-H1110 PolarHBondContact O-N 3.38Å; E1107-H1110 VanDerWaalsContact O-N 3.1Å; E1107-R1111 WeakPolarHBondContact O-CG 3.42Å; E1107-R1111 PolarHBondContact O-N 2.78Å; E1107-R1111 IonicContact OE2-CZ 3.94Å; E1107-R1111 IonicContact OE2-NE 3.07Å; E1107-R1111 PolarHBondContact OE2-NE 2.63Å; E1107-R1111 IonicContact OE2-NH2 3.28Å; E1107-R1111 PolarHBondContact OE2-NH2 2.86Å
1108	L	79.7	Confident	75.5	Confident	92 Å²	92	106.3 Å²	106.3	48%	0.482	52%	0.519	S	S	.	.	H	α-helix	trans	-64.8	-37.8	173.8	-167.3	149	0	0	0	111.3	E1104 H1112	E1104-L1108 WeakPolarHBondContact O-CB 3.4Å; E1104-L1108 PolarHBondContact O-N 3.33Å; L1108-H1112 WeakPolarHBondContact O-CB 3.4Å; L1108-H1112 PolarHBondContact O-N 2.8Å
1109	R	74.3	Confident	76.8	Confident	175 Å²	175	109 Å²	109	66%	0.66	52%	0.522	S	S	*	.	H	α-helix	trans	-64.1	-37.6	170.2	-176.1	-177.5	-176.5	-150.1	1.5	112.2	L1105 M1106 E1107 L1113	L1105-R1109 WeakPolarHBondContact O-CB 3.33Å; L1105-R1109 PolarHBondContact O-N 3.42Å; M1106-R1109 WeakPolarHBondContact O-CB 3.49Å; M1106-R1109 PolarHBondContact O-N 3.04Å; E1107-R1109 VanDerWaalsContact C-N 3.33Å; E1107-R1109 PolarHBondContact O-N 3.23Å; R1109-L1113 WeakPolarHBondContact O-CB 3.48Å; R1109-L1113 PolarHBondContact O-N 3.38Å
1110	H	81	Confident	77.7	Confident	141 Å²	141	103.1 Å²	103.1	65%	0.653	49%	0.494	S	S	*	.	H	α-helix	trans	-68.5	-47.4	176	-164.3	100.2	0	0	0	111.3	M1106 E1107 H1112 L1113 G1114	M1106-H1110 WeakPolarHBondContact O-CB 3.2Å; M1106-H1110 PolarHBondContact O-N 3.01Å; E1107-H1110 CarbonylContact O-C 3.31Å; E1107-H1110 WeakPolarHBondContact O-CB 3.21Å; E1107-H1110 PolarHBondContact O-N 3.38Å; E1107-H1110 VanDerWaalsContact O-N 3.1Å; H1110-H1112 VanDerWaalsContact C-N 3.34Å; H1110-H1112 PolarHBondContact O-N 3.1Å; H1110-L1113 PolarHBondContact O-N 3.47Å; H1110-G1114 PolarHBondContact O-N 3.3Å
1111	R	87.4	Confident	78.2	Confident	124 Å²	124	100.6 Å²	100.6	47%	0.468	49%	0.488	S	S	.	.	H	α-helix	trans	-55.9	-45.7	173.4	-75.2	-171.6	-94.4	145.6	-4.9	111.5	E1107 G1114 Q1115	E1107-R1111 WeakPolarHBondContact O-CG 3.42Å; E1107-R1111 PolarHBondContact O-N 2.78Å; E1107-R1111 IonicContact OE2-CZ 3.94Å; E1107-R1111 IonicContact OE2-NE 3.07Å; E1107-R1111 PolarHBondContact OE2-NE 2.63Å; E1107-R1111 IonicContact OE2-NH2 3.28Å; E1107-R1111 PolarHBondContact OE2-NH2 2.86Å; R1111-G1114 PolarHBondContact O-N 3.42Å; R1111-Q1115 WeakPolarHBondContact O-CG 3.18Å; R1111-Q1115 PolarHBondContact O-N 2.82Å
1112	H	80	Confident	78.9	Confident	114 Å²	114	98.9 Å²	98.9	53%	0.528	49%	0.485	S	S	.	.	H	α-helix	trans	-64	-42.4	176.3	-174.8	66.4	0	0	0	112.6	L1108 H1110 G1114 Q1115 V1116	L1108-H1112 WeakPolarHBondContact O-CB 3.4Å; L1108-H1112 PolarHBondContact O-N 2.8Å; H1110-H1112 VanDerWaalsContact C-N 3.34Å; H1110-H1112 PolarHBondContact O-N 3.1Å; H1112-G1114 PolarHBondContact O-N 3.05Å; H1112-Q1115 PolarHBondContact O-N 2.92Å; H1112-V1116 WeakPolarHBondContact O-CG2 3.48Å; H1112-V1116 PolarHBondContact O-N 2.96Å
1113	L	79.9	Confident	79.7	Confident	73 Å²	73	94.5 Å²	94.5	38%	0.382	47%	0.472	S	S	.	.	H	α-helix	trans	-63.3	-40.5	177	-173.6	62.6	0	0	0	112.1	R1109 H1110 V1116 Q1117	R1109-L1113 WeakPolarHBondContact O-CB 3.48Å; R1109-L1113 PolarHBondContact O-N 3.38Å; H1110-L1113 PolarHBondContact O-N 3.47Å; L1113-V1116 PolarHBondContact O-N 3.4Å; L1113-Q1117 WeakPolarHBondContact O-CG 3.36Å; L1113-Q1117 PolarHBondContact O-N 3.47Å
1114	G	86.9	Confident	80	Confident	31 Å²	31	91.5 Å²	91.5	32%	0.32	46%	0.456	S	S	.	.	H	α-helix	trans	-65.7	-41.7	174.9	0	0	0	0	0	113	H1110 R1111 H1112 Q1117 S1118	H1110-G1114 PolarHBondContact O-N 3.3Å; R1111-G1114 PolarHBondContact O-N 3.42Å; H1112-G1114 PolarHBondContact O-N 3.05Å; G1114-Q1117 PolarHBondContact O-N 3.38Å; G1114-S1118 WeakPolarHBondContact O-CB 3.46Å; G1114-S1118 PolarHBondContact O-N 3.41Å
1115	Q	80.8	Confident	80.3	Confident	125 Å²	125	93.8 Å²	93.8	58%	0.584	46%	0.46	S	S	*	.	H	α-helix	trans	-60.6	-45	172.4	-75.3	177.1	-7.3	0	0	111.8	R1111 H1112 Q1117 S1118 L1119	R1111-Q1115 WeakPolarHBondContact O-CG 3.18Å; R1111-Q1115 PolarHBondContact O-N 2.82Å; H1112-Q1115 PolarHBondContact O-N 2.92Å; Q1115-Q1117 VanDerWaalsContact C-N 3.33Å; Q1115-Q1117 PolarHBondContact O-N 3.4Å; Q1115-S1118 PolarHBondContact O-N 3.36Å; Q1115-L1119 WeakPolarHBondContact O-CG 3.18Å; Q1115-L1119 PolarHBondContact O-N 3.48Å
1116	V	79.8	Confident	80.8	Confident	33 Å²	33	94.8 Å²	94.8	20%	0.2	46%	0.462	C	S	.	.	H	α-helix	trans	-62.4	-39.3	176.2	168.9	0	0	0	0	111.5	H1112 L1113 Q1120 A1146	H1112-V1116 WeakPolarHBondContact O-CG2 3.48Å; H1112-V1116 PolarHBondContact O-N 2.96Å; L1113-V1116 PolarHBondContact O-N 3.4Å; V1116-Q1120 VanDerWaalsContact CG1-NE2 3.33Å; V1116-Q1120 WeakPolarHBondContact O-CB 3.4Å; V1116-Q1120 WeakPolarHBondContact O-CG 3.35Å; V1116-Q1120 PolarHBondContact O-N 3.22Å; V1116-A1146 HydrophobicContact CG1-CB 4.45Å
1117	Q	76.6	Confident	81.1	Confident	97 Å²	97	94.4 Å²	94.4	45%	0.453	46%	0.461	S	S	.	.	H	α-helix	trans	-65.9	-43.3	173.9	-76	173.3	-47	0	0	112.4	L1113 G1114 Q1115 L1119 Q1120 V1121	L1113-Q1117 WeakPolarHBondContact O-CG 3.36Å; L1113-Q1117 PolarHBondContact O-N 3.47Å; G1114-Q1117 PolarHBondContact O-N 3.38Å; Q1115-Q1117 VanDerWaalsContact C-N 3.33Å; Q1115-Q1117 PolarHBondContact O-N 3.4Å; Q1117-L1119 PolarHBondContact O-N 2.95Å; Q1117-Q1120 PolarHBondContact O-N 2.99Å; Q1117-V1121 WeakPolarHBondContact O-CG2 3.42Å; Q1117-V1121 PolarHBondContact O-N 2.96Å
1118	S	81.6	Confident	81	Confident	82 Å²	82	92.7 Å²	92.7	57%	0.573	45%	0.452	S	S	*	.	H	α-helix	trans	-60.1	-44.8	176.7	-171.7	0	0	0	0	111.7	G1114 Q1115 V1121 S1122	G1114-S1118 WeakPolarHBondContact O-CB 3.46Å; G1114-S1118 PolarHBondContact O-N 3.41Å; Q1115-S1118 PolarHBondContact O-N 3.36Å; S1118-V1121 PolarHBondContact O-N 2.87Å; S1118-S1122 WeakPolarHBondContact O-CB 3.45Å; S1118-S1122 PolarHBondContact O-N 3.29Å
1119	L	78.1	Confident	81.2	Confident	107 Å²	107	91.3 Å²	91.3	56%	0.56	44%	0.444	S	S	*	.	H	α-helix	trans	-63.2	-40.9	174.6	-71.4	168.5	0	0	0	112.4	Q1115 Q1117 V1121 S1122 Q1123	Q1115-L1119 WeakPolarHBondContact O-CG 3.18Å; Q1115-L1119 PolarHBondContact O-N 3.48Å; Q1117-L1119 PolarHBondContact O-N 2.95Å; L1119-V1121 PolarHBondContact O-N 2.89Å; L1119-S1122 PolarHBondContact O-N 3.3Å; L1119-Q1123 WeakPolarHBondContact O-CB 3.37Å; L1119-Q1123 WeakPolarHBondContact O-CG 3.4Å; L1119-Q1123 PolarHBondContact O-N 3.46Å
1120	Q	75.7	Confident	81.5	Confident	25 Å²	25	87.3 Å²	87.3	12%	0.117	44%	0.435	C	S	.	.	H	α-helix	trans	-62.5	-40.3	175.3	-74.4	169.6	7.4	0	0	112.2	V1116 Q1117 K1124 P1144 A1146	V1116-Q1120 VanDerWaalsContact CG1-NE2 3.33Å; V1116-Q1120 WeakPolarHBondContact O-CB 3.4Å; V1116-Q1120 WeakPolarHBondContact O-CG 3.35Å; V1116-Q1120 PolarHBondContact O-N 3.22Å; Q1117-Q1120 PolarHBondContact O-N 2.99Å; Q1120-K1124 VanDerWaalsContact O-CB 3.3Å; Q1120-K1124 WeakPolarHBondContact O-CB 3.45Å; Q1120-K1124 PolarHBondContact O-N 3.47Å; Q1120-P1144 HydrophobicContact CB-CB 4.16Å; Q1120-P1144 HydrophobicContact CB-CG 4.23Å; Q1120-P1144 HydrophobicContact CG-CB 4.12Å; Q1120-P1144 WeakPolarHBondContact O-CG 3.3Å; Q1120-A1146 HydrophobicContact CG-CB 3.94Å; Q1120-A1146 PolarHBondContact NE2-O 2.94Å
1121	V	81.3	Confident	81.6	Confident	85 Å²	85	85.1 Å²	85.1	52%	0.515	42%	0.421	S	S	.	.	H	α-helix	trans	-68.9	-40.7	175.7	171.8	0	0	0	0	111.4	Q1117 S1118 L1119 K1124 R1125	Q1117-V1121 WeakPolarHBondContact O-CG2 3.42Å; Q1117-V1121 PolarHBondContact O-N 2.96Å; S1118-V1121 PolarHBondContact O-N 2.87Å; L1119-V1121 PolarHBondContact O-N 2.89Å; V1121-K1124 PolarHBondContact O-N 3.27Å; V1121-R1125 WeakPolarHBondContact O-CB 3.43Å; V1121-R1125 PolarHBondContact O-N 2.95Å
1122	S	83.3	Confident	81.3	Confident	70 Å²	70	87.2 Å²	87.2	49%	0.49	43%	0.429	S	S	.	.	H	α-helix	trans	-64	-49.8	177	-163.1	0	0	0	0	111.7	S1118 L1119 K1124 R1125 E1126	S1118-S1122 WeakPolarHBondContact O-CB 3.45Å; S1118-S1122 PolarHBondContact O-N 3.29Å; L1119-S1122 PolarHBondContact O-N 3.3Å; S1122-K1124 VanDerWaalsContact C-N 3.33Å; S1122-K1124 PolarHBondContact O-N 3.45Å; S1122-R1125 PolarHBondContact O-N 3.21Å; S1122-E1126 WeakPolarHBondContact O-CB 3.36Å; S1122-E1126 PolarHBondContact O-N 2.99Å
1123	Q	78.8	Confident	81.5	Confident	74 Å²	74	88.3 Å²	88.3	35%	0.346	44%	0.435	S	S	.	.	H	α-helix	trans	-61.1	-40.3	176.5	-74.2	179.4	-17	0	0	111.9	L1119 E1126 I1127	L1119-Q1123 WeakPolarHBondContact O-CB 3.37Å; L1119-Q1123 WeakPolarHBondContact O-CG 3.4Å; L1119-Q1123 PolarHBondContact O-N 3.46Å; Q1123-E1126 PolarHBondContact O-N 3.33Å; Q1123-I1127 WeakPolarHBondContact O-CD1 3.41Å; Q1123-I1127 WeakPolarHBondContact O-CG1 3.39Å; Q1123-I1127 PolarHBondContact O-N 2.71Å
1124	K	82.4	Confident	81.4	Confident	86 Å²	86	93 Å²	93	37%	0.374	45%	0.452	S	S	.	.	H	α-helix	trans	-59.9	-49.3	174.6	-179	178.1	165.1	177.9	0	111	Q1120 V1121 S1122 E1126 I1127 E1128 P1144	Q1120-K1124 VanDerWaalsContact O-CB 3.3Å; Q1120-K1124 WeakPolarHBondContact O-CB 3.45Å; Q1120-K1124 PolarHBondContact O-N 3.47Å; V1121-K1124 PolarHBondContact O-N 3.27Å; S1122-K1124 VanDerWaalsContact C-N 3.33Å; S1122-K1124 PolarHBondContact O-N 3.45Å; K1124-E1126 VanDerWaalsContact C-N 3.33Å; K1124-E1126 PolarHBondContact O-N 3.26Å; K1124-I1127 PolarHBondContact O-N 3.08Å; K1124-E1128 WeakPolarHBondContact CE-OE1 3.37Å; K1124-E1128 WeakPolarHBondContact CE-OE2 3.45Å; K1124-E1128 HydrophobicContact CG-CG 4.43Å; K1124-E1128 IonicContact NZ-OE1 2.79Å; K1124-E1128 PolarHBondContact NZ-OE1 2.84Å; K1124-E1128 WeakPolarHBondContact O-CG 3.19Å; K1124-E1128 PolarHBondContact O-N 2.99Å; K1124-P1144 HydrophobicContact CB-CG 4.12Å
1125	R	84.4	Confident	81.1	Confident	171 Å²	171	95 Å²	95	65%	0.645	47%	0.473	S	S	*	.	H	α-helix	trans	-61.5	-40.8	179.9	-172.8	-173.7	-64.3	169.8	-0.6	112	V1121 S1122 E1128 E1129	V1121-R1125 WeakPolarHBondContact O-CB 3.43Å; V1121-R1125 PolarHBondContact O-N 2.95Å; S1122-R1125 PolarHBondContact O-N 3.21Å; R1125-E1128 PolarHBondContact O-N 3.06Å; R1125-E1129 WeakPolarHBondContact O-CB 3.36Å; R1125-E1129 PolarHBondContact O-N 3.13Å
1126	E	85.6	Confident	81.1	Confident	119 Å²	119	96 Å²	96	56%	0.556	48%	0.475	S	S	*	.	H	α-helix	trans	-63.2	-42.2	176.3	-174.8	178.7	-172.8	0	0	111.9	S1122 Q1123 K1124 E1129 L1130	S1122-E1126 WeakPolarHBondContact O-CB 3.36Å; S1122-E1126 PolarHBondContact O-N 2.99Å; Q1123-E1126 PolarHBondContact O-N 3.33Å; K1124-E1126 VanDerWaalsContact C-N 3.33Å; K1124-E1126 PolarHBondContact O-N 3.26Å; E1126-E1129 PolarHBondContact O-N 2.96Å; E1126-L1130 HydrophobicContact CG-CD1 4.43Å; E1126-L1130 VanDerWaalsContact O-CG 3.29Å; E1126-L1130 WeakPolarHBondContact O-CG 2.75Å; E1126-L1130 PolarHBondContact O-N 3.26Å
1127	I	81.1	Confident	80.7	Confident	51 Å²	51	98.8 Å²	98.8	26%	0.262	50%	0.502	S	S	.	.	H	α-helix	trans	-66.1	-44.4	174.4	-63.7	161.9	0	0	0	110.7	Q1123 K1124 E1129 L1130 Y1131 I1142	Q1123-I1127 WeakPolarHBondContact O-CD1 3.41Å; Q1123-I1127 WeakPolarHBondContact O-CG1 3.39Å; Q1123-I1127 PolarHBondContact O-N 2.71Å; K1124-I1127 PolarHBondContact O-N 3.08Å; I1127-E1129 VanDerWaalsContact C-N 3.31Å; I1127-E1129 PolarHBondContact O-N 3.07Å; I1127-L1130 PolarHBondContact O-N 3.35Å; I1127-Y1131 HydrophobicContact CG2-CD2 3.86Å; I1127-Y1131 HydrophobicContact CG2-CE2 3.93Å; I1127-Y1131 WeakPolarHBondContact O-CD2 3.43Å; I1127-Y1131 PolarHBondContact O-N 2.91Å; I1127-I1142 HydrophobicContact CD1-CG2 4.17Å; I1127-I1142 HydrophobicContact CG2-CD1 3.8Å; I1127-I1142 HydrophobicContact CG2-CG2 4.37Å
1128	E	81.6	Confident	80.2	Confident	71 Å²	71	96.7 Å²	96.7	33%	0.332	50%	0.496	S	S	.	.	H	α-helix	trans	-61.8	-38.1	177	-72.5	174	146.6	0	0	112	K1124 R1125 R1132 P1138	K1124-E1128 WeakPolarHBondContact CE-OE1 3.37Å; K1124-E1128 WeakPolarHBondContact CE-OE2 3.45Å; K1124-E1128 HydrophobicContact CG-CG 4.43Å; K1124-E1128 IonicContact NZ-OE1 2.79Å; K1124-E1128 PolarHBondContact NZ-OE1 2.84Å; K1124-E1128 WeakPolarHBondContact O-CG 3.19Å; K1124-E1128 PolarHBondContact O-N 2.99Å; R1125-E1128 PolarHBondContact O-N 3.06Å; E1128-R1132 WeakPolarHBondContact O-CB 3.48Å; E1128-R1132 PolarHBondContact O-N 2.91Å; E1128-P1138 HydrophobicContact CG-CB 4.49Å; E1128-P1138 HydrophobicContact CG-CG 4.4Å
1129	E	85.3	Confident	79.6	Confident	64 Å²	64	95.6 Å²	95.6	30%	0.299	49%	0.487	S	S	.	.	H	α-helix	trans	-62.3	-49.1	172.8	-172	66.2	-124.5	0	0	111.7	R1125 E1126 I1127 Y1131 R1132 Q1133	R1125-E1129 WeakPolarHBondContact O-CB 3.36Å; R1125-E1129 PolarHBondContact O-N 3.13Å; E1126-E1129 PolarHBondContact O-N 2.96Å; I1127-E1129 VanDerWaalsContact C-N 3.31Å; I1127-E1129 PolarHBondContact O-N 3.07Å; E1129-Y1131 VanDerWaalsContact C-N 3.35Å; E1129-Y1131 PolarHBondContact O-N 3.47Å; E1129-R1132 PolarHBondContact O-N 3.25Å; E1129-R1132 IonicContact OE1-CZ 3.22Å; E1129-R1132 IonicContact OE1-NE 3.45Å; E1129-R1132 IonicContact OE1-NH2 2.8Å; E1129-R1132 PolarHBondContact OE1-NH2 2.91Å; E1129-R1132 IonicContact OE2-CZ 3.76Å; E1129-R1132 IonicContact OE2-NH1 3.92Å; E1129-R1132 IonicContact OE2-NH2 3.68Å; E1129-R1132 PolarHBondContact OE2-NH2 3.31Å; E1129-Q1133 WeakPolarHBondContact O-CG 3.37Å; E1129-Q1133 PolarHBondContact O-N 3.24Å; E1129-Q1133 PolarHBondContact OE1-NE2 2.9Å
1130	L	80.6	Confident	78.6	Confident	91 Å²	91	97.3 Å²	97.3	48%	0.476	51%	0.505	S	S	.	.	H	α-helix	trans	-62.3	-39.9	178.8	-73.1	167.5	0	0	0	112.2	E1126 I1127 K1134	E1126-L1130 HydrophobicContact CG-CD1 4.43Å; E1126-L1130 VanDerWaalsContact O-CG 3.29Å; E1126-L1130 WeakPolarHBondContact O-CG 2.75Å; E1126-L1130 PolarHBondContact O-N 3.26Å; I1127-L1130 PolarHBondContact O-N 3.35Å; L1130-K1134 WeakPolarHBondContact O-CG 3.25Å; L1130-K1134 PolarHBondContact O-N 2.84Å; L1130-K1134 VanDerWaalsContact O-N 3.09Å
1131	Y	81.8	Confident	77.7	Confident	94 Å²	94	100.5 Å²	100.5	37%	0.369	53%	0.53	S	S	.	.	H	α-helix	trans	-64.7	-43.6	174.7	-91.7	-103.1	0	0	0	111.5	I1127 E1129 K1134 G1135 K1136 P1138	I1127-Y1131 HydrophobicContact CG2-CD2 3.86Å; I1127-Y1131 HydrophobicContact CG2-CE2 3.93Å; I1127-Y1131 WeakPolarHBondContact O-CD2 3.43Å; I1127-Y1131 PolarHBondContact O-N 2.91Å; E1129-Y1131 VanDerWaalsContact C-N 3.35Å; E1129-Y1131 PolarHBondContact O-N 3.47Å; Y1131-K1134 CarbonylContact O-C 3.57Å; Y1131-K1134 PolarHBondContact O-N 3.14Å; Y1131-G1135 PolarHBondContact O-N 2.96Å; Y1131-K1136 CarbonylContact C-O 3.6Å; Y1131-K1136 VanDerWaalsContact C-O 3.3Å; Y1131-K1136 WeakPolarHBondContact CB-O 3.27Å; Y1131-K1136 HydrophobicContact CD1-CB 4.2Å; Y1131-K1136 PolarHBondContact O-N 3.46Å; Y1131-P1138 HydrophobicContact CD1-CB 4.3Å; Y1131-P1138 HydrophobicContact CG-CB 4.17Å
1132	R	82.8	Confident	76.6	Confident	168 Å²	168	98.3 Å²	98.3	63%	0.634	52%	0.515	S	S	*	.	H	α-helix	trans	-61.2	-46.4	175.4	-169.7	174.2	71.2	-149	4.8	112.3	E1128 E1129 K1134 G1135	E1128-R1132 WeakPolarHBondContact O-CB 3.48Å; E1128-R1132 PolarHBondContact O-N 2.91Å; E1129-R1132 PolarHBondContact O-N 3.25Å; E1129-R1132 IonicContact OE1-CZ 3.22Å; E1129-R1132 IonicContact OE1-NE 3.45Å; E1129-R1132 IonicContact OE1-NH2 2.8Å; E1129-R1132 PolarHBondContact OE1-NH2 2.91Å; E1129-R1132 IonicContact OE2-CZ 3.76Å; E1129-R1132 IonicContact OE2-NH1 3.92Å; E1129-R1132 IonicContact OE2-NH2 3.68Å; E1129-R1132 PolarHBondContact OE2-NH2 3.31Å; R1132-K1134 VanDerWaalsContact C-N 3.25Å; R1132-K1134 PolarHBondContact O-N 2.96Å; R1132-G1135 PolarHBondContact O-N 3.4Å
1133	Q	83.6	Confident	75.4	Confident	137 Å²	137	100.2 Å²	100.2	64%	0.64	52%	0.518	S	S	*	.	H	α-helix	trans	-64.3	-27.5	177.6	-72.2	-178.7	15.3	0	0	113.3	E1129 G1135	E1129-Q1133 WeakPolarHBondContact O-CG 3.37Å; E1129-Q1133 PolarHBondContact O-N 3.24Å; E1129-Q1133 PolarHBondContact OE1-NE2 2.9Å; Q1133-G1135 VanDerWaalsContact C-N 3.35Å
1134	K	77.8	Confident	74.1	Confident	172 Å²	172	97.4 Å²	97.4	75%	0.748	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	12.9	174.3	-58.7	-154.3	76.8	163.7	0	113.9	L1130 Y1131 R1132 K1136	L1130-K1134 WeakPolarHBondContact O-CG 3.25Å; L1130-K1134 PolarHBondContact O-N 2.84Å; L1130-K1134 VanDerWaalsContact O-N 3.09Å; Y1131-K1134 CarbonylContact O-C 3.57Å; Y1131-K1134 PolarHBondContact O-N 3.14Å; R1132-K1134 VanDerWaalsContact C-N 3.25Å; R1132-K1134 PolarHBondContact O-N 2.96Å; K1134-K1136 VanDerWaalsContact C-N 3.32Å; K1134-K1136 PolarHBondContact O-N 2.86Å
1135	G	80.8	Confident	72.7	Confident	73 Å²	73	97.6 Å²	97.6	75%	0.753	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.1	28	173.9	0	0	0	0	0	114.4	Y1131 R1132 Q1133	Y1131-G1135 PolarHBondContact O-N 2.96Å; R1132-G1135 PolarHBondContact O-N 3.4Å; Q1133-G1135 VanDerWaalsContact C-N 3.35Å
1136	K	81.1	Confident	71.1	Confident	147 Å²	147	91.2 Å²	91.2	64%	0.639	50%	0.501	S	S	*	.			trans	-125.8	138.3	-176.9	-66.5	-173.3	-178.8	-165.2	0	111.2	Y1131 K1134	Y1131-K1136 CarbonylContact C-O 3.6Å; Y1131-K1136 VanDerWaalsContact C-O 3.3Å; Y1131-K1136 WeakPolarHBondContact CB-O 3.27Å; Y1131-K1136 HydrophobicContact CD1-CB 4.2Å; Y1131-K1136 PolarHBondContact O-N 3.46Å; K1134-K1136 VanDerWaalsContact C-N 3.32Å; K1134-K1136 PolarHBondContact O-N 2.86Å
1137	A	71.1	Confident	69.4	Low	91 Å²	91	86.9 Å²	86.9	75%	0.752	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-64.6	131	171.6	0	0	0	0	0	110.3
1138	P	66.1	Low	67.6	Low	52 Å²	52	91.4 Å²	91.4	34%	0.338	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-65.5	138.5	171.3	25.1	-31.2	0	0	0	110.5	E1128 Y1131 I1142	E1128-P1138 HydrophobicContact CG-CB 4.49Å; E1128-P1138 HydrophobicContact CG-CG 4.4Å; Y1131-P1138 HydrophobicContact CD1-CB 4.3Å; Y1131-P1138 HydrophobicContact CG-CB 4.17Å; P1138-I1142 HydrophobicContact CB-CD1 3.55Å
1139	P	67.9	Low	66	Low	60 Å²	60	95.1 Å²	95.1	39%	0.39	53%	0.528	S	S	.	.	P	Polyproline II helix	trans	-64.2	146.3	179	25	-33.5	0	0	0	111.5	S1141 I1142	P1139-S1141 PolarHBondContact O-N 3.09Å; P1139-I1142 HydrophobicContact CG-CG1 4.07Å
1140	P	57.6	Low	64	Low	142 Å²	142	96.9 Å²	96.9	92%	0.922	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	6.3	-167.7	27.8	-36.6	0	0	0	115.7
1141	S	57.7	Low	62.1	Low	93 Å²	93	101 Å²	101	65%	0.65	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.4	37.6	-174.4	52.6	0	0	0	0	113.4	P1139 I1143	P1139-S1141 PolarHBondContact O-N 3.09Å; S1141-I1143 PolarHBondContact O-N 2.91Å
1142	I	58.3	Low	60	Low	39 Å²	39	104.8 Å²	104.8	20%	0.2	57%	0.565	C	S	.	*			trans	-62.9	99	167.4	-62.6	166	0	0	0	109.4	I1127 P1138 P1139	I1127-I1142 HydrophobicContact CD1-CG2 4.17Å; I1127-I1142 HydrophobicContact CG2-CD1 3.8Å; I1127-I1142 HydrophobicContact CG2-CG2 4.37Å; P1138-I1142 HydrophobicContact CB-CD1 3.55Å; P1139-I1142 HydrophobicContact CG-CG1 4.07Å
1143	I	57.9	Low	57.7	Low	109 Å²	109	105.3 Å²	105.3	56%	0.559	57%	0.574	S	S	*	*			trans	-93.6	114.5	168.5	-63	175.3	0	0	0	106.9	S1141 A1147 M1148	S1141-I1143 PolarHBondContact O-N 2.91Å; I1143-A1147 HydrophobicContact CG2-CB 3.72Å; I1143-M1148 HydrophobicContact CG2-CG 3.98Å
1144	P	51.7	Low	55.3	Low	15 Å²	15	105.6 Å²	105.6	10%	0.097	57%	0.57	C	S	.	*			trans	-59.1	146.4	177.6	-25.7	35.9	0	0	0	111.4	Q1120 K1124 A1146 A1147	Q1120-P1144 HydrophobicContact CB-CB 4.16Å; Q1120-P1144 HydrophobicContact CB-CG 4.23Å; Q1120-P1144 HydrophobicContact CG-CB 4.12Å; Q1120-P1144 WeakPolarHBondContact O-CG 3.3Å; K1124-P1144 HydrophobicContact CB-CG 4.12Å; P1144-A1146 PolarHBondContact O-N 3.18Å; P1144-A1147 WeakPolarHBondContact O-CB 3.49Å; P1144-A1147 PolarHBondContact O-N 2.99Å
1145	P	52.1	Low	53	Low	90 Å²	90	109 Å²	109	58%	0.584	58%	0.578	S	S	*	*	G	3₁₀ helix	trans	-53.2	-38.4	-171.4	-29.4	35.6	0	0	0	114.4	A1147 M1148	P1145-A1147 PolarHBondContact O-N 3.04Å; P1145-M1148 PolarHBondContact O-N 3.23Å
1146	A	50.4	Low	50.7	Low	38 Å²	38	113.5 Å²	113.5	31%	0.314	58%	0.584	S	S	.	*	G	3₁₀ helix	trans	-68.3	-16.5	178.5	0	0	0	0	0	114.4	V1116 Q1120 P1144	V1116-A1146 HydrophobicContact CG1-CB 4.45Å; Q1120-A1146 HydrophobicContact CG-CB 3.94Å; Q1120-A1146 PolarHBondContact NE2-O 2.94Å; P1144-A1146 PolarHBondContact O-N 3.18Å
1147	A	50.4	Low	48.2	Very low	28 Å²	28	112.2 Å²	112.2	23%	0.231	59%	0.593	C	S	.	*	G	3₁₀ helix	trans	-81.1	-26.6	177.5	0	0	0	0	0	112.4	I1143 P1144 P1145 L1149 K1150	I1143-A1147 HydrophobicContact CG2-CB 3.72Å; P1144-A1147 WeakPolarHBondContact O-CB 3.49Å; P1144-A1147 PolarHBondContact O-N 2.99Å; P1145-A1147 PolarHBondContact O-N 3.04Å; A1147-L1149 PolarHBondContact O-N 3.42Å; A1147-L1149 VanDerWaalsContact O-N 3.13Å; A1147-K1150 PolarHBondContact O-N 3.35Å
1148	M	43.8	Very low	46.5	Very low	146 Å²	146	117 Å²	117	72%	0.719	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-62.2	-20.7	177.2	-63.2	-170.6	73.6	0	0	113.4	I1143 P1145 K1150	I1143-M1148 HydrophobicContact CG2-CG 3.98Å; P1145-M1148 PolarHBondContact O-N 3.23Å; M1148-K1150 VanDerWaalsContact C-N 3.31Å; M1148-K1150 PolarHBondContact O-N 3.33Å
1149	L	47.2	Very low	44.8	Very low	148 Å²	148	120.7 Å²	120.7	78%	0.775	62%	0.621	S	S	*	*	G	3₁₀ helix	trans	-74.8	-14.2	-179.9	-63.9	175.2	0	0	0	114	A1147 H1151	A1147-L1149 PolarHBondContact O-N 3.42Å; A1147-L1149 VanDerWaalsContact O-N 3.13Å; L1149-H1151 VanDerWaalsContact C-N 3.34Å; L1149-H1151 PolarHBondContact O-N 3.29Å
1150	K	44.3	Very low	43	Very low	101 Å²	101	122 Å²	122	44%	0.439	64%	0.637	S	S	.	*	G	3₁₀ helix	trans	-80	-1	-174.4	-78.6	-174.2	174.8	175.7	0	115.8	A1147 M1148	A1147-K1150 PolarHBondContact O-N 3.35Å; M1148-K1150 VanDerWaalsContact C-N 3.31Å; M1148-K1150 PolarHBondContact O-N 3.33Å
1151	H	39.6	Very low	41.6	Very low	178 Å²	178	121.9 Å²	121.9	82%	0.824	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-121.2	19.4	-172.9	-80.8	14.5	0	0	0	115.7	L1149	L1149-H1151 VanDerWaalsContact C-N 3.34Å; L1149-H1151 PolarHBondContact O-N 3.29Å
1152	R	37.3	Very low	40.3	Very low	173 Å²	173	128.3 Å²	128.3	65%	0.653	64%	0.64	S	S	*	*			trans	-120.9	50.2	170.6	-81.5	-177.3	159.3	-147	-10.3	113.7	Q907 S908 R1154	Q907-R1152 PolarHBondContact O-NH1 2.85Å; S908-R1152 PolarHBondContact OG-NH2 3.3Å; S908-R1152 VanDerWaalsContact OG-NH2 3.08Å; R1152-R1154 PolarHBondContact O-N 3.41Å
1153	H	35.3	Very low	38.9	Very low	180 Å²	180	131.8 Å²	131.8	83%	0.833	66%	0.663	S	S	*	*			trans	-71.2	92.5	162.9	-92.9	-78.3	0	0	0	110.7	R1155	H1153-R1155 PolarHBondContact O-N 3.45Å
1154	R	32.2	Very low	37.4	Very low	143 Å²	143	133.8 Å²	133.8	54%	0.54	67%	0.674	S	S	.	*	P	Polyproline II helix	trans	-66.5	122.5	165.3	-159.8	176.4	-164.5	-174.9	3.6	107.9	L909 R1152 L1156	L909-R1154 PolarHBondContact O-NH2 3.37Å; R1152-R1154 PolarHBondContact O-N 3.41Å; R1154-L1156 PolarHBondContact O-N 2.78Å
1155	R	31.2	Very low	36.8	Very low	243 Å²	243	138.5 Å²	138.5	92%	0.917	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-62.7	130.7	-176.8	-74.5	-174.1	172.6	-152.3	-1	110.9	H1153	H1153-R1155 PolarHBondContact O-N 3.45Å
1156	L	31.2	Very low	35.6	Very low	168 Å²	168	144.5 Å²	144.5	88%	0.88	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-72.4	124.6	161.7	-74.1	164.9	0	0	0	108.8	R1154 K1158	R1154-L1156 PolarHBondContact O-N 2.78Å; L1156-K1158 PolarHBondContact O-N 2.69Å
1157	S	28.7	Very low	34.6	Very low	120 Å²	120	153.8 Å²	153.8	84%	0.839	74%	0.743	S	S	*	*			trans	-77	101	166.3	49.1	0	0	0	0	109.3
1158	K	35.4	Very low	33.5	Very low	192 Å²	192	158.7 Å²	158.7	84%	0.835	77%	0.765	S	S	*	*			trans	-76	150.9	165.2	-87	-167.2	171.7	-170.7	0	110.2	L1156	L1156-K1158 PolarHBondContact O-N 2.69Å
1159	P	30.7	Very low	32.9	Very low	129 Å²	129	155.7 Å²	155.7	84%	0.838	76%	0.758	S	S	*	*			trans	-64.9	150.3	174.2	29.2	-35.7	0	0	0	110.9
1160	A	29.9	Very low	32.2	Very low	88 Å²	88	155.4 Å²	155.4	73%	0.727	76%	0.757	S	S	*	*			trans	-105.1	119.4	174.2	0	0	0	0	0	110.1
1161	N	28.7	Very low	32	Very low	138 Å²	138	157.8 Å²	157.8	74%	0.738	77%	0.77	S	S	*	*				174.5	107.9	128.9	-88.4	-12.6	0	0	0	110.5
1162	Y	30.1	Very low	31.5	Very low	229 Å²	229	158.1 Å²	158.1	90%	0.898	76%	0.764	S	S	*	*				-175.7	163.4	114.8	-93.5	-63.4	0	0	0	109.2
1163	T	28.5	Very low	31.2	Very low	111 Å²	111	158.8 Å²	158.8	68%	0.681	77%	0.766	S	S	*	*			trans	-129.8	118.3	-139.3	-26.6	0	0	0	0	114.9
1164	L	27.2	Very low	30.9	Very low	151 Å²	151	156.1 Å²	156.1	79%	0.791	76%	0.758	S	S	*	*			trans	65.3	173.6	155	-77.8	170.5	0	0	0	115.9
1165	P	39.6	Very low	30.7	Very low	115 Å²	115	156.8 Å²	156.8	75%	0.747	77%	0.771	S	S	*	*			cis	-134.1	135.8	12.7	39.4	-19.7	0	0	0	119.4
1166	R	26.9	Very low	31.1	Very low	216 Å²	216	150.5 Å²	150.5	82%	0.815	76%	0.761	S	S	*	*				51.5	115.7	120.4	-170.6	-173.3	-170.1	157.7	2.4	120.3
1167	R	28.3	Very low	31.7	Very low	232 Å²	232	148.3 Å²	148.3	88%	0.875	76%	0.757	S	S	*	*			trans	-153.7	130.3	132	-123.3	170.9	-179.2	155.9	0.3	113.7
1168	N	28.1	Very low	32	Very low	131 Å²	131	148.2 Å²	148.2	70%	0.701	75%	0.754	S	S	*	*			trans	28	155.8	144.7	-66	11.9	0	0	0	123.2
1169	S	30.5	Very low	31.8	Very low	83 Å²	83	145.3 Å²	145.3	58%	0.58	76%	0.758	S	S	*	*			cis	173.5	156.9	-26.7	56.2	0	0	0	0	109.4
1170	L	32.8	Very low	31.8	Very low	142 Å²	142	142.8 Å²	142.8	74%	0.743	76%	0.755	S	S	*	*			trans	70.3	152.6	171.2	-50.3	162.6	0	0	0	113.9
1171	Q	38.8	Very low	31.9	Very low	151 Å²	151	146.1 Å²	146.1	71%	0.706	76%	0.759	S	S	*	*			cis	-125.5	140.7	3.8	-115.3	116.3	-50.3	0	0	108.8
1172	R	30.8	Very low	32	Very low	186 Å²	186	146.9 Å²	146.9	70%	0.702	76%	0.76	S	S	*	*				70.3	122	81.5	-164.3	-176.2	-83.9	-99.1	1.7	111.6
1173	R	30.3	Very low	32.1	Very low	186 Å²	186	147 Å²	147	70%	0.702	76%	0.759	S	S	*	*			cis	-167.8	162.9	10.1	-123.2	176.4	160.3	-172.6	-2.3	114.8
1174	D	28.2	Very low	32.3	Very low	124 Å²	124	150.8 Å²	150.8	66%	0.663	77%	0.766	S	S	*	*			trans	68.5	159.2	140.6	-60.6	-18.7	0	0	0	125.4
1175	I	28.8	Very low	32.4	Very low	157 Å²	157	150.1 Å²	150.1	81%	0.805	76%	0.763	S	S	*	*			trans	-121.6	170.1	-166.6	-71.7	154.4	0	0	0	106.6
1176	P	40.3	Very low	32	Very low	111 Å²	111	149.7 Å²	149.7	72%	0.721	76%	0.763	S	S	*	*			cis	-130.3	-175	4.3	23	3.2	0	0	0	116
1177	P	43.3	Very low	32.2	Very low	122 Å²	122	145.8 Å²	145.8	79%	0.792	76%	0.763	S	S	*	*			trans	-96.7	151.9	160.6	37.2	-32.5	0	0	0	114.2
1178	P	35.8	Very low	32.2	Very low	119 Å²	119	140 Å²	140	77%	0.773	76%	0.758	S	S	*	*			trans	-123.9	122.8	170.8	36.6	-23.6	0	0	0	116.7
1179	S	30.2	Very low	32.1	Very low	131 Å²	131	137.5 Å²	137.5	92%	0.916	76%	0.763	S	S	*	*			trans	40	126.1	132.7	-52.6	0	0	0	0	124.8
1180	G	30.1	Very low	32	Very low	76 Å²	76	138.9 Å²	138.9	78%	0.784	77%	0.773	S	S	*	*			trans	133.9	149.8	150.8	0	0	0	0	0	115.4
1181	I	31.6	Very low	31.8	Very low	157 Å²	157	137 Å²	137	81%	0.805	77%	0.771	S	S	*	*			cis	-159.8	151.1	-10.9	-131.4	167.2	0	0	0	110.9
1182	M	31	Very low	31.3	Very low	154 Å²	154	136 Å²	136	76%	0.759	78%	0.781	S	S	*	*			trans	38.3	119.7	161.5	-63.5	167.4	63.4	0	0	121.2
1183	R	32.2	Very low	31	Very low	232 Å²	232	130.5 Å²	130.5	88%	0.875	78%	0.782	S	S	*	*				73.7	116.3	64.2	-78.5	-170.8	174.6	173.9	-0.7	117.3
1184	K	34.1	Very low	31.1	Very low	191 Å²	191	127.4 Å²	127.4	83%	0.83	79%	0.789	S	S	*	*			trans	-167.1	116	130.9	-103.7	159.9	-174	177.6	0	112.5
1185	N	29.2	Very low	31.1	Very low	137 Å²	137	129 Å²	129	73%	0.733	79%	0.793	S	S	*	*			trans	56.5	117.4	131.1	-58.6	16.1	0	0	0	120.3
1186	S	30.9	Very low	31.1	Very low	105 Å²	105	127 Å²	127	73%	0.734	78%	0.783	S	S	*	*				83.1	142.9	80.4	-56.5	0	0	0	0	113.2
1187	V	30.7	Very low	30.7	Very low	135 Å²	135	132 Å²	132	82%	0.818	79%	0.788	S	S	*	*			cis	-146.6	163.1	15.7	-130.3	0	0	0	0	113.5
1188	S	28.5	Very low	30.2	Very low	110 Å²	110	131.5 Å²	131.5	77%	0.769	78%	0.782	S	S	*	*			trans	-34.5	159.7	164.9	54.4	0	0	0	0	121
1189	G	26.9	Very low	30	Very low	79 Å²	79	133.3 Å²	133.3	81%	0.814	79%	0.785	S	S	*	*			trans	-173.9	104.4	157.9	0	0	0	0	0	115.3
1190	S	26.8	Very low	30.2	Very low	112 Å²	112	137.5 Å²	137.5	78%	0.783	79%	0.786	S	S	*	*			trans	-85.5	139.3	179.6	-42.2	0	0	0	0	112.2
1191	S	28.9	Very low	30.1	Very low	102 Å²	102	137 Å²	137	71%	0.713	78%	0.781	S	S	*	*				79.1	137.2	101.1	73.6	0	0	0	0	118.5
1192	S	28.3	Very low	30.1	Very low	129 Å²	129	135.7 Å²	135.7	90%	0.902	78%	0.78	S	S	*	*			trans	64.9	161.7	169.1	-63	0	0	0	0	116.5
1193	G	25.7	Very low	30	Very low	71 Å²	71	134.3 Å²	134.3	73%	0.732	78%	0.781	S	S	*	*			cis	159	110.4	-14.2	0	0	0	0	0	115.4
1194	S	31.3	Very low	29.8	Very low	121 Å²	121	132.1 Å²	132.1	85%	0.846	78%	0.778	S	S	*	*			trans	80.5	156.2	157.8	-145.9	0	0	0	0	121.4
1195	Q	28.5	Very low	29.7	Very low	159 Å²	159	127.2 Å²	127.2	74%	0.743	77%	0.773	S	S	*	*			trans	78.7	120.7	161.3	-61.5	-157.2	-107.9	0	0	122.9
1196	D	29.8	Very low	30.9	Very low	113 Å²	113	127.1 Å²	127.1	60%	0.604	78%	0.78	S	S	*	*				59.1	144	127.3	-69.4	-57.1	0	0	0	122.1
1197	R	32.1	Very low	30.9	Very low	217 Å²	217	125.7 Å²	125.7	82%	0.819	78%	0.782	S	S	*	*			cis	-171.9	170.2	-14.1	-132.1	178.7	-179.4	-164.7	-1.1	111
1198	V	31.4	Very low	31.2	Very low	111 Å²	111	128.7 Å²	128.7	67%	0.673	79%	0.786	S	S	*	*			trans	80.5	111.9	143.7	162.3	0	0	0	0	122.8
1199	L	33	Very low	31.3	Very low	158 Å²	158	129 Å²	129	83%	0.827	79%	0.789	S	S	*	*			trans	57.6	118.5	137.3	-60.1	177.2	0	0	0	125.3
1200	K	33.2	Very low	31.8	Very low	218 Å²	218	130.6 Å²	130.6	95%	0.948	79%	0.786	S	S	*	*				-172.5	150.4	126.3	-97.4	163	-175.8	176.5	0	108.1
1201	G	29	Very low	32.2	Very low	66 Å²	66	137.9 Å²	137.9	68%	0.68	81%	0.811	S	S	*	*			cis	153.9	89.1	-12.2	0	0	0	0	0	114.7
1202	V	29.9	Very low	32.4	Very low	129 Å²	129	139.7 Å²	139.7	78%	0.782	82%	0.816	S	S	*	*			trans	50.1	130.4	152.9	-154.6	0	0	0	0	118
1203	T	30.3	Very low	32.6	Very low	126 Å²	126	140.3 Å²	140.3	77%	0.773	81%	0.812	S	S	*	*				-179.1	152.6	84.3	-52.7	0	0	0	0	112.7
1204	F	27.4	Very low	33	Very low	185 Å²	185	144.1 Å²	144.1	81%	0.811	82%	0.816	S	S	*	*			trans	-37.8	140.4	-177.2	-66.2	-97.3	0	0	0	122.2
1205	A	32.4	Very low	33.1	Very low	89 Å²	89	145.5 Å²	145.5	74%	0.736	81%	0.814	S	S	*	*				33.9	169.7	114.3	0	0	0	0	0	122.2
1206	P	54.9	Low	33.4	Very low	134 Å²	134	144.6 Å²	144.6	87%	0.87	82%	0.819	S	S	*	*			cis	-132.2	-174.2	0.3	43.6	-27.1	0	0	0	115.3
1207	G	29.9	Very low	33.6	Very low	75 Å²	75	146.7 Å²	146.7	77%	0.773	83%	0.833	S	S	*	*			trans	178.6	128	166	0	0	0	0	0	115
1208	H	36.8	Very low	33.7	Very low	198 Å²	198	141.7 Å²	141.7	92%	0.917	83%	0.834	S	S	*	*			trans	-87.5	146.7	176.1	-67.3	-111.5	0	0	0	112.2
1209	S	31.8	Very low	33.9	Very low	117 Å²	117	144.1 Å²	144.1	82%	0.818	85%	0.846	S	S	*	*				-174.8	158	113.8	-166.9	0	0	0	0	111.2
1210	C	36.9	Very low	34	Very low	113 Å²	113	142.9 Å²	142.9	76%	0.764	85%	0.848	S	S	*	*			trans	-78.5	147	157.1	-51.3	0	0	0	0	109.6
1211	M	35.5	Very low	34.1	Very low	265 Å²	265	136.1 Å²	136.1	100%	1.305	84%	0.839	S	S	*	*				-159.2	0	101.7	-103.1	-172.1	163.1	0	0	110.5

Retrieved 1,211 of 1,211 residues in 1651.1 ms (Link to these results)

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