A0A078BPN7_CAEEL Loading...

Fibronectin type-III domain-containing protein

AlphaFold DB , UniProt , Accession A0A078BPN7, Species CAEEL (Caenorhabditis elegans), Gene jac-1, Length 1,183 aa.

						>A0A078BPN7_CAEEL|A0A078BPN7|jac-1
MATSYLTESLAGPTSARGSSYSYSYESHYDNPPEEEYEHFTNDDGVHQMQKVTRVTKVTTTRSVRQVPVQSPYSNIDFDSSGLPTPSPVIDRDPSLEMMARMGGASDHDSEDRSAPPPAPASRFLHEDSGIPSAPGVPDVVDAGIGEVTVVWSAPLQSNGGEVRGYQIEMREFPDGEWESMGVDHLLKDTTCRVTNLTSHEVQFRVSAYGRTGFGPASNPSLPVKIPISETDLATSAGAPLAPGRPTVIAVDGQGVLLEWTPPVADVHSSPPQGYQVEYRVYGSRDWIVANEQLVQENVFTVESLRPNGVYEFRVRGKNQDGLGHPSMSSGGVAIRPAAPQRHVPARKVSESVQPPGQPQMVEVGDDVVKLEWAPSVQNARYIVEYREVGDPEWHTANYDPIVQNGIQVEGLHRNSTYEFCVISIVDNIASQPSETSDIIHLRPTCNTSALRPAPNILEAPEFLEVDGDKITICWLPAQSQLPVMGYDVEFRDLQQDDRWYKVNDQPVFACKMTVGDLIMDHDYQFRVLAHNASGCSQPSPPSDFVHIEPSTNRFSSDTMESPHLGHHDVVKYVEAERFGAVPLLQEEMVRESPPLPERDDSPPPLRRANNNVQWRDPSLKEVIEYLSSADKDKQLNASGYLQHLTYTDNQIKEETREYGGIPKLIALLRSDTPRIQKNACACLKNLSFGKENDANKLAVMEADGVRLIAEVLRTTHDASVKEEAAAALWNLSSADMLKPVILESATEILSQQVIAPVLAVGTSDPTRHFGSTLFKNSTGVLRNVSAASQQARRRLRDIPNLIEALVHFLTHAIQKSQVDSPTVENAVCLLRNLSYRIQEVVDPNYDPAAAHSSSSKNMKHVASPKPEKKKKDKEKKKDKNPKNIVTGPSVLWQPHVVKLYLKLLQDSSNIETLEASAGAIQNLAACQFPPSAEVRAAVRVEKGLPVLVELIRLPEDFVVCAVATALRNLAIDPRNRELIVSGKYALRDFLDKLPEPGSPRRSAISDQTIGAVLGILFEIVRSSAAYTKDVHELKGTDKLRALSRSYPTYSHRVCKYASQVLYVMWQHKELHDGFKRSGLKEADFYSGTARRGDSSTLARPISSQGRERPSMHQLDETLSSGGGYGTMESNNRAGTLRPASATSQTIQRRYDQVPRDGPVYSSVQKPSPRGGGGGGNIDDSWV
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.3	Very low	29	Very low	247 Å²	247	138.8 Å²	138.8	100%	1.217	79%	0.789	S	S	*	*				0	134.7	0	-58.3	173.3	-172.8	0	0	107.1
2	A	29.7	Very low	28.6	Very low	87 Å²	87	133.3 Å²	133.3	72%	0.719	79%	0.786	S	S	*	*			cis	-154.2	141.1	-15.8	0	0	0	0	0	109.4
3	T	31.1	Very low	30.8	Very low	131 Å²	131	133.1 Å²	133.1	80%	0.804	79%	0.79	S	S	*	*			trans	21.1	133.5	144.8	56.4	0	0	0	0	118.8
4	S	32.6	Very low	30.6	Very low	95 Å²	95	134.4 Å²	134.4	66%	0.664	80%	0.8	S	S	*	*			cis	-165.8	175.4	26.7	83.8	0	0	0	0	109.1
5	Y	30.3	Very low	30.2	Very low	198 Å²	198	133.3 Å²	133.3	78%	0.776	80%	0.802	S	S	*	*			cis	-162.2	165.7	-1.2	-103.4	-33.2	0	0	0	105.8
6	L	26.9	Very low	30	Very low	133 Å²	133	129.4 Å²	129.4	70%	0.696	79%	0.789	S	S	*	*			cis	-145.5	-176.1	1.4	-120.1	-176.2	0	0	0	110.2
7	T	26.8	Very low	29.7	Very low	93 Å²	93	136.3 Å²	136.3	57%	0.571	80%	0.797	S	S	*	*			trans	-46.9	145.6	168.5	48	0	0	0	0	117.1
8	E	27.2	Very low	29.4	Very low	177 Å²	177	132.3 Å²	132.3	83%	0.827	79%	0.789	S	S	*	*				64.9	149.8	67.2	-57.4	179	160.6	0	0	113.7
9	S	26.9	Very low	29.2	Very low	92 Å²	92	131.3 Å²	131.3	64%	0.643	79%	0.789	S	S	*	*			cis	-158.5	167.9	19.5	-148.6	0	0	0	0	115.5
10	L	28.1	Very low	28.9	Very low	167 Å²	167	129.8 Å²	129.8	87%	0.874	79%	0.786	S	S	*	*			trans	9.7	133.5	152.1	-64.5	165.4	0	0	0	121.9
11	A	26.8	Very low	28.7	Very low	107 Å²	107	134 Å²	134	88%	0.884	79%	0.789	S	S	*	*			trans	-152	152.4	143.2	0	0	0	0	0	112.3
12	G	24.1	Very low	28.2	Very low	73 Å²	73	126.6 Å²	126.6	75%	0.753	76%	0.761	S	S	*	*			trans	-98.8	-167.9	-177.5	0	0	0	0	0	115.4
13	P	57.3	Low	27.9	Very low	130 Å²	130	133.2 Å²	133.2	84%	0.844	77%	0.769	S	S	*	*			trans	-95.4	154	-158.2	36.5	-36.8	0	0	0	115.4
14	T	27	Very low	27.5	Very low	151 Å²	151	132.1 Å²	132.1	93%	0.926	77%	0.767	S	S	*	*			trans	-134	156.3	165.1	41.2	0	0	0	0	112.2
15	S	24.8	Very low	27.2	Very low	118 Å²	118	138 Å²	138	83%	0.825	78%	0.776	S	S	*	*			trans	-120.1	169.7	-171.9	-179.1	0	0	0	0	111.1
16	A	27.2	Very low	26.9	Very low	72 Å²	72	137.9 Å²	137.9	60%	0.595	78%	0.782	S	S	*	*			trans	89.9	117.7	147.5	0	0	0	0	0	120.8
17	R	25	Very low	26.9	Very low	246 Å²	246	135.5 Å²	135.5	93%	0.928	78%	0.777	S	S	*	*			trans	71.2	151.4	137	-62.2	167.3	-179.5	174.7	-1.9	117.4
18	G	25.3	Very low	26.9	Very low	64 Å²	64	139.8 Å²	139.8	66%	0.66	79%	0.79	S	S	*	*			cis	-156.6	151.6	-1.5	0	0	0	0	0	110
19	S	24	Very low	26.9	Very low	113 Å²	113	141.3 Å²	141.3	79%	0.79	79%	0.79	S	S	*	*			cis	88.8	88.9	48.8	76.4	0	0	0	0	114.7
20	S	24.2	Very low	27	Very low	102 Å²	102	145 Å²	145	71%	0.713	80%	0.802	S	S	*	*			trans	-167.9	122.3	152.9	53.1	0	0	0	0	112.6
21	Y	24.3	Very low	27	Very low	218 Å²	218	143.9 Å²	143.9	86%	0.855	80%	0.797	S	S	*	*			trans	43.9	145.4	130.3	-61.6	-68	0	0	0	121.3
22	S	22.8	Very low	27.2	Very low	91 Å²	91	143.9 Å²	143.9	64%	0.636	79%	0.788	S	S	*	*			cis	-173.4	141.8	7.3	31.3	0	0	0	0	112.9
23	Y	23.8	Very low	27.7	Very low	227 Å²	227	146.5 Å²	146.5	89%	0.89	79%	0.792	S	S	*	*			trans	62.5	162.1	152.8	-79.7	-108.2	0	0	0	117.5
24	S	23.4	Very low	26.5	Very low	107 Å²	107	149.5 Å²	149.5	75%	0.748	80%	0.795	S	S	*	*			cis	-132.6	154.3	3.4	49.1	0	0	0	0	113.1
25	Y	26.3	Very low	26.8	Very low	218 Å²	218	148.1 Å²	148.1	86%	0.855	78%	0.778	S	S	*	*			trans	-76.9	141.7	161.1	-119.5	-105	0	0	0	109.3
26	E	23.1	Very low	27.3	Very low	196 Å²	196	149.3 Å²	149.3	92%	0.916	77%	0.77	S	S	*	*			trans	-155.6	158.7	132.3	-131	161.8	-150.3	0	0	110.6
27	S	27.1	Very low	27.7	Very low	84 Å²	84	150.3 Å²	150.3	59%	0.587	76%	0.759	S	S	*	*			trans	-131.2	152.7	-173.4	61	0	0	0	0	109.2
28	H	26.5	Very low	28.5	Very low	182 Å²	182	143.5 Å²	143.5	84%	0.843	74%	0.738	S	S	*	*			trans	-155.9	168.6	146.6	-99.7	-6.2	0	0	0	114
29	Y	26.5	Very low	29	Very low	210 Å²	210	146.4 Å²	146.4	82%	0.824	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-76.9	144.6	-170.1	-68.7	-109.5	0	0	0	112.3
30	D	29.2	Very low	29.8	Very low	169 Å²	169	147.6 Å²	147.6	90%	0.904	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-75.8	137.7	159.1	-83.7	-50.7	0	0	0	111
31	N	28.7	Very low	30.6	Very low	144 Å²	144	146.2 Å²	146.2	77%	0.77	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-92.3	158.1	177.1	-86	-42.5	0	0	0	112.1
32	P	31.7	Very low	31.6	Very low	107 Å²	107	141.5 Å²	141.5	70%	0.695	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-66.4	152.9	164.8	31.2	-35.3	0	0	0	111.1
33	P	34	Very low	32.5	Very low	127 Å²	127	145.7 Å²	145.7	83%	0.825	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-71.6	146.6	-176.2	29.5	-35.8	0	0	0	113.1
34	E	31.9	Very low	33.7	Very low	194 Å²	194	142.5 Å²	142.5	91%	0.907	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-79	157.7	178.4	-59.6	-176	126.2	0	0	112.5
35	E	33.6	Very low	34.5	Very low	121 Å²	121	140 Å²	140	57%	0.565	71%	0.707	S	S	*	*			trans	-104.3	110.9	174.2	-61.9	-159.3	151.5	0	0	111.4	Y37 K51	E35-Y37 HydrophobicContact CB-CD2 4.38Å; E35-Y37 HydrophobicContact CB-CE2 3.69Å; E35-Y37 WeakPolarHBondContact O-CD2 3.14Å; E35-Y37 PolarHBondContact OE2-OH 3.27Å; E35-K51 IonicContact OE1-NZ 2.72Å; E35-K51 PolarHBondContact OE1-NZ 3.3Å; E35-K51 IonicContact OE2-NZ 2.7Å; E35-K51 PolarHBondContact OE2-NZ 2.95Å
36	E	34.3	Very low	35.3	Very low	143 Å²	143	134.3 Å²	134.3	67%	0.668	70%	0.695	S	S	*	*			trans	-73.9	138.5	171.3	-63.7	-172	130.8	0	0	111.9	R54	E36-R54 IonicContact OE2-CZ 2.76Å; E36-R54 IonicContact OE2-NH1 3.28Å; E36-R54 PolarHBondContact OE2-NH1 3.37Å; E36-R54 IonicContact OE2-NH2 3.48Å
37	Y	37.1	Very low	35.8	Very low	93 Å²	93	131 Å²	131	37%	0.365	68%	0.679	S	S	.	*			trans	-132.8	124.5	170.2	-69.3	-98.4	0	0	0	109.3	E35 M49 K51	E35-Y37 HydrophobicContact CB-CD2 4.38Å; E35-Y37 HydrophobicContact CB-CE2 3.69Å; E35-Y37 WeakPolarHBondContact O-CD2 3.14Å; E35-Y37 PolarHBondContact OE2-OH 3.27Å; Y37-M49 HydrophobicContact CG-CE 4.35Å; Y37-K51 HydrophobicContact CD1-CB 4.49Å; Y37-K51 HydrophobicContact CE1-CB 3.91Å; Y37-K51 HydrophobicContact CE1-CD 4.17Å; Y37-K51 HydrophobicContact CE1-CG 4Å; Y37-K51 PolarHBondContact OH-NZ 3.33Å
38	E	40.8	Very low	36.4	Very low	104 Å²	104	134.3 Å²	134.3	49%	0.486	69%	0.685	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89	144.7	173.3	-72.3	-179.3	168.2	0	0	111.3	F40	E38-F40 HydrophobicContact CB-CE2 4.23Å
39	H	36.3	Very low	36.8	Very low	125 Å²	125	131.2 Å²	131.2	58%	0.579	67%	0.673	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-102.6	126.6	176.3	-78.1	-90.4	0	0	0	110.5	M49	H39-M49 VanDerWaalsContact CE1-SD 3.58Å
40	F	41.3	Very low	37.3	Very low	137 Å²	137	128.9 Å²	128.9	60%	0.601	67%	0.669	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-116.5	153.4	170.5	-82.1	-93.4	0	0	0	111.6	E38	E38-F40 HydrophobicContact CB-CE2 4.23Å
41	T	39.1	Very low	37.5	Very low	73 Å²	73	126.3 Å²	126.3	45%	0.448	65%	0.65	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-137.2	124.1	174	-32.8	0	0	0	0	106.8	H47	T41-H47 PolarHBondContact OG1-CE1 2.98Å; T41-H47 PolarHBondContact OG1-ND1 3.17Å
42	N	45.3	Very low	37.7	Very low	119 Å²	119	123.1 Å²	123.1	64%	0.636	64%	0.636	S	S	*	*			trans	-95.4	167.6	175	-63.4	1.9	0	0	0	109.5	D44 G45	N42-D44 PolarHBondContact O-N 3.23Å; N42-G45 PolarHBondContact O-N 3.48Å
43	D	43.1	Very low	37.8	Very low	180 Å²	180	123.6 Å²	123.6	96%	0.963	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.4	-19.1	-170.1	-62.6	-53	0	0	0	115.5	G45	D43-G45 PolarHBondContact O-N 2.91Å
44	D	48	Very low	37.5	Very low	160 Å²	160	125.7 Å²	125.7	86%	0.856	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	5.3	171.8	-66.5	-51.3	0	0	0	114.3	N42 V46	N42-D44 PolarHBondContact O-N 3.23Å; D44-V46 PolarHBondContact O-N 3.29Å
45	G	40.5	Very low	37.3	Very low	55 Å²	55	122.5 Å²	122.5	57%	0.567	62%	0.622	S	S	*	*			trans	76.5	14.7	169	0	0	0	0	0	116.6	N42 D43	N42-G45 PolarHBondContact O-N 3.48Å; D43-G45 PolarHBondContact O-N 2.91Å
46	V	42.7	Very low	36.9	Very low	97 Å²	97	122.3 Å²	122.3	59%	0.588	63%	0.629	S	S	*	*			trans	-102.4	120	179.6	-177.8	0	0	0	0	111.2	D44	D44-V46 PolarHBondContact O-N 3.29Å
47	H	34.4	Very low	36.5	Very low	128 Å²	128	123.9 Å²	123.9	59%	0.593	63%	0.633	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-75.7	139.9	171.8	-63.3	-60.9	0	0	0	112.1	T41	T41-H47 PolarHBondContact OG1-CE1 2.98Å; T41-H47 PolarHBondContact OG1-ND1 3.17Å
48	Q	40.3	Very low	35.8	Very low	153 Å²	153	124.9 Å²	124.9	72%	0.715	65%	0.649	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-134.2	148.5	163.1	-64.5	-169.6	15.9	0	0	110.2
49	M	33.9	Very low	35	Very low	116 Å²	116	124.3 Å²	124.3	57%	0.571	65%	0.653	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-106.5	133.1	171.6	-63.7	177.2	78.6	0	0	108.9	Y37 H39	Y37-M49 HydrophobicContact CG-CE 4.35Å; H39-M49 VanDerWaalsContact CE1-SD 3.58Å
50	Q	37.1	Very low	34.4	Very low	162 Å²	162	124.3 Å²	124.3	76%	0.757	66%	0.662	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-131.8	139	177.8	-148.3	176.5	29.9	0	0	110	V52	Q50-V52 PolarHBondContact O-N 3.36Å
51	K	33.9	Very low	33.6	Very low	114 Å²	114	122.8 Å²	122.8	50%	0.496	66%	0.664	S	S	.	*			trans	-80.6	108.4	-176.9	-171.1	164	-173.7	155.9	0	110.6	E35 Y37 T53	E35-K51 IonicContact OE1-NZ 2.72Å; E35-K51 PolarHBondContact OE1-NZ 3.3Å; E35-K51 IonicContact OE2-NZ 2.7Å; E35-K51 PolarHBondContact OE2-NZ 2.95Å; Y37-K51 HydrophobicContact CD1-CB 4.49Å; Y37-K51 HydrophobicContact CE1-CB 3.91Å; Y37-K51 HydrophobicContact CE1-CD 4.17Å; Y37-K51 HydrophobicContact CE1-CG 4Å; Y37-K51 PolarHBondContact OH-NZ 3.33Å; K51-T53 PolarHBondContact O-N 2.96Å
52	V	32.3	Very low	33.1	Very low	77 Å²	77	129 Å²	129	47%	0.467	68%	0.679	S	S	.	*			trans	-75.9	106.7	-176.7	-177.9	0	0	0	0	110.3	Q50 R54	Q50-V52 PolarHBondContact O-N 3.36Å; V52-R54 HydrophobicContact CG1-CG 4.25Å; V52-R54 PolarHBondContact O-N 3.33Å
53	T	34.8	Very low	32	Very low	117 Å²	117	128.8 Å²	128.8	72%	0.718	69%	0.687	S	S	*	*			trans	-86.9	95.4	166.8	-54.8	0	0	0	0	108.6	K51 V55	K51-T53 PolarHBondContact O-N 2.96Å; T53-V55 PolarHBondContact O-N 3Å
54	R	27.2	Very low	31.2	Very low	171 Å²	171	125.8 Å²	125.8	65%	0.645	68%	0.675	S	S	*	*			trans	-61.9	103.5	172	-78.6	-175.2	176.5	130	4	109.1	E36 V52 T56	E36-R54 IonicContact OE2-CZ 2.76Å; E36-R54 IonicContact OE2-NH1 3.28Å; E36-R54 PolarHBondContact OE2-NH1 3.37Å; E36-R54 IonicContact OE2-NH2 3.48Å; V52-R54 HydrophobicContact CG1-CG 4.25Å; V52-R54 PolarHBondContact O-N 3.33Å; R54-T56 VanDerWaalsContact C-N 3.34Å; R54-T56 PolarHBondContact O-N 3Å
55	V	27.4	Very low	30.1	Very low	127 Å²	127	130 Å²	130	77%	0.77	68%	0.679	S	S	*	*			trans	-74.6	91.6	168	179	0	0	0	0	107.5	T53 K57	T53-V55 PolarHBondContact O-N 3Å; V55-K57 PolarHBondContact O-N 2.91Å
56	T	25.8	Very low	29.4	Very low	117 Å²	117	135.5 Å²	135.5	72%	0.718	69%	0.69	S	S	*	*			trans	-59.6	108.3	170.5	-51	0	0	0	0	108.2	R54 V58	R54-T56 VanDerWaalsContact C-N 3.34Å; R54-T56 PolarHBondContact O-N 3Å; T56-V58 HydrophobicContact CG2-CG2 4.36Å; T56-V58 PolarHBondContact O-N 2.85Å
57	K	25.1	Very low	28.5	Very low	176 Å²	176	136.9 Å²	136.9	77%	0.765	70%	0.698	S	S	*	*			trans	-76	73.2	-175.4	-167.4	-171.4	179	-174.1	0	110.2	V55 T59	V55-K57 PolarHBondContact O-N 2.91Å; K57-T59 VanDerWaalsContact C-N 3.27Å; K57-T59 PolarHBondContact O-N 3.01Å; K57-T59 PolarHBondContact O-OG1 2.73Å; K57-T59 VanDerWaalsContact O-OG1 3.07Å
58	V	23.4	Very low	28.1	Very low	114 Å²	114	136.8 Å²	136.8	69%	0.691	71%	0.709	S	S	*	*			trans	-61.2	92	173.4	-178	0	0	0	0	108.1	T56 T60	T56-V58 HydrophobicContact CG2-CG2 4.36Å; T56-V58 PolarHBondContact O-N 2.85Å; V58-T60 PolarHBondContact O-N 3.3Å
59	T	23.5	Very low	27.4	Very low	93 Å²	93	135.6 Å²	135.6	57%	0.571	71%	0.712	S	S	*	*			trans	-90.2	85.9	178.3	-53.3	0	0	0	0	106	K57 T61	K57-T59 VanDerWaalsContact C-N 3.27Å; K57-T59 PolarHBondContact O-N 3.01Å; K57-T59 PolarHBondContact O-OG1 2.73Å; K57-T59 VanDerWaalsContact O-OG1 3.07Å; T59-T61 HydrophobicContact CG2-CG2 4.32Å; T59-T61 PolarHBondContact O-N 3Å
60	T	24.2	Very low	27	Very low	124 Å²	124	139.1 Å²	139.1	76%	0.761	73%	0.727	S	S	*	*			trans	-69.5	83.9	175.8	-52.7	0	0	0	0	109	V58 R62	V58-T60 PolarHBondContact O-N 3.3Å; T60-R62 PolarHBondContact O-N 2.85Å
61	T	24.1	Very low	26.7	Very low	106 Å²	106	136.4 Å²	136.4	65%	0.65	73%	0.726	S	S	*	*			trans	-63.6	104.9	170.4	43.9	0	0	0	0	108.9	T59 S63	T59-T61 HydrophobicContact CG2-CG2 4.32Å; T59-T61 PolarHBondContact O-N 3Å; T61-S63 PolarHBondContact O-N 3.37Å
62	R	27.9	Very low	26.6	Very low	203 Å²	203	136.2 Å²	136.2	77%	0.766	74%	0.736	S	S	*	*			trans	-63.9	102.2	168.5	-169.1	176.8	-174	-177	0.8	107.5	T60 V64	T60-R62 PolarHBondContact O-N 2.85Å; R62-V64 PolarHBondContact O-N 3.11Å
63	S	22.9	Very low	26.3	Very low	114 Å²	114	143.4 Å²	143.4	80%	0.797	76%	0.756	S	S	*	*			trans	-67.6	87.3	-170.5	-67.5	0	0	0	0	113.2	T61	T61-S63 PolarHBondContact O-N 3.37Å
64	V	26.9	Very low	25.9	Very low	117 Å²	117	142.6 Å²	142.6	71%	0.709	76%	0.756	S	S	*	*			trans	-73.1	118.5	157.2	178.2	0	0	0	0	107.7	R62 Q66	R62-V64 PolarHBondContact O-N 3.11Å; V64-Q66 HydrophobicContact CG1-CG 4.19Å; V64-Q66 PolarHBondContact O-N 2.66Å
65	R	23.1	Very low	25.8	Very low	250 Å²	250	141.5 Å²	141.5	94%	0.943	76%	0.763	S	S	*	*			trans	-75.1	91.2	167.3	-91.1	-172.8	170.1	-176	-2.1	109.4
66	Q	25.8	Very low	25.8	Very low	169 Å²	169	143.1 Å²	143.1	79%	0.79	77%	0.765	S	S	*	*			trans	-110.8	135.7	152.3	-79.6	-175.6	-17.1	0	0	108.4	V64 P68	V64-Q66 HydrophobicContact CG1-CG 4.19Å; V64-Q66 PolarHBondContact O-N 2.66Å; Q66-P68 WeakPolarHBondContact O-CD 3.41Å
67	V	24.2	Very low	25.8	Very low	127 Å²	127	144.2 Å²	144.2	77%	0.77	77%	0.767	S	S	*	*			trans	-98.4	113.1	177.8	179	0	0	0	0	108.3	V69	V67-V69 HydrophobicContact CG1-CG2 4.15Å; V67-V69 PolarHBondContact O-N 3.3Å
68	P	26.6	Very low	25.8	Very low	126 Å²	126	146.3 Å²	146.3	82%	0.818	78%	0.776	S	S	*	*			trans	-86.5	107.2	172.6	26	-16.7	0	0	0	109.6	Q66	Q66-P68 WeakPolarHBondContact O-CD 3.41Å
69	V	25.7	Very low	26	Very low	128 Å²	128	147.7 Å²	147.7	78%	0.776	78%	0.78	S	S	*	*			trans	-89	107.8	169.7	179.8	0	0	0	0	109.1	V67	V67-V69 HydrophobicContact CG1-CG2 4.15Å; V67-V69 PolarHBondContact O-N 3.3Å
70	Q	24.6	Very low	26.1	Very low	189 Å²	189	147.5 Å²	147.5	88%	0.883	78%	0.782	S	S	*	*			trans	-135.1	129.9	154.1	-75.3	-162.5	-23.7	0	0	109.9
71	S	30.6	Very low	26.4	Very low	106 Å²	106	147.5 Å²	147.5	74%	0.741	79%	0.787	S	S	*	*			trans	-68.4	147.2	176.2	179.5	0	0	0	0	110.7	Y73	S71-Y73 PolarHBondContact OG-N 3.3Å
72	P	33.3	Very low	26.6	Very low	109 Å²	109	145.9 Å²	145.9	71%	0.708	79%	0.792	S	S	*	*				-142.1	118.2	119	34.3	-20.1	0	0	0	113.7
73	Y	26	Very low	26.4	Very low	228 Å²	228	144.3 Å²	144.3	89%	0.894	80%	0.798	S	S	*	*			trans	-142.4	122	140.6	-90.6	-68.9	0	0	0	110	S71	S71-Y73 PolarHBondContact OG-N 3.3Å
74	S	25.6	Very low	27	Very low	101 Å²	101	143.3 Å²	143.3	71%	0.706	79%	0.789	S	S	*	*			trans	-90.6	143.9	171.3	55.5	0	0	0	0	110.5
75	N	25.2	Very low	27	Very low	148 Å²	148	143.9 Å²	143.9	79%	0.791	79%	0.793	S	S	*	*				168.3	124.6	130	-84.5	-5.7	0	0	0	110.6
76	I	26.8	Very low	28.2	Very low	160 Å²	160	137 Å²	137	82%	0.821	78%	0.78	S	S	*	*				174.7	144.2	126.6	-89.4	157.8	0	0	0	107.6
77	D	25.7	Very low	28.2	Very low	141 Å²	141	134.1 Å²	134.1	75%	0.754	78%	0.779	S	S	*	*			trans	-78.6	152.8	-164.1	-46.1	-95.3	0	0	0	114.5
78	F	26.8	Very low	29.4	Very low	219 Å²	219	133.3 Å²	133.3	96%	0.961	78%	0.776	S	S	*	*			trans	-141.7	120.8	146.8	-94.5	-76.5	0	0	0	109.8
79	D	26.5	Very low	29.5	Very low	144 Å²	144	133.3 Å²	133.3	77%	0.77	77%	0.774	S	S	*	*			trans	-109.4	164.8	172.7	-179.8	35.7	0	0	0	110.5
80	S	26.6	Very low	29.7	Very low	89 Å²	89	135.2 Å²	135.2	62%	0.622	78%	0.778	S	S	*	*			trans	70.6	98.5	159.4	73	0	0	0	0	117.8
81	S	29.8	Very low	30	Very low	123 Å²	123	132 Å²	132	86%	0.86	77%	0.767	S	S	*	*				145.7	153.4	92.9	62.6	0	0	0	0	115.4
82	G	27.8	Very low	30	Very low	73 Å²	73	137.9 Å²	137.9	75%	0.753	77%	0.772	S	S	*	*			trans	82.2	82.7	133.7	0	0	0	0	0	120.6
83	L	24.9	Very low	30	Very low	169 Å²	169	139.9 Å²	139.9	89%	0.885	78%	0.777	S	S	*	*			trans	-63	168.1	141.9	-72.7	166.3	0	0	0	110.5
84	P	34.4	Very low	31.3	Very low	93 Å²	93	134.3 Å²	134.3	60%	0.604	77%	0.769	S	S	*	*			cis	-144.2	168.8	-30.6	36.7	-18.4	0	0	0	116.1
85	T	27	Very low	31.7	Very low	130 Å²	130	134.5 Å²	134.5	80%	0.798	77%	0.77	S	S	*	*			trans	63.7	172.2	146.8	48.5	0	0	0	0	121
86	P	47.8	Very low	32.2	Very low	105 Å²	105	135.3 Å²	135.3	68%	0.682	77%	0.774	S	S	*	*			cis	-137.8	-171	-35.5	34.7	-15.1	0	0	0	115.6
87	S	26.8	Very low	32.6	Very low	108 Å²	108	136 Å²	136	76%	0.755	77%	0.774	S	S	*	*			trans	86	160.2	147.8	-64.6	0	0	0	0	120.3
88	P	49.2	Very low	32.8	Very low	111 Å²	111	136.2 Å²	136.2	72%	0.721	77%	0.772	S	S	*	*			cis	-137.4	152.3	-10.4	24.9	-1.1	0	0	0	118.7
89	V	28.7	Very low	33	Very low	126 Å²	126	133 Å²	133	76%	0.764	76%	0.762	S	S	*	*			trans	59.5	128.3	132.4	179.1	0	0	0	0	122.8
90	I	30.4	Very low	33.3	Very low	168 Å²	168	130.1 Å²	130.1	86%	0.862	76%	0.758	S	S	*	*				-156.4	108	115.9	-93	156.5	0	0	0	111.6
91	D	30.6	Very low	33.4	Very low	121 Å²	121	136.9 Å²	136.9	65%	0.647	77%	0.77	S	S	*	*			trans	4.4	128.1	147.1	-166.6	37.2	0	0	0	122.8
92	R	30.1	Very low	33.2	Very low	229 Å²	229	139.8 Å²	139.8	86%	0.864	77%	0.772	S	S	*	*				-179.6	153.9	109.3	-95.5	-178.8	-175.6	-162.1	0.5	116.6
93	D	34	Very low	33.1	Very low	151 Å²	151	140 Å²	140	81%	0.807	78%	0.775	S	S	*	*			trans	-144.7	-175.2	179.8	-154.3	32.3	0	0	0	107
94	P	52.7	Low	33.2	Very low	112 Å²	112	135.7 Å²	135.7	73%	0.727	77%	0.77	S	S	*	*			cis	-134.5	-147.3	-2.4	45.8	-26	0	0	0	113.9
95	S	33.5	Very low	32.8	Very low	104 Å²	104	136 Å²	136	73%	0.727	78%	0.781	S	S	*	*			trans	-138.6	175.8	178.9	61.4	0	0	0	0	114.1
96	L	36.4	Very low	32.9	Very low	166 Å²	166	134.2 Å²	134.2	87%	0.869	77%	0.774	S	S	*	*			trans	78.8	116.2	170.7	-78.4	160.9	0	0	0	121.2
97	E	34.4	Very low	32	Very low	174 Å²	174	135.6 Å²	135.6	81%	0.813	78%	0.775	S	S	*	*				-172.2	168.1	116.2	-91.1	-150.5	130.8	0	0	107.6
98	M	30.8	Very low	32.1	Very low	146 Å²	146	137.9 Å²	137.9	72%	0.719	77%	0.774	S	S	*	*			cis	-161	133.9	31.5	178.5	-173.8	159.6	0	0	112.6
99	M	29.8	Very low	31.1	Very low	151 Å²	151	138.7 Å²	138.7	74%	0.744	77%	0.772	S	S	*	*			trans	42.2	160.8	150.4	-56.4	-174.7	-162.2	0	0	124.4
100	A	32.6	Very low	31.2	Very low	84 Å²	84	138.2 Å²	138.2	69%	0.694	77%	0.774	S	S	*	*			cis	-176.6	162.8	-34	0	0	0	0	0	112.9
101	R	30	Very low	31.4	Very low	230 Å²	230	139 Å²	139	87%	0.868	77%	0.774	S	S	*	*			trans	85.8	121.7	150.6	-76.3	-178.8	180	-169.6	-0.1	124
102	M	26.1	Very low	31.3	Very low	185 Å²	185	139 Å²	139	91%	0.911	77%	0.774	S	S	*	*			trans	67.7	141.2	149.8	-56	-166	-52.4	0	0	119.6
103	G	25.9	Very low	31.7	Very low	78 Å²	78	137.9 Å²	137.9	80%	0.804	77%	0.77	S	S	*	*			cis	168.7	161.3	-7	0	0	0	0	0	113.7
104	G	25.8	Very low	31.5	Very low	77 Å²	77	136.5 Å²	136.5	79%	0.794	77%	0.772	S	S	*	*			trans	92.2	136.8	-176.1	0	0	0	0	0	112.8
105	A	27.3	Very low	30.8	Very low	101 Å²	101	135.7 Å²	135.7	84%	0.835	78%	0.775	S	S	*	*			cis	78	136	34	0	0	0	0	0	114.3
106	S	29.1	Very low	31	Very low	91 Å²	91	136.3 Å²	136.3	64%	0.636	78%	0.776	S	S	*	*			cis	-168.2	174.6	-13.9	51.3	0	0	0	0	111.2
107	D	27.4	Very low	31	Very low	134 Å²	134	134 Å²	134	72%	0.717	77%	0.771	S	S	*	*			trans	74	144.8	148.3	-53.7	-39.5	0	0	0	124.8
108	H	29.6	Very low	31.3	Very low	157 Å²	157	131.7 Å²	131.7	73%	0.727	77%	0.772	S	S	*	*			trans	70.8	119.9	144.1	-79.1	-61.6	0	0	0	125.1
109	D	28.8	Very low	31.3	Very low	128 Å²	128	129.2 Å²	129.2	68%	0.684	77%	0.774	S	S	*	*				84.6	116.5	124.3	-66.5	-3.7	0	0	0	125.7
110	S	29.8	Very low	31.6	Very low	115 Å²	115	128.2 Å²	128.2	80%	0.804	78%	0.779	S	S	*	*				89.1	167.7	125.4	73.6	0	0	0	0	122
111	E	35.1	Very low	31.7	Very low	185 Å²	185	129.2 Å²	129.2	86%	0.864	79%	0.787	S	S	*	*			trans	-57.9	168.8	-173.2	-54.7	171.3	133.5	0	0	112.8
112	D	29	Very low	31.7	Very low	121 Å²	121	123.5 Å²	123.5	65%	0.647	78%	0.783	S	S	*	*			cis	-157.6	-172.1	34	-171.7	21.1	0	0	0	111.8
113	R	37.7	Very low	32	Very low	206 Å²	206	125.5 Å²	125.5	78%	0.777	78%	0.78	S	S	*	*			trans	-53.5	147.8	177.5	-52.5	135.8	176.9	150.7	-5.1	114.5
114	S	30	Very low	32.4	Very low	121 Å²	121	131.7 Å²	131.7	85%	0.846	79%	0.785	S	S	*	*				166.3	161.3	106.5	50.7	0	0	0	0	111.2
115	A	38.7	Very low	32.7	Very low	95 Å²	95	135.1 Å²	135.1	79%	0.785	78%	0.784	S	S	*	*			trans	-93.6	141.1	-169.8	0	0	0	0	0	113.6
116	P	35.8	Very low	33.1	Very low	117 Å²	117	139.3 Å²	139.3	76%	0.76	79%	0.786	S	S	*	*			trans	-88	151.4	161.1	34.4	-31.4	0	0	0	112.2
117	P	36.4	Very low	33.6	Very low	118 Å²	118	143.7 Å²	143.7	77%	0.766	80%	0.797	S	S	*	*			trans	-88.3	-170.4	178.7	41.7	-39.6	0	0	0	111.6
118	P	42.2	Very low	34.5	Very low	126 Å²	126	142.2 Å²	142.2	82%	0.818	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-79.3	153.7	-148.4	33.3	-37.7	0	0	0	116.2
119	A	30.6	Very low	35.6	Very low	94 Å²	94	137.9 Å²	137.9	78%	0.777	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-90.1	153.6	170.5	0	0	0	0	0	112.1
120	P	36.1	Very low	36.9	Very low	129 Å²	129	132 Å²	132	84%	0.838	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-87.2	165.7	-169.8	35.7	-37.3	0	0	0	114.2
121	A	33.7	Very low	38.5	Very low	106 Å²	106	129.6 Å²	129.6	88%	0.876	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-85.7	126.5	176.1	0	0	0	0	0	112.8
122	S	30.7	Very low	40.4	Very low	110 Å²	110	121.1 Å²	121.1	77%	0.769	68%	0.684	S	S	*	*			trans	-148.7	124.9	157.1	61.1	0	0	0	0	111.2
123	R	33.2	Very low	42.6	Very low	226 Å²	226	117.1 Å²	117.1	85%	0.853	67%	0.666	S	S	*	*			trans	-26.4	129.4	174	-65.4	168.8	166	122.4	-5.7	115.4
124	F	34	Very low	44.7	Very low	208 Å²	208	109 Å²	109	91%	0.912	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-101.2	140.2	131.8	-85.4	-86.7	0	0	0	108.3
125	L	31.6	Very low	47.4	Very low	149 Å²	149	103.8 Å²	103.8	78%	0.78	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-85	125	177.8	-66.1	160.2	0	0	0	108
126	H	35	Very low	49.3	Very low	189 Å²	189	100.3 Å²	100.3	88%	0.875	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-77.5	127	150.3	-95.7	-82.8	0	0	0	107	D128	H126-D128 PolarHBondContact O-N 3.29Å
127	E	39.8	Very low	51.7	Low	183 Å²	183	96.3 Å²	96.3	86%	0.855	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-68.2	116.8	166.3	-69.5	176.7	119.1	0	0	108.1	S129	E127-S129 VanDerWaalsContact C-N 3.29Å; E127-S129 PolarHBondContact O-N 3.11Å
128	D	47.5	Very low	54.1	Low	103 Å²	103	90.7 Å²	90.7	55%	0.551	52%	0.517	S	S	*	.			trans	-76.2	82.7	178.9	-171	28	0	0	0	109	H126 G130 G160	H126-D128 PolarHBondContact O-N 3.29Å; D128-G130 PolarHBondContact O-N 3.42Å; D128-G130 VanDerWaalsContact O-N 3.11Å; D128-G160 WeakPolarHBondContact OD1-CA 3.37Å
129	S	52.4	Low	56	Low	67 Å²	67	89.9 Å²	89.9	47%	0.469	51%	0.505	S	S	.	.			trans	-65.7	-16.9	-165.1	65	0	0	0	0	114.4	E127 I131 T212	E127-S129 VanDerWaalsContact C-N 3.29Å; E127-S129 PolarHBondContact O-N 3.11Å; S129-I131 PolarHBondContact O-N 2.82Å; S129-I131 VanDerWaalsContact O-N 3.11Å; S129-T212 PolarHBondContact O-OG1 3.01Å
130	G	56	Low	58.3	Low	3 Å²	3	88 Å²	88	3%	0.031	48%	0.484	C	S	.	.			trans	70	0.2	178	0	0	0	0	0	115.6	D128 R211 T212	D128-G130 PolarHBondContact O-N 3.42Å; D128-G130 VanDerWaalsContact O-N 3.11Å; G130-R211 PolarHBondContact O-N 2.87Å; G130-T212 WeakPolarHBondContact CA-OG1 3.43Å; G130-T212 PolarHBondContact O-OG1 2.89Å
131	I	62.8	Low	60	Low	65 Å²	65	86.3 Å²	86.3	33%	0.333	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-92.6	129.7	179.4	-60.7	-177.2	0	0	0	108.8	S129 T212 F214	S129-I131 PolarHBondContact O-N 2.82Å; S129-I131 VanDerWaalsContact O-N 3.11Å; I131-T212 WeakPolarHBondContact CG1-OG1 3.36Å; I131-T212 PolarHBondContact N-OG1 3.31Å; I131-F214 WeakPolarHBondContact CG2-O 3.44Å
132	P	74.8	Confident	61.4	Low	7 Å²	7	85.2 Å²	85.2	5%	0.045	45%	0.451	C	S	.	.	P	Polyproline II helix	trans	-68.8	157.4	179.2	-17.1	32.7	0	0	0	112.4	P155 V163 A208 G215	P132-P155 HydrophobicContact CB-CG 4.24Å; P132-V163 HydrophobicContact CB-CG2 4.03Å; P132-V163 HydrophobicContact CG-CG2 4.12Å; P132-A208 HydrophobicContact CB-CB 3.86Å; P132-A208 HydrophobicContact CG-CB 4.08Å; P132-G215 WeakPolarHBondContact O-CA 3.34Å
133	S	76.6	Confident	63.1	Low	38 Å²	38	81.8 Å²	81.8	27%	0.266	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-67.4	167.4	163.2	71.9	0	0	0	0	110.9	P155	S133-P155 VanDerWaalsContact O-CB 3.32Å; S133-P155 WeakPolarHBondContact O-CB 3.4Å; S133-P155 VanDerWaalsContact O-CG 3.29Å; S133-P155 WeakPolarHBondContact O-CG 3.42Å; S133-P155 WeakPolarHBondContact OG-CB 3.15Å
134	A	80.6	Confident	64.5	Low	36 Å²	36	71.9 Å²	71.9	30%	0.298	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-57.5	142.6	176.8	0	0	0	0	0	112.2	P216	A134-P216 VanDerWaalsContact CA-O 3.24Å; A134-P216 WeakPolarHBondContact CA-O 3.32Å; A134-P216 HydrophobicContact CB-CG 4.22Å; A134-P216 VanDerWaalsContact CB-O 3.27Å; A134-P216 WeakPolarHBondContact CB-O 3.43Å
135	P	86.1	Confident	65.7	Low	10 Å²	10	67 Å²	67	7%	0.065	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-58.8	166.8	165.5	-24.9	35.8	0	0	0	113.1	Y166 V206 A208	P135-Y166 HydrophobicContact CG-CD1 4.14Å; P135-Y166 HydrophobicContact CG-CE1 4.25Å; P135-V206 HydrophobicContact CB-CB 4.45Å; P135-V206 HydrophobicContact CB-CG1 4.44Å; P135-V206 WeakPolarHBondContact CD-O 3.41Å; P135-V206 HydrophobicContact CG-CB 4.4Å; P135-V206 HydrophobicContact CG-CG1 4.15Å; P135-V206 WeakPolarHBondContact CG-O 3.27Å; P135-A208 HydrophobicContact CG-CB 3.84Å
136	G	79.7	Confident	67.1	Low	23 Å²	23	60.7 Å²	60.7	24%	0.237	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-58	156.3	160.9	0	0	0	0	0	111.4	S153 S218	G136-S153 PolarHBondContact N-O 2.98Å; G136-S218 WeakPolarHBondContact O-CB 3.31Å
137	V	86.9	Confident	68.8	Low	32 Å²	32	54.1 Å²	54.1	19%	0.194	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-58.9	134.9	172.5	-178.9	0	0	0	0	108.9	D139 N219	V137-D139 PolarHBondContact O-N 2.77Å; V137-N219 HydrophobicContact CG2-CB 3.96Å
138	P	86.6	Confident	70.6	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.006	28%	0.279	C	S	.	.			trans	-68.2	114.1	171.8	26.3	-33.1	0	0	0	109.8	V150 V151 F204 V206 S218 S221	P138-V150 HydrophobicContact CB-CB 4.12Å; P138-V150 HydrophobicContact CB-CG1 4.37Å; P138-V151 WeakPolarHBondContact CA-O 3.46Å; P138-F204 HydrophobicContact CB-CB 4.44Å; P138-F204 HydrophobicContact CG-CB 4.02Å; P138-F204 WeakPolarHBondContact CG-O 3.48Å; P138-V206 HydrophobicContact CB-CG2 3.96Å; P138-V206 HydrophobicContact CG-CG2 4.05Å; P138-S218 WeakPolarHBondContact CD-OG 3.46Å; P138-S221 VanDerWaalsContact O-CB 3.29Å; P138-S221 WeakPolarHBondContact O-CB 3.45Å
139	D	81.8	Confident	72.2	Confident	108 Å²	108	41.4 Å²	41.4	58%	0.578	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92	135.5	171.8	-72.2	-43.7	0	0	0	109	V137 V150 V151	V137-D139 PolarHBondContact O-N 2.77Å; D139-V150 CarbonylContact O-C 3.5Å; D139-V150 WeakPolarHBondContact O-CA 3.44Å; D139-V151 PolarHBondContact N-O 2.69Å; D139-V151 PolarHBondContact O-N 2.91Å
140	V	78.6	Confident	73.6	Confident	56 Å²	56	38.2 Å²	38.2	34%	0.339	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	124.5	174.4	174.2	0	0	0	0	109.4	D142 A143 V148 V150 V224	V140-D142 WeakPolarHBondContact CG1-O 3.35Å; V140-A143 HydrophobicContact CG1-CB 4.19Å; V140-V148 HydrophobicContact CB-CG1 4.3Å; V140-V148 HydrophobicContact CG1-CG1 3.72Å; V140-V148 HydrophobicContact CG2-CG1 3.64Å; V140-V150 HydrophobicContact CG2-CG1 3.86Å; V140-V224 HydrophobicContact CG1-CG1 4.43Å; V140-V224 HydrophobicContact CG2-CB 4.37Å; V140-V224 HydrophobicContact CG2-CG1 3.89Å; V140-V224 HydrophobicContact CG2-CG2 3.51Å
141	V	72.1	Confident	75	Confident	92 Å²	92	40.5 Å²	40.5	56%	0.558	25%	0.25	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-103.5	-21.1	176.7	-60.8	0	0	0	0	113.2	T149 V151	V141-T149 HydrophobicContact CG2-CG2 3.72Å; V141-T149 WeakPolarHBondContact CG2-O 3.33Å; V141-T149 PolarHBondContact N-O 2.93Å; V141-V151 HydrophobicContact CB-CG2 4.32Å; V141-V151 HydrophobicContact CG1-CB 3.91Å; V141-V151 HydrophobicContact CG1-CG2 3.6Å; V141-V151 HydrophobicContact CG2-CG2 3.72Å
142	D	62.1	Low	76.2	Confident	84 Å²	84	37.7 Å²	37.7	45%	0.449	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	146.3	175	-171.9	20	0	0	0	110.5	V140 V148 T149	V140-D142 WeakPolarHBondContact CG1-O 3.35Å; D142-V148 CarbonylContact O-C 3.44Å; D142-V148 WeakPolarHBondContact O-CA 3.34Å; D142-T149 PolarHBondContact N-O 2.83Å; D142-T149 PolarHBondContact O-N 3.15Å
143	A	66.8	Low	76.6	Confident	37 Å²	37	41 Å²	41	31%	0.306	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	98.4	-178.8	0	0	0	0	0	110.3	V140 E147 V148	V140-A143 HydrophobicContact CG1-CB 4.19Å; A143-E147 CarbonylContact C-O 3.58Å; A143-V148 HydrophobicContact CB-CG2 4.39Å
144	G	61.9	Low	76.7	Confident	18 Å²	18	41.6 Å²	41.6	19%	0.186	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	-179	177	0	0	0	0	0	112.7	G146 E147	G144-G146 PolarHBondContact O-N 2.96Å; G144-G146 VanDerWaalsContact O-N 3.1Å; G144-E147 PolarHBondContact N-O 3.18Å; G144-E147 PolarHBondContact O-N 2.94Å; G144-E147 VanDerWaalsContact O-O 3.07Å
145	I	61	Low	76.6	Confident	106 Å²	106	40.9 Å²	40.9	54%	0.544	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	109.3	177.6	-60.4	171.3	0	0	0	108.8	E147 P227	I145-E147 VanDerWaalsContact C-N 3.32Å; I145-E147 PolarHBondContact O-N 2.8Å; I145-P227 WeakPolarHBondContact CA-O 3.43Å; I145-P227 HydrophobicContact CG1-CB 4.09Å
146	G	59.3	Low	75.3	Confident	17 Å²	17	48.6 Å²	48.6	18%	0.175	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.4	17.8	-177.2	0	0	0	0	0	115.1	G144 T195 N196 L197	G144-G146 PolarHBondContact O-N 2.96Å; G144-G146 VanDerWaalsContact O-N 3.1Å; G146-T195 CarbonylContact O-C 3.5Å; G146-N196 PolarHBondContact O-N 3.03Å; G146-L197 WeakPolarHBondContact CA-O 3.49Å; G146-L197 PolarHBondContact O-N 3.23Å
147	E	72.1	Confident	74.2	Confident	50 Å²	50	53.7 Å²	53.7	23%	0.234	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	146.5	176.8	60.4	178	176.2	0	0	113.3	A143 G144 I145 R193 V194 T195	A143-E147 CarbonylContact C-O 3.58Å; G144-E147 PolarHBondContact N-O 3.18Å; G144-E147 PolarHBondContact O-N 2.94Å; G144-E147 VanDerWaalsContact O-O 3.07Å; I145-E147 VanDerWaalsContact C-N 3.32Å; I145-E147 PolarHBondContact O-N 2.8Å; E147-R193 IonicContact OE1-CZ 3.77Å; E147-R193 IonicContact OE1-NH2 2.79Å; E147-R193 PolarHBondContact OE1-NH2 3Å; E147-R193 IonicContact OE2-CZ 3.3Å; E147-R193 IonicContact OE2-NE 3.77Å; E147-R193 PolarHBondContact OE2-NE 2.79Å; E147-R193 IonicContact OE2-NH2 3.66Å; E147-R193 PolarHBondContact OE2-NH2 3.39Å; E147-V194 CarbonylContact C-O 3.51Å; E147-V194 VanDerWaalsContact CA-O 3.24Å; E147-V194 WeakPolarHBondContact CA-O 3.36Å; E147-V194 WeakPolarHBondContact CB-O 3.01Å; E147-T195 HydrophobicContact CB-CG2 3.97Å
148	V	76.4	Confident	72.5	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	125.4	-179.9	176.6	0	0	0	0	109	V140 D142 A143 V150 V194 L197 F204 V224 I226	V140-V148 HydrophobicContact CB-CG1 4.3Å; V140-V148 HydrophobicContact CG1-CG1 3.72Å; V140-V148 HydrophobicContact CG2-CG1 3.64Å; D142-V148 CarbonylContact O-C 3.44Å; D142-V148 WeakPolarHBondContact O-CA 3.34Å; A143-V148 HydrophobicContact CB-CG2 4.39Å; V148-V150 HydrophobicContact CG1-CG1 4.14Å; V148-V194 PolarHBondContact N-O 2.91Å; V148-V194 WeakPolarHBondContact O-CB 3.4Å; V148-V194 PolarHBondContact O-N 3.19Å; V148-L197 HydrophobicContact CB-CD1 3.85Å; V148-L197 HydrophobicContact CG2-CD1 3.63Å; V148-F204 HydrophobicContact CB-CE2 4.13Å; V148-F204 HydrophobicContact CB-CZ 4.16Å; V148-F204 HydrophobicContact CG1-CE2 3.78Å; V148-F204 HydrophobicContact CG1-CZ 4.29Å; V148-F204 HydrophobicContact CG2-CE2 4.49Å; V148-V224 HydrophobicContact CG1-CG1 4.13Å; V148-V224 HydrophobicContact CG2-CG1 3.94Å; V148-I226 HydrophobicContact CG2-CD1 4.32Å; V148-I226 HydrophobicContact CG2-CG1 4.35Å
149	T	81.1	Confident	70.5	Confident	20 Å²	20	60.7 Å²	60.7	12%	0.123	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	121	170.7	-51.3	0	0	0	0	109.5	V141 D142 C192 R193	V141-T149 HydrophobicContact CG2-CG2 3.72Å; V141-T149 WeakPolarHBondContact CG2-O 3.33Å; V141-T149 PolarHBondContact N-O 2.93Å; D142-T149 PolarHBondContact N-O 2.83Å; D142-T149 PolarHBondContact O-N 3.15Å; T149-C192 WeakPolarHBondContact CA-O 3.37Å; T149-R193 HydrophobicContact CG2-CB 4.32Å
150	V	82.8	Confident	69	Low	0 Å²	0	57.5 Å²	57.5	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	147.2	174	-70	0	0	0	0	111.6	P138 D139 V140 V148 W152 I168 T191 C192 F204	P138-V150 HydrophobicContact CB-CB 4.12Å; P138-V150 HydrophobicContact CB-CG1 4.37Å; D139-V150 CarbonylContact O-C 3.5Å; D139-V150 WeakPolarHBondContact O-CA 3.44Å; V140-V150 HydrophobicContact CG2-CG1 3.86Å; V148-V150 HydrophobicContact CG1-CG1 4.14Å; V150-W152 HydrophobicContact CG2-CE3 4.41Å; V150-W152 HydrophobicContact CG2-CZ3 4.17Å; V150-I168 HydrophobicContact CG2-CD1 3.43Å; V150-I168 VanDerWaalsContact CG2-CD1 3.43Å; V150-T191 WeakPolarHBondContact O-CA 3.46Å; V150-T191 PolarHBondContact O-OG1 3.06Å; V150-C192 HydrophobicContact CG2-CB 4.33Å; V150-C192 PolarHBondContact N-O 2.99Å; V150-C192 PolarHBondContact O-N 3.29Å; V150-F204 HydrophobicContact CG1-CB 4.4Å; V150-F204 HydrophobicContact CG1-CD2 3.81Å; V150-F204 HydrophobicContact CG1-CE2 4.34Å; V150-F204 HydrophobicContact CG1-CG 4.12Å
151	V	84.3	Confident	67.7	Low	51 Å²	51	55 Å²	55	31%	0.309	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	138.4	172.6	176.6	0	0	0	0	108.1	P138 D139 V141 T190	P138-V151 WeakPolarHBondContact CA-O 3.46Å; D139-V151 PolarHBondContact N-O 2.69Å; D139-V151 PolarHBondContact O-N 2.91Å; V141-V151 HydrophobicContact CB-CG2 4.32Å; V141-V151 HydrophobicContact CG1-CB 3.91Å; V141-V151 HydrophobicContact CG1-CG2 3.6Å; V141-V151 HydrophobicContact CG2-CG2 3.72Å; V151-T190 WeakPolarHBondContact CA-O 3.42Å
152	W	89.4	Confident	67.2	Low	5 Å²	5	58 Å²	58	2%	0.019	35%	0.345	C	S	.	.			trans	-124	168.4	173.3	57.2	95.4	0	0	0	110.6	V150 Y166 L187 D189 T190 C192 V206	V150-W152 HydrophobicContact CG2-CE3 4.41Å; V150-W152 HydrophobicContact CG2-CZ3 4.17Å; W152-Y166 AromaticContact CD1-CD1 3.96Å; W152-Y166 AromaticContact CD1-CE1 3.96Å; W152-Y166 AromaticContact CE2-CG 3.81Å; W152-Y166 AromaticContact CZ2-CD2 3.97Å; W152-Y166 HydrophobicContact CZ2-CD2 3.97Å; W152-Y166 AromaticContact CZ2-CG 3.83Å; W152-Y166 HydrophobicContact CZ2-CG 3.83Å; W152-Y166 AromaticContact NE1-CD1 3.21Å; W152-Y166 AromaticContact NE1-CD2 3.54Å; W152-Y166 AromaticContact NE1-CE1 3.48Å; W152-Y166 AromaticContact NE1-CE2 3.83Å; W152-Y166 AromaticContact NE1-CG 3.26Å; W152-Y166 VanDerWaalsContact NE1-CG 3.26Å; W152-Y166 AromaticContact NE1-CZ 3.81Å; W152-L187 HydrophobicContact CH2-CD1 3.93Å; W152-D189 WeakPolarHBondContact CZ2-O 3.35Å; W152-T190 VanDerWaalsContact CE2-CA 3.5Å; W152-T190 PolarHBondContact N-O 3.17Å; W152-T190 WeakPolarHBondContact O-CB 3.46Å; W152-T190 PolarHBondContact O-OG1 3.28Å; W152-C192 HydrophobicContact CH2-CB 3.86Å; W152-C192 HydrophobicContact CZ3-CB 3.74Å; W152-V206 HydrophobicContact CD2-CB 4.35Å; W152-V206 HydrophobicContact CD2-CG1 3.91Å; W152-V206 HydrophobicContact CD2-CG2 3.87Å; W152-V206 HydrophobicContact CE3-CG2 3.8Å; W152-V206 HydrophobicContact CG-CB 4.37Å; W152-V206 HydrophobicContact CG-CG1 4.12Å; W152-V206 HydrophobicContact CG-CG2 4.21Å; W152-V206 HydrophobicContact CZ2-CG1 4.18Å; W152-V206 HydrophobicContact CZ3-CG2 4.32Å
153	S	82.9	Confident	67.6	Low	78 Å²	78	56 Å²	56	55%	0.545	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-95.3	145.4	169.7	-62.7	0	0	0	0	110.6	G136	G136-S153 PolarHBondContact N-O 2.98Å
154	A	78.3	Confident	67.8	Low	50 Å²	50	59.2 Å²	59.2	41%	0.413	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-60.1	154.2	169.2	0	0	0	0	0	111.6	Y166	A154-Y166 WeakPolarHBondContact CA-OH 3.22Å; A154-Y166 WeakPolarHBondContact CB-OH 3.36Å
155	P	78.2	Confident	68.5	Low	20 Å²	20	58.4 Å²	58.4	13%	0.13	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-60.2	136.3	178.2	-23.1	34.5	0	0	0	112.9	P132 S133 Q157 V163 A208	P132-P155 HydrophobicContact CB-CG 4.24Å; S133-P155 VanDerWaalsContact O-CB 3.32Å; S133-P155 WeakPolarHBondContact O-CB 3.4Å; S133-P155 VanDerWaalsContact O-CG 3.29Å; S133-P155 WeakPolarHBondContact O-CG 3.42Å; S133-P155 WeakPolarHBondContact OG-CB 3.15Å; P155-Q157 PolarHBondContact O-N 3.43Å; P155-V163 HydrophobicContact CG-CG2 4.04Å; P155-A208 HydrophobicContact CG-CB 3.69Å
156	L	58.7	Low	69.5	Low	173 Å²	173	54 Å²	54	91%	0.906	31%	0.309	S	S	*	.	S	Bend	trans	-78.5	-11.7	-172.8	-72.4	169.5	0	0	0	115.1
157	Q	56.9	Low	70.8	Confident	129 Å²	129	55.9 Å²	55.9	60%	0.603	31%	0.313	S	S	*	.			trans	-134	105.6	175.3	-74.8	-173.8	-48.2	0	0	111.1	P155 N159	P155-Q157 PolarHBondContact O-N 3.43Å; Q157-N159 PolarHBondContact O-N 3.3Å; Q157-N159 VanDerWaalsContact O-N 3.16Å
158	S	51.9	Low	71.5	Confident	93 Å²	93	53.6 Å²	53.6	65%	0.65	30%	0.302	S	S	*	.			trans	-78.7	84.6	165.2	42.4	0	0	0	0	110	G160 G161	S158-G160 VanDerWaalsContact C-N 3.26Å; S158-G160 PolarHBondContact O-N 2.87Å; S158-G161 WeakPolarHBondContact CB-O 3.2Å
159	N	44.7	Very low	72	Confident	87 Å²	87	54.6 Å²	54.6	47%	0.465	31%	0.307	S	S	.	.	S	Bend	trans	-70.2	84.1	170	-64.1	-18.4	0	0	0	108.9	Q157 G161	Q157-N159 PolarHBondContact O-N 3.3Å; Q157-N159 VanDerWaalsContact O-N 3.16Å; N159-G161 PolarHBondContact O-N 2.88Å
160	G	48.8	Very low	72.3	Confident	41 Å²	41	54.6 Å²	54.6	42%	0.423	31%	0.306	S	S	.	.	S	Bend	trans	69.4	-20.3	177.3	0	0	0	0	0	117.1	D128 S158 R211	D128-G160 WeakPolarHBondContact OD1-CA 3.37Å; S158-G160 VanDerWaalsContact C-N 3.26Å; S158-G160 PolarHBondContact O-N 2.87Å; G160-R211 PolarHBondContact O-NH1 3Å; G160-R211 PolarHBondContact O-NH2 2.81Å
161	G	53.2	Low	72.3	Confident	5 Å²	5	57.2 Å²	57.2	5%	0.052	32%	0.316	C	S	.	.			trans	-100.8	131.5	-179	0	0	0	0	0	114.4	S158 N159	S158-G161 WeakPolarHBondContact CB-O 3.2Å; N159-G161 PolarHBondContact O-N 2.88Å
162	E	60.3	Low	72.1	Confident	153 Å²	153	59.2 Å²	59.2	72%	0.715	32%	0.322	S	S	*	.			trans	-72.6	142	159.7	-179.2	174.6	-145.3	0	0	109.7	R164	E162-R164 PolarHBondContact O-N 3.16Å
163	V	70.1	Confident	71.5	Confident	44 Å²	44	62.8 Å²	62.8	27%	0.267	34%	0.338	S	S	.	.			trans	-83.5	113.2	177.6	-179.6	0	0	0	0	108.8	P132 P155 Y166 A208	P132-V163 HydrophobicContact CB-CG2 4.03Å; P132-V163 HydrophobicContact CG-CG2 4.12Å; P155-V163 HydrophobicContact CG-CG2 4.04Å; V163-Y166 HydrophobicContact CG1-CE1 3.9Å; V163-Y166 HydrophobicContact CG1-CE2 4.23Å; V163-A208 HydrophobicContact CG1-CB 3.95Å
164	R	70.6	Confident	70.2	Confident	104 Å²	104	62.4 Å²	62.4	39%	0.392	33%	0.333	S	S	.	.			trans	-84.5	-14.1	-175.6	-68.9	179.8	165.8	176.2	-13	113.6	E162 Y209 G210	E162-R164 PolarHBondContact O-N 3.16Å; R164-Y209 HydrophobicContact CB-CD1 4.26Å; R164-Y209 PolarHBondContact N-O 2.85Å; R164-G210 WeakPolarHBondContact CD-O 3.19Å
165	G	76.8	Confident	69.9	Low	1 Å²	1	67.1 Å²	67.1	1%	0.01	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	161.6	-167.5	172	0	0	0	0	0	112.4	L187 Y209	G165-L187 CarbonylContact C-O 3.53Å; G165-L187 WeakPolarHBondContact CA-O 3.27Å; G165-Y209 PolarHBondContact O-N 2.83Å
166	Y	82.3	Confident	69.6	Low	14 Å²	14	67.1 Å²	67.1	6%	0.055	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	151	-172.1	-56.7	-84.9	0	0	0	111.8	P135 W152 A154 V163 L187 T190 V206 S207 A208	P135-Y166 HydrophobicContact CG-CD1 4.14Å; P135-Y166 HydrophobicContact CG-CE1 4.25Å; W152-Y166 AromaticContact CD1-CD1 3.96Å; W152-Y166 AromaticContact CD1-CE1 3.96Å; W152-Y166 AromaticContact CE2-CG 3.81Å; W152-Y166 AromaticContact CZ2-CD2 3.97Å; W152-Y166 HydrophobicContact CZ2-CD2 3.97Å; W152-Y166 AromaticContact CZ2-CG 3.83Å; W152-Y166 HydrophobicContact CZ2-CG 3.83Å; W152-Y166 AromaticContact NE1-CD1 3.21Å; W152-Y166 AromaticContact NE1-CD2 3.54Å; W152-Y166 AromaticContact NE1-CE1 3.48Å; W152-Y166 AromaticContact NE1-CE2 3.83Å; W152-Y166 AromaticContact NE1-CG 3.26Å; W152-Y166 VanDerWaalsContact NE1-CG 3.26Å; W152-Y166 AromaticContact NE1-CZ 3.81Å; A154-Y166 WeakPolarHBondContact CA-OH 3.22Å; A154-Y166 WeakPolarHBondContact CB-OH 3.36Å; V163-Y166 HydrophobicContact CG1-CE1 3.9Å; V163-Y166 HydrophobicContact CG1-CE2 4.23Å; Y166-L187 WeakPolarHBondContact CD2-O 3.17Å; Y166-L187 PolarHBondContact N-O 3.35Å; Y166-L187 WeakPolarHBondContact O-CB 3.33Å; Y166-L187 PolarHBondContact O-N 2.81Å; Y166-T190 HydrophobicContact CE2-CG2 3.71Å; Y166-V206 HydrophobicContact CD1-CG1 4.06Å; Y166-V206 HydrophobicContact CG-CG1 4.35Å; Y166-S207 CarbonylContact C-O 3.52Å; Y166-S207 WeakPolarHBondContact CA-O 3.44Å; Y166-A208 HydrophobicContact CD1-CB 3.95Å; Y166-A208 HydrophobicContact CE1-CB 3.87Å
167	Q	87.9	Confident	70.3	Confident	55 Å²	55	66.6 Å²	66.6	26%	0.257	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	130.9	168.9	178.6	178.6	16.8	0	0	108.3	S180 V206 S207 F214	Q167-S180 PolarHBondContact NE2-OG 2.9Å; Q167-V206 WeakPolarHBondContact O-CA 3.44Å; Q167-V206 WeakPolarHBondContact O-CG1 3.42Å; Q167-S207 PolarHBondContact N-O 3.27Å; Q167-S207 PolarHBondContact O-N 2.92Å; Q167-F214 HydrophobicContact CB-CD1 4.35Å; Q167-F214 HydrophobicContact CB-CE1 3.6Å; Q167-F214 HydrophobicContact CB-CZ 4.19Å; Q167-F214 HydrophobicContact CG-CE1 4.47Å
168	I	85.9	Confident	71.3	Confident	2 Å²	2	63 Å²	63	1%	0.01	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	132.4	175.6	-179	177.2	0	0	0	109.9	V150 M181 L187 C192 V194 F204 V206	V150-I168 HydrophobicContact CG2-CD1 3.43Å; V150-I168 VanDerWaalsContact CG2-CD1 3.43Å; I168-M181 HydrophobicContact CG2-CB 3.92Å; I168-M181 HydrophobicContact CG2-CG 3.94Å; I168-M181 PolarHBondContact O-N 2.7Å; I168-L187 HydrophobicContact CG2-CD1 3.81Å; I168-C192 HydrophobicContact CD1-CB 4.37Å; I168-V194 HydrophobicContact CD1-CG2 3.81Å; I168-F204 HydrophobicContact CD1-CD1 4Å; I168-F204 HydrophobicContact CG1-CD1 4.41Å; I168-V206 HydrophobicContact CB-CG2 4.36Å; I168-V206 HydrophobicContact CG1-CG2 4.25Å
169	E	87.5	Confident	72.2	Confident	22 Å²	22	64.9 Å²	64.9	10%	0.103	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	145.1	175.5	-60.5	167.5	94.7	0	0	109.3	W178 E179 F204 R205	E169-W178 HydrophobicContact CB-CE3 4.03Å; E169-E179 CarbonylContact C-O 3.5Å; E169-E179 VanDerWaalsContact CA-O 3.22Å; E169-E179 WeakPolarHBondContact CA-O 3.28Å; E169-F204 CarbonylContact O-C 3.57Å; E169-F204 VanDerWaalsContact O-CA 3.31Å; E169-F204 WeakPolarHBondContact O-CA 3.48Å; E169-R205 HydrophobicContact CB-CG 3.88Å; E169-R205 VanDerWaalsContact CD-NE 3.31Å; E169-R205 VanDerWaalsContact CD-NH2 3.34Å; E169-R205 PolarHBondContact N-O 2.92Å; E169-R205 PolarHBondContact O-N 3.49Å; E169-R205 IonicContact OE1-CZ 2.78Å; E169-R205 IonicContact OE1-NE 3.15Å; E169-R205 PolarHBondContact OE1-NE 2.99Å; E169-R205 IonicContact OE1-NH2 2.65Å; E169-R205 PolarHBondContact OE1-NH2 3.16Å; E169-R205 IonicContact OE2-CZ 3.27Å; E169-R205 IonicContact OE2-NE 2.99Å; E169-R205 PolarHBondContact OE2-NE 3.01Å; E169-R205 IonicContact OE2-NH2 2.7Å; E169-R205 PolarHBondContact OE2-NH2 2.81Å
170	M	86	Confident	73.6	Confident	20 Å²	20	63.3 Å²	63.3	10%	0.099	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	152.9	179.1	-177.2	-169.3	73.7	0	0	109.4	E179 M181 L197 V202 Q203 F204	M170-E179 PolarHBondContact N-O 3.49Å; M170-E179 PolarHBondContact O-N 3.04Å; M170-M181 HydrophobicContact CB-CG 4.49Å; M170-M181 HydrophobicContact CB-SD 3.72Å; M170-M181 HydrophobicContact CE-SD 4.37Å; M170-M181 HydrophobicContact SD-SD 4.1Å; M170-L197 HydrophobicContact CE-CD2 4.28Å; M170-L197 HydrophobicContact SD-CD2 3.26Å; M170-L197 WeakPolarHBondContact SD-CD2 3.31Å; M170-V202 HydrophobicContact CG-CB 4.35Å; M170-V202 HydrophobicContact SD-CG1 4.36Å; M170-Q203 CarbonylContact C-O 3.56Å; M170-Q203 VanDerWaalsContact CA-O 3.31Å; M170-Q203 WeakPolarHBondContact CA-O 3.26Å; M170-F204 HydrophobicContact CB-CD1 3.89Å; M170-F204 HydrophobicContact CB-CE1 3.86Å; M170-F204 HydrophobicContact CG-CD1 3.93Å; M170-F204 HydrophobicContact CG-CE1 3.53Å; M170-F204 HydrophobicContact CG-CZ 4.22Å; M170-F204 HydrophobicContact SD-CE1 3.91Å; M170-F204 HydrophobicContact SD-CZ 4.35Å
171	R	83.5	Confident	74.3	Confident	54 Å²	54	63.6 Å²	63.6	20%	0.204	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	161.2	159.3	66	165.4	179.9	162.8	10.5	112.2	P174 G176 E177 W178 V202 Q203	R171-P174 PolarHBondContact NH1-O 3.39Å; R171-G176 WeakPolarHBondContact CD-O 3.17Å; R171-G176 PolarHBondContact NH1-O 2.96Å; R171-E177 WeakPolarHBondContact CB-O 3.35Å; R171-W178 HydrophobicContact CB-CD2 4.06Å; R171-W178 HydrophobicContact CB-CE3 4.06Å; R171-W178 HydrophobicContact CB-CG 4.45Å; R171-W178 HydrophobicContact CB-CZ3 4.4Å; R171-W178 VanDerWaalsContact CD-CE2 3.48Å; R171-W178 HydrophobicContact CG-CD2 3.94Å; R171-W178 HydrophobicContact CG-CE3 3.98Å; R171-W178 HydrophobicContact CG-CH2 3.82Å; R171-W178 HydrophobicContact CG-CZ2 3.74Å; R171-W178 HydrophobicContact CG-CZ3 3.91Å; R171-V202 CarbonylContact O-C 3.56Å; R171-V202 VanDerWaalsContact O-CA 3.28Å; R171-V202 WeakPolarHBondContact O-CA 3.38Å; R171-V202 WeakPolarHBondContact O-CB 3.35Å; R171-Q203 HydrophobicContact CG-CB 4.06Å; R171-Q203 PolarHBondContact N-O 2.93Å; R171-Q203 VanDerWaalsContact NE-OE1 3.09Å; R171-Q203 PolarHBondContact O-N 3.07Å
172	E	81.1	Confident	74.1	Confident	93 Å²	93	65.9 Å²	65.9	44%	0.435	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	150.4	163.5	-54.8	-158.1	-171.1	0	0	111	G176 S199	E172-G176 VanDerWaalsContact O-CA 3.29Å; E172-G176 WeakPolarHBondContact O-CA 3.46Å; E172-G176 PolarHBondContact O-N 3.44Å; E172-S199 VanDerWaalsContact OE2-CB 3.24Å; E172-S199 WeakPolarHBondContact OE2-CB 3.5Å; E172-S199 PolarHBondContact OE2-OG 3.18Å
173	F	75.2	Confident	73.4	Confident	81 Å²	81	62.1 Å²	62.1	36%	0.355	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	138.5	-179.5	-176.2	-95.4	0	0	0	110.7	E201 Q203 P223	F173-E201 HydrophobicContact CB-CB 4.47Å; F173-E201 HydrophobicContact CB-CG 4.14Å; F173-E201 WeakPolarHBondContact CB-O 2.98Å; F173-E201 HydrophobicContact CD1-CG 4.01Å; F173-E201 HydrophobicContact CG-CG 4.41Å; F173-E201 PolarHBondContact N-O 3.27Å; F173-Q203 HydrophobicContact CB-CG 4.47Å; F173-Q203 HydrophobicContact CD2-CG 4.06Å; F173-P223 HydrophobicContact CB-CB 4.37Å; F173-P223 HydrophobicContact CD1-CB 3.89Å; F173-P223 HydrophobicContact CD1-CG 3.97Å; F173-P223 HydrophobicContact CD2-CB 4.14Å; F173-P223 HydrophobicContact CD2-CG 3.64Å; F173-P223 HydrophobicContact CE1-CB 4.22Å; F173-P223 HydrophobicContact CE1-CG 3.9Å; F173-P223 HydrophobicContact CE2-CB 4.47Å; F173-P223 HydrophobicContact CE2-CG 3.57Å; F173-P223 HydrophobicContact CG-CB 3.85Å; F173-P223 HydrophobicContact CG-CG 3.85Å; F173-P223 HydrophobicContact CZ-CG 3.72Å
174	P	57.3	Low	72	Confident	69 Å²	69	67 Å²	67	45%	0.448	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	cis	-86.6	-29.7	6.3	30.9	-32.3	0	0	0	115.8	R171	R171-P174 PolarHBondContact NH1-O 3.39Å
175	D	70.1	Confident	71	Confident	150 Å²	150	69.3 Å²	69.3	80%	0.802	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.2	14.1	-158.6	-58	-37	0	0	0	114.4
176	G	72.5	Confident	70.8	Confident	20 Å²	20	71.9 Å²	71.9	21%	0.206	38%	0.378	C	S	.	.			trans	-72	149.4	178.7	0	0	0	0	0	113.8	R171 E172	R171-G176 WeakPolarHBondContact CD-O 3.17Å; R171-G176 PolarHBondContact NH1-O 2.96Å; E172-G176 VanDerWaalsContact O-CA 3.29Å; E172-G176 WeakPolarHBondContact O-CA 3.46Å; E172-G176 PolarHBondContact O-N 3.44Å
177	E	73.1	Confident	70.3	Confident	162 Å²	162	72.9 Å²	72.9	76%	0.757	38%	0.384	S	S	*	.			trans	-79.2	159.3	168.4	-76.9	-63.3	170.4	0	0	112	R171 E179	R171-E177 WeakPolarHBondContact CB-O 3.35Å; E177-E179 PolarHBondContact O-N 3.05Å
178	W	78.9	Confident	69.3	Low	52 Å²	52	78.1 Å²	78.1	20%	0.197	41%	0.406	C	S	.	.			trans	-86.1	110.1	-178.6	-71.2	94.2	0	0	0	111.9	E169 R171 Q203 R205 P220	E169-W178 HydrophobicContact CB-CE3 4.03Å; R171-W178 HydrophobicContact CB-CD2 4.06Å; R171-W178 HydrophobicContact CB-CE3 4.06Å; R171-W178 HydrophobicContact CB-CG 4.45Å; R171-W178 HydrophobicContact CB-CZ3 4.4Å; R171-W178 VanDerWaalsContact CD-CE2 3.48Å; R171-W178 HydrophobicContact CG-CD2 3.94Å; R171-W178 HydrophobicContact CG-CE3 3.98Å; R171-W178 HydrophobicContact CG-CH2 3.82Å; R171-W178 HydrophobicContact CG-CZ2 3.74Å; R171-W178 HydrophobicContact CG-CZ3 3.91Å; W178-Q203 HydrophobicContact CH2-CB 3.92Å; W178-Q203 WeakPolarHBondContact CZ3-O 3.4Å; W178-R205 HydrophobicContact CD2-CG 4.29Å; W178-R205 HydrophobicContact CE3-CG 3.71Å; W178-R205 VanDerWaalsContact CG-CZ 3.47Å; W178-R205 HydrophobicContact CH2-CB 3.96Å; W178-R205 HydrophobicContact CH2-CG 4.01Å; W178-R205 HydrophobicContact CZ3-CB 3.88Å; W178-R205 HydrophobicContact CZ3-CG 3.57Å; W178-P220 HydrophobicContact CH2-CB 3.86Å; W178-P220 HydrophobicContact CH2-CG 3.97Å; W178-P220 HydrophobicContact CZ2-CB 3.95Å; W178-P220 HydrophobicContact CZ2-CG 3.61Å
179	E	71.3	Confident	68.5	Low	134 Å²	134	83.6 Å²	83.6	63%	0.626	44%	0.435	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.9	137.9	172.8	-63	-165.9	168.9	0	0	110.8	E169 M170 E177	E169-E179 CarbonylContact C-O 3.5Å; E169-E179 VanDerWaalsContact CA-O 3.22Å; E169-E179 WeakPolarHBondContact CA-O 3.28Å; M170-E179 PolarHBondContact N-O 3.49Å; M170-E179 PolarHBondContact O-N 3.04Å; E177-E179 PolarHBondContact O-N 3.05Å
180	S	73.7	Confident	68.3	Low	53 Å²	53	85.1 Å²	85.1	37%	0.371	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	131.1	168.2	-67.7	0	0	0	0	110.1	Q167 G182	Q167-S180 PolarHBondContact NE2-OG 2.9Å; S180-G182 PolarHBondContact O-N 3.31Å
181	M	63.2	Low	67.7	Low	47 Å²	47	87.3 Å²	87.3	23%	0.232	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-62.9	122.1	167.4	-60.4	-55	-46.2	0	0	107.9	I168 M170 V183 V194	I168-M181 HydrophobicContact CG2-CB 3.92Å; I168-M181 HydrophobicContact CG2-CG 3.94Å; I168-M181 PolarHBondContact O-N 2.7Å; M170-M181 HydrophobicContact CB-CG 4.49Å; M170-M181 HydrophobicContact CB-SD 3.72Å; M170-M181 HydrophobicContact CE-SD 4.37Å; M170-M181 HydrophobicContact SD-SD 4.1Å; M181-V183 VanDerWaalsContact C-N 3.33Å; M181-V183 PolarHBondContact O-N 2.95Å; M181-V194 HydrophobicContact CE-CG1 3.66Å; M181-V194 HydrophobicContact CG-CG1 4.45Å; M181-V194 HydrophobicContact SD-CG1 3.9Å
182	G	47.9	Very low	67.4	Low	54 Å²	54	85.9 Å²	85.9	56%	0.557	46%	0.458	S	S	*	.			trans	-69.2	82.3	-170.6	0	0	0	0	0	113.5	S180	S180-G182 PolarHBondContact O-N 3.31Å
183	V	46.2	Very low	67.3	Low	74 Å²	74	87.9 Å²	87.9	45%	0.448	46%	0.462	S	S	.	.			trans	-111.7	117.7	167.4	-162.2	0	0	0	0	106.8	M181 H185 L187	M181-V183 VanDerWaalsContact C-N 3.33Å; M181-V183 PolarHBondContact O-N 2.95Å; V183-H185 WeakPolarHBondContact CG1-O 3.21Å; V183-H185 PolarHBondContact O-N 2.77Å; V183-L187 HydrophobicContact CG1-CD2 4.29Å; V183-L187 HydrophobicContact CG2-CD2 4.36Å
184	D	41.7	Very low	67.1	Low	145 Å²	145	84.3 Å²	84.3	78%	0.775	45%	0.447	S	S	*	.	S	Bend	trans	-68	-4.6	-178.8	-60.9	-39	0	0	0	113.2
185	H	50.1	Low	67.5	Low	154 Å²	154	83.5 Å²	83.5	71%	0.713	44%	0.441	S	S	*	.	S	Bend	trans	-135.8	150.5	-177.2	-53.8	-30.4	0	0	0	110.6	V183	V183-H185 WeakPolarHBondContact CG1-O 3.21Å; V183-H185 PolarHBondContact O-N 2.77Å
186	L	71.2	Confident	67	Low	54 Å²	54	78.5 Å²	78.5	28%	0.283	41%	0.414	S	S	.	.			trans	-67.1	134.2	177.6	-64.7	164.6	0	0	0	111.5	K188 Y209 F214	L186-K188 PolarHBondContact O-N 3.37Å; L186-Y209 HydrophobicContact CD1-CD1 3.44Å; L186-Y209 VanDerWaalsContact CD1-CD1 3.44Å; L186-Y209 HydrophobicContact CD1-CD2 4.25Å; L186-Y209 HydrophobicContact CD1-CE1 4.08Å; L186-Y209 HydrophobicContact CD1-CG 3.55Å; L186-Y209 HydrophobicContact CD2-CD2 4.41Å; L186-Y209 HydrophobicContact CD2-CG 4.12Å; L186-F214 HydrophobicContact CD2-CE1 3.52Å; L186-F214 HydrophobicContact CD2-CZ 3.67Å
187	L	71.9	Confident	66.7	Low	36 Å²	36	78.1 Å²	78.1	19%	0.188	41%	0.407	C	S	.	.	B	Isolated β-bridge	trans	-67.5	123.2	173.8	-61.1	175.6	0	0	0	109.3	W152 G165 Y166 I168 V183 C192	W152-L187 HydrophobicContact CH2-CD1 3.93Å; G165-L187 CarbonylContact C-O 3.53Å; G165-L187 WeakPolarHBondContact CA-O 3.27Å; Y166-L187 WeakPolarHBondContact CD2-O 3.17Å; Y166-L187 PolarHBondContact N-O 3.35Å; Y166-L187 WeakPolarHBondContact O-CB 3.33Å; Y166-L187 PolarHBondContact O-N 2.81Å; I168-L187 HydrophobicContact CG2-CD1 3.81Å; V183-L187 HydrophobicContact CG1-CD2 4.29Å; V183-L187 HydrophobicContact CG2-CD2 4.36Å; L187-C192 HydrophobicContact CD1-CB 4Å
188	K	67.8	Low	65.8	Low	165 Å²	165	74.5 Å²	74.5	72%	0.717	40%	0.396	S	S	*	.			trans	-84.7	-32.4	-179.7	-65.3	-178.3	-179.5	177.2	0	112.2	L186	L186-K188 PolarHBondContact O-N 3.37Å
189	D	69.1	Low	65.1	Low	117 Å²	117	73 Å²	73	63%	0.626	39%	0.394	S	S	*	.	S	Bend	trans	-78.8	158.6	174.7	-60	-62.6	0	0	0	112.6	W152 T191	W152-D189 WeakPolarHBondContact CZ2-O 3.35Å; D189-T191 VanDerWaalsContact C-N 3.27Å; D189-T191 HydrophobicContact CB-CG2 4.13Å; D189-T191 PolarHBondContact O-N 3.48Å
190	T	83.2	Confident	64.7	Low	53 Å²	53	72.5 Å²	72.5	33%	0.325	39%	0.391	S	S	.	.	S	Bend	trans	-92.8	28.3	174.4	67.4	0	0	0	0	113.5	V151 W152 Y166	V151-T190 WeakPolarHBondContact CA-O 3.42Å; W152-T190 VanDerWaalsContact CE2-CA 3.5Å; W152-T190 PolarHBondContact N-O 3.17Å; W152-T190 WeakPolarHBondContact O-CB 3.46Å; W152-T190 PolarHBondContact O-OG1 3.28Å; Y166-T190 HydrophobicContact CE2-CG2 3.71Å
191	T	73.6	Confident	64.9	Low	67 Å²	67	72.2 Å²	72.2	41%	0.411	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	144.6	179.4	-178.5	0	0	0	0	110.3	V150 D189	V150-T191 WeakPolarHBondContact O-CA 3.46Å; V150-T191 PolarHBondContact O-OG1 3.06Å; D189-T191 VanDerWaalsContact C-N 3.27Å; D189-T191 HydrophobicContact CB-CG2 4.13Å; D189-T191 PolarHBondContact O-N 3.48Å
192	C	77.4	Confident	65.9	Low	23 Å²	23	70 Å²	70	16%	0.155	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	130.9	176.4	-170.9	0	0	0	0	110.9	T149 V150 W152 I168 L187	T149-C192 WeakPolarHBondContact CA-O 3.37Å; V150-C192 HydrophobicContact CG2-CB 4.33Å; V150-C192 PolarHBondContact N-O 2.99Å; V150-C192 PolarHBondContact O-N 3.29Å; W152-C192 HydrophobicContact CH2-CB 3.86Å; W152-C192 HydrophobicContact CZ3-CB 3.74Å; I168-C192 HydrophobicContact CD1-CB 4.37Å; L187-C192 HydrophobicContact CD1-CB 4Å
193	R	77.2	Confident	67.8	Low	135 Å²	135	68.3 Å²	68.3	51%	0.509	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	100.9	169.7	-178.5	171.2	177.2	151.8	-5	109.3	E147 T149 T195	E147-R193 IonicContact OE1-CZ 3.77Å; E147-R193 IonicContact OE1-NH2 2.79Å; E147-R193 PolarHBondContact OE1-NH2 3Å; E147-R193 IonicContact OE2-CZ 3.3Å; E147-R193 IonicContact OE2-NE 3.77Å; E147-R193 PolarHBondContact OE2-NE 2.79Å; E147-R193 IonicContact OE2-NH2 3.66Å; E147-R193 PolarHBondContact OE2-NH2 3.39Å; T149-R193 HydrophobicContact CG2-CB 4.32Å; R193-T195 HydrophobicContact CG-CG2 3.96Å
194	V	71.3	Confident	69.9	Low	6 Å²	6	64.8 Å²	64.8	4%	0.036	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	133.3	174.2	-169.9	0	0	0	0	108.5	E147 V148 I168 M181 L197 F204	E147-V194 CarbonylContact C-O 3.51Å; E147-V194 VanDerWaalsContact CA-O 3.24Å; E147-V194 WeakPolarHBondContact CA-O 3.36Å; E147-V194 WeakPolarHBondContact CB-O 3.01Å; V148-V194 PolarHBondContact N-O 2.91Å; V148-V194 WeakPolarHBondContact O-CB 3.4Å; V148-V194 PolarHBondContact O-N 3.19Å; I168-V194 HydrophobicContact CD1-CG2 3.81Å; M181-V194 HydrophobicContact CE-CG1 3.66Å; M181-V194 HydrophobicContact CG-CG1 4.45Å; M181-V194 HydrophobicContact SD-CG1 3.9Å; V194-L197 HydrophobicContact CB-CD1 4.36Å; V194-L197 HydrophobicContact CG1-CD1 4.15Å; V194-L197 HydrophobicContact CG1-CD2 3.7Å; V194-L197 HydrophobicContact CG1-CG 4.09Å; V194-F204 HydrophobicContact CB-CE1 4.22Å; V194-F204 HydrophobicContact CB-CZ 4.46Å; V194-F204 HydrophobicContact CG1-CE1 4.12Å; V194-F204 HydrophobicContact CG2-CD1 4.4Å; V194-F204 HydrophobicContact CG2-CE1 3.87Å; V194-F204 HydrophobicContact CG2-CZ 4.43Å
195	T	67.1	Low	72.3	Confident	53 Å²	53	60.7 Å²	60.7	33%	0.325	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	170.2	-175.3	63.2	0	0	0	0	111.5	G146 E147 R193 L197	G146-T195 CarbonylContact O-C 3.5Å; E147-T195 HydrophobicContact CB-CG2 3.97Å; R193-T195 HydrophobicContact CG-CG2 3.96Å; T195-L197 VanDerWaalsContact C-N 3.3Å; T195-L197 PolarHBondContact O-N 2.82Å
196	N	58	Low	74.1	Confident	45 Å²	45	53.4 Å²	53.4	24%	0.241	27%	0.269	C	S	.	.			trans	62.9	28.7	-177.1	-48.1	-43.1	0	0	0	114	G146 M328 S329	G146-N196 PolarHBondContact O-N 3.03Å; N196-M328 VanDerWaalsContact O-CE 3.29Å; N196-M328 WeakPolarHBondContact O-CE 3.45Å; N196-S329 PolarHBondContact ND2-OG 3.44Å; N196-S329 VanDerWaalsContact ND2-OG 3.15Å
197	L	66.2	Low	74.9	Confident	12 Å²	12	51.2 Å²	51.2	6%	0.063	26%	0.259	C	S	.	.			trans	-73.7	125.4	-177.7	-63.7	170.7	0	0	0	112	G146 V148 M170 V194 T195 F204 I226	G146-L197 WeakPolarHBondContact CA-O 3.49Å; G146-L197 PolarHBondContact O-N 3.23Å; V148-L197 HydrophobicContact CB-CD1 3.85Å; V148-L197 HydrophobicContact CG2-CD1 3.63Å; M170-L197 HydrophobicContact CE-CD2 4.28Å; M170-L197 HydrophobicContact SD-CD2 3.26Å; M170-L197 WeakPolarHBondContact SD-CD2 3.31Å; V194-L197 HydrophobicContact CB-CD1 4.36Å; V194-L197 HydrophobicContact CG1-CD1 4.15Å; V194-L197 HydrophobicContact CG1-CD2 3.7Å; V194-L197 HydrophobicContact CG1-CG 4.09Å; T195-L197 VanDerWaalsContact C-N 3.3Å; T195-L197 PolarHBondContact O-N 2.82Å; L197-F204 HydrophobicContact CD1-CZ 4.19Å; L197-I226 HydrophobicContact CB-CD1 3.43Å; L197-I226 VanDerWaalsContact CB-CD1 3.43Å; L197-I226 HydrophobicContact CD1-CD1 3.63Å; L197-I226 HydrophobicContact CG-CD1 4.09Å
198	T	56	Low	75.4	Confident	85 Å²	85	49.5 Å²	49.5	52%	0.521	25%	0.25	S	C	.	.			trans	-101.4	-22.6	-175.9	47.8	0	0	0	0	115.1	M328	T198-M328 HydrophobicContact CG2-SD 3.67Å; T198-M328 PolarHBondContact OG1-SD 2.94Å
199	S	62.8	Low	76	Confident	22 Å²	22	44.8 Å²	44.8	15%	0.154	23%	0.228	C	C	.	.			trans	-83.3	153	-176.6	-164.2	0	0	0	0	112.8	E172 I226	E172-S199 VanDerWaalsContact OE2-CB 3.24Å; E172-S199 WeakPolarHBondContact OE2-CB 3.5Å; E172-S199 PolarHBondContact OE2-OG 3.18Å; S199-I226 WeakPolarHBondContact O-CD1 3.48Å
200	H	63.3	Low	76.2	Confident	122 Å²	122	39.2 Å²	39.2	57%	0.565	20%	0.198	S	C	*	.	S	Bend	trans	-78.1	-25.3	-177.8	-63.7	-34	0	0	0	113.8	K225 I226 I228	H200-K225 WeakPolarHBondContact O-CA 3.39Å; H200-I226 PolarHBondContact O-N 3.12Å; H200-I228 WeakPolarHBondContact CE1-CD1 3.35Å; H200-I228 WeakPolarHBondContact ND1-CD1 3.23Å
201	E	77.9	Confident	75.2	Confident	47 Å²	47	43 Å²	43	22%	0.22	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	117.7	-178.6	-166.9	159.9	-156.4	0	0	110.5	F173 P223 V224 K225	F173-E201 HydrophobicContact CB-CB 4.47Å; F173-E201 HydrophobicContact CB-CG 4.14Å; F173-E201 WeakPolarHBondContact CB-O 2.98Å; F173-E201 HydrophobicContact CD1-CG 4.01Å; F173-E201 HydrophobicContact CG-CG 4.41Å; F173-E201 PolarHBondContact N-O 3.27Å; E201-P223 HydrophobicContact CG-CB 3.67Å; E201-P223 WeakPolarHBondContact OE1-CB 3.3Å; E201-V224 WeakPolarHBondContact CA-O 3.44Å; E201-K225 HydrophobicContact CB-CG 4.48Å; E201-K225 HydrophobicContact CG-CG 4.04Å; E201-K225 WeakPolarHBondContact OE1-CE 3.33Å; E201-K225 IonicContact OE1-NZ 2.74Å; E201-K225 WeakPolarHBondContact OE2-CE 3.45Å; E201-K225 IonicContact OE2-NZ 3.57Å; E201-K225 PolarHBondContact OE2-NZ 3.12Å
202	V	83.6	Confident	74.3	Confident	1 Å²	1	44 Å²	44	1%	0.006	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	161.3	-173.5	-62.6	0	0	0	0	112.5	M170 R171 F204 P223 V224 I226	M170-V202 HydrophobicContact CG-CB 4.35Å; M170-V202 HydrophobicContact SD-CG1 4.36Å; R171-V202 CarbonylContact O-C 3.56Å; R171-V202 VanDerWaalsContact O-CA 3.28Å; R171-V202 WeakPolarHBondContact O-CA 3.38Å; R171-V202 WeakPolarHBondContact O-CB 3.35Å; V202-F204 HydrophobicContact CG2-CE2 3.62Å; V202-F204 HydrophobicContact CG2-CZ 3.68Å; V202-P223 CarbonylContact O-C 3.5Å; V202-P223 WeakPolarHBondContact O-CA 3.29Å; V202-V224 HydrophobicContact CG2-CB 4.07Å; V202-V224 PolarHBondContact N-O 3.49Å; V202-V224 VanDerWaalsContact N-O 3.09Å; V202-V224 PolarHBondContact O-N 2.86Å; V202-I226 HydrophobicContact CG1-CD1 4.28Å; V202-I226 HydrophobicContact CG2-CD1 3.96Å; V202-I226 HydrophobicContact CG2-CG1 4.33Å
203	Q	88.4	Confident	73.7	Confident	18 Å²	18	43.6 Å²	43.6	8%	0.084	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	148.8	168.6	-68.7	-172.2	-68.7	0	0	111.1	M170 R171 F173 W178 S221 P223	M170-Q203 CarbonylContact C-O 3.56Å; M170-Q203 VanDerWaalsContact CA-O 3.31Å; M170-Q203 WeakPolarHBondContact CA-O 3.26Å; R171-Q203 HydrophobicContact CG-CB 4.06Å; R171-Q203 PolarHBondContact N-O 2.93Å; R171-Q203 VanDerWaalsContact NE-OE1 3.09Å; R171-Q203 PolarHBondContact O-N 3.07Å; F173-Q203 HydrophobicContact CB-CG 4.47Å; F173-Q203 HydrophobicContact CD2-CG 4.06Å; W178-Q203 HydrophobicContact CH2-CB 3.92Å; W178-Q203 WeakPolarHBondContact CZ3-O 3.4Å; Q203-S221 PolarHBondContact NE2-O 3.24Å; Q203-P223 HydrophobicContact CG-CB 4.37Å; Q203-P223 HydrophobicContact CG-CG 4.17Å
204	F	90.9	Very high	73.6	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	149.4	176.3	-58.8	-79.1	0	0	0	111.2	P138 V148 V150 I168 E169 M170 V194 L197 V202 P220 S221 V224	P138-F204 HydrophobicContact CB-CB 4.44Å; P138-F204 HydrophobicContact CG-CB 4.02Å; P138-F204 WeakPolarHBondContact CG-O 3.48Å; V148-F204 HydrophobicContact CB-CE2 4.13Å; V148-F204 HydrophobicContact CB-CZ 4.16Å; V148-F204 HydrophobicContact CG1-CE2 3.78Å; V148-F204 HydrophobicContact CG1-CZ 4.29Å; V148-F204 HydrophobicContact CG2-CE2 4.49Å; V150-F204 HydrophobicContact CG1-CB 4.4Å; V150-F204 HydrophobicContact CG1-CD2 3.81Å; V150-F204 HydrophobicContact CG1-CE2 4.34Å; V150-F204 HydrophobicContact CG1-CG 4.12Å; I168-F204 HydrophobicContact CD1-CD1 4Å; I168-F204 HydrophobicContact CG1-CD1 4.41Å; E169-F204 CarbonylContact O-C 3.57Å; E169-F204 VanDerWaalsContact O-CA 3.31Å; E169-F204 WeakPolarHBondContact O-CA 3.48Å; M170-F204 HydrophobicContact CB-CD1 3.89Å; M170-F204 HydrophobicContact CB-CE1 3.86Å; M170-F204 HydrophobicContact CG-CD1 3.93Å; M170-F204 HydrophobicContact CG-CE1 3.53Å; M170-F204 HydrophobicContact CG-CZ 4.22Å; M170-F204 HydrophobicContact SD-CE1 3.91Å; M170-F204 HydrophobicContact SD-CZ 4.35Å; V194-F204 HydrophobicContact CB-CE1 4.22Å; V194-F204 HydrophobicContact CB-CZ 4.46Å; V194-F204 HydrophobicContact CG1-CE1 4.12Å; V194-F204 HydrophobicContact CG2-CD1 4.4Å; V194-F204 HydrophobicContact CG2-CE1 3.87Å; V194-F204 HydrophobicContact CG2-CZ 4.43Å; L197-F204 HydrophobicContact CD1-CZ 4.19Å; V202-F204 HydrophobicContact CG2-CE2 3.62Å; V202-F204 HydrophobicContact CG2-CZ 3.68Å; F204-P220 CarbonylContact O-C 3.59Å; F204-P220 WeakPolarHBondContact O-CA 3.45Å; F204-S221 PolarHBondContact N-OG 3.16Å; F204-S221 PolarHBondContact O-N 2.91Å; F204-V224 HydrophobicContact CD2-CG2 4.13Å; F204-V224 HydrophobicContact CE2-CG2 4.08Å
205	R	90.9	Very high	73.7	Confident	60 Å²	60	41.5 Å²	41.5	23%	0.226	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	158.2	165.4	73.4	-176.2	-168.2	-156	-3.6	109.5	E169 W178 A217 S218	E169-R205 HydrophobicContact CB-CG 3.88Å; E169-R205 VanDerWaalsContact CD-NE 3.31Å; E169-R205 VanDerWaalsContact CD-NH2 3.34Å; E169-R205 PolarHBondContact N-O 2.92Å; E169-R205 PolarHBondContact O-N 3.49Å; E169-R205 IonicContact OE1-CZ 2.78Å; E169-R205 IonicContact OE1-NE 3.15Å; E169-R205 PolarHBondContact OE1-NE 2.99Å; E169-R205 IonicContact OE1-NH2 2.65Å; E169-R205 PolarHBondContact OE1-NH2 3.16Å; E169-R205 IonicContact OE2-CZ 3.27Å; E169-R205 IonicContact OE2-NE 2.99Å; E169-R205 PolarHBondContact OE2-NE 3.01Å; E169-R205 IonicContact OE2-NH2 2.7Å; E169-R205 PolarHBondContact OE2-NH2 2.81Å; W178-R205 HydrophobicContact CD2-CG 4.29Å; W178-R205 HydrophobicContact CE3-CG 3.71Å; W178-R205 VanDerWaalsContact CG-CZ 3.47Å; W178-R205 HydrophobicContact CH2-CB 3.96Å; W178-R205 HydrophobicContact CH2-CG 4.01Å; W178-R205 HydrophobicContact CZ3-CB 3.88Å; W178-R205 HydrophobicContact CZ3-CG 3.57Å; R205-A217 HydrophobicContact CG-CB 4.14Å; R205-S218 WeakPolarHBondContact CA-OG 3.33Å
206	V	89.4	Confident	74.3	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	136.7	-176.6	-175.6	0	0	0	0	110.7	P135 P138 W152 Y166 Q167 I168 S218	P135-V206 HydrophobicContact CB-CB 4.45Å; P135-V206 HydrophobicContact CB-CG1 4.44Å; P135-V206 WeakPolarHBondContact CD-O 3.41Å; P135-V206 HydrophobicContact CG-CB 4.4Å; P135-V206 HydrophobicContact CG-CG1 4.15Å; P135-V206 WeakPolarHBondContact CG-O 3.27Å; P138-V206 HydrophobicContact CB-CG2 3.96Å; P138-V206 HydrophobicContact CG-CG2 4.05Å; W152-V206 HydrophobicContact CD2-CB 4.35Å; W152-V206 HydrophobicContact CD2-CG1 3.91Å; W152-V206 HydrophobicContact CD2-CG2 3.87Å; W152-V206 HydrophobicContact CE3-CG2 3.8Å; W152-V206 HydrophobicContact CG-CB 4.37Å; W152-V206 HydrophobicContact CG-CG1 4.12Å; W152-V206 HydrophobicContact CG-CG2 4.21Å; W152-V206 HydrophobicContact CZ2-CG1 4.18Å; W152-V206 HydrophobicContact CZ3-CG2 4.32Å; Y166-V206 HydrophobicContact CD1-CG1 4.06Å; Y166-V206 HydrophobicContact CG-CG1 4.35Å; Q167-V206 WeakPolarHBondContact O-CA 3.44Å; Q167-V206 WeakPolarHBondContact O-CG1 3.42Å; I168-V206 HydrophobicContact CB-CG2 4.36Å; I168-V206 HydrophobicContact CG1-CG2 4.25Å; V206-S218 PolarHBondContact N-OG 2.79Å; V206-S218 PolarHBondContact O-N 3.28Å
207	S	86.9	Confident	75.6	Confident	9 Å²	9	42.5 Å²	42.5	6%	0.063	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	132.6	176.2	-61	0	0	0	0	109.8	Y166 Q167 A217	Y166-S207 CarbonylContact C-O 3.52Å; Y166-S207 WeakPolarHBondContact CA-O 3.44Å; Q167-S207 PolarHBondContact N-O 3.27Å; Q167-S207 PolarHBondContact O-N 2.92Å; S207-A217 WeakPolarHBondContact OG-CA 3.25Å; S207-A217 WeakPolarHBondContact OG-CB 3.44Å
208	A	81.7	Confident	76.7	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	140.4	175.2	0	0	0	0	0	111	P132 P135 P155 V163 Y166 F214 G215	P132-A208 HydrophobicContact CB-CB 3.86Å; P132-A208 HydrophobicContact CG-CB 4.08Å; P135-A208 HydrophobicContact CG-CB 3.84Å; P155-A208 HydrophobicContact CG-CB 3.69Å; V163-A208 HydrophobicContact CG1-CB 3.95Å; Y166-A208 HydrophobicContact CD1-CB 3.95Å; Y166-A208 HydrophobicContact CE1-CB 3.87Å; A208-F214 CarbonylContact O-C 3.58Å; A208-F214 WeakPolarHBondContact O-CA 3.23Å; A208-G215 PolarHBondContact O-N 3.15Å
209	Y	80.8	Confident	78.1	Confident	65 Å²	65	43.9 Å²	43.9	26%	0.255	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	132.4	175.8	-170.9	-87.9	0	0	0	111	R164 G165 L186 F214	R164-Y209 HydrophobicContact CB-CD1 4.26Å; R164-Y209 PolarHBondContact N-O 2.85Å; G165-Y209 PolarHBondContact O-N 2.83Å; L186-Y209 HydrophobicContact CD1-CD1 3.44Å; L186-Y209 VanDerWaalsContact CD1-CD1 3.44Å; L186-Y209 HydrophobicContact CD1-CD2 4.25Å; L186-Y209 HydrophobicContact CD1-CE1 4.08Å; L186-Y209 HydrophobicContact CD1-CG 3.55Å; L186-Y209 HydrophobicContact CD2-CD2 4.41Å; L186-Y209 HydrophobicContact CD2-CG 4.12Å; Y209-F214 AromaticContact CD2-CD1 3.73Å; Y209-F214 HydrophobicContact CD2-CD1 3.73Å; Y209-F214 AromaticContact CD2-CD2 3.81Å; Y209-F214 HydrophobicContact CD2-CD2 3.81Å; Y209-F214 AromaticContact CD2-CE1 3.65Å; Y209-F214 HydrophobicContact CD2-CE1 3.65Å; Y209-F214 AromaticContact CD2-CE2 3.74Å; Y209-F214 HydrophobicContact CD2-CE2 3.74Å; Y209-F214 AromaticContact CD2-CG 3.81Å; Y209-F214 HydrophobicContact CD2-CG 3.81Å; Y209-F214 AromaticContact CD2-CZ 3.66Å; Y209-F214 HydrophobicContact CD2-CZ 3.66Å; Y209-F214 HydrophobicContact CE2-CD2 4.22Å; Y209-F214 HydrophobicContact CE2-CE2 4.08Å; Y209-F214 HydrophobicContact CE2-CZ 4.33Å; Y209-F214 HydrophobicContact CG-CD1 4.32Å; Y209-F214 HydrophobicContact CG-CE1 4.18Å; Y209-F214 HydrophobicContact CG-CZ 4.49Å
210	G	73.4	Confident	79.2	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.236	C	C	.	.			trans	-115.3	-142	-176.8	0	0	0	0	0	113.9	R164 G213	R164-G210 WeakPolarHBondContact CD-O 3.19Å; G210-G213 PolarHBondContact N-O 3Å
211	R	63.3	Low	80.4	Confident	134 Å²	134	39.8 Å²	39.8	51%	0.506	21%	0.21	S	C	.	.	S	Bend	trans	-80.3	-26.2	-178.9	-171.1	177.7	-70.7	140.4	3.3	112.8	G130 G160	G130-R211 PolarHBondContact O-N 2.87Å; G160-R211 PolarHBondContact O-NH1 3Å; G160-R211 PolarHBondContact O-NH2 2.81Å
212	T	53.9	Low	80.5	Confident	87 Å²	87	44.7 Å²	44.7	53%	0.534	24%	0.237	S	C	.	.	S	Bend	trans	-125.1	-5.8	-169.4	48.5	0	0	0	0	114.5	S129 G130 I131	S129-T212 PolarHBondContact O-OG1 3.01Å; G130-T212 WeakPolarHBondContact CA-OG1 3.43Å; G130-T212 PolarHBondContact O-OG1 2.89Å; I131-T212 WeakPolarHBondContact CG1-OG1 3.36Å; I131-T212 PolarHBondContact N-OG1 3.31Å
213	G	65.9	Low	80.3	Confident	14 Å²	14	46.6 Å²	46.6	14%	0.144	25%	0.249	C	C	.	.	S	Bend	trans	155.3	-168.9	178	0	0	0	0	0	113.9	G210	G210-G213 PolarHBondContact N-O 3Å
214	F	73.6	Confident	79.9	Confident	90 Å²	90	46.5 Å²	46.5	40%	0.395	25%	0.25	S	C	.	.	B	Isolated β-bridge	trans	-75.9	135.3	172.2	-69.2	-76.1	0	0	0	111.7	I131 Q167 L186 A208 Y209	I131-F214 WeakPolarHBondContact CG2-O 3.44Å; Q167-F214 HydrophobicContact CB-CD1 4.35Å; Q167-F214 HydrophobicContact CB-CE1 3.6Å; Q167-F214 HydrophobicContact CB-CZ 4.19Å; Q167-F214 HydrophobicContact CG-CE1 4.47Å; L186-F214 HydrophobicContact CD2-CE1 3.52Å; L186-F214 HydrophobicContact CD2-CZ 3.67Å; A208-F214 CarbonylContact O-C 3.58Å; A208-F214 WeakPolarHBondContact O-CA 3.23Å; Y209-F214 AromaticContact CD2-CD1 3.73Å; Y209-F214 HydrophobicContact CD2-CD1 3.73Å; Y209-F214 AromaticContact CD2-CD2 3.81Å; Y209-F214 HydrophobicContact CD2-CD2 3.81Å; Y209-F214 AromaticContact CD2-CE1 3.65Å; Y209-F214 HydrophobicContact CD2-CE1 3.65Å; Y209-F214 AromaticContact CD2-CE2 3.74Å; Y209-F214 HydrophobicContact CD2-CE2 3.74Å; Y209-F214 AromaticContact CD2-CG 3.81Å; Y209-F214 HydrophobicContact CD2-CG 3.81Å; Y209-F214 AromaticContact CD2-CZ 3.66Å; Y209-F214 HydrophobicContact CD2-CZ 3.66Å; Y209-F214 HydrophobicContact CE2-CD2 4.22Å; Y209-F214 HydrophobicContact CE2-CE2 4.08Å; Y209-F214 HydrophobicContact CE2-CZ 4.33Å; Y209-F214 HydrophobicContact CG-CD1 4.32Å; Y209-F214 HydrophobicContact CG-CE1 4.18Å; Y209-F214 HydrophobicContact CG-CZ 4.49Å
215	G	74.8	Confident	79	Confident	7 Å²	7	53.4 Å²	53.4	7%	0.072	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-74.9	168.8	164.3	0	0	0	0	0	112.7	P132 A208 A217	P132-G215 WeakPolarHBondContact O-CA 3.34Å; A208-G215 PolarHBondContact O-N 3.15Å; G215-A217 PolarHBondContact O-N 3.36Å
216	P	79.3	Confident	78.1	Confident	83 Å²	83	51.2 Å²	51.2	54%	0.539	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-58.3	139.7	176.1	24.3	-32.4	0	0	0	110.3	A134	A134-P216 VanDerWaalsContact CA-O 3.24Å; A134-P216 WeakPolarHBondContact CA-O 3.32Å; A134-P216 HydrophobicContact CB-CG 4.22Å; A134-P216 VanDerWaalsContact CB-O 3.27Å; A134-P216 WeakPolarHBondContact CB-O 3.43Å
217	A	84.3	Confident	76.3	Confident	36 Å²	36	54.1 Å²	54.1	30%	0.298	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-59	150.8	176	0	0	0	0	0	111.6	R205 S207 G215	R205-A217 HydrophobicContact CG-CB 4.14Å; S207-A217 WeakPolarHBondContact OG-CA 3.25Å; S207-A217 WeakPolarHBondContact OG-CB 3.44Å; G215-A217 PolarHBondContact O-N 3.36Å
218	S	89.4	Confident	74.7	Confident	6 Å²	6	58.8 Å²	58.8	4%	0.042	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-56	161.1	167.4	74.7	0	0	0	0	110.8	G136 P138 R205 V206	G136-S218 WeakPolarHBondContact O-CB 3.31Å; P138-S218 WeakPolarHBondContact CD-OG 3.46Å; R205-S218 WeakPolarHBondContact CA-OG 3.33Å; V206-S218 PolarHBondContact N-OG 2.79Å; V206-S218 PolarHBondContact O-N 3.28Å
219	N	85.3	Confident	72.8	Confident	121 Å²	121	60.2 Å²	60.2	65%	0.647	32%	0.324	S	S	*	.	P	Polyproline II helix	trans	-58.5	147.7	159.6	-64.8	-76.4	0	0	0	109	V137	V137-N219 HydrophobicContact CG2-CB 3.96Å
220	P	86.7	Confident	70.9	Confident	54 Å²	54	65.5 Å²	65.5	35%	0.351	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-56.6	150	174.2	-28.4	37.5	0	0	0	112.9	W178 F204	W178-P220 HydrophobicContact CH2-CB 3.86Å; W178-P220 HydrophobicContact CH2-CG 3.97Å; W178-P220 HydrophobicContact CZ2-CB 3.95Å; W178-P220 HydrophobicContact CZ2-CG 3.61Å; F204-P220 CarbonylContact O-C 3.59Å; F204-P220 WeakPolarHBondContact O-CA 3.45Å
221	S	88.6	Confident	69.4	Low	4 Å²	4	70.6 Å²	70.6	3%	0.028	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-57	164.7	164.2	73.1	0	0	0	0	110.8	P138 Q203 F204	P138-S221 VanDerWaalsContact O-CB 3.29Å; P138-S221 WeakPolarHBondContact O-CB 3.45Å; Q203-S221 PolarHBondContact NE2-O 3.24Å; F204-S221 PolarHBondContact N-OG 3.16Å; F204-S221 PolarHBondContact O-N 2.91Å
222	L	79.3	Confident	68.3	Low	150 Å²	150	67.7 Å²	67.7	79%	0.785	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-60.5	151.7	158.8	-65.3	178	0	0	0	109.6	V224	L222-V224 VanDerWaalsContact O-CG2 3.31Å; L222-V224 WeakPolarHBondContact O-CG2 3.36Å; L222-V224 PolarHBondContact O-N 3.18Å
223	P	79.2	Confident	67.7	Low	41 Å²	41	70.2 Å²	70.2	27%	0.266	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-57	129.7	172	-24.5	35.6	0	0	0	111.3	F173 E201 V202 Q203	F173-P223 HydrophobicContact CB-CB 4.37Å; F173-P223 HydrophobicContact CD1-CB 3.89Å; F173-P223 HydrophobicContact CD1-CG 3.97Å; F173-P223 HydrophobicContact CD2-CB 4.14Å; F173-P223 HydrophobicContact CD2-CG 3.64Å; F173-P223 HydrophobicContact CE1-CB 4.22Å; F173-P223 HydrophobicContact CE1-CG 3.9Å; F173-P223 HydrophobicContact CE2-CB 4.47Å; F173-P223 HydrophobicContact CE2-CG 3.57Å; F173-P223 HydrophobicContact CG-CB 3.85Å; F173-P223 HydrophobicContact CG-CG 3.85Å; F173-P223 HydrophobicContact CZ-CG 3.72Å; E201-P223 HydrophobicContact CG-CB 3.67Å; E201-P223 WeakPolarHBondContact OE1-CB 3.3Å; V202-P223 CarbonylContact O-C 3.5Å; V202-P223 WeakPolarHBondContact O-CA 3.29Å; Q203-P223 HydrophobicContact CG-CB 4.37Å; Q203-P223 HydrophobicContact CG-CG 4.17Å
224	V	79.9	Confident	66.4	Low	15 Å²	15	74 Å²	74	9%	0.091	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	108.3	-170.9	-170.2	0	0	0	0	108.3	V140 V148 E201 V202 F204 L222 I226	V140-V224 HydrophobicContact CG1-CG1 4.43Å; V140-V224 HydrophobicContact CG2-CB 4.37Å; V140-V224 HydrophobicContact CG2-CG1 3.89Å; V140-V224 HydrophobicContact CG2-CG2 3.51Å; V148-V224 HydrophobicContact CG1-CG1 4.13Å; V148-V224 HydrophobicContact CG2-CG1 3.94Å; E201-V224 WeakPolarHBondContact CA-O 3.44Å; V202-V224 HydrophobicContact CG2-CB 4.07Å; V202-V224 PolarHBondContact N-O 3.49Å; V202-V224 VanDerWaalsContact N-O 3.09Å; V202-V224 PolarHBondContact O-N 2.86Å; F204-V224 HydrophobicContact CD2-CG2 4.13Å; F204-V224 HydrophobicContact CE2-CG2 4.08Å; L222-V224 VanDerWaalsContact O-CG2 3.31Å; L222-V224 WeakPolarHBondContact O-CG2 3.36Å; L222-V224 PolarHBondContact O-N 3.18Å; V224-I226 PolarHBondContact O-N 2.8Å
225	K	72.8	Confident	64.9	Low	145 Å²	145	74 Å²	74	63%	0.63	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.6	118.3	175.9	-65.1	-165	175.3	-153.6	0	110.2	H200 E201	H200-K225 WeakPolarHBondContact O-CA 3.39Å; E201-K225 HydrophobicContact CB-CG 4.48Å; E201-K225 HydrophobicContact CG-CG 4.04Å; E201-K225 WeakPolarHBondContact OE1-CE 3.33Å; E201-K225 IonicContact OE1-NZ 2.74Å; E201-K225 WeakPolarHBondContact OE2-CE 3.45Å; E201-K225 IonicContact OE2-NZ 3.57Å; E201-K225 PolarHBondContact OE2-NZ 3.12Å
226	I	72.5	Confident	63.5	Low	14 Å²	14	76.9 Å²	76.9	7%	0.072	44%	0.443	C	S	.	.	P	Polyproline II helix	trans	-86.4	126	-177.3	-51.5	-166.6	0	0	0	109	V148 L197 S199 H200 V202 V224 I228	V148-I226 HydrophobicContact CG2-CD1 4.32Å; V148-I226 HydrophobicContact CG2-CG1 4.35Å; L197-I226 HydrophobicContact CB-CD1 3.43Å; L197-I226 VanDerWaalsContact CB-CD1 3.43Å; L197-I226 HydrophobicContact CD1-CD1 3.63Å; L197-I226 HydrophobicContact CG-CD1 4.09Å; S199-I226 WeakPolarHBondContact O-CD1 3.48Å; H200-I226 PolarHBondContact O-N 3.12Å; V202-I226 HydrophobicContact CG1-CD1 4.28Å; V202-I226 HydrophobicContact CG2-CD1 3.96Å; V202-I226 HydrophobicContact CG2-CG1 4.33Å; V224-I226 PolarHBondContact O-N 2.8Å; I226-I228 PolarHBondContact O-N 2.88Å
227	P	50.8	Low	62.2	Low	61 Å²	61	78 Å²	78	40%	0.396	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-58.2	130.8	172.9	-24.7	34.8	0	0	0	111.6	I145	I145-P227 WeakPolarHBondContact CA-O 3.43Å; I145-P227 HydrophobicContact CG1-CB 4.09Å
228	I	52.7	Low	60.8	Low	108 Å²	108	77 Å²	77	55%	0.554	45%	0.453	S	S	*	.			trans	-106.1	143.6	173.8	-31.3	160.8	0	0	0	107.5	H200 I226	H200-I228 WeakPolarHBondContact CE1-CD1 3.35Å; H200-I228 WeakPolarHBondContact ND1-CD1 3.23Å; I226-I228 PolarHBondContact O-N 2.88Å
229	S	43.5	Very low	59.7	Low	30 Å²	30	77.6 Å²	77.6	21%	0.21	46%	0.458	C	S	.	.			trans	-74	128.9	176.2	-157.9	0	0	0	0	111.1	T231 D232	S229-T231 PolarHBondContact O-N 2.95Å; S229-T231 VanDerWaalsContact O-N 3.1Å; S229-T231 PolarHBondContact OG-OG1 3.44Å; S229-D232 VanDerWaalsContact CB-OD2 3.28Å; S229-D232 WeakPolarHBondContact CB-OD2 3.47Å; S229-D232 PolarHBondContact O-N 2.86Å
230	E	39.9	Very low	59.1	Low	175 Å²	175	72 Å²	72	82%	0.818	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-18.3	171.4	-67.7	-171.2	146.7	0	0	112.2	D232	E230-D232 VanDerWaalsContact C-N 3.33Å; E230-D232 PolarHBondContact O-N 3.42Å
231	T	41.5	Very low	58.3	Low	108 Å²	108	73.4 Å²	73.4	66%	0.663	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-28.6	173.6	-16.6	0	0	0	0	113.6	S229	S229-T231 PolarHBondContact O-N 2.95Å; S229-T231 VanDerWaalsContact O-N 3.1Å; S229-T231 PolarHBondContact OG-OG1 3.44Å
232	D	41.6	Very low	57.6	Low	72 Å²	72	75.2 Å²	75.2	39%	0.385	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-78.7	-22	-176.4	-70	-54.6	0	0	0	112.8	S229 E230 A234 T235	S229-D232 VanDerWaalsContact CB-OD2 3.28Å; S229-D232 WeakPolarHBondContact CB-OD2 3.47Å; S229-D232 PolarHBondContact O-N 2.86Å; E230-D232 VanDerWaalsContact C-N 3.33Å; E230-D232 PolarHBondContact O-N 3.42Å; D232-A234 PolarHBondContact O-N 2.89Å; D232-A234 VanDerWaalsContact O-N 3.08Å; D232-T235 PolarHBondContact O-N 3.38Å
233	L	39.8	Very low	57.7	Low	141 Å²	141	68.4 Å²	68.4	74%	0.738	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-64.2	-11	177.2	-79.7	165.9	0	0	0	114.1
234	A	38.2	Very low	57.3	Low	92 Å²	92	67.3 Å²	67.3	76%	0.76	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-88.3	-7.4	-177.5	0	0	0	0	0	114.9	D232	D232-A234 PolarHBondContact O-N 2.89Å; D232-A234 VanDerWaalsContact O-N 3.08Å
235	T	42.7	Very low	57	Low	91 Å²	91	72.3 Å²	72.3	56%	0.558	43%	0.426	S	S	*	.	S	Bend	trans	-119.6	-9.5	-164.6	-37.3	0	0	0	0	114.9	D232	D232-T235 PolarHBondContact O-N 3.38Å
236	S	46	Very low	57.3	Low	67 Å²	67	65.5 Å²	65.5	47%	0.469	40%	0.396	S	S	.	.			trans	-102	15.1	-164.1	52.2	0	0	0	0	116.4	G238	S236-G238 PolarHBondContact O-N 2.92Å
237	A	50.8	Low	57.5	Low	108 Å²	108	68.5 Å²	68.5	89%	0.893	42%	0.415	S	S	*	.	S	Bend	trans	-80.3	60.2	173.5	0	0	0	0	0	112.8
238	G	55.4	Low	58.8	Low	15 Å²	15	68.4 Å²	68.4	16%	0.155	41%	0.413	C	S	.	.	S	Bend	trans	136.3	-18.7	172.1	0	0	0	0	0	116	S236 N319	S236-G238 PolarHBondContact O-N 2.92Å; G238-N319 PolarHBondContact O-ND2 3.05Å
239	A	65.9	Low	60	Low	17 Å²	17	67.5 Å²	67.5	14%	0.14	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-63.2	157.4	179.5	0	0	0	0	0	112.9
240	P	72.4	Confident	61	Low	5 Å²	5	68.4 Å²	68.4	3%	0.032	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-68.6	150.2	-176.5	-19.1	34.3	0	0	0	112.6	P272 N319 G324	P240-P272 HydrophobicContact CB-CB 4.31Å; P240-P272 HydrophobicContact CG-CB 4.14Å; P240-N319 VanDerWaalsContact CD-CG 3.47Å; P240-N319 WeakPolarHBondContact CD-ND2 3.48Å; P240-N319 HydrophobicContact CG-CB 3.78Å; P240-G324 WeakPolarHBondContact O-CA 3.29Å
241	L	71.4	Confident	62.5	Low	83 Å²	83	63.1 Å²	63.1	44%	0.435	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-62.9	160.8	164.6	-68.6	170.9	0	0	0	111	P263 V264 D266	L241-P263 HydrophobicContact CB-CB 4.02Å; L241-P263 WeakPolarHBondContact O-CB 3.27Å; L241-P263 WeakPolarHBondContact O-CG 3.34Å; L241-V264 WeakPolarHBondContact CD1-O 3.5Å; L241-D266 HydrophobicContact CD1-CB 4.46Å
242	A	73.6	Confident	63.3	Low	41 Å²	41	62.4 Å²	62.4	34%	0.339	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-62.3	137.8	-179.7	0	0	0	0	0	111.4	H325	A242-H325 HydrophobicContact CB-CB 4.46Å
243	P	81.3	Confident	64	Low	7 Å²	7	59.4 Å²	59.4	5%	0.045	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-65.3	163.6	168.2	-17.3	31.7	0	0	0	111.6	P263 Y275 V315 S327	P243-P263 HydrophobicContact CG-CG 4.39Å; P243-Y275 HydrophobicContact CB-CE1 4.29Å; P243-Y275 HydrophobicContact CG-CD1 3.88Å; P243-Y275 HydrophobicContact CG-CE1 3.9Å; P243-V315 HydrophobicContact CB-CB 4.37Å; P243-V315 HydrophobicContact CB-CG1 4.43Å; P243-V315 WeakPolarHBondContact CD-O 3.42Å; P243-V315 HydrophobicContact CG-CB 4.29Å; P243-V315 HydrophobicContact CG-CG1 4.12Å; P243-S327 WeakPolarHBondContact O-CB 3.49Å
244	G	70.5	Confident	64.8	Low	19 Å²	19	59.1 Å²	59.1	20%	0.196	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-61.5	160.8	170.2	0	0	0	0	0	112.7	T261 S327	G244-T261 WeakPolarHBondContact CA-OG1 3.41Å; G244-T261 PolarHBondContact N-O 2.7Å; G244-S327 WeakPolarHBondContact O-CB 3.32Å
245	R	74.4	Confident	66.3	Low	120 Å²	120	54.8 Å²	54.8	45%	0.453	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-56.3	128.2	175.1	-175.6	176.9	175.7	-160.6	-9.4	109.9	T247 M328 S329 S330	R245-T247 PolarHBondContact O-N 3.34Å; R245-M328 HydrophobicContact CB-CB 4.15Å; R245-M328 HydrophobicContact CG-CB 4.12Å; R245-S329 WeakPolarHBondContact CD-O 3.33Å; R245-S329 WeakPolarHBondContact CG-O 3.49Å; R245-S329 PolarHBondContact NE-O 3.32Å; R245-S330 PolarHBondContact NH2-O 3.12Å
246	P	78.7	Confident	68.2	Low	2 Å²	2	50.5 Å²	50.5	1%	0.013	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-70	128.1	176.6	28.2	-33.4	0	0	0	110.6	E259 W260 F313 V315 S327 M328	P246-E259 CarbonylContact C-O 3.43Å; P246-E259 VanDerWaalsContact CA-O 3.3Å; P246-E259 WeakPolarHBondContact CA-O 3.44Å; P246-W260 HydrophobicContact CB-CB 4.42Å; P246-F313 HydrophobicContact CG-CB 4.46Å; P246-V315 HydrophobicContact CB-CG2 3.96Å; P246-V315 HydrophobicContact CG-CG2 4.11Å; P246-S327 WeakPolarHBondContact CD-OG 3.23Å; P246-M328 WeakPolarHBondContact CD-O 3.45Å
247	T	75.7	Confident	69.9	Low	76 Å²	76	49.8 Å²	49.8	47%	0.466	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	145.6	172.7	55.1	0	0	0	0	109.9	R245 L258 E259	R245-T247 PolarHBondContact O-N 3.34Å; T247-L258 VanDerWaalsContact O-CA 3.31Å; T247-L258 WeakPolarHBondContact O-CA 3.16Å; T247-E259 PolarHBondContact N-O 3.38Å; T247-E259 PolarHBondContact O-N 2.94Å; T247-E259 PolarHBondContact OG1-O 2.83Å
248	V	79.1	Confident	71.6	Confident	59 Å²	59	44.7 Å²	44.7	36%	0.358	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	118.8	173.2	175.5	0	0	0	0	108.6	V251 V256 L258 V333	V248-V251 HydrophobicContact CG1-CG2 3.6Å; V248-V256 HydrophobicContact CG1-CG1 3.89Å; V248-V256 HydrophobicContact CG2-CG1 4.05Å; V248-L258 HydrophobicContact CG2-CD2 3.93Å; V248-V333 HydrophobicContact CG1-CG1 4.45Å; V248-V333 HydrophobicContact CG2-CB 4.49Å; V248-V333 HydrophobicContact CG2-CG1 4.03Å; V248-V333 HydrophobicContact CG2-CG2 3.61Å
249	I	76.7	Confident	73.1	Confident	89 Å²	89	48.5 Å²	48.5	46%	0.456	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	-36.7	179.2	-55.6	-54.5	0	0	0	111	L257 E259	I249-L257 HydrophobicContact CB-CD2 4.05Å; I249-L257 HydrophobicContact CB-CG 4.14Å; I249-L257 HydrophobicContact CG2-CD2 3.94Å; I249-L257 PolarHBondContact N-O 3.42Å; I249-E259 HydrophobicContact CD1-CB 3.95Å; I249-E259 HydrophobicContact CG1-CB 3.62Å
250	A	66.4	Low	74.1	Confident	49 Å²	49	48.1 Å²	48.1	41%	0.405	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	151.9	173.8	0	0	0	0	0	111.4	V256 L257	A250-V256 WeakPolarHBondContact O-CA 3.49Å; A250-L257 HydrophobicContact CB-CB 4.1Å; A250-L257 HydrophobicContact CB-CD2 4.4Å; A250-L257 PolarHBondContact N-O 3.12Å; A250-L257 PolarHBondContact O-N 2.83Å
251	V	69.6	Low	74.6	Confident	64 Å²	64	52.4 Å²	52.4	39%	0.388	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	125.2	168.5	-177.3	0	0	0	0	107	V248 V256 V333 I335	V248-V251 HydrophobicContact CG1-CG2 3.6Å; V251-V256 HydrophobicContact CG1-CG2 4.24Å; V251-V256 HydrophobicContact CG2-CG1 4.43Å; V251-V256 HydrophobicContact CG2-CG2 4.19Å; V251-V333 HydrophobicContact CG2-CG1 3.9Å; V251-I335 HydrophobicContact CG1-CD1 3.95Å
252	D	58.8	Low	75	Confident	93 Å²	93	51.9 Å²	51.9	50%	0.497	29%	0.294	S	S	.	.			trans	-105.3	-177.2	166.1	74.5	51.9	0	0	0	110.5	Q254 G255	D252-Q254 PolarHBondContact O-N 2.87Å; D252-Q254 VanDerWaalsContact O-N 3.13Å; D252-Q254 PolarHBondContact OD1-N 2.76Å; D252-G255 PolarHBondContact N-O 3.44Å; D252-G255 PolarHBondContact OD1-N 3.37Å
253	G	57.4	Low	74.9	Confident	9 Å²	9	51 Å²	51	9%	0.093	29%	0.285	C	S	.	.	S	Bend	trans	-67.3	-9.2	-175.4	0	0	0	0	0	115.7
254	Q	55.2	Low	74	Confident	136 Å²	136	57 Å²	57	64%	0.636	32%	0.321	S	S	*	.	S	Bend	trans	-142.3	-5.6	-175	-62.7	-172.3	-25.4	0	0	114.2	D252 S304 L305	D252-Q254 PolarHBondContact O-N 2.87Å; D252-Q254 VanDerWaalsContact O-N 3.13Å; D252-Q254 PolarHBondContact OD1-N 2.76Å; Q254-S304 PolarHBondContact O-N 3.24Å; Q254-L305 PolarHBondContact O-N 2.96Å
255	G	69.9	Low	73.2	Confident	1 Å²	1	59.7 Å²	59.7	1%	0.01	34%	0.341	C	S	.	.			trans	-153.7	169.9	178.9	0	0	0	0	0	116	D252 V302	D252-G255 PolarHBondContact N-O 3.44Å; D252-G255 PolarHBondContact OD1-N 3.37Å; G255-V302 CarbonylContact C-O 3.56Å; G255-V302 WeakPolarHBondContact CA-O 3.42Å
256	V	82.1	Confident	72.1	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	125.5	-179.5	180	0	0	0	0	110.6	V248 A250 V251 L258 T301 V302 L305 F313 V333 I335	V248-V256 HydrophobicContact CG1-CG1 3.89Å; V248-V256 HydrophobicContact CG2-CG1 4.05Å; A250-V256 WeakPolarHBondContact O-CA 3.49Å; V251-V256 HydrophobicContact CG1-CG2 4.24Å; V251-V256 HydrophobicContact CG2-CG1 4.43Å; V251-V256 HydrophobicContact CG2-CG2 4.19Å; V256-L258 HydrophobicContact CG1-CD2 3.68Å; V256-L258 HydrophobicContact CG1-CG 4.13Å; V256-T301 CarbonylContact O-C 3.54Å; V256-T301 WeakPolarHBondContact O-CA 3.46Å; V256-V302 PolarHBondContact N-O 3.4Å; V256-V302 PolarHBondContact O-N 2.86Å; V256-L305 HydrophobicContact CB-CD1 4.31Å; V256-L305 HydrophobicContact CG2-CD1 3.77Å; V256-F313 HydrophobicContact CB-CE2 4.12Å; V256-F313 HydrophobicContact CB-CZ 3.9Å; V256-F313 HydrophobicContact CG1-CE2 3.96Å; V256-F313 HydrophobicContact CG1-CZ 4.24Å; V256-F313 HydrophobicContact CG2-CE2 3.99Å; V256-F313 HydrophobicContact CG2-CZ 3.75Å; V256-V333 HydrophobicContact CG2-CG1 4.26Å; V256-I335 HydrophobicContact CG2-CD1 3.25Å
257	L	83.1	Confident	70.8	Confident	53 Å²	53	64.8 Å²	64.8	28%	0.277	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	119.7	170.7	-177.8	66.3	0	0	0	109.8	I249 A250 V299 T301	I249-L257 HydrophobicContact CB-CD2 4.05Å; I249-L257 HydrophobicContact CB-CG 4.14Å; I249-L257 HydrophobicContact CG2-CD2 3.94Å; I249-L257 PolarHBondContact N-O 3.42Å; A250-L257 HydrophobicContact CB-CB 4.1Å; A250-L257 HydrophobicContact CB-CD2 4.4Å; A250-L257 PolarHBondContact N-O 3.12Å; A250-L257 PolarHBondContact O-N 2.83Å; L257-V299 HydrophobicContact CD1-CG2 3.68Å; L257-V299 HydrophobicContact CG-CG2 4.32Å; L257-T301 WeakPolarHBondContact CD1-OG1 3.39Å
258	L	86.6	Confident	69.7	Low	0 Å²	0	69.1 Å²	69.1	0%	0	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	142.4	-179.7	-58.8	171.5	0	0	0	111.1	T247 V248 V256 W260 V277 V299 F300 V302 F313	T247-L258 VanDerWaalsContact O-CA 3.31Å; T247-L258 WeakPolarHBondContact O-CA 3.16Å; V248-L258 HydrophobicContact CG2-CD2 3.93Å; V256-L258 HydrophobicContact CG1-CD2 3.68Å; V256-L258 HydrophobicContact CG1-CG 4.13Å; L258-W260 HydrophobicContact CB-CE3 4.48Å; L258-W260 HydrophobicContact CB-CZ3 4.39Å; L258-V277 HydrophobicContact CD1-CG1 3.98Å; L258-V299 CarbonylContact O-C 3.56Å; L258-V299 VanDerWaalsContact O-CA 3.22Å; L258-V299 WeakPolarHBondContact O-CA 3.46Å; L258-V299 VanDerWaalsContact O-CG2 3.28Å; L258-V299 WeakPolarHBondContact O-CG2 3.49Å; L258-F300 PolarHBondContact N-O 2.88Å; L258-F300 PolarHBondContact O-N 3.25Å; L258-V302 HydrophobicContact CD1-CG2 3.78Å; L258-F313 HydrophobicContact CD1-CB 3.58Å; L258-F313 HydrophobicContact CD1-CD1 3.76Å; L258-F313 HydrophobicContact CD1-CD2 4.32Å; L258-F313 HydrophobicContact CD1-CG 3.63Å; L258-F313 HydrophobicContact CD2-CB 4.15Å; L258-F313 HydrophobicContact CD2-CD2 3.86Å; L258-F313 HydrophobicContact CD2-CE2 4.48Å; L258-F313 HydrophobicContact CD2-CG 4Å; L258-F313 HydrophobicContact CG-CG 4.4Å
259	E	85.6	Confident	68.7	Low	96 Å²	96	67.6 Å²	67.6	45%	0.449	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	147.1	169.1	-175.3	175	-153.9	0	0	109.6	P246 T247 I249 N298	P246-E259 CarbonylContact C-O 3.43Å; P246-E259 VanDerWaalsContact CA-O 3.3Å; P246-E259 WeakPolarHBondContact CA-O 3.44Å; T247-E259 PolarHBondContact N-O 3.38Å; T247-E259 PolarHBondContact O-N 2.94Å; T247-E259 PolarHBondContact OG1-O 2.83Å; I249-E259 HydrophobicContact CD1-CB 3.95Å; I249-E259 HydrophobicContact CG1-CB 3.62Å; E259-N298 WeakPolarHBondContact CA-O 3.3Å
260	W	87.8	Confident	67.9	Low	8 Å²	8	65.5 Å²	65.5	3%	0.03	38%	0.381	C	S	.	.			trans	-146.3	151.9	178	59.2	89.8	0	0	0	111.5	P246 L258 Y275 V277 V295 E297 N298 F300 V315	P246-W260 HydrophobicContact CB-CB 4.42Å; L258-W260 HydrophobicContact CB-CE3 4.48Å; L258-W260 HydrophobicContact CB-CZ3 4.39Å; W260-Y275 AromaticContact CE2-CD2 3.9Å; W260-Y275 AromaticContact CE2-CG 3.96Å; W260-Y275 AromaticContact CZ2-CD2 3.71Å; W260-Y275 HydrophobicContact CZ2-CD2 3.71Å; W260-Y275 AromaticContact CZ2-CG 3.85Å; W260-Y275 HydrophobicContact CZ2-CG 3.85Å; W260-Y275 AromaticContact NE1-CD1 3.67Å; W260-Y275 AromaticContact NE1-CD2 3.45Å; W260-Y275 AromaticContact NE1-CE1 3.79Å; W260-Y275 AromaticContact NE1-CE2 3.56Å; W260-Y275 AromaticContact NE1-CG 3.51Å; W260-Y275 AromaticContact NE1-CZ 3.74Å; W260-V277 HydrophobicContact CH2-CG2 3.65Å; W260-V277 HydrophobicContact CZ2-CG2 4.38Å; W260-V277 HydrophobicContact CZ3-CG2 3.94Å; W260-V295 HydrophobicContact CH2-CB 4.41Å; W260-V295 HydrophobicContact CH2-CG1 4.28Å; W260-V295 HydrophobicContact CZ2-CB 4.44Å; W260-V295 HydrophobicContact CZ2-CG1 4.47Å; W260-E297 WeakPolarHBondContact CZ2-O 3.24Å; W260-N298 VanDerWaalsContact CD1-ND2 3.31Å; W260-N298 PolarHBondContact N-O 2.8Å; W260-N298 PolarHBondContact NE1-ND2 3.49Å; W260-N298 WeakPolarHBondContact O-CB 3.37Å; W260-N298 PolarHBondContact O-ND2 2.69Å; W260-F300 HydrophobicContact CH2-CB 3.64Å; W260-F300 HydrophobicContact CZ3-CB 3.79Å; W260-V315 HydrophobicContact CB-CG2 4.49Å; W260-V315 HydrophobicContact CD2-CB 4.38Å; W260-V315 HydrophobicContact CD2-CG1 4.01Å; W260-V315 HydrophobicContact CD2-CG2 3.81Å; W260-V315 HydrophobicContact CE3-CG2 3.78Å; W260-V315 HydrophobicContact CG-CB 4.45Å; W260-V315 HydrophobicContact CG-CG1 4.31Å; W260-V315 HydrophobicContact CG-CG2 4.12Å; W260-V315 HydrophobicContact CZ2-CG1 4.07Å; W260-V315 HydrophobicContact CZ3-CG2 4.3Å
261	T	83.1	Confident	68.1	Low	95 Å²	95	67.8 Å²	67.8	58%	0.583	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-78.6	145.1	173.6	49.8	0	0	0	0	111.9	G244	G244-T261 WeakPolarHBondContact CA-OG1 3.41Å; G244-T261 PolarHBondContact N-O 2.7Å
262	P	78.4	Confident	68.6	Low	73 Å²	73	66.3 Å²	66.3	47%	0.474	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-70.2	155.1	176.4	30.8	-35.5	0	0	0	111	V264 Y275 N298	P262-V264 PolarHBondContact O-N 2.83Å; P262-Y275 WeakPolarHBondContact CA-OH 3.36Å; P262-Y275 WeakPolarHBondContact CB-OH 3.21Å; P262-N298 WeakPolarHBondContact CD-ND2 3.34Å
263	P	73.3	Confident	69.9	Low	23 Å²	23	66.9 Å²	66.9	15%	0.149	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-60.7	136	176.7	-18	29.2	0	0	0	111.7	L241 P243 A265 P272	L241-P263 HydrophobicContact CB-CB 4.02Å; L241-P263 WeakPolarHBondContact O-CB 3.27Å; L241-P263 WeakPolarHBondContact O-CG 3.34Å; P243-P263 HydrophobicContact CG-CG 4.39Å; P263-A265 PolarHBondContact O-N 3.35Å; P263-P272 HydrophobicContact CG-CG 4.3Å
264	V	60.9	Low	71.1	Confident	133 Å²	133	66.6 Å²	66.6	81%	0.806	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-74.1	122.2	172.9	-176.2	0	0	0	0	108.5	L241 P262	L241-V264 WeakPolarHBondContact CD1-O 3.5Å; P262-V264 PolarHBondContact O-N 2.83Å
265	A	53.4	Low	72.7	Confident	74 Å²	74	60.6 Å²	60.6	61%	0.612	35%	0.352	S	S	*	.	P	Polyproline II helix	trans	-79	124.2	-170.8	0	0	0	0	0	113.3	P263	P263-A265 PolarHBondContact O-N 3.35Å
266	D	52.5	Low	73.6	Confident	87 Å²	87	62 Å²	62	47%	0.465	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-74.4	151.3	158.1	-170.9	-69.4	0	0	0	109.6	L241 H268 S269	L241-D266 HydrophobicContact CD1-CB 4.46Å; D266-H268 PolarHBondContact O-N 3.33Å; D266-H268 IonicContact OD1-CG 2.7Å; D266-H268 PolarHBondContact OD1-N 2.63Å; D266-H268 IonicContact OD1-ND1 3.41Å; D266-H268 PolarHBondContact OD1-ND1 3.46Å; D266-S269 PolarHBondContact N-OG 3.03Å; D266-S269 PolarHBondContact O-N 2.76Å; D266-S269 PolarHBondContact O-OG 3.41Å; D266-S269 VanDerWaalsContact O-OG 3.06Å
267	V	51.8	Low	73.9	Confident	142 Å²	142	62 Å²	62	86%	0.861	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.2	-23.8	172.2	-175.4	0	0	0	0	113.2
268	H	51.6	Low	74.1	Confident	167 Å²	167	60 Å²	60	77%	0.773	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104	-0.9	-178.4	-55.9	82.8	0	0	0	114.8	D266	D266-H268 PolarHBondContact O-N 3.33Å; D266-H268 IonicContact OD1-CG 2.7Å; D266-H268 PolarHBondContact OD1-N 2.63Å; D266-H268 IonicContact OD1-ND1 3.41Å; D266-H268 PolarHBondContact OD1-ND1 3.46Å
269	S	58	Low	74	Confident	27 Å²	27	62.1 Å²	62.1	19%	0.189	36%	0.356	C	S	.	.			trans	-109.7	126.6	-175.5	65	0	0	0	0	112.8	D266	D266-S269 PolarHBondContact N-OG 3.03Å; D266-S269 PolarHBondContact O-N 2.76Å; D266-S269 PolarHBondContact O-OG 3.41Å; D266-S269 VanDerWaalsContact O-OG 3.06Å
270	S	61.3	Low	73.7	Confident	45 Å²	45	58.9 Å²	58.9	32%	0.315	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-79	130.4	176.8	-68.2	0	0	0	0	110.8	N319	S270-N319 WeakPolarHBondContact CB-ND2 3.17Å; S270-N319 PolarHBondContact O-ND2 2.76Å
271	P	69.8	Low	72.7	Confident	97 Å²	97	62.2 Å²	62.2	63%	0.63	36%	0.361	S	S	*	.	P	Polyproline II helix	trans	-62.5	155	-176.6	25.9	-35	0	0	0	112.6	N319	P271-N319 WeakPolarHBondContact O-CB 3.34Å
272	P	81	Confident	71.4	Confident	34 Å²	34	64.5 Å²	64.5	22%	0.221	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-64.4	138.5	178.1	27.4	-33.9	0	0	0	111.6	P240 P263 G274 Y275 K318	P240-P272 HydrophobicContact CB-CB 4.31Å; P240-P272 HydrophobicContact CG-CB 4.14Å; P263-P272 HydrophobicContact CG-CG 4.3Å; P272-G274 VanDerWaalsContact C-N 3.28Å; P272-Y275 HydrophobicContact CB-CE1 4.15Å; P272-Y275 HydrophobicContact CG-CE1 3.81Å; P272-K318 CarbonylContact C-O 3.56Å; P272-K318 WeakPolarHBondContact CA-O 3.4Å
273	Q	84.3	Confident	69.9	Low	105 Å²	105	64.3 Å²	64.3	49%	0.491	37%	0.371	S	S	.	.	S	Bend	trans	-83.8	-8.5	168.9	-65.1	175.1	-10.2	0	0	112	Q296 K318 N319	Q273-Q296 PolarHBondContact O-NE2 3.45Å; Q273-K318 PolarHBondContact N-O 2.75Å; Q273-N319 HydrophobicContact CG-CB 4.36Å
274	G	83.2	Confident	69	Low	2 Å²	2	65.3 Å²	65.3	2%	0.021	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	166.2	177.9	172.5	0	0	0	0	0	111.1	P272 V295 K318	P272-G274 VanDerWaalsContact C-N 3.28Å; G274-V295 CarbonylContact C-O 3.51Å; G274-V295 WeakPolarHBondContact CA-O 3.34Å; G274-K318 PolarHBondContact N-O 2.79Å; G274-K318 PolarHBondContact O-N 3.33Å
275	Y	88.6	Confident	68.6	Low	10 Å²	10	69.4 Å²	69.4	4%	0.039	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	147.8	-173.1	-58.3	-75.9	0	0	0	112.6	P243 W260 P262 P272 N291 L294 V295 V315 R316	P243-Y275 HydrophobicContact CB-CE1 4.29Å; P243-Y275 HydrophobicContact CG-CD1 3.88Å; P243-Y275 HydrophobicContact CG-CE1 3.9Å; W260-Y275 AromaticContact CE2-CD2 3.9Å; W260-Y275 AromaticContact CE2-CG 3.96Å; W260-Y275 AromaticContact CZ2-CD2 3.71Å; W260-Y275 HydrophobicContact CZ2-CD2 3.71Å; W260-Y275 AromaticContact CZ2-CG 3.85Å; W260-Y275 HydrophobicContact CZ2-CG 3.85Å; W260-Y275 AromaticContact NE1-CD1 3.67Å; W260-Y275 AromaticContact NE1-CD2 3.45Å; W260-Y275 AromaticContact NE1-CE1 3.79Å; W260-Y275 AromaticContact NE1-CE2 3.56Å; W260-Y275 AromaticContact NE1-CG 3.51Å; W260-Y275 AromaticContact NE1-CZ 3.74Å; P262-Y275 WeakPolarHBondContact CA-OH 3.36Å; P262-Y275 WeakPolarHBondContact CB-OH 3.21Å; P272-Y275 HydrophobicContact CB-CE1 4.15Å; P272-Y275 HydrophobicContact CG-CE1 3.81Å; Y275-N291 PolarHBondContact O-ND2 2.9Å; Y275-L294 WeakPolarHBondContact O-CA 3.4Å; Y275-V295 WeakPolarHBondContact CD2-O 3.15Å; Y275-V295 PolarHBondContact N-O 3.28Å; Y275-V295 PolarHBondContact O-N 3.25Å; Y275-V315 HydrophobicContact CD1-CG1 4.02Å; Y275-V315 HydrophobicContact CG-CG1 4.13Å; Y275-R316 CarbonylContact C-O 3.49Å; Y275-R316 WeakPolarHBondContact CA-O 3.27Å
276	Q	90.1	Very high	68.8	Low	32 Å²	32	71.8 Å²	71.8	15%	0.15	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	116	168.6	-174	174.8	-62.4	0	0	107.8	E278 V289 L294 V315 R316 L323	Q276-E278 HydrophobicContact CG-CG 4.49Å; Q276-E278 PolarHBondContact NE2-OE1 3.24Å; Q276-V289 HydrophobicContact CG-CG1 3.75Å; Q276-V289 HydrophobicContact CG-CG2 4.26Å; Q276-L294 HydrophobicContact CB-CD2 4.4Å; Q276-V315 CarbonylContact O-C 3.6Å; Q276-V315 WeakPolarHBondContact O-CA 3.41Å; Q276-R316 HydrophobicContact CB-CB 4.4Å; Q276-R316 PolarHBondContact N-O 3.16Å; Q276-R316 PolarHBondContact O-N 3.23Å; Q276-L323 HydrophobicContact CB-CD1 4.02Å
277	V	88.6	Confident	69.9	Low	0 Å²	0	69.9 Å²	69.9	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	132.9	176.9	-177.7	0	0	0	0	107.7	L258 W260 A290 N291 V295 F300 V302 V315	L258-V277 HydrophobicContact CD1-CG1 3.98Å; W260-V277 HydrophobicContact CH2-CG2 3.65Å; W260-V277 HydrophobicContact CZ2-CG2 4.38Å; W260-V277 HydrophobicContact CZ3-CG2 3.94Å; V277-A290 HydrophobicContact CB-CB 4.22Å; V277-A290 HydrophobicContact CG1-CB 4.15Å; V277-A290 PolarHBondContact O-N 2.87Å; V277-N291 PolarHBondContact N-OD1 2.71Å; V277-N291 PolarHBondContact O-OD1 3.37Å; V277-V295 HydrophobicContact CG2-CG2 4.23Å; V277-F300 HydrophobicContact CB-CD1 4.14Å; V277-F300 HydrophobicContact CG1-CD1 4.21Å; V277-F300 HydrophobicContact CG2-CB 4.16Å; V277-F300 HydrophobicContact CG2-CD1 4Å; V277-F300 HydrophobicContact CG2-CG 4.22Å; V277-V302 HydrophobicContact CG1-CG2 3.96Å; V277-V315 HydrophobicContact CG2-CG1 4.36Å; V277-V315 HydrophobicContact CG2-CG2 4.37Å
278	E	85.8	Confident	71	Confident	9 Å²	9	67.2 Å²	67.2	4%	0.042	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	143.1	-178.8	-72.4	170.6	-167.1	0	0	109.7	Q276 W287 I288 V289 F313 R314 R316	Q276-E278 HydrophobicContact CG-CG 4.49Å; Q276-E278 PolarHBondContact NE2-OE1 3.24Å; E278-W287 HydrophobicContact CB-CB 4.43Å; E278-W287 HydrophobicContact CB-CE3 4.07Å; E278-I288 CarbonylContact C-O 3.56Å; E278-I288 VanDerWaalsContact CA-O 3.25Å; E278-I288 WeakPolarHBondContact CA-O 3.39Å; E278-V289 HydrophobicContact CG-CG2 4.07Å; E278-F313 CarbonylContact O-C 3.46Å; E278-F313 WeakPolarHBondContact O-CA 3.49Å; E278-R314 HydrophobicContact CB-CG 3.91Å; E278-R314 PolarHBondContact N-O 3.49Å; E278-R314 PolarHBondContact O-N 3.2Å; E278-R314 IonicContact OE2-CZ 3.83Å; E278-R314 IonicContact OE2-NE 3.71Å; E278-R314 PolarHBondContact OE2-NE 3.47Å; E278-R314 IonicContact OE2-NH2 2.78Å; E278-R314 PolarHBondContact OE2-NH2 3.47Å; E278-R316 WeakPolarHBondContact OE1-CD 3.35Å; E278-R316 IonicContact OE1-NH1 3.83Å
279	Y	84.6	Confident	72.6	Confident	45 Å²	45	62.5 Å²	62.5	18%	0.176	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	155.4	179.3	77.7	-77.3	0	0	0	111.8	I288 A290 V302 L305 Y311 E312 F313	Y279-I288 HydrophobicContact CD1-CB 4.09Å; Y279-I288 HydrophobicContact CD1-CG2 4.36Å; Y279-I288 VanDerWaalsContact CD1-O 3.29Å; Y279-I288 WeakPolarHBondContact CD1-O 3.42Å; Y279-I288 HydrophobicContact CE1-CB 3.79Å; Y279-I288 HydrophobicContact CE1-CG2 3.62Å; Y279-I288 HydrophobicContact CE2-CD1 4.47Å; Y279-I288 PolarHBondContact N-O 2.87Å; Y279-I288 PolarHBondContact O-N 2.88Å; Y279-A290 HydrophobicContact CD1-CB 3.92Å; Y279-A290 HydrophobicContact CE1-CB 4.34Å; Y279-V302 HydrophobicContact CD1-CG1 4.15Å; Y279-V302 HydrophobicContact CE1-CG1 4.47Å; Y279-V302 HydrophobicContact CG-CG1 4.28Å; Y279-L305 HydrophobicContact CD2-CD2 3.6Å; Y279-L305 HydrophobicContact CE2-CD2 3.45Å; Y279-L305 VanDerWaalsContact CE2-CD2 3.45Å; Y279-L305 HydrophobicContact CG-CD2 4.44Å; Y279-Y311 AromaticContact CD2-CD1 3.78Å; Y279-Y311 HydrophobicContact CD2-CD1 3.78Å; Y279-Y311 HydrophobicContact CD2-CE1 4.05Å; Y279-Y311 HydrophobicContact CE2-CD1 4.2Å; Y279-Y311 AromaticContact CE2-CE1 3.99Å; Y279-Y311 HydrophobicContact CE2-CE1 3.99Å; Y279-E312 CarbonylContact C-O 3.6Å; Y279-E312 WeakPolarHBondContact CA-O 3.41Å; Y279-F313 VanDerWaalsContact CB-CD1 3.43Å; Y279-F313 HydrophobicContact CG-CE1 4.38Å
280	R	79.2	Confident	73.6	Confident	29 Å²	29	62.7 Å²	62.7	11%	0.109	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	156	171.8	65.2	169.7	178.4	-165.7	-8.8	111.3	S284 D286 W287 Y311 E312	R280-S284 WeakPolarHBondContact CD-O 3.27Å; R280-S284 PolarHBondContact NE-O 2.88Å; R280-S284 PolarHBondContact NH1-O 2.85Å; R280-D286 WeakPolarHBondContact CB-O 3.47Å; R280-W287 HydrophobicContact CB-CD2 4.21Å; R280-W287 HydrophobicContact CB-CE3 4.17Å; R280-W287 HydrophobicContact CG-CD2 3.97Å; R280-W287 HydrophobicContact CG-CE3 3.96Å; R280-W287 HydrophobicContact CG-CH2 3.96Å; R280-W287 HydrophobicContact CG-CZ2 3.97Å; R280-W287 HydrophobicContact CG-CZ3 3.95Å; R280-W287 VanDerWaalsContact NE-CZ2 3.29Å; R280-Y311 CarbonylContact O-C 3.45Å; R280-Y311 WeakPolarHBondContact O-CA 3.39Å; R280-Y311 WeakPolarHBondContact O-CD1 3.26Å; R280-E312 HydrophobicContact CG-CB 4.09Å; R280-E312 IonicContact CZ-OE2 3.74Å; R280-E312 PolarHBondContact N-O 2.81Å; R280-E312 IonicContact NE-OE2 2.67Å; R280-E312 PolarHBondContact NE-OE2 2.87Å; R280-E312 IonicContact NH2-OE2 3.18Å; R280-E312 PolarHBondContact NH2-OE2 3.06Å; R280-E312 PolarHBondContact O-N 3.46Å
281	V	67.6	Low	74.8	Confident	77 Å²	77	61.2 Å²	61.2	47%	0.467	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	138.3	163.7	-179.7	0	0	0	0	108.2	G283 S284 Y311	V281-G283 PolarHBondContact O-N 2.93Å; V281-S284 WeakPolarHBondContact O-CB 3.48Å; V281-S284 PolarHBondContact O-N 3.04Å; V281-Y311 HydrophobicContact CG2-CD1 4.14Å; V281-Y311 HydrophobicContact CG2-CE1 3.66Å
282	Y	56.3	Low	75	Confident	143 Å²	143	66.4 Å²	66.4	56%	0.561	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	131.3	-178.6	-167.3	-93.7	0	0	0	111.1	S284 V310 E312	Y282-S284 VanDerWaalsContact C-N 3.28Å; Y282-S284 PolarHBondContact O-N 3.5Å; Y282-V310 HydrophobicContact CD2-CG1 4.33Å; Y282-V310 HydrophobicContact CG-CG1 4.11Å; Y282-V310 PolarHBondContact N-O 3.05Å; Y282-E312 HydrophobicContact CD2-CG 3.61Å; Y282-E312 HydrophobicContact CE2-CG 4.14Å
283	G	47.2	Very low	75.2	Confident	69 Å²	69	72.7 Å²	72.7	71%	0.711	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.7	-8.5	-173.7	0	0	0	0	0	116	V281	V281-G283 PolarHBondContact O-N 2.93Å
284	S	54.4	Low	75.3	Confident	44 Å²	44	70.8 Å²	70.8	31%	0.308	36%	0.358	S	S	.	.			trans	-69.9	154.9	173	-172.3	0	0	0	0	112.2	R280 V281 Y282 D286	R280-S284 WeakPolarHBondContact CD-O 3.27Å; R280-S284 PolarHBondContact NE-O 2.88Å; R280-S284 PolarHBondContact NH1-O 2.85Å; V281-S284 WeakPolarHBondContact O-CB 3.48Å; V281-S284 PolarHBondContact O-N 3.04Å; Y282-S284 VanDerWaalsContact C-N 3.28Å; Y282-S284 PolarHBondContact O-N 3.5Å; S284-D286 PolarHBondContact OG-N 3.46Å
285	R	51.2	Low	75.6	Confident	220 Å²	220	71.6 Å²	71.6	83%	0.83	36%	0.363	S	S	*	.	S	Bend	trans	-85.8	-34.1	173.2	-66.7	-174.5	177	-167.8	-2.2	112.6
286	D	57.8	Low	75.4	Confident	123 Å²	123	78.7 Å²	78.7	66%	0.658	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-90	133.8	-170.5	-56.5	-53.2	0	0	0	112.5	R280 S284	R280-D286 WeakPolarHBondContact CB-O 3.47Å; S284-D286 PolarHBondContact OG-N 3.46Å
287	W	76.4	Confident	75	Confident	47 Å²	47	83.8 Å²	83.8	18%	0.178	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-103	128.4	176.9	-72.4	85.8	0	0	0	110.4	E278 R280 E312 R314	E278-W287 HydrophobicContact CB-CB 4.43Å; E278-W287 HydrophobicContact CB-CE3 4.07Å; R280-W287 HydrophobicContact CB-CD2 4.21Å; R280-W287 HydrophobicContact CB-CE3 4.17Å; R280-W287 HydrophobicContact CG-CD2 3.97Å; R280-W287 HydrophobicContact CG-CE3 3.96Å; R280-W287 HydrophobicContact CG-CH2 3.96Å; R280-W287 HydrophobicContact CG-CZ2 3.97Å; R280-W287 HydrophobicContact CG-CZ3 3.95Å; R280-W287 VanDerWaalsContact NE-CZ2 3.29Å; W287-E312 HydrophobicContact CH2-CB 3.8Å; W287-E312 HydrophobicContact CZ3-CB 4.3Å; W287-R314 HydrophobicContact CD2-CG 4.25Å; W287-R314 HydrophobicContact CE3-CG 3.71Å; W287-R314 VanDerWaalsContact CG-CZ 3.5Å; W287-R314 HydrophobicContact CH2-CB 4.03Å; W287-R314 HydrophobicContact CH2-CG 3.97Å; W287-R314 HydrophobicContact CZ2-CG 4.47Å; W287-R314 HydrophobicContact CZ3-CB 3.93Å; W287-R314 HydrophobicContact CZ3-CG 3.57Å
288	I	73.9	Confident	74.9	Confident	87 Å²	87	86 Å²	86	45%	0.446	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	131.6	-177.2	-54.1	175.2	0	0	0	108.3	E278 Y279	E278-I288 CarbonylContact C-O 3.56Å; E278-I288 VanDerWaalsContact CA-O 3.25Å; E278-I288 WeakPolarHBondContact CA-O 3.39Å; Y279-I288 HydrophobicContact CD1-CB 4.09Å; Y279-I288 HydrophobicContact CD1-CG2 4.36Å; Y279-I288 VanDerWaalsContact CD1-O 3.29Å; Y279-I288 WeakPolarHBondContact CD1-O 3.42Å; Y279-I288 HydrophobicContact CE1-CB 3.79Å; Y279-I288 HydrophobicContact CE1-CG2 3.62Å; Y279-I288 HydrophobicContact CE2-CD1 4.47Å; Y279-I288 PolarHBondContact N-O 2.87Å; Y279-I288 PolarHBondContact O-N 2.88Å
289	V	84.9	Confident	74.8	Confident	68 Å²	68	88 Å²	88	41%	0.412	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	130.5	175.1	-178.9	0	0	0	0	109.7	Q276 E278 N291	Q276-V289 HydrophobicContact CG-CG1 3.75Å; Q276-V289 HydrophobicContact CG-CG2 4.26Å; E278-V289 HydrophobicContact CG-CG2 4.07Å; V289-N291 WeakPolarHBondContact CG1-O 3.42Å
290	A	80.5	Confident	74.9	Confident	31 Å²	31	88.2 Å²	88.2	26%	0.256	45%	0.446	S	S	.	.			trans	-87.3	-24.4	-178.2	0	0	0	0	0	113.7	V277 Y279 F300 V302	V277-A290 HydrophobicContact CB-CB 4.22Å; V277-A290 HydrophobicContact CG1-CB 4.15Å; V277-A290 PolarHBondContact O-N 2.87Å; Y279-A290 HydrophobicContact CD1-CB 3.92Å; Y279-A290 HydrophobicContact CE1-CB 4.34Å; A290-F300 HydrophobicContact CB-CE1 3.9Å; A290-V302 HydrophobicContact CB-CB 4.46Å; A290-V302 HydrophobicContact CB-CG1 3.91Å; A290-V302 HydrophobicContact CB-CG2 3.87Å
291	N	84.8	Confident	75.2	Confident	14 Å²	14	89.2 Å²	89.2	8%	0.075	46%	0.456	C	S	.	.			trans	-123.4	126.4	-172.1	64	-58	0	0	0	113	Y275 V277 V289 Q293 V295 F300	Y275-N291 PolarHBondContact O-ND2 2.9Å; V277-N291 PolarHBondContact N-OD1 2.71Å; V277-N291 PolarHBondContact O-OD1 3.37Å; V289-N291 WeakPolarHBondContact CG1-O 3.42Å; N291-Q293 PolarHBondContact ND2-O 2.84Å; N291-V295 HydrophobicContact CB-CG2 4.25Å; N291-F300 HydrophobicContact CB-CE1 4.15Å; N291-F300 HydrophobicContact CB-CE2 3.95Å; N291-F300 HydrophobicContact CB-CZ 3.63Å
292	E	74.6	Confident	75.9	Confident	205 Å²	205	85.7 Å²	85.7	96%	0.958	43%	0.434	S	S	*	.	S	Bend	trans	-70.9	-29.9	176.9	-62.5	-170.2	161.9	0	0	113.3
293	Q	85.1	Confident	77.1	Confident	166 Å²	166	85.4 Å²	85.4	78%	0.776	44%	0.438	S	S	*	.	S	Bend	trans	-122.2	145.9	177.7	-60.8	-172.8	20.4	0	0	109.9	N291 V295	N291-Q293 PolarHBondContact ND2-O 2.84Å; Q293-V295 PolarHBondContact O-N 3.42Å
294	L	85.9	Confident	78.4	Confident	66 Å²	66	87.4 Å²	87.4	35%	0.346	44%	0.441	S	S	.	.			trans	-61.7	127.8	-176.2	-59.4	171.4	0	0	0	111.4	Y275 Q276 Q296 K318	Y275-L294 WeakPolarHBondContact O-CA 3.4Å; Q276-L294 HydrophobicContact CB-CD2 4.4Å; L294-Q296 PolarHBondContact O-N 2.98Å; L294-K318 HydrophobicContact CD1-CB 4.24Å; L294-K318 HydrophobicContact CD1-CD 3.91Å; L294-K318 HydrophobicContact CD1-CG 4.42Å; L294-K318 HydrophobicContact CD2-CB 4.11Å; L294-K318 HydrophobicContact CD2-CD 3.76Å; L294-K318 HydrophobicContact CG-CD 4.43Å
295	V	89.5	Confident	79.3	Confident	19 Å²	19	85.5 Å²	85.5	12%	0.115	43%	0.427	C	S	.	.	B	Isolated β-bridge	trans	-71.6	119.6	175.8	-163.5	0	0	0	0	108.1	W260 G274 Y275 V277 N291 Q293 E297 V299 F300	W260-V295 HydrophobicContact CH2-CB 4.41Å; W260-V295 HydrophobicContact CH2-CG1 4.28Å; W260-V295 HydrophobicContact CZ2-CB 4.44Å; W260-V295 HydrophobicContact CZ2-CG1 4.47Å; G274-V295 CarbonylContact C-O 3.51Å; G274-V295 WeakPolarHBondContact CA-O 3.34Å; Y275-V295 WeakPolarHBondContact CD2-O 3.15Å; Y275-V295 PolarHBondContact N-O 3.28Å; Y275-V295 PolarHBondContact O-N 3.25Å; V277-V295 HydrophobicContact CG2-CG2 4.23Å; N291-V295 HydrophobicContact CB-CG2 4.25Å; Q293-V295 PolarHBondContact O-N 3.42Å; V295-E297 HydrophobicContact CG1-CB 4.46Å; V295-E297 WeakPolarHBondContact CG1-O 3.25Å; V295-V299 WeakPolarHBondContact CG1-O 3.37Å; V295-F300 HydrophobicContact CG1-CB 4.3Å; V295-F300 HydrophobicContact CG1-CD2 4.25Å; V295-F300 HydrophobicContact CG2-CB 4.17Å; V295-F300 HydrophobicContact CG2-CD2 3.55Å; V295-F300 HydrophobicContact CG2-CE2 4.11Å; V295-F300 HydrophobicContact CG2-CG 3.92Å
296	Q	84.7	Confident	80.1	Confident	158 Å²	158	84.3 Å²	84.3	74%	0.738	42%	0.423	S	S	*	.			trans	-87.3	-17.2	175.6	-64.2	-155	-38.7	0	0	113	Q273 L294	Q273-Q296 PolarHBondContact O-NE2 3.45Å; L294-Q296 PolarHBondContact O-N 2.98Å
297	E	81.2	Confident	80.1	Confident	139 Å²	139	81.8 Å²	81.8	65%	0.65	41%	0.413	S	S	*	.	S	Bend	trans	-87.8	165.4	171.9	-61.2	-176.7	-174.2	0	0	110.9	W260 V295 V299	W260-E297 WeakPolarHBondContact CZ2-O 3.24Å; V295-E297 HydrophobicContact CG1-CB 4.46Å; V295-E297 WeakPolarHBondContact CG1-O 3.25Å; E297-V299 VanDerWaalsContact C-N 3.28Å; E297-V299 HydrophobicContact CB-CG1 4.31Å; E297-V299 PolarHBondContact O-N 3.28Å
298	N	87.3	Confident	79.2	Confident	48 Å²	48	85.6 Å²	85.6	26%	0.257	44%	0.437	S	S	.	.	S	Bend	trans	-93.2	17.6	-178.5	-90.4	84.6	0	0	0	113.2	E259 W260 P262	E259-N298 WeakPolarHBondContact CA-O 3.3Å; W260-N298 VanDerWaalsContact CD1-ND2 3.31Å; W260-N298 PolarHBondContact N-O 2.8Å; W260-N298 PolarHBondContact NE1-ND2 3.49Å; W260-N298 WeakPolarHBondContact O-CB 3.37Å; W260-N298 PolarHBondContact O-ND2 2.69Å; P262-N298 WeakPolarHBondContact CD-ND2 3.34Å
299	V	83.5	Confident	78.5	Confident	50 Å²	50	82.2 Å²	82.2	30%	0.303	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	142.6	-177	65	0	0	0	0	109.6	L257 L258 V295 E297	L257-V299 HydrophobicContact CD1-CG2 3.68Å; L257-V299 HydrophobicContact CG-CG2 4.32Å; L258-V299 CarbonylContact O-C 3.56Å; L258-V299 VanDerWaalsContact O-CA 3.22Å; L258-V299 WeakPolarHBondContact O-CA 3.46Å; L258-V299 VanDerWaalsContact O-CG2 3.28Å; L258-V299 WeakPolarHBondContact O-CG2 3.49Å; V295-V299 WeakPolarHBondContact CG1-O 3.37Å; E297-V299 VanDerWaalsContact C-N 3.28Å; E297-V299 HydrophobicContact CB-CG1 4.31Å; E297-V299 PolarHBondContact O-N 3.28Å
300	F	86.8	Confident	77.8	Confident	50 Å²	50	81.8 Å²	81.8	22%	0.219	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	142.2	178	-176.9	-103.8	0	0	0	112.5	L258 W260 V277 A290 N291 V295 V302	L258-F300 PolarHBondContact N-O 2.88Å; L258-F300 PolarHBondContact O-N 3.25Å; W260-F300 HydrophobicContact CH2-CB 3.64Å; W260-F300 HydrophobicContact CZ3-CB 3.79Å; V277-F300 HydrophobicContact CB-CD1 4.14Å; V277-F300 HydrophobicContact CG1-CD1 4.21Å; V277-F300 HydrophobicContact CG2-CB 4.16Å; V277-F300 HydrophobicContact CG2-CD1 4Å; V277-F300 HydrophobicContact CG2-CG 4.22Å; A290-F300 HydrophobicContact CB-CE1 3.9Å; N291-F300 HydrophobicContact CB-CE1 4.15Å; N291-F300 HydrophobicContact CB-CE2 3.95Å; N291-F300 HydrophobicContact CB-CZ 3.63Å; V295-F300 HydrophobicContact CG1-CB 4.3Å; V295-F300 HydrophobicContact CG1-CD2 4.25Å; V295-F300 HydrophobicContact CG2-CB 4.17Å; V295-F300 HydrophobicContact CG2-CD2 3.55Å; V295-F300 HydrophobicContact CG2-CE2 4.11Å; V295-F300 HydrophobicContact CG2-CG 3.92Å; F300-V302 HydrophobicContact CD1-CG2 3.93Å; F300-V302 HydrophobicContact CE1-CG2 4.03Å
301	T	85.9	Confident	77.5	Confident	50 Å²	50	80.9 Å²	80.9	31%	0.307	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	118.8	172.3	-48	0	0	0	0	110.2	V256 L257 E303	V256-T301 CarbonylContact O-C 3.54Å; V256-T301 WeakPolarHBondContact O-CA 3.46Å; L257-T301 WeakPolarHBondContact CD1-OG1 3.39Å; T301-E303 HydrophobicContact CG2-CG 3.87Å
302	V	83	Confident	77.2	Confident	3 Å²	3	80.8 Å²	80.8	2%	0.018	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	108.4	168.8	-174.6	0	0	0	0	108.6	G255 V256 L258 V277 Y279 A290 F300 L305 F313	G255-V302 CarbonylContact C-O 3.56Å; G255-V302 WeakPolarHBondContact CA-O 3.42Å; V256-V302 PolarHBondContact N-O 3.4Å; V256-V302 PolarHBondContact O-N 2.86Å; L258-V302 HydrophobicContact CD1-CG2 3.78Å; V277-V302 HydrophobicContact CG1-CG2 3.96Å; Y279-V302 HydrophobicContact CD1-CG1 4.15Å; Y279-V302 HydrophobicContact CE1-CG1 4.47Å; Y279-V302 HydrophobicContact CG-CG1 4.28Å; A290-V302 HydrophobicContact CB-CB 4.46Å; A290-V302 HydrophobicContact CB-CG1 3.91Å; A290-V302 HydrophobicContact CB-CG2 3.87Å; F300-V302 HydrophobicContact CD1-CG2 3.93Å; F300-V302 HydrophobicContact CE1-CG2 4.03Å; V302-L305 HydrophobicContact CB-CD1 4.38Å; V302-L305 HydrophobicContact CG1-CD1 4.14Å; V302-L305 HydrophobicContact CG1-CD2 3.98Å; V302-L305 HydrophobicContact CG1-CG 4.17Å; V302-F313 HydrophobicContact CB-CD1 4.43Å; V302-F313 HydrophobicContact CB-CE1 3.91Å; V302-F313 HydrophobicContact CG1-CE1 3.95Å; V302-F313 HydrophobicContact CG2-CD1 3.95Å; V302-F313 HydrophobicContact CG2-CE1 3.95Å
303	E	81.2	Confident	77.7	Confident	137 Å²	137	71 Å²	71	64%	0.64	37%	0.365	S	S	*	.			trans	-97.4	172.1	-176.4	-61.4	-177.3	176.3	0	0	113	T301 L305	T301-E303 HydrophobicContact CG2-CG 3.87Å; E303-L305 VanDerWaalsContact C-N 3.29Å; E303-L305 PolarHBondContact O-N 3.43Å
304	S	72.9	Confident	77.8	Confident	110 Å²	110	65.3 Å²	65.3	77%	0.769	34%	0.336	S	S	*	.	S	Bend	trans	61.5	27.8	176.7	-57.9	0	0	0	0	115.6	Q254	Q254-S304 PolarHBondContact O-N 3.24Å
305	L	74.4	Confident	77.8	Confident	5 Å²	5	62.2 Å²	62.2	3%	0.026	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-75.6	151	174.2	-61.7	172.8	0	0	0	111	Q254 V256 Y279 V302 E303 Y311 F313 I335	Q254-L305 PolarHBondContact O-N 2.96Å; V256-L305 HydrophobicContact CB-CD1 4.31Å; V256-L305 HydrophobicContact CG2-CD1 3.77Å; Y279-L305 HydrophobicContact CD2-CD2 3.6Å; Y279-L305 HydrophobicContact CE2-CD2 3.45Å; Y279-L305 VanDerWaalsContact CE2-CD2 3.45Å; Y279-L305 HydrophobicContact CG-CD2 4.44Å; V302-L305 HydrophobicContact CB-CD1 4.38Å; V302-L305 HydrophobicContact CG1-CD1 4.14Å; V302-L305 HydrophobicContact CG1-CD2 3.98Å; V302-L305 HydrophobicContact CG1-CG 4.17Å; E303-L305 VanDerWaalsContact C-N 3.29Å; E303-L305 PolarHBondContact O-N 3.43Å; L305-Y311 HydrophobicContact CB-CE2 4.07Å; L305-Y311 HydrophobicContact CD2-CD1 4.11Å; L305-Y311 HydrophobicContact CD2-CD2 4.43Å; L305-Y311 HydrophobicContact CD2-CE1 3.97Å; L305-Y311 HydrophobicContact CD2-CE2 4.3Å; L305-Y311 HydrophobicContact CD2-CG 4.32Å; L305-F313 HydrophobicContact CD1-CE1 4.02Å; L305-F313 HydrophobicContact CD1-CZ 3.71Å; L305-I335 HydrophobicContact CB-CD1 4.41Å; L305-I335 HydrophobicContact CB-CG1 4.06Å; L305-I335 HydrophobicContact CD1-CD1 3.83Å; L305-I335 HydrophobicContact CD1-CG1 4.31Å
306	R	67.8	Low	77.7	Confident	195 Å²	195	64 Å²	64	74%	0.736	32%	0.324	S	S	*	.	P	Polyproline II helix	trans	-78.6	129	-177.9	-63.4	-173.5	177.8	-156.9	-0.1	110.8	G309 Y311	R306-G309 PolarHBondContact O-N 3.45Å; R306-Y311 WeakPolarHBondContact CB-OH 3.44Å; R306-Y311 PolarHBondContact N-OH 3.04Å
307	P	56.7	Low	77.6	Confident	69 Å²	69	56.4 Å²	56.4	45%	0.448	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	144.3	169.9	-23.8	33.4	0	0	0	111.8	G309 P337	P307-G309 PolarHBondContact O-N 3.37Å; P307-P337 HydrophobicContact CB-CB 4.42Å
308	N	57.7	Low	77.7	Confident	127 Å²	127	53.6 Å²	53.6	68%	0.679	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.4	6.4	-170.7	-57.2	-28.6	0	0	0	115.4	I335 P337	N308-I335 VanDerWaalsContact CA-O 3.22Å; N308-I335 WeakPolarHBondContact CA-O 3.4Å; N308-I335 PolarHBondContact N-O 3.14Å; N308-P337 WeakPolarHBondContact OD1-CD 3.09Å
309	G	60.5	Low	77.4	Confident	17 Å²	17	51.7 Å²	51.7	18%	0.175	27%	0.265	C	S	.	.			trans	-79.5	142.3	170.2	0	0	0	0	0	112.1	R306 P307 I335	R306-G309 PolarHBondContact O-N 3.45Å; P307-G309 PolarHBondContact O-N 3.37Å; G309-I335 PolarHBondContact O-N 2.94Å
310	V	69.2	Low	77.1	Confident	58 Å²	58	55.8 Å²	55.8	35%	0.352	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	130	167.7	-169.8	0	0	0	0	108.5	Y282 V333 A334	Y282-V310 HydrophobicContact CD2-CG1 4.33Å; Y282-V310 HydrophobicContact CG-CG1 4.11Å; Y282-V310 PolarHBondContact N-O 3.05Å; V310-V333 CarbonylContact C-O 3.42Å; V310-V333 WeakPolarHBondContact CA-O 3.4Å; V310-A334 HydrophobicContact CG2-CB 4.12Å
311	Y	75	Confident	76.3	Confident	13 Å²	13	57.2 Å²	57.2	5%	0.051	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	149.4	-174.3	-67.7	-89.5	0	0	0	112.4	Y279 R280 V281 L305 R306 G332 V333 I335	Y279-Y311 AromaticContact CD2-CD1 3.78Å; Y279-Y311 HydrophobicContact CD2-CD1 3.78Å; Y279-Y311 HydrophobicContact CD2-CE1 4.05Å; Y279-Y311 HydrophobicContact CE2-CD1 4.2Å; Y279-Y311 AromaticContact CE2-CE1 3.99Å; Y279-Y311 HydrophobicContact CE2-CE1 3.99Å; R280-Y311 CarbonylContact O-C 3.45Å; R280-Y311 WeakPolarHBondContact O-CA 3.39Å; R280-Y311 WeakPolarHBondContact O-CD1 3.26Å; V281-Y311 HydrophobicContact CG2-CD1 4.14Å; V281-Y311 HydrophobicContact CG2-CE1 3.66Å; L305-Y311 HydrophobicContact CB-CE2 4.07Å; L305-Y311 HydrophobicContact CD2-CD1 4.11Å; L305-Y311 HydrophobicContact CD2-CD2 4.43Å; L305-Y311 HydrophobicContact CD2-CE1 3.97Å; L305-Y311 HydrophobicContact CD2-CE2 4.3Å; L305-Y311 HydrophobicContact CD2-CG 4.32Å; R306-Y311 WeakPolarHBondContact CB-OH 3.44Å; R306-Y311 PolarHBondContact N-OH 3.04Å; Y311-G332 CarbonylContact O-C 3.6Å; Y311-V333 PolarHBondContact N-O 3.36Å; Y311-V333 PolarHBondContact O-N 3.35Å; Y311-I335 HydrophobicContact CD2-CD1 4.43Å; Y311-I335 HydrophobicContact CD2-CG1 3.72Å; Y311-I335 HydrophobicContact CE2-CG1 3.93Å
312	E	78.4	Confident	75.5	Confident	12 Å²	12	55.7 Å²	55.7	6%	0.056	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	149.2	164.3	-61.9	-166.2	97.5	0	0	110.5	Y279 R280 Y282 W287 S329	Y279-E312 CarbonylContact C-O 3.6Å; Y279-E312 WeakPolarHBondContact CA-O 3.41Å; R280-E312 HydrophobicContact CG-CB 4.09Å; R280-E312 IonicContact CZ-OE2 3.74Å; R280-E312 PolarHBondContact N-O 2.81Å; R280-E312 IonicContact NE-OE2 2.67Å; R280-E312 PolarHBondContact NE-OE2 2.87Å; R280-E312 IonicContact NH2-OE2 3.18Å; R280-E312 PolarHBondContact NH2-OE2 3.06Å; R280-E312 PolarHBondContact O-N 3.46Å; Y282-E312 HydrophobicContact CD2-CG 3.61Å; Y282-E312 HydrophobicContact CE2-CG 4.14Å; W287-E312 HydrophobicContact CH2-CB 3.8Å; W287-E312 HydrophobicContact CZ3-CB 4.3Å; E312-S329 WeakPolarHBondContact OE1-CB 3.38Å; E312-S329 PolarHBondContact OE1-OG 3.17Å
313	F	84.9	Confident	75.2	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	147.3	177.7	-53.6	-80.7	0	0	0	111.2	P246 V256 L258 E278 Y279 V302 L305 S329 S330 V333	P246-F313 HydrophobicContact CG-CB 4.46Å; V256-F313 HydrophobicContact CB-CE2 4.12Å; V256-F313 HydrophobicContact CB-CZ 3.9Å; V256-F313 HydrophobicContact CG1-CE2 3.96Å; V256-F313 HydrophobicContact CG1-CZ 4.24Å; V256-F313 HydrophobicContact CG2-CE2 3.99Å; V256-F313 HydrophobicContact CG2-CZ 3.75Å; L258-F313 HydrophobicContact CD1-CB 3.58Å; L258-F313 HydrophobicContact CD1-CD1 3.76Å; L258-F313 HydrophobicContact CD1-CD2 4.32Å; L258-F313 HydrophobicContact CD1-CG 3.63Å; L258-F313 HydrophobicContact CD2-CB 4.15Å; L258-F313 HydrophobicContact CD2-CD2 3.86Å; L258-F313 HydrophobicContact CD2-CE2 4.48Å; L258-F313 HydrophobicContact CD2-CG 4Å; L258-F313 HydrophobicContact CG-CG 4.4Å; E278-F313 CarbonylContact O-C 3.46Å; E278-F313 WeakPolarHBondContact O-CA 3.49Å; Y279-F313 VanDerWaalsContact CB-CD1 3.43Å; Y279-F313 HydrophobicContact CG-CE1 4.38Å; V302-F313 HydrophobicContact CB-CD1 4.43Å; V302-F313 HydrophobicContact CB-CE1 3.91Å; V302-F313 HydrophobicContact CG1-CE1 3.95Å; V302-F313 HydrophobicContact CG2-CD1 3.95Å; V302-F313 HydrophobicContact CG2-CE1 3.95Å; L305-F313 HydrophobicContact CD1-CE1 4.02Å; L305-F313 HydrophobicContact CD1-CZ 3.71Å; F313-S329 CarbonylContact O-C 3.57Å; F313-S329 VanDerWaalsContact O-CA 3.23Å; F313-S329 WeakPolarHBondContact O-CA 3.45Å; F313-S330 PolarHBondContact N-OG 2.94Å; F313-S330 PolarHBondContact O-N 3.34Å; F313-V333 HydrophobicContact CD2-CB 4.48Å; F313-V333 HydrophobicContact CD2-CG2 3.94Å; F313-V333 HydrophobicContact CE2-CB 3.86Å; F313-V333 HydrophobicContact CE2-CG1 4.28Å; F313-V333 HydrophobicContact CE2-CG2 3.82Å
314	R	87.9	Confident	74.7	Confident	46 Å²	46	51.2 Å²	51.2	17%	0.174	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	163.1	171.9	74.1	-174.9	-171.7	-177.4	-2.5	110.6	E278 W287 P326	E278-R314 HydrophobicContact CB-CG 3.91Å; E278-R314 PolarHBondContact N-O 3.49Å; E278-R314 PolarHBondContact O-N 3.2Å; E278-R314 IonicContact OE2-CZ 3.83Å; E278-R314 IonicContact OE2-NE 3.71Å; E278-R314 PolarHBondContact OE2-NE 3.47Å; E278-R314 IonicContact OE2-NH2 2.78Å; E278-R314 PolarHBondContact OE2-NH2 3.47Å; W287-R314 HydrophobicContact CD2-CG 4.25Å; W287-R314 HydrophobicContact CE3-CG 3.71Å; W287-R314 VanDerWaalsContact CG-CZ 3.5Å; W287-R314 HydrophobicContact CH2-CB 4.03Å; W287-R314 HydrophobicContact CH2-CG 3.97Å; W287-R314 HydrophobicContact CZ2-CG 4.47Å; W287-R314 HydrophobicContact CZ3-CB 3.93Å; W287-R314 HydrophobicContact CZ3-CG 3.57Å; R314-P326 HydrophobicContact CG-CB 4.41Å
315	V	85.3	Confident	74.6	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	144	-176.5	-168.2	0	0	0	0	110.9	P243 P246 W260 Y275 Q276 V277 S327	P243-V315 HydrophobicContact CB-CB 4.37Å; P243-V315 HydrophobicContact CB-CG1 4.43Å; P243-V315 WeakPolarHBondContact CD-O 3.42Å; P243-V315 HydrophobicContact CG-CB 4.29Å; P243-V315 HydrophobicContact CG-CG1 4.12Å; P246-V315 HydrophobicContact CB-CG2 3.96Å; P246-V315 HydrophobicContact CG-CG2 4.11Å; W260-V315 HydrophobicContact CB-CG2 4.49Å; W260-V315 HydrophobicContact CD2-CB 4.38Å; W260-V315 HydrophobicContact CD2-CG1 4.01Å; W260-V315 HydrophobicContact CD2-CG2 3.81Å; W260-V315 HydrophobicContact CE3-CG2 3.78Å; W260-V315 HydrophobicContact CG-CB 4.45Å; W260-V315 HydrophobicContact CG-CG1 4.31Å; W260-V315 HydrophobicContact CG-CG2 4.12Å; W260-V315 HydrophobicContact CZ2-CG1 4.07Å; W260-V315 HydrophobicContact CZ3-CG2 4.3Å; Y275-V315 HydrophobicContact CD1-CG1 4.02Å; Y275-V315 HydrophobicContact CG-CG1 4.13Å; Q276-V315 CarbonylContact O-C 3.6Å; Q276-V315 WeakPolarHBondContact O-CA 3.41Å; V277-V315 HydrophobicContact CG2-CG1 4.36Å; V277-V315 HydrophobicContact CG2-CG2 4.37Å; V315-S327 PolarHBondContact N-OG 3.07Å; V315-S327 PolarHBondContact O-N 3.11Å
316	R	86.6	Confident	74.6	Confident	56 Å²	56	51.8 Å²	51.8	21%	0.211	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	129.7	178.2	-53.9	-171.6	65.9	174.1	-2.6	110.1	Y275 Q276 E278 L323 G324 P326	Y275-R316 CarbonylContact C-O 3.49Å; Y275-R316 WeakPolarHBondContact CA-O 3.27Å; Q276-R316 HydrophobicContact CB-CB 4.4Å; Q276-R316 PolarHBondContact N-O 3.16Å; Q276-R316 PolarHBondContact O-N 3.23Å; E278-R316 WeakPolarHBondContact OE1-CD 3.35Å; E278-R316 IonicContact OE1-NH1 3.83Å; R316-L323 HydrophobicContact CB-CD1 3.67Å; R316-L323 HydrophobicContact CB-CG 4.18Å; R316-L323 VanDerWaalsContact CZ-CD2 3.5Å; R316-L323 PolarHBondContact NH2-O 2.97Å; R316-G324 PolarHBondContact NE-O 3.18Å; R316-G324 PolarHBondContact NH2-O 3.35Å; R316-P326 HydrophobicContact CG-CB 3.94Å
317	G	83	Confident	75.2	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	139.8	171.2	0	0	0	0	0	111.3	G324	G317-G324 PolarHBondContact O-N 3.27Å
318	K	83.2	Confident	75.6	Confident	79 Å²	79	42.1 Å²	42.1	34%	0.343	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	136.5	175.4	-164.5	175.5	179.9	177.5	0	111.1	P272 Q273 G274 L294 G322 L323	P272-K318 CarbonylContact C-O 3.56Å; P272-K318 WeakPolarHBondContact CA-O 3.4Å; Q273-K318 PolarHBondContact N-O 2.75Å; G274-K318 PolarHBondContact N-O 2.79Å; G274-K318 PolarHBondContact O-N 3.33Å; L294-K318 HydrophobicContact CD1-CB 4.24Å; L294-K318 HydrophobicContact CD1-CD 3.91Å; L294-K318 HydrophobicContact CD1-CG 4.42Å; L294-K318 HydrophobicContact CD2-CB 4.11Å; L294-K318 HydrophobicContact CD2-CD 3.76Å; L294-K318 HydrophobicContact CG-CD 4.43Å; K318-G322 WeakPolarHBondContact CA-O 3.47Å; K318-G322 WeakPolarHBondContact CG-O 3.11Å; K318-L323 HydrophobicContact CB-CD1 3.78Å; K318-L323 HydrophobicContact CD-CD1 4.18Å; K318-L323 HydrophobicContact CG-CB 4.28Å; K318-L323 HydrophobicContact CG-CD1 4.07Å
319	N	82.2	Confident	76.3	Confident	9 Å²	9	36.8 Å²	36.8	5%	0.048	19%	0.19	C	C	.	.			trans	-131.7	-165.7	171.9	70.7	12.4	0	0	0	110.6	G238 P240 S270 P271 Q273 D321 G322	G238-N319 PolarHBondContact O-ND2 3.05Å; P240-N319 VanDerWaalsContact CD-CG 3.47Å; P240-N319 WeakPolarHBondContact CD-ND2 3.48Å; P240-N319 HydrophobicContact CG-CB 3.78Å; S270-N319 WeakPolarHBondContact CB-ND2 3.17Å; S270-N319 PolarHBondContact O-ND2 2.76Å; P271-N319 WeakPolarHBondContact O-CB 3.34Å; Q273-N319 HydrophobicContact CG-CB 4.36Å; N319-D321 PolarHBondContact O-N 3.32Å; N319-D321 WeakPolarHBondContact OD1-CA 3.27Å; N319-D321 WeakPolarHBondContact OD1-CB 3.43Å; N319-D321 PolarHBondContact OD1-N 3.07Å; N319-G322 PolarHBondContact N-O 3.09Å; N319-G322 PolarHBondContact OD1-N 2.96Å
320	Q	75.6	Confident	76.5	Confident	136 Å²	136	36.7 Å²	36.7	64%	0.636	19%	0.187	S	C	*	.	S	Bend	trans	-60.9	-29.2	178.5	72.7	-165.9	5.6	0	0	113.9
321	D	71.6	Confident	76.3	Confident	79 Å²	79	34.7 Å²	34.7	42%	0.422	18%	0.178	S	C	.	.	S	Bend	trans	-93.1	-22.9	-171.3	-57.7	-62.1	0	0	0	111.5	N319	N319-D321 PolarHBondContact O-N 3.32Å; N319-D321 WeakPolarHBondContact OD1-CA 3.27Å; N319-D321 WeakPolarHBondContact OD1-CB 3.43Å; N319-D321 PolarHBondContact OD1-N 3.07Å
322	G	69.2	Low	75.6	Confident	19 Å²	19	35.6 Å²	35.6	20%	0.196	19%	0.192	C	C	.	.			trans	163.4	-168.7	171.3	0	0	0	0	0	115.6	K318 N319	K318-G322 WeakPolarHBondContact CA-O 3.47Å; K318-G322 WeakPolarHBondContact CG-O 3.11Å; N319-G322 PolarHBondContact N-O 3.09Å; N319-G322 PolarHBondContact OD1-N 2.96Å
323	L	75.5	Confident	75.1	Confident	42 Å²	42	35.9 Å²	35.9	22%	0.22	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	112.4	172.5	-178	68.7	0	0	0	108.7	Q276 R316 K318	Q276-L323 HydrophobicContact CB-CD1 4.02Å; R316-L323 HydrophobicContact CB-CD1 3.67Å; R316-L323 HydrophobicContact CB-CG 4.18Å; R316-L323 VanDerWaalsContact CZ-CD2 3.5Å; R316-L323 PolarHBondContact NH2-O 2.97Å; K318-L323 HydrophobicContact CB-CD1 3.78Å; K318-L323 HydrophobicContact CD-CD1 4.18Å; K318-L323 HydrophobicContact CG-CB 4.28Å; K318-L323 HydrophobicContact CG-CD1 4.07Å
324	G	71.6	Confident	74.3	Confident	4 Å²	4	38.1 Å²	38.1	4%	0.041	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	-179.7	-176.3	0	0	0	0	0	114.4	P240 R316 G317	P240-G324 WeakPolarHBondContact O-CA 3.29Å; R316-G324 PolarHBondContact NE-O 3.18Å; R316-G324 PolarHBondContact NH2-O 3.35Å; G317-G324 PolarHBondContact O-N 3.27Å
325	H	69.4	Low	73.4	Confident	93 Å²	93	36 Å²	36	43%	0.431	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	149.5	176.3	-65.1	-78.6	0	0	0	111.2	A242	A242-H325 HydrophobicContact CB-CB 4.46Å
326	P	75.8	Confident	71.6	Confident	34 Å²	34	45.2 Å²	45.2	22%	0.221	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	152.4	176.3	30.7	-34.7	0	0	0	112.7	R314 R316	R314-P326 HydrophobicContact CG-CB 4.41Å; R316-P326 HydrophobicContact CG-CB 3.94Å
327	S	78.9	Confident	69.5	Low	8 Å²	8	46.1 Å²	46.1	6%	0.056	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-60.8	164.2	162.6	72.7	0	0	0	0	111.5	P243 G244 P246 V315	P243-S327 WeakPolarHBondContact O-CB 3.49Å; G244-S327 WeakPolarHBondContact O-CB 3.32Å; P246-S327 WeakPolarHBondContact CD-OG 3.23Å; V315-S327 PolarHBondContact N-OG 3.07Å; V315-S327 PolarHBondContact O-N 3.11Å
328	M	65.4	Low	67.2	Low	53 Å²	53	50.1 Å²	50.1	26%	0.261	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-51.9	152.4	156.4	-59.9	-58.4	-72	0	0	110.4	N196 T198 R245 P246	N196-M328 VanDerWaalsContact O-CE 3.29Å; N196-M328 WeakPolarHBondContact O-CE 3.45Å; T198-M328 HydrophobicContact CG2-SD 3.67Å; T198-M328 PolarHBondContact OG1-SD 2.94Å; R245-M328 HydrophobicContact CB-CB 4.15Å; R245-M328 HydrophobicContact CG-CB 4.12Å; P246-M328 WeakPolarHBondContact CD-O 3.45Å
329	S	73.1	Confident	64.8	Low	14 Å²	14	50.4 Å²	50.4	10%	0.098	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-74.8	157.5	175.9	67.3	0	0	0	0	112	N196 R245 E312 F313 G331	N196-S329 PolarHBondContact ND2-OG 3.44Å; N196-S329 VanDerWaalsContact ND2-OG 3.15Å; R245-S329 WeakPolarHBondContact CD-O 3.33Å; R245-S329 WeakPolarHBondContact CG-O 3.49Å; R245-S329 PolarHBondContact NE-O 3.32Å; E312-S329 WeakPolarHBondContact OE1-CB 3.38Å; E312-S329 PolarHBondContact OE1-OG 3.17Å; F313-S329 CarbonylContact O-C 3.57Å; F313-S329 VanDerWaalsContact O-CA 3.23Å; F313-S329 WeakPolarHBondContact O-CA 3.45Å; S329-G331 PolarHBondContact O-N 2.97Å; S329-G331 VanDerWaalsContact O-N 3.17Å
330	S	65.1	Low	62.4	Low	15 Å²	15	56 Å²	56	11%	0.105	34%	0.339	C	S	.	.			trans	-57.7	-23.1	171.9	55	0	0	0	0	113.5	R245 F313	R245-S330 PolarHBondContact NH2-O 3.12Å; F313-S330 PolarHBondContact N-OG 2.94Å; F313-S330 PolarHBondContact O-N 3.34Å
331	G	64.3	Low	60.5	Low	16 Å²	16	58.8 Å²	58.8	17%	0.165	35%	0.352	C	S	.	.			trans	83.4	178.9	-154.7	0	0	0	0	0	111.1	S329	S329-G331 PolarHBondContact O-N 2.97Å; S329-G331 VanDerWaalsContact O-N 3.17Å
332	G	60.6	Low	58.5	Low	33 Å²	33	66.3 Å²	66.3	34%	0.34	38%	0.375	S	S	.	.			trans	-79.2	122.8	-175.8	0	0	0	0	0	113.3	Y311	Y311-G332 CarbonylContact O-C 3.6Å
333	V	68.1	Low	56.7	Low	17 Å²	17	74.5 Å²	74.5	10%	0.103	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	114.8	-176	-172.1	0	0	0	0	109.2	V248 V251 V256 V310 Y311 F313	V248-V333 HydrophobicContact CG1-CG1 4.45Å; V248-V333 HydrophobicContact CG2-CB 4.49Å; V248-V333 HydrophobicContact CG2-CG1 4.03Å; V248-V333 HydrophobicContact CG2-CG2 3.61Å; V251-V333 HydrophobicContact CG2-CG1 3.9Å; V256-V333 HydrophobicContact CG2-CG1 4.26Å; V310-V333 CarbonylContact C-O 3.42Å; V310-V333 WeakPolarHBondContact CA-O 3.4Å; Y311-V333 PolarHBondContact N-O 3.36Å; Y311-V333 PolarHBondContact O-N 3.35Å; F313-V333 HydrophobicContact CD2-CB 4.48Å; F313-V333 HydrophobicContact CD2-CG2 3.94Å; F313-V333 HydrophobicContact CE2-CB 3.86Å; F313-V333 HydrophobicContact CE2-CG1 4.28Å; F313-V333 HydrophobicContact CE2-CG2 3.82Å
334	A	68.9	Low	54.6	Low	48 Å²	48	77 Å²	77	40%	0.397	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	116.7	-178.5	0	0	0	0	0	112	V310 R336	V310-A334 HydrophobicContact CG2-CB 4.12Å; A334-R336 PolarHBondContact O-N 2.89Å
335	I	67.5	Low	52.9	Low	0 Å²	0	81.8 Å²	81.8	0%	0	46%	0.455	C	S	.	.			trans	-77.5	113.2	174.4	-47.2	-55.7	0	0	0	108.6	V251 V256 L305 N308 G309 Y311	V251-I335 HydrophobicContact CG1-CD1 3.95Å; V256-I335 HydrophobicContact CG2-CD1 3.25Å; L305-I335 HydrophobicContact CB-CD1 4.41Å; L305-I335 HydrophobicContact CB-CG1 4.06Å; L305-I335 HydrophobicContact CD1-CD1 3.83Å; L305-I335 HydrophobicContact CD1-CG1 4.31Å; N308-I335 VanDerWaalsContact CA-O 3.22Å; N308-I335 WeakPolarHBondContact CA-O 3.4Å; N308-I335 PolarHBondContact N-O 3.14Å; G309-I335 PolarHBondContact O-N 2.94Å; Y311-I335 HydrophobicContact CD2-CD1 4.43Å; Y311-I335 HydrophobicContact CD2-CG1 3.72Å; Y311-I335 HydrophobicContact CE2-CG1 3.93Å
336	R	48.4	Very low	51.4	Low	195 Å²	195	82.5 Å²	82.5	74%	0.736	48%	0.476	S	S	*	.			trans	-101	136	178.1	-62.9	-178.4	-178.5	178.6	0.2	109.8	A334 A338	A334-R336 PolarHBondContact O-N 2.89Å; R336-A338 PolarHBondContact O-N 2.77Å
337	P	42.1	Very low	50.5	Low	74 Å²	74	85.3 Å²	85.3	48%	0.481	48%	0.483	S	S	.	.			trans	-59.1	138.3	177.7	24.7	-34.4	0	0	0	110.8	P307 N308 A339	P307-P337 HydrophobicContact CB-CB 4.42Å; N308-P337 WeakPolarHBondContact OD1-CD 3.09Å; P337-A339 PolarHBondContact O-N 2.89Å
338	A	35.7	Very low	49.3	Very low	85 Å²	85	93.2 Å²	93.2	70%	0.702	52%	0.516	S	S	*	.			trans	-66.4	103.8	-170.2	0	0	0	0	0	112.9	R336	R336-A338 PolarHBondContact O-N 2.77Å
339	A	32.9	Very low	49.1	Very low	84 Å²	84	95.1 Å²	95.1	69%	0.694	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-72.6	142.2	167.6	0	0	0	0	0	110.7	P337 Q341	P337-A339 PolarHBondContact O-N 2.89Å; A339-Q341 PolarHBondContact O-N 2.72Å
340	P	30.8	Very low	48.7	Very low	126 Å²	126	96.7 Å²	96.7	82%	0.818	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-69.8	118	-179	27.8	-34	0	0	0	111.2	R342	P340-R342 PolarHBondContact O-N 2.69Å
341	Q	35.8	Very low	48.3	Very low	195 Å²	195	104.3 Å²	104.3	91%	0.911	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-59.2	126.3	-179.4	-69.7	-173.9	-6.8	0	0	112.6	A339	A339-Q341 PolarHBondContact O-N 2.72Å
342	R	29.4	Very low	48.4	Very low	238 Å²	238	108 Å²	108	90%	0.898	60%	0.599	S	S	*	*			trans	-140.2	132.9	158.9	-75	-168.5	169.7	-174.1	-2.3	110	P340	P340-R342 PolarHBondContact O-N 2.69Å
343	H	31.6	Very low	49.1	Very low	191 Å²	191	107.3 Å²	107.3	88%	0.884	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-65.6	132.6	175.4	-69.4	-93.7	0	0	0	111.2
344	V	31.8	Very low	49.6	Very low	95 Å²	95	112.9 Å²	112.9	58%	0.576	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-97.6	117.6	159.9	-177	0	0	0	0	107.7
345	P	35.3	Very low	50.3	Low	104 Å²	104	113.5 Å²	113.5	68%	0.675	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-75.3	146.4	176.8	30.6	-33.8	0	0	0	111.2	R347	P345-R347 PolarHBondContact O-N 3.44Å
346	A	37.6	Very low	51.2	Low	107 Å²	107	113.8 Å²	113.8	88%	0.884	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-57.3	125.3	179.6	0	0	0	0	0	111.9
347	R	57.4	Low	52.8	Low	93 Å²	93	105.9 Å²	105.9	35%	0.351	59%	0.594	S	S	.	*	P	Polyproline II helix	trans	-77.1	146.3	-176.9	-59.8	179.6	-170.4	136.7	4.9	110.9	P345 E385	P345-R347 PolarHBondContact O-N 3.44Å; R347-E385 IonicContact NH1-OE1 3.55Å; R347-E385 PolarHBondContact NH1-OE1 3.03Å
348	K	53.1	Low	54.9	Low	175 Å²	175	105.5 Å²	105.5	76%	0.761	59%	0.585	S	S	*	*			trans	-100.5	106.1	178.1	-147	173.9	-173	179.7	0	109.5	A430	K348-A430 PolarHBondContact O-N 3.03Å
349	V	60.6	Low	57.4	Low	93 Å²	93	101.5 Å²	101.5	56%	0.564	55%	0.552	S	S	*	*	B	Isolated β-bridge	trans	-78.1	145.3	-179.9	-176.3	0	0	0	0	110.2	A430 Q432	V349-A430 CarbonylContact C-O 3.6Å; V349-A430 WeakPolarHBondContact CA-O 3.42Å; V349-A430 HydrophobicContact CG2-CB 4.47Å; V349-Q432 HydrophobicContact CG1-CG 4.37Å
350	S	66	Low	59.6	Low	47 Å²	47	103.6 Å²	103.6	33%	0.329	55%	0.548	S	S	.	.			trans	-145.1	139.5	172.5	-159.5	0	0	0	0	112.6	S352 V353 I429 A430	S350-S352 PolarHBondContact O-N 2.88Å; S350-S352 PolarHBondContact OG-OG 3.1Å; S350-V353 PolarHBondContact O-N 2.99Å; S350-I429 VanDerWaalsContact CB-CG2 3.46Å; S350-A430 PolarHBondContact N-O 3.5Å
351	E	57.1	Low	61.9	Low	174 Å²	174	102.8 Å²	102.8	81%	0.813	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-5.9	179.3	-54.5	-178.3	146	0	0	113.4
352	S	65.6	Low	63.9	Low	95 Å²	95	97 Å²	97	66%	0.664	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-13.4	178.8	58.8	0	0	0	0	114.4	S350	S350-S352 PolarHBondContact O-N 2.88Å; S350-S352 PolarHBondContact OG-OG 3.1Å
353	V	76.1	Confident	65.9	Low	18 Å²	18	91 Å²	91	11%	0.109	49%	0.494	C	S	.	.	S	Bend	trans	-104	121.1	177.8	-171.8	0	0	0	0	108.8	S350 V426 I429 S431	S350-V353 PolarHBondContact O-N 2.99Å; V353-V426 HydrophobicContact CG1-CB 4.34Å; V353-V426 HydrophobicContact CG1-CG2 3.85Å; V353-I429 HydrophobicContact CG2-CB 4.29Å; V353-I429 HydrophobicContact CG2-CG2 3.84Å; V353-S431 WeakPolarHBondContact O-CB 3.36Å
354	Q	77.3	Confident	67.6	Low	133 Å²	133	83.9 Å²	83.9	62%	0.621	46%	0.464	S	S	*	.	P	Polyproline II helix	trans	-71.8	136.4	-179	-68.9	-170	-39.1	0	0	111.6	S376 S424	Q354-S376 WeakPolarHBondContact O-CB 3.37Å; Q354-S376 PolarHBondContact O-OG 3.34Å; Q354-S424 PolarHBondContact O-OG 3.37Å
355	P	84	Confident	69.1	Low	62 Å²	62	80 Å²	80	40%	0.403	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-66	156.1	173.7	29.8	-35.4	0	0	0	111.4	S376	P355-S376 VanDerWaalsContact O-CB 3.32Å; P355-S376 WeakPolarHBondContact O-CB 3.49Å
356	P	86.4	Confident	70.1	Confident	6 Å²	6	77 Å²	77	4%	0.039	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-68.7	167.7	168.7	31.4	-32.7	0	0	0	111	A374 Y382 V422 S434	P356-A374 WeakPolarHBondContact CB-O 3.22Å; P356-Y382 HydrophobicContact CB-CD1 4.27Å; P356-Y382 HydrophobicContact CB-CE1 3.93Å; P356-Y382 HydrophobicContact CG-CD1 4.24Å; P356-Y382 HydrophobicContact CG-CE1 4.33Å; P356-V422 WeakPolarHBondContact CD-O 3.49Å; P356-V422 HydrophobicContact CG-CB 3.67Å; P356-V422 HydrophobicContact CG-CG1 3.77Å; P356-V422 VanDerWaalsContact CG-O 3.28Å; P356-V422 WeakPolarHBondContact CG-O 3.48Å; P356-S434 WeakPolarHBondContact O-CB 3.37Å
357	G	81.6	Confident	71.4	Confident	28 Å²	28	74.4 Å²	74.4	29%	0.289	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-63.7	160.6	171.7	0	0	0	0	0	112.3	A374	G357-A374 PolarHBondContact N-O 3.34Å
358	Q	87.2	Confident	72	Confident	66 Å²	66	71.6 Å²	71.6	31%	0.308	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-49.2	129.2	175.4	-164.9	-166.4	15.7	0	0	111	Q360 E435 T436	Q358-Q360 PolarHBondContact O-N 2.9Å; Q358-E435 HydrophobicContact CG-CB 4.38Å; Q358-T436 WeakPolarHBondContact CG-O 3.49Å; Q358-T436 PolarHBondContact NE2-O 2.59Å
359	P	87.7	Confident	73.2	Confident	1 Å²	1	63.2 Å²	63.2	1%	0.006	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-70.2	126	177	26.4	-31.3	0	0	0	110.7	W373 F420 V422 E435 S437	P359-W373 HydrophobicContact CB-CE3 4.41Å; P359-F420 HydrophobicContact CG-CB 4.36Å; P359-F420 VanDerWaalsContact CG-O 3.31Å; P359-F420 WeakPolarHBondContact CG-O 3.38Å; P359-V422 HydrophobicContact CB-CG2 3.82Å; P359-V422 HydrophobicContact CG-CG2 3.95Å; P359-E435 WeakPolarHBondContact CD-O 3.35Å; P359-S437 WeakPolarHBondContact O-CA 3.38Å; P359-S437 VanDerWaalsContact O-CB 3.29Å; P359-S437 WeakPolarHBondContact O-CB 3.49Å
360	Q	78.5	Confident	74.2	Confident	129 Å²	129	61.9 Å²	61.9	60%	0.603	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.7	138.5	-179.4	-61.8	-163.4	-35	0	0	111.1	Q358 V362 L371 E372	Q358-Q360 PolarHBondContact O-N 2.9Å; Q360-V362 PolarHBondContact O-N 3.32Å; Q360-L371 WeakPolarHBondContact O-CA 3.49Å; Q360-E372 PolarHBondContact N-O 2.85Å; Q360-E372 PolarHBondContact O-N 3.49Å
361	M	80.1	Confident	75.2	Confident	109 Å²	109	59.7 Å²	59.7	54%	0.537	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	119.7	177.6	-176.2	-167.9	79.4	0	0	110.6	V364 I440	M361-V364 HydrophobicContact CG-CG2 3.55Å; M361-V364 HydrophobicContact SD-CG2 3.4Å; M361-V364 WeakPolarHBondContact SD-CG2 3.37Å; M361-I440 HydrophobicContact CB-CD1 3.74Å; M361-I440 HydrophobicContact CB-CG1 4.24Å; M361-I440 HydrophobicContact CG-CD1 3.89Å; M361-I440 HydrophobicContact CG-CG1 4.26Å; M361-I440 HydrophobicContact CG-CG2 4.4Å; M361-I440 HydrophobicContact SD-CD1 4.4Å; M361-I440 HydrophobicContact SD-CG1 4.12Å; M361-I440 HydrophobicContact SD-CG2 3.93Å
362	V	77.8	Confident	76.8	Confident	73 Å²	73	56.6 Å²	56.6	44%	0.442	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	-40.5	177.6	-178.9	0	0	0	0	111.4	Q360 K370 E372	Q360-V362 PolarHBondContact O-N 3.32Å; V362-K370 PolarHBondContact N-O 3.04Å; V362-E372 HydrophobicContact CG2-CB 3.86Å; V362-E372 HydrophobicContact CG2-CG 3.8Å
363	E	70.5	Confident	78	Confident	111 Å²	111	52.8 Å²	52.8	52%	0.519	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	145.5	-172.9	-156.2	171	177.6	0	0	109.9	K370	E363-K370 HydrophobicContact CB-CB 3.83Å; E363-K370 HydrophobicContact CB-CD 3.92Å; E363-K370 HydrophobicContact CB-CG 4.47Å; E363-K370 PolarHBondContact N-O 2.9Å; E363-K370 PolarHBondContact O-N 2.79Å; E363-K370 WeakPolarHBondContact OE2-CD 3.21Å; E363-K370 IonicContact OE2-NZ 3.95Å; E363-K370 PolarHBondContact OE2-NZ 2.82Å
364	V	69	Low	78.5	Confident	42 Å²	42	54.8 Å²	54.8	26%	0.255	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	129.6	-179.4	-179.3	0	0	0	0	109.5	M361 V368 V369 I440 L442	M361-V364 HydrophobicContact CG-CG2 3.55Å; M361-V364 HydrophobicContact SD-CG2 3.4Å; M361-V364 WeakPolarHBondContact SD-CG2 3.37Å; V364-V368 WeakPolarHBondContact CA-O 3.46Å; V364-V369 HydrophobicContact CG1-CG2 4.46Å; V364-V369 HydrophobicContact CG2-CG2 4.49Å; V364-I440 HydrophobicContact CG2-CG2 3.79Å; V364-L442 HydrophobicContact CG1-CD2 3.7Å
365	G	62.1	Low	78.8	Confident	15 Å²	15	52 Å²	52	16%	0.155	29%	0.289	C	S	.	.			trans	-112.8	-162.7	170.6	0	0	0	0	0	111.8	D367 V368 L442	G365-D367 PolarHBondContact O-N 3Å; G365-V368 PolarHBondContact N-O 2.88Å; G365-L442 WeakPolarHBondContact O-CD2 3.47Å
366	D	57.6	Low	78.3	Confident	40 Å²	40	50.3 Å²	50.3	21%	0.214	28%	0.279	C	S	.	.	S	Bend	trans	-59.5	-44.9	-179.7	-82.6	-0.9	0	0	0	113.5	R414 T445	D366-R414 WeakPolarHBondContact O-CG 3.31Å; D366-R414 IonicContact OD2-CZ 3.13Å; D366-R414 IonicContact OD2-NH1 2.74Å; D366-R414 PolarHBondContact OD2-NH1 3.41Å; D366-R414 IonicContact OD2-NH2 3.76Å; D366-T445 PolarHBondContact N-OG1 3.17Å; D366-T445 VanDerWaalsContact N-OG1 3.08Å; D366-T445 WeakPolarHBondContact OD1-CA 3.04Å; D366-T445 PolarHBondContact OD1-N 2.94Å; D366-T445 PolarHBondContact OD1-OG1 3.36Å
367	D	64.1	Low	77.8	Confident	53 Å²	53	52.8 Å²	52.8	28%	0.283	29%	0.294	S	S	.	.	S	Bend	trans	-139.6	21.1	-171.7	43.9	25.8	0	0	0	112.2	G365 E410 G411 L412 R414	G365-D367 PolarHBondContact O-N 3Å; D367-E410 CarbonylContact O-C 3.59Å; D367-G411 PolarHBondContact O-N 2.99Å; D367-L412 WeakPolarHBondContact CB-O 3.47Å; D367-L412 PolarHBondContact O-N 2.89Å; D367-R414 HydrophobicContact CB-CG 4.12Å; D367-R414 IonicContact OD2-CZ 2.68Å; D367-R414 IonicContact OD2-NE 2.74Å; D367-R414 PolarHBondContact OD2-NE 2.88Å; D367-R414 IonicContact OD2-NH2 2.59Å; D367-R414 PolarHBondContact OD2-NH2 2.93Å
368	V	70.8	Confident	77	Confident	33 Å²	33	60 Å²	60	20%	0.2	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	136.4	-176.6	57.9	0	0	0	0	111.7	V364 G365 Q408 V409 E410	V364-V368 WeakPolarHBondContact CA-O 3.46Å; G365-V368 PolarHBondContact N-O 2.88Å; V368-Q408 HydrophobicContact CG2-CG 3.42Å; V368-Q408 VanDerWaalsContact CG2-CG 3.42Å; V368-V409 CarbonylContact C-O 3.48Å; V368-V409 VanDerWaalsContact CA-O 3.29Å; V368-V409 WeakPolarHBondContact CA-O 3.29Å; V368-E410 HydrophobicContact CB-CG 4.22Å; V368-E410 HydrophobicContact CG2-CG 3.7Å
369	V	76.3	Confident	76.4	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	135.8	174.9	178	0	0	0	0	109.6	V364 L371 V409 L412 F420 I440 L442	V364-V369 HydrophobicContact CG1-CG2 4.46Å; V364-V369 HydrophobicContact CG2-CG2 4.49Å; V369-L371 HydrophobicContact CG1-CD2 3.8Å; V369-L371 HydrophobicContact CG1-CG 4.06Å; V369-V409 PolarHBondContact N-O 3.42Å; V369-V409 PolarHBondContact O-N 2.9Å; V369-L412 HydrophobicContact CB-CD1 3.99Å; V369-L412 HydrophobicContact CG2-CD1 3.65Å; V369-F420 HydrophobicContact CB-CE2 4.36Å; V369-F420 HydrophobicContact CB-CZ 3.97Å; V369-F420 HydrophobicContact CG1-CE2 4.02Å; V369-F420 HydrophobicContact CG1-CZ 4.06Å; V369-F420 HydrophobicContact CG2-CE2 4.34Å; V369-F420 HydrophobicContact CG2-CZ 4.1Å; V369-I440 HydrophobicContact CG1-CD1 3.62Å; V369-I440 HydrophobicContact CG1-CG2 4.06Å; V369-I440 HydrophobicContact CG2-CG2 3.78Å; V369-L442 HydrophobicContact CG2-CD1 4.41Å; V369-L442 HydrophobicContact CG2-CD2 3.84Å; V369-L442 HydrophobicContact CG2-CG 4.18Å
370	K	82.2	Confident	76	Confident	64 Å²	64	64.7 Å²	64.7	28%	0.278	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	129.2	177.6	-172	174	166	-173.7	0	110.5	V362 E363 I407	V362-K370 PolarHBondContact N-O 3.04Å; E363-K370 HydrophobicContact CB-CB 3.83Å; E363-K370 HydrophobicContact CB-CD 3.92Å; E363-K370 HydrophobicContact CB-CG 4.47Å; E363-K370 PolarHBondContact N-O 2.9Å; E363-K370 PolarHBondContact O-N 2.79Å; E363-K370 WeakPolarHBondContact OE2-CD 3.21Å; E363-K370 IonicContact OE2-NZ 3.95Å; E363-K370 PolarHBondContact OE2-NZ 2.82Å; K370-I407 WeakPolarHBondContact CA-O 3.48Å
371	L	88.2	Confident	76.3	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.005	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	144.8	-169.3	-59.4	169.6	0	0	0	110.7	Q360 V369 W373 V384 G406 I407 V409 F420 I440	Q360-L371 WeakPolarHBondContact O-CA 3.49Å; V369-L371 HydrophobicContact CG1-CD2 3.8Å; V369-L371 HydrophobicContact CG1-CG 4.06Å; L371-W373 HydrophobicContact CB-CE3 4.46Å; L371-W373 HydrophobicContact CB-CZ3 4.22Å; L371-V384 HydrophobicContact CD1-CG1 4.09Å; L371-G406 CarbonylContact O-C 3.6Å; L371-G406 WeakPolarHBondContact O-CA 3.24Å; L371-I407 PolarHBondContact N-O 2.77Å; L371-I407 PolarHBondContact O-N 2.93Å; L371-V409 HydrophobicContact CD1-CG2 4.48Å; L371-F420 HydrophobicContact CD1-CB 3.74Å; L371-F420 HydrophobicContact CD1-CD1 3.47Å; L371-F420 VanDerWaalsContact CD1-CD1 3.47Å; L371-F420 HydrophobicContact CD1-CD2 4.19Å; L371-F420 HydrophobicContact CD1-CE1 4.08Å; L371-F420 HydrophobicContact CD1-CG 3.53Å; L371-F420 HydrophobicContact CD2-CD2 4.42Å; L371-F420 HydrophobicContact CD2-CG 4.49Å; L371-I440 HydrophobicContact CD2-CD1 3.66Å
372	E	89.8	Confident	76.5	Confident	109 Å²	109	57.5 Å²	57.5	51%	0.509	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	151.8	167.2	-72.5	179.7	-162.9	0	0	110.2	Q360 V362 N405	Q360-E372 PolarHBondContact N-O 2.85Å; Q360-E372 PolarHBondContact O-N 3.49Å; V362-E372 HydrophobicContact CG2-CB 3.86Å; V362-E372 HydrophobicContact CG2-CG 3.8Å; E372-N405 CarbonylContact C-O 3.51Å; E372-N405 WeakPolarHBondContact CA-O 3.31Å
373	W	90.6	Very high	76.7	Confident	16 Å²	16	54.1 Å²	54.1	6%	0.061	29%	0.289	C	S	.	.			trans	-142.4	160.1	-178.3	52.3	89.9	0	0	0	112.8	P359 L371 Y382 V384 I402 Q404 N405 G406 I407 V422	P359-W373 HydrophobicContact CB-CE3 4.41Å; L371-W373 HydrophobicContact CB-CE3 4.46Å; L371-W373 HydrophobicContact CB-CZ3 4.22Å; W373-Y382 AromaticContact CE2-CG 3.95Å; W373-Y382 HydrophobicContact CZ2-CD2 4.14Å; W373-Y382 AromaticContact CZ2-CG 3.94Å; W373-Y382 HydrophobicContact CZ2-CG 3.94Å; W373-Y382 AromaticContact NE1-CD1 3.55Å; W373-Y382 AromaticContact NE1-CD2 3.55Å; W373-Y382 AromaticContact NE1-CE1 3.84Å; W373-Y382 AromaticContact NE1-CE2 3.83Å; W373-Y382 AromaticContact NE1-CG 3.4Å; W373-Y382 AromaticContact NE1-CZ 3.97Å; W373-V384 HydrophobicContact CH2-CG2 3.32Å; W373-V384 HydrophobicContact CZ2-CG2 4.15Å; W373-V384 HydrophobicContact CZ3-CG2 3.6Å; W373-I402 HydrophobicContact CH2-CD1 4.05Å; W373-I402 HydrophobicContact CZ2-CD1 4.17Å; W373-Q404 WeakPolarHBondContact CZ2-O 3.29Å; W373-N405 VanDerWaalsContact CE2-C 3.42Å; W373-N405 PolarHBondContact N-O 2.8Å; W373-G406 VanDerWaalsContact CH2-CA 3.48Å; W373-G406 VanDerWaalsContact CZ3-CA 3.45Å; W373-I407 HydrophobicContact CH2-CB 4.16Å; W373-I407 HydrophobicContact CH2-CG2 4.18Å; W373-I407 HydrophobicContact CZ3-CB 4.46Å; W373-I407 HydrophobicContact CZ3-CG2 4.13Å; W373-V422 HydrophobicContact CD2-CG1 4.16Å; W373-V422 HydrophobicContact CD2-CG2 3.96Å; W373-V422 HydrophobicContact CE3-CG2 3.84Å; W373-V422 HydrophobicContact CG-CG2 4.42Å; W373-V422 HydrophobicContact CZ2-CG1 4.02Å; W373-V422 HydrophobicContact CZ3-CG2 4.2Å
374	A	86.6	Confident	77.4	Confident	60 Å²	60	48.8 Å²	48.8	50%	0.496	27%	0.265	S	S	.	.			trans	-73	129.5	170.3	0	0	0	0	0	110.5	P356 G357	P356-A374 WeakPolarHBondContact CB-O 3.22Å; G357-A374 PolarHBondContact N-O 3.34Å
375	P	83.4	Confident	78.2	Confident	73 Å²	73	48 Å²	48	47%	0.474	26%	0.258	S	S	.	.			trans	-67.5	143.3	178	26.9	-34	0	0	0	111.9	Y382	P375-Y382 VanDerWaalsContact CA-OH 3.27Å; P375-Y382 WeakPolarHBondContact CA-OH 3.37Å; P375-Y382 VanDerWaalsContact CB-OH 3.27Å; P375-Y382 WeakPolarHBondContact CB-OH 3.29Å
376	S	74	Confident	79.1	Confident	27 Å²	27	49.6 Å²	49.6	19%	0.189	26%	0.26	C	S	.	.			trans	-81	-58	179.1	56.7	0	0	0	0	113	Q354 P355 Y382 S424	Q354-S376 WeakPolarHBondContact O-CB 3.37Å; Q354-S376 PolarHBondContact O-OG 3.34Å; P355-S376 VanDerWaalsContact O-CB 3.32Å; P355-S376 WeakPolarHBondContact O-CB 3.49Å; S376-Y382 PolarHBondContact N-OH 2.87Å; S376-S424 WeakPolarHBondContact OG-CB 3.36Å; S376-S424 PolarHBondContact OG-OG 3.12Å
377	V	75.9	Confident	80	Confident	59 Å²	59	50.7 Å²	50.7	36%	0.358	26%	0.261	S	S	.	.	S	Bend	trans	-142.6	159.4	-177.5	-61.5	0	0	0	0	112.2	A380 V426	V377-A380 HydrophobicContact CG2-CB 3.97Å; V377-A380 WeakPolarHBondContact O-CB 3.31Å; V377-A380 PolarHBondContact O-N 2.79Å; V377-V426 HydrophobicContact CG2-CG2 3.6Å
378	Q	64.5	Low	80.2	Confident	180 Å²	180	50.4 Å²	50.4	84%	0.841	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	140.2	175	-68.1	-177.1	-12.3	0	0	110.9	A380	Q378-A380 PolarHBondContact O-N 3.04Å
379	N	73.9	Confident	79.5	Confident	157 Å²	157	50.7 Å²	50.7	84%	0.84	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.7	10.3	-175.7	-48.2	-40.9	0	0	0	116.2
380	A	80.4	Confident	78.2	Confident	8 Å²	8	52.9 Å²	52.9	7%	0.066	28%	0.282	C	S	.	.			trans	-63.5	145.8	167.8	0	0	0	0	0	111.9	V377 Q378 Y382 V426	V377-A380 HydrophobicContact CG2-CB 3.97Å; V377-A380 WeakPolarHBondContact O-CB 3.31Å; V377-A380 PolarHBondContact O-N 2.79Å; Q378-A380 PolarHBondContact O-N 3.04Å; A380-Y382 HydrophobicContact CB-CE1 4.14Å; A380-V426 HydrophobicContact CB-CG2 4.05Å
381	R	84.3	Confident	76.9	Confident	83 Å²	83	52.3 Å²	52.3	31%	0.313	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	150.3	163.4	-62.4	-178.4	-68.5	152.9	-2.7	109.6	P401 I402 V403 S424 I425 N428	R381-P401 HydrophobicContact CB-CB 3.53Å; R381-P401 HydrophobicContact CG-CB 4.45Å; R381-I402 CarbonylContact C-O 3.52Å; R381-I402 WeakPolarHBondContact CA-O 3.05Å; R381-V403 HydrophobicContact CG-CG1 3.92Å; R381-S424 CarbonylContact O-C 3.49Å; R381-S424 WeakPolarHBondContact O-CA 3.41Å; R381-I425 PolarHBondContact N-O 2.76Å; R381-I425 PolarHBondContact O-N 2.93Å; R381-N428 PolarHBondContact NH2-OD1 2.85Å; R381-N428 VanDerWaalsContact NH2-OD1 3.15Å
382	Y	83.9	Confident	75.1	Confident	4 Å²	4	57.6 Å²	57.6	2%	0.016	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	143.4	-172.4	-54.9	-73.9	0	0	0	112.3	P356 W373 P375 S376 A380 N398 P401 I402 Q404 N405 V422 I423	P356-Y382 HydrophobicContact CB-CD1 4.27Å; P356-Y382 HydrophobicContact CB-CE1 3.93Å; P356-Y382 HydrophobicContact CG-CD1 4.24Å; P356-Y382 HydrophobicContact CG-CE1 4.33Å; W373-Y382 AromaticContact CE2-CG 3.95Å; W373-Y382 HydrophobicContact CZ2-CD2 4.14Å; W373-Y382 AromaticContact CZ2-CG 3.94Å; W373-Y382 HydrophobicContact CZ2-CG 3.94Å; W373-Y382 AromaticContact NE1-CD1 3.55Å; W373-Y382 AromaticContact NE1-CD2 3.55Å; W373-Y382 AromaticContact NE1-CE1 3.84Å; W373-Y382 AromaticContact NE1-CE2 3.83Å; W373-Y382 AromaticContact NE1-CG 3.4Å; W373-Y382 AromaticContact NE1-CZ 3.97Å; P375-Y382 VanDerWaalsContact CA-OH 3.27Å; P375-Y382 WeakPolarHBondContact CA-OH 3.37Å; P375-Y382 VanDerWaalsContact CB-OH 3.27Å; P375-Y382 WeakPolarHBondContact CB-OH 3.29Å; S376-Y382 PolarHBondContact N-OH 2.87Å; A380-Y382 HydrophobicContact CB-CE1 4.14Å; Y382-N398 PolarHBondContact O-ND2 2.71Å; Y382-P401 CarbonylContact O-C 3.6Å; Y382-P401 WeakPolarHBondContact O-CA 3.37Å; Y382-I402 PolarHBondContact N-O 2.93Å; Y382-I402 WeakPolarHBondContact O-CG1 3.4Å; Y382-I402 PolarHBondContact O-N 2.98Å; Y382-Q404 WeakPolarHBondContact CD2-O 3.44Å; Y382-N405 WeakPolarHBondContact CE2-OD1 3.35Å; Y382-V422 HydrophobicContact CD1-CG1 4Å; Y382-V422 HydrophobicContact CG-CG1 4.23Å; Y382-I423 WeakPolarHBondContact CA-O 3.11Å
383	I	82.8	Confident	73.6	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.005	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	126.6	163.5	-73.3	-169.4	0	0	0	107.9	E385 T396 P401 V422 I423 I425	I383-E385 HydrophobicContact CG2-CG 3.89Å; I383-T396 HydrophobicContact CG2-CG2 3.51Å; I383-P401 HydrophobicContact CD1-CB 4.33Å; I383-P401 HydrophobicContact CD1-CG 3.8Å; I383-P401 HydrophobicContact CG1-CB 4.02Å; I383-P401 HydrophobicContact CG1-CG 4.06Å; I383-V422 WeakPolarHBondContact O-CA 3.19Å; I383-I423 PolarHBondContact N-O 2.81Å; I383-I423 PolarHBondContact O-N 3.24Å; I383-I425 HydrophobicContact CD1-CD1 3.97Å; I383-I425 HydrophobicContact CG1-CD1 4.12Å
384	V	84.9	Confident	72.6	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	131	173.9	-175.5	0	0	0	0	108.2	L371 W373 A397 N398 I407 F420 C421 V422	L371-V384 HydrophobicContact CD1-CG1 4.09Å; W373-V384 HydrophobicContact CH2-CG2 3.32Å; W373-V384 HydrophobicContact CZ2-CG2 4.15Å; W373-V384 HydrophobicContact CZ3-CG2 3.6Å; V384-A397 HydrophobicContact CB-CB 4.25Å; V384-A397 HydrophobicContact CG1-CB 4.43Å; V384-A397 WeakPolarHBondContact O-CB 3.45Å; V384-A397 PolarHBondContact O-N 2.98Å; V384-N398 PolarHBondContact N-OD1 2.74Å; V384-I407 HydrophobicContact CB-CG2 4.23Å; V384-I407 HydrophobicContact CG1-CG2 4.38Å; V384-I407 HydrophobicContact CG2-CB 4.48Å; V384-I407 HydrophobicContact CG2-CG2 3.71Å; V384-F420 HydrophobicContact CG1-CD1 4.23Å; V384-C421 WeakPolarHBondContact CA-O 3.42Å; V384-V422 HydrophobicContact CG1-CG2 4.49Å; V384-V422 HydrophobicContact CG2-CG1 4.23Å; V384-V422 HydrophobicContact CG2-CG2 4.04Å
385	E	85.4	Confident	71.7	Confident	26 Å²	26	63 Å²	63	12%	0.121	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	142.1	174.5	-52.3	-167.1	153.3	0	0	108.1	R347 I383 W394 H395 T396 F420 C421 I423	R347-E385 IonicContact NH1-OE1 3.55Å; R347-E385 PolarHBondContact NH1-OE1 3.03Å; I383-E385 HydrophobicContact CG2-CG 3.89Å; E385-W394 HydrophobicContact CB-CB 4.39Å; E385-W394 HydrophobicContact CB-CE3 4.18Å; E385-W394 WeakPolarHBondContact O-CZ3 3.42Å; E385-H395 CarbonylContact C-O 3.56Å; E385-H395 VanDerWaalsContact CA-O 3.23Å; E385-H395 WeakPolarHBondContact CA-O 3.31Å; E385-T396 HydrophobicContact CG-CG2 4.43Å; E385-T396 PolarHBondContact OE1-OG1 2.95Å; E385-F420 CarbonylContact O-C 3.56Å; E385-F420 WeakPolarHBondContact O-CA 3.27Å; E385-C421 PolarHBondContact N-O 3.41Å; E385-C421 PolarHBondContact O-N 2.64Å; E385-I423 HydrophobicContact CG-CD1 4.34Å; E385-I423 WeakPolarHBondContact OE2-CD1 3.18Å
386	Y	81.6	Confident	71	Confident	47 Å²	47	60.9 Å²	60.9	18%	0.184	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	157.1	-172	73.7	-79.6	0	0	0	110.9	H395 A397 V409 L412 Y418 E419 F420	Y386-H395 HydrophobicContact CD1-CB 4.01Å; Y386-H395 WeakPolarHBondContact CD1-O 3.31Å; Y386-H395 HydrophobicContact CE1-CB 3.67Å; Y386-H395 HydrophobicContact CE2-CB 4.23Å; Y386-H395 HydrophobicContact CG-CB 4.44Å; Y386-H395 PolarHBondContact N-O 2.93Å; Y386-H395 WeakPolarHBondContact O-CB 3.27Å; Y386-H395 PolarHBondContact O-N 2.86Å; Y386-A397 HydrophobicContact CD1-CB 3.83Å; Y386-A397 HydrophobicContact CE1-CB 4.15Å; Y386-V409 HydrophobicContact CD1-CG1 4.47Å; Y386-L412 HydrophobicContact CD2-CD2 3.57Å; Y386-L412 HydrophobicContact CE2-CD2 3.34Å; Y386-L412 HydrophobicContact CG-CD2 4.47Å; Y386-Y418 AromaticContact CD2-CD1 3.81Å; Y386-Y418 HydrophobicContact CD2-CD1 3.81Å; Y386-Y418 AromaticContact CD2-CE1 3.92Å; Y386-Y418 HydrophobicContact CD2-CE1 3.92Å; Y386-Y418 HydrophobicContact CE2-CD1 4.44Å; Y386-Y418 HydrophobicContact CE2-CE1 4.09Å; Y386-E419 WeakPolarHBondContact CA-O 3.39Å; Y386-F420 VanDerWaalsContact CB-CE1 3.42Å; Y386-F420 HydrophobicContact CG-CD1 4.44Å; Y386-F420 HydrophobicContact CG-CE1 4.13Å
387	R	76.3	Confident	70.8	Confident	63 Å²	63	61 Å²	61	24%	0.238	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	151.3	173.9	66	178.7	-177.4	178.8	-2.2	111	D391 E393 W394 Y418 E419	R387-D391 HydrophobicContact CB-CB 4.41Å; R387-E393 WeakPolarHBondContact CB-O 3.21Å; R387-W394 HydrophobicContact CB-CD2 4.45Å; R387-W394 HydrophobicContact CB-CE3 4.18Å; R387-W394 HydrophobicContact CB-CZ3 4.42Å; R387-W394 HydrophobicContact CG-CD2 4.28Å; R387-W394 HydrophobicContact CG-CE3 4.04Å; R387-W394 HydrophobicContact CG-CH2 3.94Å; R387-W394 HydrophobicContact CG-CZ2 4.2Å; R387-W394 HydrophobicContact CG-CZ3 3.86Å; R387-W394 VanDerWaalsContact NE-CZ2 3.34Å; R387-Y418 VanDerWaalsContact C-CD1 3.43Å; R387-Y418 VanDerWaalsContact O-CA 3.31Å; R387-Y418 WeakPolarHBondContact O-CA 3.43Å; R387-Y418 VanDerWaalsContact O-CD1 3.25Å; R387-Y418 WeakPolarHBondContact O-CD1 3.42Å; R387-E419 HydrophobicContact CG-CB 4.26Å; R387-E419 IonicContact CZ-OE2 3.11Å; R387-E419 VanDerWaalsContact CZ-OE2 3.25Å; R387-E419 PolarHBondContact N-O 3.29Å; R387-E419 IonicContact NE-OE2 3.36Å; R387-E419 PolarHBondContact NE-OE2 2.64Å; R387-E419 IonicContact NH2-OE2 2.73Å; R387-E419 PolarHBondContact NH2-OE2 3.43Å; R387-E419 PolarHBondContact O-N 3.38Å
388	E	68.3	Low	70.6	Confident	48 Å²	48	58.9 Å²	58.9	22%	0.224	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	142.4	168.7	-155.5	170.2	147.3	0	0	109.1	G390 D391 H413 S416 T417 Y418	E388-G390 PolarHBondContact O-N 2.95Å; E388-D391 HydrophobicContact CB-CB 4.36Å; E388-D391 VanDerWaalsContact O-CB 3.23Å; E388-D391 WeakPolarHBondContact O-CB 3.4Å; E388-D391 PolarHBondContact O-N 3.13Å; E388-H413 IonicContact OE2-CE1 3.84Å; E388-H413 IonicContact OE2-CG 3.39Å; E388-H413 IonicContact OE2-ND1 2.76Å; E388-H413 PolarHBondContact OE2-ND1 3.32Å; E388-S416 VanDerWaalsContact CD-CB 3.42Å; E388-S416 WeakPolarHBondContact OE1-CB 3.32Å; E388-S416 PolarHBondContact OE1-OG 3.24Å; E388-S416 PolarHBondContact OE2-OG 3.17Å; E388-T417 CarbonylContact C-O 3.44Å; E388-T417 WeakPolarHBondContact CA-O 3.46Å; E388-T417 WeakPolarHBondContact CG-O 3.24Å; E388-Y418 HydrophobicContact CB-CD1 4.24Å; E388-Y418 HydrophobicContact CB-CE1 3.82Å; E388-Y418 HydrophobicContact CG-CE1 4.18Å; E388-Y418 PolarHBondContact OE2-OH 3.25Å
389	V	57	Low	70.5	Confident	39 Å²	39	58.1 Å²	58.1	24%	0.236	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	98.7	-172.6	178	0	0	0	0	110.8	T417 E419 I439	V389-T417 WeakPolarHBondContact CG2-O 3.45Å; V389-T417 PolarHBondContact N-O 3.27Å; V389-E419 HydrophobicContact CG2-CG 3.86Å; V389-I439 HydrophobicContact CG1-CD1 4.19Å; V389-I439 HydrophobicContact CG2-CD1 4.33Å; V389-I439 HydrophobicContact CG2-CG1 4.05Å; V389-I439 HydrophobicContact CG2-CG2 3.87Å
390	G	48.8	Very low	70.3	Confident	46 Å²	46	57.2 Å²	57.2	47%	0.474	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	127.7	-16.2	-173.2	0	0	0	0	0	113.3	E388	E388-G390 PolarHBondContact O-N 2.95Å
391	D	54.7	Low	70.2	Confident	51 Å²	51	58.2 Å²	58.2	27%	0.273	30%	0.295	S	S	.	.			trans	-72.5	128.9	171	-168.7	-17.1	0	0	0	110.3	R387 E388 E393 H395	R387-D391 HydrophobicContact CB-CB 4.41Å; E388-D391 HydrophobicContact CB-CB 4.36Å; E388-D391 VanDerWaalsContact O-CB 3.23Å; E388-D391 WeakPolarHBondContact O-CB 3.4Å; E388-D391 PolarHBondContact O-N 3.13Å; D391-E393 PolarHBondContact OD1-N 2.74Å; D391-H395 IonicContact OD2-CE1 2.7Å; D391-H395 PolarHBondContact OD2-CE1 2.68Å; D391-H395 IonicContact OD2-ND1 3.44Å
392	P	50.6	Low	70.1	Confident	112 Å²	112	56.3 Å²	56.3	73%	0.727	29%	0.291	S	S	*	.	S	Bend	trans	-73.1	-22.3	172.8	30.1	-35.9	0	0	0	114
393	E	58	Low	70	Confident	137 Å²	137	61.4 Å²	61.4	64%	0.64	32%	0.322	S	S	*	.	S	Bend	trans	-96.9	131.4	-172.9	-62	-154.6	148.4	0	0	113.5	R387 D391 H395	R387-E393 WeakPolarHBondContact CB-O 3.21Å; D391-E393 PolarHBondContact OD1-N 2.74Å; E393-H395 PolarHBondContact O-ND1 2.91Å; E393-H395 VanDerWaalsContact O-ND1 3.12Å
394	W	69.3	Low	69.9	Low	85 Å²	85	67.9 Å²	67.9	32%	0.322	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-86.4	120.6	174	-75.3	97.6	0	0	0	110.5	E385 R387 E419 C421 T436	E385-W394 HydrophobicContact CB-CB 4.39Å; E385-W394 HydrophobicContact CB-CE3 4.18Å; E385-W394 WeakPolarHBondContact O-CZ3 3.42Å; R387-W394 HydrophobicContact CB-CD2 4.45Å; R387-W394 HydrophobicContact CB-CE3 4.18Å; R387-W394 HydrophobicContact CB-CZ3 4.42Å; R387-W394 HydrophobicContact CG-CD2 4.28Å; R387-W394 HydrophobicContact CG-CE3 4.04Å; R387-W394 HydrophobicContact CG-CH2 3.94Å; R387-W394 HydrophobicContact CG-CZ2 4.2Å; R387-W394 HydrophobicContact CG-CZ3 3.86Å; R387-W394 VanDerWaalsContact NE-CZ2 3.34Å; W394-E419 HydrophobicContact CH2-CB 4.24Å; W394-C421 HydrophobicContact CH2-CB 4.12Å; W394-C421 HydrophobicContact CZ3-CB 4.22Å; W394-C421 VanDerWaalsContact CZ3-SG 3.57Å; W394-T436 HydrophobicContact CH2-CG2 3.69Å; W394-T436 HydrophobicContact CZ2-CG2 3.96Å
395	H	66.9	Low	69.9	Low	78 Å²	78	71.1 Å²	71.1	36%	0.361	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	132.2	179.9	-67.1	70.9	0	0	0	110.1	E385 Y386 D391 E393 A397	E385-H395 CarbonylContact C-O 3.56Å; E385-H395 VanDerWaalsContact CA-O 3.23Å; E385-H395 WeakPolarHBondContact CA-O 3.31Å; Y386-H395 HydrophobicContact CD1-CB 4.01Å; Y386-H395 WeakPolarHBondContact CD1-O 3.31Å; Y386-H395 HydrophobicContact CE1-CB 3.67Å; Y386-H395 HydrophobicContact CE2-CB 4.23Å; Y386-H395 HydrophobicContact CG-CB 4.44Å; Y386-H395 PolarHBondContact N-O 2.93Å; Y386-H395 WeakPolarHBondContact O-CB 3.27Å; Y386-H395 PolarHBondContact O-N 2.86Å; D391-H395 IonicContact OD2-CE1 2.7Å; D391-H395 PolarHBondContact OD2-CE1 2.68Å; D391-H395 IonicContact OD2-ND1 3.44Å; E393-H395 PolarHBondContact O-ND1 2.91Å; E393-H395 VanDerWaalsContact O-ND1 3.12Å; H395-A397 PolarHBondContact O-N 3.17Å
396	T	69.8	Low	69.8	Low	27 Å²	27	70.5 Å²	70.5	17%	0.166	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	118.7	-180	-53	0	0	0	0	111.4	I383 E385 N398 Y399	I383-T396 HydrophobicContact CG2-CG2 3.51Å; E385-T396 HydrophobicContact CG-CG2 4.43Å; E385-T396 PolarHBondContact OE1-OG1 2.95Å; T396-N398 VanDerWaalsContact CG2-O 3.3Å; T396-N398 WeakPolarHBondContact CG2-O 3.32Å; T396-Y399 HydrophobicContact CG2-CD1 4.49Å
397	A	69.1	Low	69.8	Low	30 Å²	30	69.9 Å²	69.9	25%	0.248	37%	0.37	C	S	.	.	S	Bend	trans	-73.9	-37.8	176.9	0	0	0	0	0	112.6	V384 Y386 H395 V409	V384-A397 HydrophobicContact CB-CB 4.25Å; V384-A397 HydrophobicContact CG1-CB 4.43Å; V384-A397 WeakPolarHBondContact O-CB 3.45Å; V384-A397 PolarHBondContact O-N 2.98Å; Y386-A397 HydrophobicContact CD1-CB 3.83Å; Y386-A397 HydrophobicContact CE1-CB 4.15Å; H395-A397 PolarHBondContact O-N 3.17Å; A397-V409 HydrophobicContact CB-CG1 3.89Å; A397-V409 HydrophobicContact CB-CG2 3.84Å
398	N	71.8	Confident	70.2	Confident	15 Å²	15	71.6 Å²	71.6	8%	0.08	38%	0.38	C	S	.	.			trans	-127.6	110	175.3	67	-72.1	0	0	0	112.5	Y382 V384 T396 D400 I407	Y382-N398 PolarHBondContact O-ND2 2.71Å; V384-N398 PolarHBondContact N-OD1 2.74Å; T396-N398 VanDerWaalsContact CG2-O 3.3Å; T396-N398 WeakPolarHBondContact CG2-O 3.32Å; N398-D400 PolarHBondContact ND2-O 2.88Å; N398-D400 PolarHBondContact O-N 2.79Å; N398-I407 HydrophobicContact CB-CD1 3.65Å
399	Y	62.1	Low	70.3	Confident	163 Å²	163	69.7 Å²	69.7	64%	0.639	37%	0.372	S	S	*	.	S	Bend	trans	-66.9	-35	-179.5	-62.5	-84.5	0	0	0	112.9	T396	T396-Y399 HydrophobicContact CG2-CD1 4.49Å
400	D	70.1	Confident	71.1	Confident	138 Å²	138	74 Å²	74	74%	0.738	39%	0.39	S	S	*	.	S	Bend	trans	-90.2	127.5	171.9	-80.7	-53.2	0	0	0	110.8	N398 I402	N398-D400 PolarHBondContact ND2-O 2.88Å; N398-D400 PolarHBondContact O-N 2.79Å; D400-I402 PolarHBondContact O-N 3.29Å
401	P	77.8	Confident	71.4	Confident	30 Å²	30	74.9 Å²	74.9	20%	0.195	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-64.2	119.5	179.2	-18.5	27.4	0	0	0	113.2	R381 Y382 I383 I425	R381-P401 HydrophobicContact CB-CB 3.53Å; R381-P401 HydrophobicContact CG-CB 4.45Å; Y382-P401 CarbonylContact O-C 3.6Å; Y382-P401 WeakPolarHBondContact O-CA 3.37Å; I383-P401 HydrophobicContact CD1-CB 4.33Å; I383-P401 HydrophobicContact CD1-CG 3.8Å; I383-P401 HydrophobicContact CG1-CB 4.02Å; I383-P401 HydrophobicContact CG1-CG 4.06Å; P401-I425 HydrophobicContact CB-CD1 4.32Å; P401-I425 HydrophobicContact CG-CD1 3.99Å
402	I	82.6	Confident	72.2	Confident	42 Å²	42	72.7 Å²	72.7	22%	0.215	39%	0.387	C	S	.	.	B	Isolated β-bridge	trans	-84.5	151.5	-178.9	58.9	165.6	0	0	0	112.5	W373 R381 Y382 D400 Q404 G406 I407	W373-I402 HydrophobicContact CH2-CD1 4.05Å; W373-I402 HydrophobicContact CZ2-CD1 4.17Å; R381-I402 CarbonylContact C-O 3.52Å; R381-I402 WeakPolarHBondContact CA-O 3.05Å; Y382-I402 PolarHBondContact N-O 2.93Å; Y382-I402 WeakPolarHBondContact O-CG1 3.4Å; Y382-I402 PolarHBondContact O-N 2.98Å; D400-I402 PolarHBondContact O-N 3.29Å; I402-Q404 HydrophobicContact CD1-CB 4.43Å; I402-G406 WeakPolarHBondContact CD1-O 3.2Å; I402-I407 HydrophobicContact CD1-CB 4.09Å; I402-I407 HydrophobicContact CD1-CD1 4.13Å; I402-I407 HydrophobicContact CD1-CG1 4.27Å
403	V	82.3	Confident	72.7	Confident	111 Å²	111	72.7 Å²	72.7	67%	0.673	38%	0.377	S	S	*	.	S	Bend	trans	-91.9	0.4	174.4	-67.4	0	0	0	0	113.6	R381	R381-V403 HydrophobicContact CG-CG1 3.92Å
404	Q	80.5	Confident	72.7	Confident	137 Å²	137	72.9 Å²	72.9	64%	0.64	37%	0.372	S	S	*	.	S	Bend	trans	-95.5	146.4	-176.4	-59.4	178.3	17.9	0	0	109.9	W373 Y382 I402 G406	W373-Q404 WeakPolarHBondContact CZ2-O 3.29Å; Y382-Q404 WeakPolarHBondContact CD2-O 3.44Å; I402-Q404 HydrophobicContact CD1-CB 4.43Å; Q404-G406 PolarHBondContact O-N 2.92Å
405	N	85.5	Confident	72	Confident	69 Å²	69	74.6 Å²	74.6	37%	0.369	39%	0.387	S	S	.	.	S	Bend	trans	-87.4	31.7	-179.7	-55.8	-26.6	0	0	0	112.2	E372 W373 Y382	E372-N405 CarbonylContact C-O 3.51Å; E372-N405 WeakPolarHBondContact CA-O 3.31Å; W373-N405 VanDerWaalsContact CE2-C 3.42Å; W373-N405 PolarHBondContact N-O 2.8Å; Y382-N405 WeakPolarHBondContact CE2-OD1 3.35Å
406	G	82.9	Confident	71.5	Confident	13 Å²	13	71.9 Å²	71.9	13%	0.134	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.6	157.5	-175.9	0	0	0	0	0	111.6	L371 W373 I402 Q404	L371-G406 CarbonylContact O-C 3.6Å; L371-G406 WeakPolarHBondContact O-CA 3.24Å; W373-G406 VanDerWaalsContact CH2-CA 3.48Å; W373-G406 VanDerWaalsContact CZ3-CA 3.45Å; I402-G406 WeakPolarHBondContact CD1-O 3.2Å; Q404-G406 PolarHBondContact O-N 2.92Å
407	I	81.1	Confident	71.4	Confident	34 Å²	34	72.3 Å²	72.3	17%	0.174	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	157.6	179	-157.6	171	0	0	0	111.2	K370 L371 W373 V384 N398 I402 V409	K370-I407 WeakPolarHBondContact CA-O 3.48Å; L371-I407 PolarHBondContact N-O 2.77Å; L371-I407 PolarHBondContact O-N 2.93Å; W373-I407 HydrophobicContact CH2-CB 4.16Å; W373-I407 HydrophobicContact CH2-CG2 4.18Å; W373-I407 HydrophobicContact CZ3-CB 4.46Å; W373-I407 HydrophobicContact CZ3-CG2 4.13Å; V384-I407 HydrophobicContact CB-CG2 4.23Å; V384-I407 HydrophobicContact CG1-CG2 4.38Å; V384-I407 HydrophobicContact CG2-CB 4.48Å; V384-I407 HydrophobicContact CG2-CG2 3.71Å; N398-I407 HydrophobicContact CB-CD1 3.65Å; I402-I407 HydrophobicContact CD1-CB 4.09Å; I402-I407 HydrophobicContact CD1-CD1 4.13Å; I402-I407 HydrophobicContact CD1-CG1 4.27Å; I407-V409 HydrophobicContact CG2-CG2 3.77Å
408	Q	84.1	Confident	71.8	Confident	98 Å²	98	71.3 Å²	71.3	46%	0.458	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	122.3	165.1	-173.3	166.4	-63.7	0	0	108.2	V368 E410	V368-Q408 HydrophobicContact CG2-CG 3.42Å; V368-Q408 VanDerWaalsContact CG2-CG 3.42Å; Q408-E410 HydrophobicContact CG-CG 4.22Å; Q408-E410 PolarHBondContact NE2-OE1 3.08Å
409	V	71.4	Confident	72.2	Confident	8 Å²	8	71.9 Å²	71.9	5%	0.048	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	121.4	178.6	-170.8	0	0	0	0	108.2	V368 V369 L371 Y386 A397 I407 L412 F420	V368-V409 CarbonylContact C-O 3.48Å; V368-V409 VanDerWaalsContact CA-O 3.29Å; V368-V409 WeakPolarHBondContact CA-O 3.29Å; V369-V409 PolarHBondContact N-O 3.42Å; V369-V409 PolarHBondContact O-N 2.9Å; L371-V409 HydrophobicContact CD1-CG2 4.48Å; Y386-V409 HydrophobicContact CD1-CG1 4.47Å; A397-V409 HydrophobicContact CB-CG1 3.89Å; A397-V409 HydrophobicContact CB-CG2 3.84Å; I407-V409 HydrophobicContact CG2-CG2 3.77Å; V409-L412 HydrophobicContact CB-CD1 4.3Å; V409-L412 HydrophobicContact CG1-CD1 4.16Å; V409-L412 HydrophobicContact CG1-CD2 4.07Å; V409-L412 HydrophobicContact CG1-CG 4.26Å; V409-F420 HydrophobicContact CB-CE1 4.19Å; V409-F420 HydrophobicContact CG1-CE1 4.27Å; V409-F420 HydrophobicContact CG2-CD1 4.48Å; V409-F420 HydrophobicContact CG2-CE1 4.03Å
410	E	73.8	Confident	73.5	Confident	131 Å²	131	64.1 Å²	64.1	61%	0.612	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.4	157.9	-171.7	-67.5	173.8	-171.3	0	0	111.5	D367 V368 Q408	D367-E410 CarbonylContact O-C 3.59Å; V368-E410 HydrophobicContact CB-CG 4.22Å; V368-E410 HydrophobicContact CG2-CG 3.7Å; Q408-E410 HydrophobicContact CG-CG 4.22Å; Q408-E410 PolarHBondContact NE2-OE1 3.08Å
411	G	55.7	Low	74.2	Confident	63 Å²	63	57.7 Å²	57.7	65%	0.649	31%	0.307	S	S	*	.	S	Bend	trans	81.9	23.9	177.6	0	0	0	0	0	114.1	D367	D367-G411 PolarHBondContact O-N 2.99Å
412	L	71.3	Confident	74.7	Confident	6 Å²	6	56.3 Å²	56.3	3%	0.031	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-81	154.5	179.3	-60.6	168.5	0	0	0	111.3	D367 V369 Y386 V409 R414 Y418 F420 L442	D367-L412 WeakPolarHBondContact CB-O 3.47Å; D367-L412 PolarHBondContact O-N 2.89Å; V369-L412 HydrophobicContact CB-CD1 3.99Å; V369-L412 HydrophobicContact CG2-CD1 3.65Å; Y386-L412 HydrophobicContact CD2-CD2 3.57Å; Y386-L412 HydrophobicContact CE2-CD2 3.34Å; Y386-L412 HydrophobicContact CG-CD2 4.47Å; V409-L412 HydrophobicContact CB-CD1 4.3Å; V409-L412 HydrophobicContact CG1-CD1 4.16Å; V409-L412 HydrophobicContact CG1-CD2 4.07Å; V409-L412 HydrophobicContact CG1-CG 4.26Å; L412-R414 PolarHBondContact O-N 3.46Å; L412-Y418 HydrophobicContact CB-CE2 3.98Å; L412-Y418 HydrophobicContact CD2-CD1 4.27Å; L412-Y418 HydrophobicContact CD2-CE1 4.05Å; L412-Y418 HydrophobicContact CD2-CE2 4.41Å; L412-F420 HydrophobicContact CD1-CE1 4.48Å; L412-F420 HydrophobicContact CD1-CZ 3.94Å; L412-L442 HydrophobicContact CB-CD1 3.29Å; L412-L442 HydrophobicContact CD1-CD1 3.98Å; L412-L442 HydrophobicContact CG-CD1 4.26Å
413	H	61.5	Low	74.9	Confident	111 Å²	111	55 Å²	55	51%	0.514	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-69.8	129.8	-176.9	-59.6	151	0	0	0	112.2	E388 S416 Y418 L442	E388-H413 IonicContact OE2-CE1 3.84Å; E388-H413 IonicContact OE2-CG 3.39Å; E388-H413 IonicContact OE2-ND1 2.76Å; E388-H413 PolarHBondContact OE2-ND1 3.32Å; H413-S416 WeakPolarHBondContact CB-OG 3.07Å; H413-S416 WeakPolarHBondContact O-CB 3.26Å; H413-S416 PolarHBondContact O-N 2.86Å; H413-Y418 HydrophobicContact CB-CE2 4.43Å; H413-Y418 VanDerWaalsContact CB-OH 3.27Å; H413-Y418 WeakPolarHBondContact CB-OH 3.37Å; H413-Y418 PolarHBondContact N-OH 3.01Å; H413-Y418 PolarHBondContact ND1-OH 3.19Å; H413-L442 WeakPolarHBondContact O-CD1 3.5Å
414	R	57.3	Low	75	Confident	142 Å²	142	49.8 Å²	49.8	54%	0.536	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	140.6	176.4	-49.2	-168.9	177.3	-158.7	-5.1	110.2	D366 D367 L412 S416	D366-R414 WeakPolarHBondContact O-CG 3.31Å; D366-R414 IonicContact OD2-CZ 3.13Å; D366-R414 IonicContact OD2-NH1 2.74Å; D366-R414 PolarHBondContact OD2-NH1 3.41Å; D366-R414 IonicContact OD2-NH2 3.76Å; D367-R414 HydrophobicContact CB-CG 4.12Å; D367-R414 IonicContact OD2-CZ 2.68Å; D367-R414 IonicContact OD2-NE 2.74Å; D367-R414 PolarHBondContact OD2-NE 2.88Å; D367-R414 IonicContact OD2-NH2 2.59Å; D367-R414 PolarHBondContact OD2-NH2 2.93Å; L412-R414 PolarHBondContact O-N 3.46Å; R414-S416 PolarHBondContact O-N 3.33Å
415	N	54.3	Low	75.1	Confident	120 Å²	120	43.8 Å²	43.8	64%	0.642	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.9	2.8	-167.4	-71.1	-34.2	0	0	0	116.2	L442 P444	N415-L442 WeakPolarHBondContact CA-O 3.46Å; N415-L442 PolarHBondContact N-O 2.94Å; N415-P444 WeakPolarHBondContact OD1-CD 3.5Å; N415-P444 WeakPolarHBondContact OD1-CG 3.25Å
416	S	56.3	Low	75	Confident	21 Å²	21	42 Å²	42	15%	0.147	22%	0.223	C	C	.	.			trans	-90.7	172.8	176	-72	0	0	0	0	112.9	E388 H413 R414 L442	E388-S416 VanDerWaalsContact CD-CB 3.42Å; E388-S416 WeakPolarHBondContact OE1-CB 3.32Å; E388-S416 PolarHBondContact OE1-OG 3.24Å; E388-S416 PolarHBondContact OE2-OG 3.17Å; H413-S416 WeakPolarHBondContact CB-OG 3.07Å; H413-S416 WeakPolarHBondContact O-CB 3.26Å; H413-S416 PolarHBondContact O-N 2.86Å; R414-S416 PolarHBondContact O-N 3.33Å; S416-L442 PolarHBondContact O-N 3.39Å
417	T	68.3	Low	74.6	Confident	37 Å²	37	48.5 Å²	48.5	23%	0.227	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	129.9	-174.8	56.6	0	0	0	0	109.6	E388 V389 I440 H441	E388-T417 CarbonylContact C-O 3.44Å; E388-T417 WeakPolarHBondContact CA-O 3.46Å; E388-T417 WeakPolarHBondContact CG-O 3.24Å; V389-T417 WeakPolarHBondContact CG2-O 3.45Å; V389-T417 PolarHBondContact N-O 3.27Å; T417-I440 CarbonylContact C-O 3.47Å; T417-I440 WeakPolarHBondContact CA-O 3.35Å; T417-H441 HydrophobicContact CG2-CB 4.35Å; T417-H441 WeakPolarHBondContact CG2-ND1 3.21Å
418	Y	76.8	Confident	74.1	Confident	8 Å²	8	52.7 Å²	52.7	3%	0.031	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	145.7	-171.2	-72	-89	0	0	0	113.2	Y386 R387 E388 L412 H413 I440 L442	Y386-Y418 AromaticContact CD2-CD1 3.81Å; Y386-Y418 HydrophobicContact CD2-CD1 3.81Å; Y386-Y418 AromaticContact CD2-CE1 3.92Å; Y386-Y418 HydrophobicContact CD2-CE1 3.92Å; Y386-Y418 HydrophobicContact CE2-CD1 4.44Å; Y386-Y418 HydrophobicContact CE2-CE1 4.09Å; R387-Y418 VanDerWaalsContact C-CD1 3.43Å; R387-Y418 VanDerWaalsContact O-CA 3.31Å; R387-Y418 WeakPolarHBondContact O-CA 3.43Å; R387-Y418 VanDerWaalsContact O-CD1 3.25Å; R387-Y418 WeakPolarHBondContact O-CD1 3.42Å; E388-Y418 HydrophobicContact CB-CD1 4.24Å; E388-Y418 HydrophobicContact CB-CE1 3.82Å; E388-Y418 HydrophobicContact CG-CE1 4.18Å; E388-Y418 PolarHBondContact OE2-OH 3.25Å; L412-Y418 HydrophobicContact CB-CE2 3.98Å; L412-Y418 HydrophobicContact CD2-CD1 4.27Å; L412-Y418 HydrophobicContact CD2-CE1 4.05Å; L412-Y418 HydrophobicContact CD2-CE2 4.41Å; H413-Y418 HydrophobicContact CB-CE2 4.43Å; H413-Y418 VanDerWaalsContact CB-OH 3.27Å; H413-Y418 WeakPolarHBondContact CB-OH 3.37Å; H413-Y418 PolarHBondContact N-OH 3.01Å; H413-Y418 PolarHBondContact ND1-OH 3.19Å; Y418-I440 PolarHBondContact N-O 2.89Å; Y418-I440 PolarHBondContact O-N 3.19Å; Y418-L442 HydrophobicContact CD2-CD1 3.62Å; Y418-L442 HydrophobicContact CE2-CD1 3.63Å
419	E	81	Confident	73.6	Confident	27 Å²	27	51.4 Å²	51.4	13%	0.126	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	142.1	165.8	-79.9	163.2	-159.2	0	0	109	Y386 R387 V389 W394 I439	Y386-E419 WeakPolarHBondContact CA-O 3.39Å; R387-E419 HydrophobicContact CG-CB 4.26Å; R387-E419 IonicContact CZ-OE2 3.11Å; R387-E419 VanDerWaalsContact CZ-OE2 3.25Å; R387-E419 PolarHBondContact N-O 3.29Å; R387-E419 IonicContact NE-OE2 3.36Å; R387-E419 PolarHBondContact NE-OE2 2.64Å; R387-E419 IonicContact NH2-OE2 2.73Å; R387-E419 PolarHBondContact NH2-OE2 3.43Å; R387-E419 PolarHBondContact O-N 3.38Å; V389-E419 HydrophobicContact CG2-CG 3.86Å; W394-E419 HydrophobicContact CH2-CB 4.24Å; E419-I439 HydrophobicContact CG-CG1 4.09Å
420	F	89.2	Confident	74.1	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	140.6	179.2	-61.1	-97.9	0	0	0	110.3	P359 V369 L371 V384 E385 Y386 V409 L412 T436 S437 I440	P359-F420 HydrophobicContact CG-CB 4.36Å; P359-F420 VanDerWaalsContact CG-O 3.31Å; P359-F420 WeakPolarHBondContact CG-O 3.38Å; V369-F420 HydrophobicContact CB-CE2 4.36Å; V369-F420 HydrophobicContact CB-CZ 3.97Å; V369-F420 HydrophobicContact CG1-CE2 4.02Å; V369-F420 HydrophobicContact CG1-CZ 4.06Å; V369-F420 HydrophobicContact CG2-CE2 4.34Å; V369-F420 HydrophobicContact CG2-CZ 4.1Å; L371-F420 HydrophobicContact CD1-CB 3.74Å; L371-F420 HydrophobicContact CD1-CD1 3.47Å; L371-F420 VanDerWaalsContact CD1-CD1 3.47Å; L371-F420 HydrophobicContact CD1-CD2 4.19Å; L371-F420 HydrophobicContact CD1-CE1 4.08Å; L371-F420 HydrophobicContact CD1-CG 3.53Å; L371-F420 HydrophobicContact CD2-CD2 4.42Å; L371-F420 HydrophobicContact CD2-CG 4.49Å; V384-F420 HydrophobicContact CG1-CD1 4.23Å; E385-F420 CarbonylContact O-C 3.56Å; E385-F420 WeakPolarHBondContact O-CA 3.27Å; Y386-F420 VanDerWaalsContact CB-CE1 3.42Å; Y386-F420 HydrophobicContact CG-CD1 4.44Å; Y386-F420 HydrophobicContact CG-CE1 4.13Å; V409-F420 HydrophobicContact CB-CE1 4.19Å; V409-F420 HydrophobicContact CG1-CE1 4.27Å; V409-F420 HydrophobicContact CG2-CD1 4.48Å; V409-F420 HydrophobicContact CG2-CE1 4.03Å; L412-F420 HydrophobicContact CD1-CE1 4.48Å; L412-F420 HydrophobicContact CD1-CZ 3.94Å; F420-T436 CarbonylContact O-C 3.48Å; F420-T436 VanDerWaalsContact O-CA 3.26Å; F420-T436 WeakPolarHBondContact O-CA 3.38Å; F420-S437 PolarHBondContact N-OG 3.37Å; F420-S437 PolarHBondContact O-N 2.75Å; F420-I440 HydrophobicContact CD2-CD1 3.81Å; F420-I440 HydrophobicContact CE2-CB 4.28Å; F420-I440 HydrophobicContact CE2-CD1 3.84Å; F420-I440 HydrophobicContact CE2-CG1 4.44Å
421	C	84.8	Confident	74.6	Confident	4 Å²	4	45 Å²	45	3%	0.027	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	160.3	167.9	67.2	0	0	0	0	110.5	V384 E385 W394 P433 T436	V384-C421 WeakPolarHBondContact CA-O 3.42Å; E385-C421 PolarHBondContact N-O 3.41Å; E385-C421 PolarHBondContact O-N 2.64Å; W394-C421 HydrophobicContact CH2-CB 4.12Å; W394-C421 HydrophobicContact CZ3-CB 4.22Å; W394-C421 VanDerWaalsContact CZ3-SG 3.57Å; C421-P433 HydrophobicContact CB-CB 4.24Å; C421-T436 HydrophobicContact CB-CG2 4.37Å
422	V	88.8	Confident	75.8	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	128.5	-177.2	-168.6	0	0	0	0	110.3	P356 P359 W373 Y382 I383 V384 S434	P356-V422 WeakPolarHBondContact CD-O 3.49Å; P356-V422 HydrophobicContact CG-CB 3.67Å; P356-V422 HydrophobicContact CG-CG1 3.77Å; P356-V422 VanDerWaalsContact CG-O 3.28Å; P356-V422 WeakPolarHBondContact CG-O 3.48Å; P359-V422 HydrophobicContact CB-CG2 3.82Å; P359-V422 HydrophobicContact CG-CG2 3.95Å; W373-V422 HydrophobicContact CD2-CG1 4.16Å; W373-V422 HydrophobicContact CD2-CG2 3.96Å; W373-V422 HydrophobicContact CE3-CG2 3.84Å; W373-V422 HydrophobicContact CG-CG2 4.42Å; W373-V422 HydrophobicContact CZ2-CG1 4.02Å; W373-V422 HydrophobicContact CZ3-CG2 4.2Å; Y382-V422 HydrophobicContact CD1-CG1 4Å; Y382-V422 HydrophobicContact CG-CG1 4.23Å; I383-V422 WeakPolarHBondContact O-CA 3.19Å; V384-V422 HydrophobicContact CG1-CG2 4.49Å; V384-V422 HydrophobicContact CG2-CG1 4.23Å; V384-V422 HydrophobicContact CG2-CG2 4.04Å; V422-S434 PolarHBondContact N-OG 3.4Å; V422-S434 WeakPolarHBondContact O-CB 3.38Å; V422-S434 PolarHBondContact O-N 2.88Å
423	I	86.1	Confident	76.5	Confident	16 Å²	16	49.8 Å²	49.8	8%	0.082	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	129.6	176.2	-61.7	168.2	0	0	0	108	Y382 I383 E385 I425 A430 P433	Y382-I423 WeakPolarHBondContact CA-O 3.11Å; I383-I423 PolarHBondContact N-O 2.81Å; I383-I423 PolarHBondContact O-N 3.24Å; E385-I423 HydrophobicContact CG-CD1 4.34Å; E385-I423 WeakPolarHBondContact OE2-CD1 3.18Å; I423-I425 HydrophobicContact CG2-CG1 4.4Å; I423-A430 HydrophobicContact CG2-CB 3.92Å; I423-P433 HydrophobicContact CD1-CG 4.31Å; I423-P433 HydrophobicContact CG1-CB 4.11Å; I423-P433 HydrophobicContact CG1-CG 4.07Å
424	S	85	Confident	77.7	Confident	0 Å²	0	45 Å²	45	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	145.7	171	72.1	0	0	0	0	111.1	Q354 S376 R381 A430 S431	Q354-S424 PolarHBondContact O-OG 3.37Å; S376-S424 WeakPolarHBondContact OG-CB 3.36Å; S376-S424 PolarHBondContact OG-OG 3.12Å; R381-S424 CarbonylContact O-C 3.49Å; R381-S424 WeakPolarHBondContact O-CA 3.41Å; S424-A430 WeakPolarHBondContact O-CA 3.48Å; S424-S431 PolarHBondContact N-OG 2.83Å; S424-S431 PolarHBondContact O-N 3.3Å; S424-S431 PolarHBondContact O-OG 3.26Å; S424-S431 WeakPolarHBondContact OG-CB 3.38Å; S424-S431 PolarHBondContact OG-OG 2.95Å
425	I	82.8	Confident	78.9	Confident	11 Å²	11	45.7 Å²	45.7	6%	0.056	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	119.2	-176.6	-58.7	176.4	0	0	0	108.6	R381 I383 P401 I423 I429 A430	R381-I425 PolarHBondContact N-O 2.76Å; R381-I425 PolarHBondContact O-N 2.93Å; I383-I425 HydrophobicContact CD1-CD1 3.97Å; I383-I425 HydrophobicContact CG1-CD1 4.12Å; P401-I425 HydrophobicContact CB-CD1 4.32Å; P401-I425 HydrophobicContact CG-CD1 3.99Å; I423-I425 HydrophobicContact CG2-CG1 4.4Å; I425-I429 WeakPolarHBondContact CA-O 3.4Å; I425-A430 HydrophobicContact CG1-CB 4.33Å
426	V	82.1	Confident	80.4	Confident	31 Å²	31	42.4 Å²	42.4	19%	0.188	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	127.6	178.3	-176.2	0	0	0	0	107.6	V353 V377 A380 N428 I429	V353-V426 HydrophobicContact CG1-CB 4.34Å; V353-V426 HydrophobicContact CG1-CG2 3.85Å; V377-V426 HydrophobicContact CG2-CG2 3.6Å; A380-V426 HydrophobicContact CB-CG2 4.05Å; V426-N428 PolarHBondContact O-N 3.09Å; V426-I429 PolarHBondContact N-O 2.77Å; V426-I429 PolarHBondContact O-N 2.95Å
427	D	75.9	Confident	81.8	Confident	151 Å²	151	41.7 Å²	41.7	81%	0.807	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.4	34.4	-177.9	-60.5	-33.2	0	0	0	114.8	I429	D427-I429 PolarHBondContact O-N 3.37Å
428	N	69.1	Low	82.3	Confident	122 Å²	122	46 Å²	46	65%	0.652	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.6	14.2	-175.7	-52.1	-49.9	0	0	0	115.8	R381 V426	R381-N428 PolarHBondContact NH2-OD1 2.85Å; R381-N428 VanDerWaalsContact NH2-OD1 3.15Å; V426-N428 PolarHBondContact O-N 3.09Å
429	I	74.8	Confident	82	Confident	70 Å²	70	49.5 Å²	49.5	36%	0.359	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	131.5	165	-57.9	175.4	0	0	0	108.1	S350 V353 I425 V426 D427	S350-I429 VanDerWaalsContact CB-CG2 3.46Å; V353-I429 HydrophobicContact CG2-CB 4.29Å; V353-I429 HydrophobicContact CG2-CG2 3.84Å; I425-I429 WeakPolarHBondContact CA-O 3.4Å; V426-I429 PolarHBondContact N-O 2.77Å; V426-I429 PolarHBondContact O-N 2.95Å; D427-I429 PolarHBondContact O-N 3.37Å
430	A	81.2	Confident	81.6	Confident	4 Å²	4	48.3 Å²	48.3	3%	0.033	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	140.2	176.4	0	0	0	0	0	111.3	K348 V349 S350 I423 S424 I425	K348-A430 PolarHBondContact O-N 3.03Å; V349-A430 CarbonylContact C-O 3.6Å; V349-A430 WeakPolarHBondContact CA-O 3.42Å; V349-A430 HydrophobicContact CG2-CB 4.47Å; S350-A430 PolarHBondContact N-O 3.5Å; I423-A430 HydrophobicContact CG2-CB 3.92Å; S424-A430 WeakPolarHBondContact O-CA 3.48Å; I425-A430 HydrophobicContact CG1-CB 4.33Å
431	S	83.6	Confident	80.4	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.007	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	171.9	163.5	66	0	0	0	0	110.9	V353 S424	V353-S431 WeakPolarHBondContact O-CB 3.36Å; S424-S431 PolarHBondContact N-OG 2.83Å; S424-S431 PolarHBondContact O-N 3.3Å; S424-S431 PolarHBondContact O-OG 3.26Å; S424-S431 WeakPolarHBondContact OG-CB 3.38Å; S424-S431 PolarHBondContact OG-OG 2.95Å
432	Q	81.1	Confident	78.9	Confident	100 Å²	100	53 Å²	53	47%	0.467	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	159.1	154.5	-64.5	-177.9	-0.6	0	0	109.6	V349	V349-Q432 HydrophobicContact CG1-CG 4.37Å
433	P	85.6	Confident	77.1	Confident	70 Å²	70	61.1 Å²	61.1	46%	0.455	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	155.8	170	-21.1	33.2	0	0	0	112.1	C421 I423	C421-P433 HydrophobicContact CB-CB 4.24Å; I423-P433 HydrophobicContact CD1-CG 4.31Å; I423-P433 HydrophobicContact CG1-CB 4.11Å; I423-P433 HydrophobicContact CG1-CG 4.07Å
434	S	87.4	Confident	74.9	Confident	10 Å²	10	64.3 Å²	64.3	7%	0.07	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-62.7	167.7	165.2	69.7	0	0	0	0	111.7	P356 V422	P356-S434 WeakPolarHBondContact O-CB 3.37Å; V422-S434 PolarHBondContact N-OG 3.4Å; V422-S434 WeakPolarHBondContact O-CB 3.38Å; V422-S434 PolarHBondContact O-N 2.88Å
435	E	83.8	Confident	72.5	Confident	156 Å²	156	66.8 Å²	66.8	73%	0.729	35%	0.346	S	S	*	.	P	Polyproline II helix	trans	-54.8	146.6	154.8	-65.4	-178.1	160.4	0	0	109.5	Q358 P359	Q358-E435 HydrophobicContact CG-CB 4.38Å; P359-E435 WeakPolarHBondContact CD-O 3.35Å
436	T	84.4	Confident	70	Confident	51 Å²	51	71.1 Å²	71.1	31%	0.313	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-71.6	152.7	-178.8	55.5	0	0	0	0	111	Q358 W394 F420 C421	Q358-T436 WeakPolarHBondContact CG-O 3.49Å; Q358-T436 PolarHBondContact NE2-O 2.59Å; W394-T436 HydrophobicContact CH2-CG2 3.69Å; W394-T436 HydrophobicContact CZ2-CG2 3.96Å; F420-T436 CarbonylContact O-C 3.48Å; F420-T436 VanDerWaalsContact O-CA 3.26Å; F420-T436 WeakPolarHBondContact O-CA 3.38Å; C421-T436 HydrophobicContact CB-CG2 4.37Å
437	S	85	Confident	67.5	Low	6 Å²	6	77.2 Å²	77.2	4%	0.042	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-51.8	161.4	164.6	66.7	0	0	0	0	111.3	P359 F420	P359-S437 WeakPolarHBondContact O-CA 3.38Å; P359-S437 VanDerWaalsContact O-CB 3.29Å; P359-S437 WeakPolarHBondContact O-CB 3.49Å; F420-S437 PolarHBondContact N-OG 3.37Å; F420-S437 PolarHBondContact O-N 2.75Å
438	D	79.4	Confident	65.4	Low	127 Å²	127	75.3 Å²	75.3	68%	0.679	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-54.7	158.2	154.3	-65.8	-47.3	0	0	0	110.1	I440	D438-I440 WeakPolarHBondContact O-CG1 3.38Å; D438-I440 PolarHBondContact O-N 3.48Å
439	I	70.6	Confident	63.5	Low	82 Å²	82	75 Å²	75	42%	0.421	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-69.2	117.6	-179.5	-66.3	170.2	0	0	0	109.9	V389 E419 H441	V389-I439 HydrophobicContact CG1-CD1 4.19Å; V389-I439 HydrophobicContact CG2-CD1 4.33Å; V389-I439 HydrophobicContact CG2-CG1 4.05Å; V389-I439 HydrophobicContact CG2-CG2 3.87Å; E419-I439 HydrophobicContact CG-CG1 4.09Å; I439-H441 PolarHBondContact O-CD2 3.48Å
440	I	72.5	Confident	61.5	Low	3 Å²	3	76 Å²	76	2%	0.015	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	115.8	-178.2	-58.9	-179.7	0	0	0	109.1	M361 V364 V369 L371 T417 Y418 F420 D438	M361-I440 HydrophobicContact CB-CD1 3.74Å; M361-I440 HydrophobicContact CB-CG1 4.24Å; M361-I440 HydrophobicContact CG-CD1 3.89Å; M361-I440 HydrophobicContact CG-CG1 4.26Å; M361-I440 HydrophobicContact CG-CG2 4.4Å; M361-I440 HydrophobicContact SD-CD1 4.4Å; M361-I440 HydrophobicContact SD-CG1 4.12Å; M361-I440 HydrophobicContact SD-CG2 3.93Å; V364-I440 HydrophobicContact CG2-CG2 3.79Å; V369-I440 HydrophobicContact CG1-CD1 3.62Å; V369-I440 HydrophobicContact CG1-CG2 4.06Å; V369-I440 HydrophobicContact CG2-CG2 3.78Å; L371-I440 HydrophobicContact CD2-CD1 3.66Å; T417-I440 CarbonylContact C-O 3.47Å; T417-I440 WeakPolarHBondContact CA-O 3.35Å; Y418-I440 PolarHBondContact N-O 2.89Å; Y418-I440 PolarHBondContact O-N 3.19Å; F420-I440 HydrophobicContact CD2-CD1 3.81Å; F420-I440 HydrophobicContact CE2-CB 4.28Å; F420-I440 HydrophobicContact CE2-CD1 3.84Å; F420-I440 HydrophobicContact CE2-CG1 4.44Å; D438-I440 WeakPolarHBondContact O-CG1 3.38Å; D438-I440 PolarHBondContact O-N 3.48Å
441	H	63.8	Low	59.4	Low	101 Å²	101	83.2 Å²	83.2	47%	0.468	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	109.6	179.7	-63.9	-100	0	0	0	111.1	T417 I439 R443	T417-H441 HydrophobicContact CG2-CB 4.35Å; T417-H441 WeakPolarHBondContact CG2-ND1 3.21Å; I439-H441 PolarHBondContact O-CD2 3.48Å; H441-R443 VanDerWaalsContact C-N 3.31Å; H441-R443 HydrophobicContact CB-CG 4.39Å; H441-R443 PolarHBondContact O-N 3.13Å
442	L	53.6	Low	57.6	Low	1 Å²	1	90.6 Å²	90.6	1%	0.005	49%	0.493	C	S	.	.			trans	-77.2	80.6	171.4	-75.9	164.4	0	0	0	110.1	V364 G365 V369 L412 H413 N415 S416 Y418	V364-L442 HydrophobicContact CG1-CD2 3.7Å; G365-L442 WeakPolarHBondContact O-CD2 3.47Å; V369-L442 HydrophobicContact CG2-CD1 4.41Å; V369-L442 HydrophobicContact CG2-CD2 3.84Å; V369-L442 HydrophobicContact CG2-CG 4.18Å; L412-L442 HydrophobicContact CB-CD1 3.29Å; L412-L442 HydrophobicContact CD1-CD1 3.98Å; L412-L442 HydrophobicContact CG-CD1 4.26Å; H413-L442 WeakPolarHBondContact O-CD1 3.5Å; N415-L442 WeakPolarHBondContact CA-O 3.46Å; N415-L442 PolarHBondContact N-O 2.94Å; S416-L442 PolarHBondContact O-N 3.39Å; Y418-L442 HydrophobicContact CD2-CD1 3.62Å; Y418-L442 HydrophobicContact CE2-CD1 3.63Å
443	R	50.6	Low	55.8	Low	171 Å²	171	90.3 Å²	90.3	65%	0.645	50%	0.499	S	S	*	.			trans	-79.3	160.4	170	-63.6	-176.3	-174.7	170.5	4.4	109.9	H441 T445	H441-R443 VanDerWaalsContact C-N 3.31Å; H441-R443 HydrophobicContact CB-CG 4.39Å; H441-R443 PolarHBondContact O-N 3.13Å; R443-T445 PolarHBondContact O-N 3.16Å
444	P	40.6	Very low	53.8	Low	83 Å²	83	89 Å²	89	54%	0.539	49%	0.494	S	S	.	.			trans	-68.1	110.4	176.6	-10.8	29.2	0	0	0	107.6	N415 C446	N415-P444 WeakPolarHBondContact OD1-CD 3.5Å; N415-P444 WeakPolarHBondContact OD1-CG 3.25Å; P444-C446 PolarHBondContact O-N 3.32Å
445	T	34.4	Very low	52.3	Low	52 Å²	52	88.8 Å²	88.8	32%	0.319	49%	0.493	S	S	.	.			trans	-75	90.5	175.3	52.2	0	0	0	0	108.8	D366 R443 N447	D366-T445 PolarHBondContact N-OG1 3.17Å; D366-T445 VanDerWaalsContact N-OG1 3.08Å; D366-T445 WeakPolarHBondContact OD1-CA 3.04Å; D366-T445 PolarHBondContact OD1-N 2.94Å; D366-T445 PolarHBondContact OD1-OG1 3.36Å; R443-T445 PolarHBondContact O-N 3.16Å; T445-N447 PolarHBondContact O-N 3.42Å
446	C	30.9	Very low	51.4	Low	101 Å²	101	85.1 Å²	85.1	68%	0.682	48%	0.478	S	S	*	.			trans	-56.3	111.1	164	53.9	0	0	0	0	108.4	P444 T448	P444-C446 PolarHBondContact O-N 3.32Å; C446-T448 WeakPolarHBondContact O-CA 3.22Å; C446-T448 PolarHBondContact O-N 2.99Å; C446-T448 VanDerWaalsContact O-N 3.08Å
447	N	29.2	Very low	50.7	Low	160 Å²	160	83.3 Å²	83.3	86%	0.856	47%	0.466	S	S	*	.			trans	-45.2	113.5	-163.2	-169.5	-10.1	0	0	0	112.3	T445 S449	T445-N447 PolarHBondContact O-N 3.42Å; N447-S449 VanDerWaalsContact C-N 3.32Å; N447-S449 PolarHBondContact O-N 2.89Å
448	T	31.1	Very low	49.7	Very low	111 Å²	111	87.7 Å²	87.7	68%	0.681	49%	0.489	S	S	*	.	S	Bend	trans	-82.6	65.4	-145.3	-29.5	0	0	0	0	114.3	C446	C446-T448 WeakPolarHBondContact O-CA 3.22Å; C446-T448 PolarHBondContact O-N 2.99Å; C446-T448 VanDerWaalsContact O-N 3.08Å
449	S	30.1	Very low	49.5	Very low	115 Å²	115	86.8 Å²	86.8	80%	0.804	48%	0.481	S	S	*	.	S	Bend	trans	-136.4	17.2	176.8	-168.2	0	0	0	0	115.2	N447	N447-S449 VanDerWaalsContact C-N 3.32Å; N447-S449 PolarHBondContact O-N 2.89Å
450	A	33.8	Very low	49.9	Very low	91 Å²	91	84.6 Å²	84.6	75%	0.752	48%	0.475	S	S	*	.			trans	-158.6	60.4	172.3	0	0	0	0	0	114.6	R452	A450-R452 PolarHBondContact O-N 3.12Å
451	L	35.8	Very low	50.6	Low	155 Å²	155	84.6 Å²	84.6	81%	0.812	48%	0.475	S	S	*	.			trans	-64.9	125.7	169.8	-92.6	168.7	0	0	0	111.2
452	R	45.7	Very low	51.6	Low	157 Å²	157	84.8 Å²	84.8	59%	0.592	48%	0.476	S	S	*	.			trans	-111.5	146.4	159.4	-61.2	-162.3	-169.4	-169.2	10	108.7	A450 Q481	A450-R452 PolarHBondContact O-N 3.12Å; R452-Q481 HydrophobicContact CB-CB 3.83Å; R452-Q481 HydrophobicContact CB-CG 4.23Å; R452-Q481 HydrophobicContact CG-CB 4.35Å
453	P	42.6	Very low	52.9	Low	93 Å²	93	87.9 Å²	87.9	60%	0.604	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-71.7	155.5	-172.7	28.6	-36	0	0	0	113.7
454	A	43.8	Very low	53.9	Low	43 Å²	43	84.6 Å²	84.6	36%	0.355	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-59.8	165.9	165.3	0	0	0	0	0	111.6
455	P	56.8	Low	55.4	Low	6 Å²	6	86.6 Å²	86.6	4%	0.039	49%	0.487	C	S	.	.	P	Polyproline II helix	trans	-62.7	146.4	-179.4	-15.1	30.1	0	0	0	110.8	A478 Q479 A530 N532 S537	P455-A478 HydrophobicContact CB-CB 3.86Å; P455-Q479 WeakPolarHBondContact CA-O 3.35Å; P455-A530 HydrophobicContact CB-CB 3.84Å; P455-A530 HydrophobicContact CG-CB 4.36Å; P455-N532 WeakPolarHBondContact CD-ND2 3.4Å; P455-N532 HydrophobicContact CG-CB 3.77Å; P455-N532 WeakPolarHBondContact CG-ND2 3.4Å; P455-S537 WeakPolarHBondContact O-CA 3.32Å; P455-S537 WeakPolarHBondContact O-CB 3.37Å
456	N	65.7	Low	57.2	Low	78 Å²	78	87.8 Å²	87.8	42%	0.417	49%	0.493	S	S	.	.	B	Isolated β-bridge	trans	-125.8	133.2	174.5	-162.2	1.1	0	0	0	111.3	L458 A478 Q479	N456-L458 WeakPolarHBondContact ND2-CD2 3.45Å; N456-A478 WeakPolarHBondContact O-CA 3.24Å; N456-Q479 PolarHBondContact N-O 3.16Å; N456-Q479 PolarHBondContact O-N 3.45Å
457	I	69.7	Low	58.8	Low	13 Å²	13	87.8 Å²	87.8	7%	0.067	49%	0.487	C	S	.	.			trans	-114.4	103.3	175.3	-55.6	170	0	0	0	106.8	E459 A478 Y487 V528 A530	I457-E459 WeakPolarHBondContact CG2-O 3.33Å; I457-A478 HydrophobicContact CG1-CB 3.73Å; I457-Y487 HydrophobicContact CD1-CD1 4.36Å; I457-Y487 HydrophobicContact CD1-CE1 4.44Å; I457-V528 HydrophobicContact CD1-CB 4.15Å; I457-V528 HydrophobicContact CD1-CG1 4.02Å; I457-V528 WeakPolarHBondContact CD1-O 3.38Å; I457-A530 HydrophobicContact CD1-CB 3.88Å; I457-A530 HydrophobicContact CG1-CB 4.24Å
458	L	63.6	Low	60.9	Low	99 Å²	99	81 Å²	81	52%	0.518	46%	0.455	S	S	.	.			trans	-84.3	-18.4	-172.2	-64.5	174.5	0	0	0	113.8	N456	N456-L458 WeakPolarHBondContact ND2-CD2 3.45Å
459	E	74	Confident	62.9	Low	108 Å²	108	76.8 Å²	76.8	51%	0.505	43%	0.428	S	S	.	.	S	Bend	trans	-123	151.8	-169.3	-67.9	173.6	-139.6	0	0	110.4	I457 L476	I457-E459 WeakPolarHBondContact CG2-O 3.33Å; E459-L476 WeakPolarHBondContact OE2-CD1 3.46Å
460	A	80.2	Confident	65	Low	36 Å²	36	74.4 Å²	74.4	30%	0.298	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-73.9	154.5	178	0	0	0	0	0	111.3	E462 P541 P542	A460-E462 PolarHBondContact O-N 2.79Å; A460-P541 WeakPolarHBondContact CA-O 3.18Å; A460-P541 HydrophobicContact CB-CB 4.22Å; A460-P542 WeakPolarHBondContact CB-O 3.35Å
461	P	87	Confident	67.2	Low	3 Å²	3	70.1 Å²	70.1	2%	0.019	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-67.6	132	169.9	27	-31.6	0	0	0	111	I473 C474 W475 F526 V528 S543	P461-I473 HydrophobicContact CB-CB 4.41Å; P461-I473 HydrophobicContact CB-CD1 4.16Å; P461-C474 CarbonylContact C-O 3.53Å; P461-C474 WeakPolarHBondContact CA-O 3.31Å; P461-W475 HydrophobicContact CB-CB 4.4Å; P461-F526 HydrophobicContact CG-CB 4.14Å; P461-F526 WeakPolarHBondContact CG-O 3.14Å; P461-V528 HydrophobicContact CB-CG2 3.98Å; P461-V528 HydrophobicContact CG-CG2 4.06Å; P461-S543 WeakPolarHBondContact O-CB 3.45Å
462	E	83.6	Confident	69.3	Low	104 Å²	104	63.5 Å²	63.5	49%	0.486	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	152.8	179.1	-63.6	-170.7	127.2	0	0	111.5	A460 I473 C474 Y573	A460-E462 PolarHBondContact O-N 2.79Å; E462-I473 CarbonylContact O-C 3.53Å; E462-I473 VanDerWaalsContact O-CA 3.26Å; E462-I473 WeakPolarHBondContact O-CA 3.4Å; E462-C474 PolarHBondContact N-O 2.99Å; E462-C474 PolarHBondContact O-N 2.84Å; E462-Y573 PolarHBondContact OE2-OH 3.43Å
463	F	82.8	Confident	71.1	Confident	67 Å²	67	56 Å²	56	29%	0.294	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	114.7	175	-60.2	-59.3	0	0	0	111.3	I471 I473 F526 S543 D544 V546	F463-I471 HydrophobicContact CD1-CG2 3.59Å; F463-I471 HydrophobicContact CE1-CG2 4.02Å; F463-I473 HydrophobicContact CD1-CG2 3.71Å; F463-I473 HydrophobicContact CE1-CG2 3.8Å; F463-F526 AromaticContact CE1-CD2 3.61Å; F463-F526 HydrophobicContact CE1-CD2 3.61Å; F463-F526 AromaticContact CE1-CE2 3.89Å; F463-F526 HydrophobicContact CE1-CE2 3.89Å; F463-F526 HydrophobicContact CZ-CD2 4.06Å; F463-F526 HydrophobicContact CZ-CE2 4.45Å; F463-S543 WeakPolarHBondContact CZ-OG 3.5Å; F463-D544 VanDerWaalsContact CE2-O 3.31Å; F463-D544 WeakPolarHBondContact CE2-O 3.35Å; F463-D544 VanDerWaalsContact CZ-O 3.27Å; F463-D544 WeakPolarHBondContact CZ-O 3.46Å; F463-V546 HydrophobicContact CD1-CG1 4.16Å; F463-V546 HydrophobicContact CD2-CB 4.3Å; F463-V546 HydrophobicContact CE1-CB 4.16Å; F463-V546 HydrophobicContact CE1-CG1 3.44Å; F463-V546 VanDerWaalsContact CE1-CG1 3.44Å; F463-V546 HydrophobicContact CE2-CB 3.82Å; F463-V546 HydrophobicContact CE2-CG1 3.92Å; F463-V546 HydrophobicContact CZ-CB 3.74Å; F463-V546 HydrophobicContact CZ-CG1 3.29Å
464	L	70.7	Confident	72.9	Confident	102 Å²	102	52.2 Å²	52.2	53%	0.534	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	-45.2	179.1	-171.7	67.5	0	0	0	112	T472	L464-T472 HydrophobicContact CB-CG2 4.24Å; L464-T472 WeakPolarHBondContact CB-O 3.41Å; L464-T472 HydrophobicContact CD2-CG2 4.04Å; L464-T472 PolarHBondContact N-O 3.15Å
465	E	71.7	Confident	74.8	Confident	125 Å²	125	50.3 Å²	50.3	58%	0.584	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.8	142.4	-179.6	-64.2	177	154.8	0	0	110.3	I471 T472	E465-I471 CarbonylContact O-C 3.36Å; E465-I471 WeakPolarHBondContact O-CA 3.29Å; E465-T472 PolarHBondContact N-O 2.87Å; E465-T472 PolarHBondContact O-N 3.44Å
466	V	72.8	Confident	75.6	Confident	76 Å²	76	53 Å²	53	46%	0.461	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	114	172.3	-176.2	0	0	0	0	107.9	I471 V546	V466-I471 HydrophobicContact CG1-CG1 4.2Å; V466-I471 HydrophobicContact CG2-CG1 4.33Å; V466-V546 HydrophobicContact CG1-CG2 4.47Å; V466-V546 HydrophobicContact CG2-CG2 4.06Å
467	D	65.2	Low	75.7	Confident	101 Å²	101	52.5 Å²	52.5	54%	0.54	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	79.6	-175.4	170.5	44.3	0	0	0	110.4	D469 K470	D467-D469 PolarHBondContact O-N 2.86Å; D467-D469 VanDerWaalsContact O-N 3.13Å; D467-K470 PolarHBondContact N-O 3.25Å; D467-K470 PolarHBondContact O-N 2.67Å; D467-K470 VanDerWaalsContact O-N 3.15Å; D467-K470 PolarHBondContact O-NZ 2.98Å; D467-K470 VanDerWaalsContact O-NZ 3.12Å; D467-K470 IonicContact OD2-NZ 3.86Å; D467-K470 PolarHBondContact OD2-NZ 3.48Å
468	G	73.2	Confident	75.8	Confident	18 Å²	18	52.3 Å²	52.3	19%	0.186	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.6	-115.9	-179.6	0	0	0	0	0	111.5	K470 I548	G468-K470 PolarHBondContact O-N 2.8Å; G468-I548 WeakPolarHBondContact O-CG2 3.48Å
469	D	72.2	Confident	76	Confident	23 Å²	23	53.9 Å²	53.9	12%	0.123	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71	16.1	179.2	52.7	40.5	0	0	0	115.8	D467 G516 D517 L518 R1100	D467-D469 PolarHBondContact O-N 2.86Å; D467-D469 VanDerWaalsContact O-N 3.13Å; D469-G516 CarbonylContact O-C 3.52Å; D469-G516 VanDerWaalsContact O-CA 3.27Å; D469-G516 WeakPolarHBondContact O-CA 3.26Å; D469-D517 PolarHBondContact O-N 3.46Å; D469-D517 VanDerWaalsContact O-N 3.12Å; D469-L518 PolarHBondContact O-N 3.01Å; D469-R1100 IonicContact OD1-NH1 3.35Å; D469-R1100 PolarHBondContact OD1-NH1 2.96Å; D469-R1100 IonicContact OD2-CZ 2.74Å; D469-R1100 IonicContact OD2-NH1 2.85Å; D469-R1100 PolarHBondContact OD2-NH1 3.21Å; D469-R1100 IonicContact OD2-NH2 3.16Å; D469-R1100 PolarHBondContact OD2-NH2 3.13Å
470	K	75.1	Confident	75.4	Confident	65 Å²	65	50.5 Å²	50.5	28%	0.283	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	144.4	-179.7	-73.2	169.8	-99.4	66.8	0	112.9	D467 G468 T514 V515	D467-K470 PolarHBondContact N-O 3.25Å; D467-K470 PolarHBondContact O-N 2.67Å; D467-K470 VanDerWaalsContact O-N 3.15Å; D467-K470 PolarHBondContact O-NZ 2.98Å; D467-K470 VanDerWaalsContact O-NZ 3.12Å; D467-K470 IonicContact OD2-NZ 3.86Å; D467-K470 PolarHBondContact OD2-NZ 3.48Å; G468-K470 PolarHBondContact O-N 2.8Å; K470-T514 HydrophobicContact CB-CG2 4.19Å; K470-T514 HydrophobicContact CD-CG2 4.48Å; K470-T514 HydrophobicContact CG-CG2 4.42Å; K470-V515 VanDerWaalsContact CA-O 3.23Å; K470-V515 WeakPolarHBondContact CA-O 3.36Å
471	I	80.1	Confident	73.9	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	129.6	170.6	-65.5	165.7	0	0	0	108.4	F463 E465 V466 I473 T514 V515 L518 F526 V546 I548	F463-I471 HydrophobicContact CD1-CG2 3.59Å; F463-I471 HydrophobicContact CE1-CG2 4.02Å; E465-I471 CarbonylContact O-C 3.36Å; E465-I471 WeakPolarHBondContact O-CA 3.29Å; V466-I471 HydrophobicContact CG1-CG1 4.2Å; V466-I471 HydrophobicContact CG2-CG1 4.33Å; I471-I473 HydrophobicContact CG2-CG2 3.95Å; I471-T514 CarbonylContact O-C 3.49Å; I471-T514 WeakPolarHBondContact O-CA 3.49Å; I471-V515 PolarHBondContact N-O 3.02Å; I471-V515 PolarHBondContact O-N 2.7Å; I471-L518 HydrophobicContact CB-CD1 4.38Å; I471-L518 HydrophobicContact CD1-CD1 3.66Å; I471-L518 HydrophobicContact CG1-CD1 3.95Å; I471-F526 HydrophobicContact CD1-CE2 3.82Å; I471-F526 HydrophobicContact CD1-CZ 3.97Å; I471-V546 HydrophobicContact CD1-CB 4.45Å; I471-V546 HydrophobicContact CD1-CG1 3.4Å; I471-V546 HydrophobicContact CD1-CG2 4.18Å; I471-I548 HydrophobicContact CD1-CD1 3.59Å; I471-I548 HydrophobicContact CG1-CD1 4.05Å
472	T	78.5	Confident	72	Confident	16 Å²	16	56.9 Å²	56.9	10%	0.098	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	115.9	164.3	-57.1	0	0	0	0	109.1	L464 E465 M513 T514	L464-T472 HydrophobicContact CB-CG2 4.24Å; L464-T472 WeakPolarHBondContact CB-O 3.41Å; L464-T472 HydrophobicContact CD2-CG2 4.04Å; L464-T472 PolarHBondContact N-O 3.15Å; E465-T472 PolarHBondContact N-O 2.87Å; E465-T472 PolarHBondContact O-N 3.44Å; T472-M513 WeakPolarHBondContact CA-O 3.45Å; T472-T514 PolarHBondContact OG1-OG1 2.88Å
473	I	84.8	Confident	70.1	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	151.8	169.1	55	161.4	0	0	0	111.1	P461 E462 F463 I471 W475 V489 K512 M513 F526	P461-I473 HydrophobicContact CB-CB 4.41Å; P461-I473 HydrophobicContact CB-CD1 4.16Å; E462-I473 CarbonylContact O-C 3.53Å; E462-I473 VanDerWaalsContact O-CA 3.26Å; E462-I473 WeakPolarHBondContact O-CA 3.4Å; F463-I473 HydrophobicContact CD1-CG2 3.71Å; F463-I473 HydrophobicContact CE1-CG2 3.8Å; I471-I473 HydrophobicContact CG2-CG2 3.95Å; I473-W475 HydrophobicContact CD1-CE3 4.13Å; I473-W475 HydrophobicContact CD1-CZ3 3.88Å; I473-W475 HydrophobicContact CG1-CE3 4.38Å; I473-W475 HydrophobicContact CG1-CZ3 4.04Å; I473-V489 HydrophobicContact CD1-CG1 3.68Å; I473-V489 HydrophobicContact CD1-CG2 4.43Å; I473-K512 CarbonylContact O-C 3.59Å; I473-K512 VanDerWaalsContact O-CA 3.23Å; I473-K512 WeakPolarHBondContact O-CA 3.31Å; I473-K512 WeakPolarHBondContact O-CB 3.3Å; I473-M513 WeakPolarHBondContact CG1-O 3.34Å; I473-M513 PolarHBondContact N-O 2.8Å; I473-M513 PolarHBondContact O-N 2.84Å; I473-F526 HydrophobicContact CD1-CB 4.21Å; I473-F526 HydrophobicContact CG2-CB 4.47Å; I473-F526 HydrophobicContact CG2-CD2 4.26Å; I473-F526 HydrophobicContact CG2-CG 4.26Å
474	C	78.7	Confident	69	Low	13 Å²	13	55.8 Å²	55.8	9%	0.088	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	159.8	166.8	56.8	0	0	0	0	111.3	P461 E462 C511 K512	P461-C474 CarbonylContact C-O 3.53Å; P461-C474 WeakPolarHBondContact CA-O 3.31Å; E462-C474 PolarHBondContact N-O 2.99Å; E462-C474 PolarHBondContact O-N 2.84Å; C474-C511 WeakPolarHBondContact CA-O 3.47Å; C474-K512 HydrophobicContact CB-CB 4.06Å
475	W	85.5	Confident	68.2	Low	3 Å²	3	56.2 Å²	56.2	1%	0.011	31%	0.306	C	S	.	.			trans	-146.6	161.4	179.5	56.4	95.4	0	0	0	110.4	P461 I473 Y487 V489 A510 C511 M513 V528	P461-W475 HydrophobicContact CB-CB 4.4Å; I473-W475 HydrophobicContact CD1-CE3 4.13Å; I473-W475 HydrophobicContact CD1-CZ3 3.88Å; I473-W475 HydrophobicContact CG1-CE3 4.38Å; I473-W475 HydrophobicContact CG1-CZ3 4.04Å; W475-Y487 AromaticContact CD1-CE1 3.95Å; W475-Y487 AromaticContact CE2-CG 3.93Å; W475-Y487 HydrophobicContact CZ2-CD2 4.12Å; W475-Y487 AromaticContact CZ2-CG 3.89Å; W475-Y487 HydrophobicContact CZ2-CG 3.89Å; W475-Y487 AromaticContact NE1-CD1 3.27Å; W475-Y487 VanDerWaalsContact NE1-CD1 3.27Å; W475-Y487 AromaticContact NE1-CD2 3.69Å; W475-Y487 AromaticContact NE1-CE1 3.45Å; W475-Y487 AromaticContact NE1-CE2 3.91Å; W475-Y487 AromaticContact NE1-CG 3.41Å; W475-Y487 AromaticContact NE1-CZ 3.82Å; W475-V489 HydrophobicContact CH2-CG2 3.69Å; W475-V489 HydrophobicContact CZ2-CG2 4.37Å; W475-V489 HydrophobicContact CZ3-CG2 3.96Å; W475-A510 VanDerWaalsContact CZ2-O 3.26Å; W475-A510 WeakPolarHBondContact CZ2-O 3.28Å; W475-C511 HydrophobicContact CD2-CB 4.47Å; W475-C511 VanDerWaalsContact CE2-CA 3.49Å; W475-C511 HydrophobicContact CG-CB 4.34Å; W475-C511 PolarHBondContact N-O 2.99Å; W475-C511 VanDerWaalsContact O-CB 3.29Å; W475-C511 WeakPolarHBondContact O-CB 3.27Å; W475-M513 HydrophobicContact CH2-CB 4.08Å; W475-M513 HydrophobicContact CZ3-CB 4.16Å; W475-V528 HydrophobicContact CB-CG2 4.44Å; W475-V528 HydrophobicContact CD2-CG1 4.12Å; W475-V528 HydrophobicContact CD2-CG2 3.87Å; W475-V528 HydrophobicContact CE3-CG2 3.92Å; W475-V528 HydrophobicContact CG-CG1 4.33Å; W475-V528 HydrophobicContact CG-CG2 4.12Å; W475-V528 HydrophobicContact CZ2-CG1 4.23Å; W475-V528 HydrophobicContact CZ3-CG2 4.47Å
476	L	72.8	Confident	67.4	Low	63 Å²	63	50.3 Å²	50.3	33%	0.33	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-75.9	146.3	170.4	-72.7	175.7	0	0	0	111	E459 Y573	E459-L476 WeakPolarHBondContact OE2-CD1 3.46Å; L476-Y573 HydrophobicContact CD2-CD1 3.96Å; L476-Y573 HydrophobicContact CD2-CE1 3.44Å; L476-Y573 VanDerWaalsContact CD2-CE1 3.44Å; L476-Y573 HydrophobicContact CG-CE1 3.89Å
477	P	67.5	Low	67.6	Low	68 Å²	68	47.1 Å²	47.1	44%	0.442	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-56.1	138.9	174.3	-23.6	32.6	0	0	0	112.5	Q479 Y487	P477-Q479 PolarHBondContact O-N 3.37Å; P477-Y487 VanDerWaalsContact CA-OH 3.3Å; P477-Y487 WeakPolarHBondContact CA-OH 3.44Å
478	A	72.6	Confident	68.2	Low	9 Å²	9	43.2 Å²	43.2	7%	0.074	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-63.6	134.4	179.5	0	0	0	0	0	111.2	P455 N456 I457 S480 V484 Y487 A530	P455-A478 HydrophobicContact CB-CB 3.86Å; N456-A478 WeakPolarHBondContact O-CA 3.24Å; I457-A478 HydrophobicContact CG1-CB 3.73Å; A478-S480 PolarHBondContact O-N 2.81Å; A478-S480 VanDerWaalsContact O-N 3.13Å; A478-V484 HydrophobicContact CB-CG2 4.28Å; A478-Y487 HydrophobicContact CB-CE1 3.99Å; A478-Y487 PolarHBondContact N-OH 2.77Å; A478-A530 HydrophobicContact CB-CB 3.48Å; A478-A530 VanDerWaalsContact CB-CB 3.48Å
479	Q	67	Low	68.6	Low	132 Å²	132	42.3 Å²	42.3	62%	0.617	23%	0.229	S	C	*	.	B	Isolated β-bridge	trans	-72.3	109.2	175	-63.4	-175.5	10.9	0	0	108.5	P455 N456 P477	P455-Q479 WeakPolarHBondContact CA-O 3.35Å; N456-Q479 PolarHBondContact N-O 3.16Å; N456-Q479 PolarHBondContact O-N 3.45Å; P477-Q479 PolarHBondContact O-N 3.37Å
480	S	61	Low	69.3	Low	36 Å²	36	42.9 Å²	42.9	25%	0.252	23%	0.23	S	C	.	.			trans	-140.2	142.1	-174.8	179.2	0	0	0	0	110.6	A478 L482 N532	A478-S480 PolarHBondContact O-N 2.81Å; A478-S480 VanDerWaalsContact O-N 3.13Å; S480-L482 VanDerWaalsContact C-N 3.33Å; S480-L482 WeakPolarHBondContact CB-O 3.06Å; S480-L482 PolarHBondContact OG-N 3.02Å; S480-L482 PolarHBondContact OG-O 3.42Å; S480-N532 PolarHBondContact OG-ND2 2.88Å
481	Q	50.3	Low	70	Confident	109 Å²	109	42 Å²	42	51%	0.509	23%	0.227	S	C	.	.	S	Bend	trans	-87	-5.3	174.9	-73.8	-75.6	-32.9	0	0	113.2	R452	R452-Q481 HydrophobicContact CB-CB 3.83Å; R452-Q481 HydrophobicContact CB-CG 4.23Å; R452-Q481 HydrophobicContact CG-CB 4.35Å
482	L	46	Very low	70.4	Confident	64 Å²	64	44.3 Å²	44.3	34%	0.335	24%	0.235	S	C	.	.	S	Bend	trans	-125.6	157.8	174.8	-60.7	174.8	0	0	0	109.3	S480 V484 N532 S534	S480-L482 VanDerWaalsContact C-N 3.33Å; S480-L482 WeakPolarHBondContact CB-O 3.06Å; S480-L482 PolarHBondContact OG-N 3.02Å; S480-L482 PolarHBondContact OG-O 3.42Å; L482-V484 PolarHBondContact O-N 2.88Å; L482-N532 HydrophobicContact CB-CB 4.33Å; L482-S534 VanDerWaalsContact CD1-OG 3.23Å; L482-S534 WeakPolarHBondContact CD1-OG 3.41Å
483	P	44.6	Very low	70.8	Confident	105 Å²	105	43.8 Å²	43.8	68%	0.682	23%	0.232	S	C	*	.			trans	-53.9	130.6	176.8	-26.2	35.4	0	0	0	112.4	M485 N532	P483-M485 PolarHBondContact O-N 3.3Å; P483-N532 VanDerWaalsContact O-CB 3.32Å; P483-N532 WeakPolarHBondContact O-CB 3.41Å
484	V	59.9	Low	70.6	Confident	44 Å²	44	47.1 Å²	47.1	27%	0.267	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	117.4	173.8	178.3	0	0	0	0	108.2	A478 L482 G486 Y487 A530 H531	A478-V484 HydrophobicContact CB-CG2 4.28Å; L482-V484 PolarHBondContact O-N 2.88Å; V484-G486 VanDerWaalsContact C-N 3.25Å; V484-G486 PolarHBondContact O-N 2.78Å; V484-Y487 HydrophobicContact CG1-CE1 4.25Å; V484-Y487 HydrophobicContact CG1-CE2 4.03Å; V484-A530 HydrophobicContact CG1-CB 4.13Å; V484-H531 CarbonylContact C-O 3.58Å; V484-H531 VanDerWaalsContact CA-O 3.32Å; V484-H531 WeakPolarHBondContact CA-O 2.87Å; V484-H531 WeakPolarHBondContact CG1-O 3.41Å
485	M	52.5	Low	70.7	Confident	110 Å²	110	50.6 Å²	50.6	54%	0.542	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	6.6	-174.6	-62.3	177.3	68.6	0	0	113.2	P483 F509 H531 A533	P483-M485 PolarHBondContact O-N 3.3Å; M485-F509 WeakPolarHBondContact O-CE1 3.42Å; M485-H531 PolarHBondContact N-O 3.05Å; M485-A533 HydrophobicContact SD-CB 4.22Å
486	G	55.8	Low	70.1	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.01	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	135	173.2	175.1	0	0	0	0	0	112.8	V484 V508 H531	V484-G486 VanDerWaalsContact C-N 3.25Å; V484-G486 PolarHBondContact O-N 2.78Å; G486-V508 CarbonylContact C-O 3.58Å; G486-V508 WeakPolarHBondContact CA-O 3.31Å; G486-H531 PolarHBondContact O-N 3.39Å
487	Y	75.7	Confident	69.7	Low	9 Å²	9	56.4 Å²	56.4	4%	0.035	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	141.7	-178.9	-61.7	-88.6	0	0	0	111.1	I457 W475 P477 A478 V484 N504 P507 V508 C511 V528 L529 A530	I457-Y487 HydrophobicContact CD1-CD1 4.36Å; I457-Y487 HydrophobicContact CD1-CE1 4.44Å; W475-Y487 AromaticContact CD1-CE1 3.95Å; W475-Y487 AromaticContact CE2-CG 3.93Å; W475-Y487 HydrophobicContact CZ2-CD2 4.12Å; W475-Y487 AromaticContact CZ2-CG 3.89Å; W475-Y487 HydrophobicContact CZ2-CG 3.89Å; W475-Y487 AromaticContact NE1-CD1 3.27Å; W475-Y487 VanDerWaalsContact NE1-CD1 3.27Å; W475-Y487 AromaticContact NE1-CD2 3.69Å; W475-Y487 AromaticContact NE1-CE1 3.45Å; W475-Y487 AromaticContact NE1-CE2 3.91Å; W475-Y487 AromaticContact NE1-CG 3.41Å; W475-Y487 AromaticContact NE1-CZ 3.82Å; P477-Y487 VanDerWaalsContact CA-OH 3.3Å; P477-Y487 WeakPolarHBondContact CA-OH 3.44Å; A478-Y487 HydrophobicContact CB-CE1 3.99Å; A478-Y487 PolarHBondContact N-OH 2.77Å; V484-Y487 HydrophobicContact CG1-CE1 4.25Å; V484-Y487 HydrophobicContact CG1-CE2 4.03Å; Y487-N504 PolarHBondContact O-ND2 2.96Å; Y487-P507 CarbonylContact O-C 3.52Å; Y487-P507 WeakPolarHBondContact O-CA 3.46Å; Y487-V508 VanDerWaalsContact CD2-O 3.32Å; Y487-V508 WeakPolarHBondContact CD2-O 3.48Å; Y487-V508 PolarHBondContact N-O 2.68Å; Y487-V508 PolarHBondContact O-N 2.64Å; Y487-C511 VanDerWaalsContact CE2-SG 3.52Å; Y487-V528 HydrophobicContact CD1-CG1 3.74Å; Y487-V528 HydrophobicContact CG-CG1 4.21Å; Y487-L529 CarbonylContact C-O 3.54Å; Y487-L529 WeakPolarHBondContact CA-O 3.42Å; Y487-A530 HydrophobicContact CD1-CB 3.77Å; Y487-A530 HydrophobicContact CE1-CB 3.7Å
488	D	77.8	Confident	69.7	Low	19 Å²	19	58.8 Å²	58.8	10%	0.102	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	140.2	165.3	-76.1	-28.5	0	0	0	110.2	K502 N504 V528 L529 H531	D488-K502 WeakPolarHBondContact OD1-CE 3.45Å; D488-K502 IonicContact OD1-NZ 3.31Å; D488-K502 PolarHBondContact OD1-NZ 3.48Å; D488-K502 WeakPolarHBondContact OD2-CE 3.47Å; D488-K502 IonicContact OD2-NZ 2.61Å; D488-K502 PolarHBondContact OD2-NZ 2.95Å; D488-N504 WeakPolarHBondContact CA-OD1 3.38Å; D488-N504 PolarHBondContact OD1-ND2 3.45Å; D488-V528 CarbonylContact O-C 3.48Å; D488-V528 WeakPolarHBondContact O-CA 3.47Å; D488-L529 HydrophobicContact CB-CB 4.39Å; D488-L529 PolarHBondContact N-O 3.3Å; D488-L529 PolarHBondContact O-N 2.95Å; D488-H531 VanDerWaalsContact CG-NE2 3.31Å; D488-H531 IonicContact OD2-CD2 2.69Å; D488-H531 IonicContact OD2-CE1 3.83Å; D488-H531 IonicContact OD2-NE2 3.69Å; D488-H531 PolarHBondContact OD2-NE2 2.8Å
489	V	82.9	Confident	69.5	Low	0 Å²	0	66.2 Å²	66.2	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	132.9	179.6	177.7	0	0	0	0	108.8	I473 W475 V503 N504 M513 V528	I473-V489 HydrophobicContact CD1-CG1 3.68Å; I473-V489 HydrophobicContact CD1-CG2 4.43Å; W475-V489 HydrophobicContact CH2-CG2 3.69Å; W475-V489 HydrophobicContact CZ2-CG2 4.37Å; W475-V489 HydrophobicContact CZ3-CG2 3.96Å; V489-V503 HydrophobicContact CB-CB 4.48Å; V489-V503 HydrophobicContact CG1-CB 4.47Å; V489-V503 HydrophobicContact CG1-CG2 4.06Å; V489-V503 PolarHBondContact O-N 2.85Å; V489-N504 PolarHBondContact N-OD1 3.36Å; V489-N504 PolarHBondContact O-OD1 2.88Å; V489-M513 HydrophobicContact CB-CE 3.6Å; V489-M513 HydrophobicContact CG1-CE 3.8Å; V489-M513 HydrophobicContact CG2-CE 3.81Å; V489-V528 HydrophobicContact CG2-CG2 4.39Å
490	E	86.9	Confident	70.1	Confident	35 Å²	35	62 Å²	62	16%	0.164	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	151	174.6	-57	-175.2	135	0	0	110.7	W500 Y501 F526 R527 L529	E490-W500 HydrophobicContact CB-CB 4.38Å; E490-W500 HydrophobicContact CB-CE3 3.95Å; E490-Y501 CarbonylContact C-O 3.47Å; E490-Y501 WeakPolarHBondContact CA-O 3.27Å; E490-F526 CarbonylContact O-C 3.48Å; E490-F526 VanDerWaalsContact O-CA 3.3Å; E490-F526 WeakPolarHBondContact O-CA 3.34Å; E490-R527 HydrophobicContact CB-CG 4.1Å; E490-R527 PolarHBondContact N-O 3.43Å; E490-R527 PolarHBondContact O-N 3.07Å; E490-R527 IonicContact OE2-CZ 3.81Å; E490-R527 IonicContact OE2-NE 3.74Å; E490-R527 PolarHBondContact OE2-NE 2.99Å; E490-R527 IonicContact OE2-NH2 2.63Å; E490-R527 PolarHBondContact OE2-NH2 3.1Å; E490-L529 HydrophobicContact CG-CD1 4.03Å
491	F	89.7	Confident	70.7	Confident	46 Å²	46	64.4 Å²	64.4	20%	0.202	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	158.3	174.2	78.4	-80.8	0	0	0	111.4	W500 Y501 V503 Y524 Q525 F526	F491-W500 CarbonylContact O-C 3.51Å; F491-W500 WeakPolarHBondContact O-CA 3.3Å; F491-Y501 VanDerWaalsContact CD1-O 3.24Å; F491-Y501 WeakPolarHBondContact CD1-O 3.43Å; F491-Y501 VanDerWaalsContact CE1-CB 3.46Å; F491-Y501 HydrophobicContact CE1-CG 4.45Å; F491-Y501 HydrophobicContact CZ-CG 4.35Å; F491-Y501 PolarHBondContact N-O 2.75Å; F491-Y501 PolarHBondContact O-N 3.36Å; F491-V503 HydrophobicContact CB-CG2 4.33Å; F491-V503 HydrophobicContact CD1-CG2 3.56Å; F491-V503 HydrophobicContact CE1-CG2 4.34Å; F491-V503 HydrophobicContact CG-CG2 4.37Å; F491-Y524 AromaticContact CD2-CD1 3.77Å; F491-Y524 HydrophobicContact CD2-CD1 3.77Å; F491-Y524 AromaticContact CD2-CE1 3.95Å; F491-Y524 HydrophobicContact CD2-CE1 3.95Å; F491-Y524 HydrophobicContact CE2-CD1 4.28Å; F491-Y524 AromaticContact CE2-CE1 3.98Å; F491-Y524 HydrophobicContact CE2-CE1 3.98Å; F491-Q525 CarbonylContact C-O 3.56Å; F491-Q525 WeakPolarHBondContact CA-O 3.41Å; F491-F526 HydrophobicContact CB-CD1 3.58Å; F491-F526 HydrophobicContact CB-CE1 3.47Å; F491-F526 VanDerWaalsContact CB-CE1 3.47Å; F491-F526 HydrophobicContact CB-CZ 4.33Å; F491-F526 HydrophobicContact CG-CE1 4.44Å
492	R	88	Confident	71.9	Confident	48 Å²	48	63.7 Å²	63.7	18%	0.181	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	147.9	163.3	65.7	172.9	178.3	-171.8	0	111.3	L494 D498 R499 W500 Y524 Q525	R492-L494 HydrophobicContact CG-CD2 4.05Å; R492-D498 WeakPolarHBondContact CD-OD1 3.32Å; R492-D498 IonicContact CZ-OD1 3.54Å; R492-D498 IonicContact NE-OD1 3.48Å; R492-D498 IonicContact NH1-OD1 3.56Å; R492-D498 PolarHBondContact NH1-OD1 2.81Å; R492-D498 IonicContact NH1-OD2 2.7Å; R492-R499 WeakPolarHBondContact CB-O 3.39Å; R492-W500 HydrophobicContact CB-CD2 4.21Å; R492-W500 HydrophobicContact CB-CE3 4.25Å; R492-W500 HydrophobicContact CB-CZ3 4.47Å; R492-W500 HydrophobicContact CG-CD2 4.38Å; R492-W500 HydrophobicContact CG-CE3 4.39Å; R492-W500 HydrophobicContact CG-CH2 3.94Å; R492-W500 HydrophobicContact CG-CZ2 3.9Å; R492-W500 HydrophobicContact CG-CZ3 4.18Å; R492-Y524 WeakPolarHBondContact O-CA 3.44Å; R492-Y524 WeakPolarHBondContact O-CD1 3.44Å; R492-Q525 HydrophobicContact CG-CB 4.08Å; R492-Q525 VanDerWaalsContact CZ-OE1 3.29Å; R492-Q525 PolarHBondContact N-O 3Å; R492-Q525 PolarHBondContact O-N 2.95Å
493	D	86.7	Confident	73.2	Confident	5 Å²	5	62.8 Å²	62.8	3%	0.027	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	100.7	-177.1	-174.4	-46	0	0	0	108.8	Q495 Q496 D497 H522 Y524	D493-Q495 PolarHBondContact O-N 2.96Å; D493-Q495 PolarHBondContact OD1-N 3.15Å; D493-Q496 HydrophobicContact CB-CB 4.28Å; D493-Q496 PolarHBondContact O-N 3.13Å; D493-Q496 PolarHBondContact OD1-N 3.45Å; D493-Q496 PolarHBondContact OD2-NE2 2.79Å; D493-D497 PolarHBondContact O-N 2.93Å; D493-H522 IonicContact OD1-CE1 2.75Å; D493-H522 IonicContact OD1-CG 3.18Å; D493-H522 IonicContact OD1-ND1 2.72Å; D493-H522 PolarHBondContact OD1-ND1 2.93Å; D493-H522 IonicContact OD2-CE1 3.35Å; D493-H522 IonicContact OD2-ND1 2.76Å; D493-H522 PolarHBondContact OD2-ND1 3.3Å; D493-H522 VanDerWaalsContact OD2-ND1 3.16Å; D493-Y524 HydrophobicContact CB-CD1 4.2Å; D493-Y524 HydrophobicContact CB-CE1 3.59Å; D493-Y524 VanDerWaalsContact OD2-CE1 3.32Å; D493-Y524 WeakPolarHBondContact OD2-CE1 3.48Å; D493-Y524 PolarHBondContact OD2-OH 2.74Å
494	L	81.7	Confident	74.5	Confident	70 Å²	70	58.4 Å²	58.4	37%	0.366	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-7.4	-167.8	-59.8	-179.8	0	0	0	114	R492 D523 Q525 F545	R492-L494 HydrophobicContact CG-CD2 4.05Å; L494-D523 HydrophobicContact CB-CB 4.25Å; L494-D523 HydrophobicContact CD1-CB 3.98Å; L494-D523 HydrophobicContact CG-CB 4.43Å; L494-D523 WeakPolarHBondContact CG-O 3.31Å; L494-D523 PolarHBondContact N-O 2.84Å; L494-Q525 HydrophobicContact CD1-CG 4.38Å; L494-F545 HydrophobicContact CD1-CB 3.83Å; L494-F545 HydrophobicContact CD1-CG 4.46Å
495	Q	79.1	Confident	74	Confident	87 Å²	87	63.7 Å²	63.7	41%	0.407	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	-14.5	178	-78.5	73.7	12.8	0	0	113.2	D493 D523	D493-Q495 PolarHBondContact O-N 2.96Å; D493-Q495 PolarHBondContact OD1-N 3.15Å; Q495-D523 PolarHBondContact NE2-OD2 3.2Å
496	Q	72.5	Confident	73.9	Confident	121 Å²	121	65.5 Å²	65.5	57%	0.565	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102	-63.7	177.7	-70.4	-171.5	67.7	0	0	112.6	D493	D493-Q496 HydrophobicContact CB-CB 4.28Å; D493-Q496 PolarHBondContact O-N 3.13Å; D493-Q496 PolarHBondContact OD1-N 3.45Å; D493-Q496 PolarHBondContact OD2-NE2 2.79Å
497	D	64.7	Low	73.9	Confident	66 Å²	66	67.6 Å²	67.6	35%	0.353	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	163.8	179	64.4	45.1	0	0	0	111.6	D493 R499 Y501	D493-D497 PolarHBondContact O-N 2.93Å; D497-R499 PolarHBondContact O-N 2.99Å; D497-R499 VanDerWaalsContact O-N 3.17Å; D497-R499 WeakPolarHBondContact OD1-CA 3Å; D497-R499 WeakPolarHBondContact OD1-CB 3.47Å; D497-R499 PolarHBondContact OD1-N 3.35Å; D497-Y501 WeakPolarHBondContact OD1-CE2 3.43Å; D497-Y501 PolarHBondContact OD1-OH 2.86Å; D497-Y501 PolarHBondContact OD2-OH 2.88Å
498	D	68.5	Low	73	Confident	119 Å²	119	68.5 Å²	68.5	64%	0.636	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.2	30.7	179.8	-163.3	22.5	0	0	0	112.9	R492	R492-D498 WeakPolarHBondContact CD-OD1 3.32Å; R492-D498 IonicContact CZ-OD1 3.54Å; R492-D498 IonicContact NE-OD1 3.48Å; R492-D498 IonicContact NH1-OD1 3.56Å; R492-D498 PolarHBondContact NH1-OD1 2.81Å; R492-D498 IonicContact NH1-OD2 2.7Å
499	R	69	Low	72.2	Confident	165 Å²	165	75 Å²	75	62%	0.623	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.3	141.1	-178.5	-164.8	-179.8	177.9	161.6	3.1	111.5	R492 D497 Y501	R492-R499 WeakPolarHBondContact CB-O 3.39Å; D497-R499 PolarHBondContact O-N 2.99Å; D497-R499 VanDerWaalsContact O-N 3.17Å; D497-R499 WeakPolarHBondContact OD1-CA 3Å; D497-R499 WeakPolarHBondContact OD1-CB 3.47Å; D497-R499 PolarHBondContact OD1-N 3.35Å; R499-Y501 HydrophobicContact CB-CD2 4.49Å; R499-Y501 HydrophobicContact CB-CE2 3.81Å; R499-Y501 HydrophobicContact CG-CE2 4.36Å; R499-Y501 VanDerWaalsContact O-CD2 3.27Å; R499-Y501 WeakPolarHBondContact O-CD2 3.14Å; R499-Y501 WeakPolarHBondContact O-CE2 3.2Å
500	W	79.6	Confident	71	Confident	43 Å²	43	77.4 Å²	77.4	16%	0.163	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	129.2	169	-67.5	90.3	0	0	0	110.8	E490 F491 R492 Q525 R527 P542	E490-W500 HydrophobicContact CB-CB 4.38Å; E490-W500 HydrophobicContact CB-CE3 3.95Å; F491-W500 CarbonylContact O-C 3.51Å; F491-W500 WeakPolarHBondContact O-CA 3.3Å; R492-W500 HydrophobicContact CB-CD2 4.21Å; R492-W500 HydrophobicContact CB-CE3 4.25Å; R492-W500 HydrophobicContact CB-CZ3 4.47Å; R492-W500 HydrophobicContact CG-CD2 4.38Å; R492-W500 HydrophobicContact CG-CE3 4.39Å; R492-W500 HydrophobicContact CG-CH2 3.94Å; R492-W500 HydrophobicContact CG-CZ2 3.9Å; R492-W500 HydrophobicContact CG-CZ3 4.18Å; W500-Q525 HydrophobicContact CH2-CB 4.1Å; W500-Q525 WeakPolarHBondContact CZ3-O 3.21Å; W500-R527 HydrophobicContact CD2-CG 4.24Å; W500-R527 HydrophobicContact CE3-CG 3.69Å; W500-R527 HydrophobicContact CH2-CB 4.15Å; W500-R527 HydrophobicContact CH2-CG 4.09Å; W500-R527 HydrophobicContact CZ3-CB 3.99Å; W500-R527 HydrophobicContact CZ3-CG 3.62Å; W500-P542 HydrophobicContact CH2-CB 3.96Å; W500-P542 HydrophobicContact CH2-CG 4.2Å; W500-P542 HydrophobicContact CZ2-CB 4.11Å; W500-P542 HydrophobicContact CZ2-CG 3.9Å
501	Y	73.4	Confident	70.5	Confident	86 Å²	86	77.4 Å²	77.4	34%	0.337	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	127.9	-180	-69.3	-83.8	0	0	0	109.7	E490 F491 D497 R499	E490-Y501 CarbonylContact C-O 3.47Å; E490-Y501 WeakPolarHBondContact CA-O 3.27Å; F491-Y501 VanDerWaalsContact CD1-O 3.24Å; F491-Y501 WeakPolarHBondContact CD1-O 3.43Å; F491-Y501 VanDerWaalsContact CE1-CB 3.46Å; F491-Y501 HydrophobicContact CE1-CG 4.45Å; F491-Y501 HydrophobicContact CZ-CG 4.35Å; F491-Y501 PolarHBondContact N-O 2.75Å; F491-Y501 PolarHBondContact O-N 3.36Å; D497-Y501 WeakPolarHBondContact OD1-CE2 3.43Å; D497-Y501 PolarHBondContact OD1-OH 2.86Å; D497-Y501 PolarHBondContact OD2-OH 2.88Å; R499-Y501 HydrophobicContact CB-CD2 4.49Å; R499-Y501 HydrophobicContact CB-CE2 3.81Å; R499-Y501 HydrophobicContact CG-CE2 4.36Å; R499-Y501 VanDerWaalsContact O-CD2 3.27Å; R499-Y501 WeakPolarHBondContact O-CD2 3.14Å; R499-Y501 WeakPolarHBondContact O-CE2 3.2Å
502	K	75.6	Confident	69.8	Low	95 Å²	95	81.4 Å²	81.4	41%	0.413	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	133.6	176.1	-158.1	-174.4	-170.4	-158.6	0	110.8	D488 N504	D488-K502 WeakPolarHBondContact OD1-CE 3.45Å; D488-K502 IonicContact OD1-NZ 3.31Å; D488-K502 PolarHBondContact OD1-NZ 3.48Å; D488-K502 WeakPolarHBondContact OD2-CE 3.47Å; D488-K502 IonicContact OD2-NZ 2.61Å; D488-K502 PolarHBondContact OD2-NZ 2.95Å; K502-N504 VanDerWaalsContact CD-O 3.25Å; K502-N504 WeakPolarHBondContact CD-O 3.04Å; K502-N504 WeakPolarHBondContact CE-O 3.25Å; K502-N504 PolarHBondContact NZ-O 3.32Å
503	V	71.7	Confident	69.1	Low	45 Å²	45	80.7 Å²	80.7	27%	0.273	39%	0.394	S	S	.	.			trans	-87.4	-34.5	178.1	-176.4	0	0	0	0	111.9	V489 F491 M513 V515	V489-V503 HydrophobicContact CB-CB 4.48Å; V489-V503 HydrophobicContact CG1-CB 4.47Å; V489-V503 HydrophobicContact CG1-CG2 4.06Å; V489-V503 PolarHBondContact O-N 2.85Å; F491-V503 HydrophobicContact CB-CG2 4.33Å; F491-V503 HydrophobicContact CD1-CG2 3.56Å; F491-V503 HydrophobicContact CE1-CG2 4.34Å; F491-V503 HydrophobicContact CG-CG2 4.37Å; V503-M513 HydrophobicContact CB-CE 3.73Å; V503-M513 HydrophobicContact CG1-CE 3.4Å; V503-M513 VanDerWaalsContact CG1-CE 3.4Å; V503-M513 HydrophobicContact CG2-CE 4.41Å; V503-V515 HydrophobicContact CG1-CG1 3.97Å; V503-V515 HydrophobicContact CG1-CG2 4.19Å; V503-V515 HydrophobicContact CG2-CG1 4.27Å; V503-V515 HydrophobicContact CG2-CG2 4.35Å
504	N	71.8	Confident	68.9	Low	12 Å²	12	84.2 Å²	84.2	6%	0.064	42%	0.416	C	S	.	.			trans	-115.5	124.9	-167.8	67.5	-61.7	0	0	0	113.1	Y487 D488 V489 K502 Q506 V508 M513	Y487-N504 PolarHBondContact O-ND2 2.96Å; D488-N504 WeakPolarHBondContact CA-OD1 3.38Å; D488-N504 PolarHBondContact OD1-ND2 3.45Å; V489-N504 PolarHBondContact N-OD1 3.36Å; V489-N504 PolarHBondContact O-OD1 2.88Å; K502-N504 VanDerWaalsContact CD-O 3.25Å; K502-N504 WeakPolarHBondContact CD-O 3.04Å; K502-N504 WeakPolarHBondContact CE-O 3.25Å; K502-N504 PolarHBondContact NZ-O 3.32Å; N504-Q506 VanDerWaalsContact C-N 3.27Å; N504-Q506 PolarHBondContact ND2-O 3.12Å; N504-Q506 PolarHBondContact O-N 2.67Å; N504-V508 HydrophobicContact CB-CG2 4.02Å; N504-M513 HydrophobicContact CB-SD 4.37Å
505	D	50.3	Low	68.7	Low	156 Å²	156	81.2 Å²	81.2	83%	0.834	40%	0.4	S	S	*	.	S	Bend	trans	-69.8	-23.4	177.3	-63.1	-48.2	0	0	0	113.1
506	Q	50.3	Low	68.5	Low	148 Å²	148	78.8 Å²	78.8	69%	0.692	40%	0.399	S	S	*	.	S	Bend	trans	-134.8	144.6	-180	-64.7	-68.1	-85.9	0	0	110.1	N504 V508	N504-Q506 VanDerWaalsContact C-N 3.27Å; N504-Q506 PolarHBondContact ND2-O 3.12Å; N504-Q506 PolarHBondContact O-N 2.67Å; Q506-V508 PolarHBondContact O-N 3.12Å
507	P	56.2	Low	68.5	Low	44 Å²	44	77.5 Å²	77.5	29%	0.286	40%	0.396	S	S	.	.			trans	-56	135.6	-178.9	-27.3	36	0	0	0	113.5	Y487 F509	Y487-P507 CarbonylContact O-C 3.52Å; Y487-P507 WeakPolarHBondContact O-CA 3.46Å; P507-F509 WeakPolarHBondContact O-CE2 3.42Å
508	V	56	Low	69.1	Low	29 Å²	29	75.1 Å²	75.1	18%	0.176	38%	0.383	C	S	.	.	B	Isolated β-bridge	trans	-89.5	129.7	-179.8	-174.4	0	0	0	0	109.1	G486 Y487 N504 Q506 M513	G486-V508 CarbonylContact C-O 3.58Å; G486-V508 WeakPolarHBondContact CA-O 3.31Å; Y487-V508 VanDerWaalsContact CD2-O 3.32Å; Y487-V508 WeakPolarHBondContact CD2-O 3.48Å; Y487-V508 PolarHBondContact N-O 2.68Å; Y487-V508 PolarHBondContact O-N 2.64Å; N504-V508 HydrophobicContact CB-CG2 4.02Å; Q506-V508 PolarHBondContact O-N 3.12Å; V508-M513 HydrophobicContact CG2-SD 3.72Å
509	F	60.9	Low	69.4	Low	155 Å²	155	72.1 Å²	72.1	68%	0.68	37%	0.367	S	S	*	.			trans	-89.4	-25	-177.1	-62.3	-88.5	0	0	0	113.9	M485 P507	M485-F509 WeakPolarHBondContact O-CE1 3.42Å; P507-F509 WeakPolarHBondContact O-CE2 3.42Å
510	A	58.9	Low	69.7	Low	51 Å²	51	67.4 Å²	67.4	42%	0.421	35%	0.352	S	S	.	.	S	Bend	trans	-83.4	143.3	175.7	0	0	0	0	0	110.9	W475 K512	W475-A510 VanDerWaalsContact CZ2-O 3.26Å; W475-A510 WeakPolarHBondContact CZ2-O 3.28Å; A510-K512 HydrophobicContact CB-CG 4.37Å; A510-K512 PolarHBondContact O-N 3.08Å
511	C	76.7	Confident	69.4	Low	35 Å²	35	69.6 Å²	69.6	24%	0.236	37%	0.367	C	S	.	.	S	Bend	trans	-80.6	40.4	178.6	-56.6	0	0	0	0	113.1	C474 W475 Y487	C474-C511 WeakPolarHBondContact CA-O 3.47Å; W475-C511 HydrophobicContact CD2-CB 4.47Å; W475-C511 VanDerWaalsContact CE2-CA 3.49Å; W475-C511 HydrophobicContact CG-CB 4.34Å; W475-C511 PolarHBondContact N-O 2.99Å; W475-C511 VanDerWaalsContact O-CB 3.29Å; W475-C511 WeakPolarHBondContact O-CB 3.27Å; Y487-C511 VanDerWaalsContact CE2-SG 3.52Å
512	K	73.7	Confident	69.7	Low	129 Å²	129	67.3 Å²	67.3	56%	0.561	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-159.6	147.2	177.4	65.4	-174.1	178.7	-171.2	0	110.6	I473 C474 A510	I473-K512 CarbonylContact O-C 3.59Å; I473-K512 VanDerWaalsContact O-CA 3.23Å; I473-K512 WeakPolarHBondContact O-CA 3.31Å; I473-K512 WeakPolarHBondContact O-CB 3.3Å; C474-K512 HydrophobicContact CB-CB 4.06Å; A510-K512 HydrophobicContact CB-CG 4.37Å; A510-K512 PolarHBondContact O-N 3.08Å
513	M	74.4	Confident	70.1	Confident	33 Å²	33	64.1 Å²	64.1	16%	0.163	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	142.1	172.8	-168	174.3	68	0	0	112.1	T472 I473 W475 V489 V503 N504 V508 V515	T472-M513 WeakPolarHBondContact CA-O 3.45Å; I473-M513 WeakPolarHBondContact CG1-O 3.34Å; I473-M513 PolarHBondContact N-O 2.8Å; I473-M513 PolarHBondContact O-N 2.84Å; W475-M513 HydrophobicContact CH2-CB 4.08Å; W475-M513 HydrophobicContact CZ3-CB 4.16Å; V489-M513 HydrophobicContact CB-CE 3.6Å; V489-M513 HydrophobicContact CG1-CE 3.8Å; V489-M513 HydrophobicContact CG2-CE 3.81Å; V503-M513 HydrophobicContact CB-CE 3.73Å; V503-M513 HydrophobicContact CG1-CE 3.4Å; V503-M513 VanDerWaalsContact CG1-CE 3.4Å; V503-M513 HydrophobicContact CG2-CE 4.41Å; N504-M513 HydrophobicContact CB-SD 4.37Å; V508-M513 HydrophobicContact CG2-SD 3.72Å; M513-V515 HydrophobicContact CE-CG2 4.15Å
514	T	81.2	Confident	70.8	Confident	80 Å²	80	62.1 Å²	62.1	49%	0.491	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	113.1	169.3	-49.4	0	0	0	0	110.2	K470 I471 T472	K470-T514 HydrophobicContact CB-CG2 4.19Å; K470-T514 HydrophobicContact CD-CG2 4.48Å; K470-T514 HydrophobicContact CG-CG2 4.42Å; I471-T514 CarbonylContact O-C 3.49Å; I471-T514 WeakPolarHBondContact O-CA 3.49Å; T472-T514 PolarHBondContact OG1-OG1 2.88Å
515	V	78.9	Confident	71.7	Confident	6 Å²	6	62.9 Å²	62.9	4%	0.036	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	147.1	167.9	-167	0	0	0	0	108.7	K470 I471 V503 M513 L518 F526	K470-V515 VanDerWaalsContact CA-O 3.23Å; K470-V515 WeakPolarHBondContact CA-O 3.36Å; I471-V515 PolarHBondContact N-O 3.02Å; I471-V515 PolarHBondContact O-N 2.7Å; V503-V515 HydrophobicContact CG1-CG1 3.97Å; V503-V515 HydrophobicContact CG1-CG2 4.19Å; V503-V515 HydrophobicContact CG2-CG1 4.27Å; V503-V515 HydrophobicContact CG2-CG2 4.35Å; M513-V515 HydrophobicContact CE-CG2 4.15Å; V515-L518 HydrophobicContact CG1-CD2 4.01Å; V515-L518 HydrophobicContact CG1-CG 4.42Å; V515-F526 HydrophobicContact CB-CE1 4.12Å; V515-F526 HydrophobicContact CG1-CE1 4.1Å; V515-F526 HydrophobicContact CG2-CD1 4.16Å; V515-F526 HydrophobicContact CG2-CE1 3.72Å
516	G	75.3	Confident	73.7	Confident	36 Å²	36	55.4 Å²	55.4	37%	0.371	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	179.8	-178.1	0	0	0	0	0	113.9	D469 L518	D469-G516 CarbonylContact O-C 3.52Å; D469-G516 VanDerWaalsContact O-CA 3.27Å; D469-G516 WeakPolarHBondContact O-CA 3.26Å; G516-L518 PolarHBondContact O-N 2.72Å
517	D	71.5	Confident	75.6	Confident	94 Å²	94	51 Å²	51	50%	0.503	28%	0.275	S	S	.	.	S	Bend	trans	60.4	23.8	-171.1	-74.6	-41.3	0	0	0	113.3	D469 R1053	D469-D517 PolarHBondContact O-N 3.46Å; D469-D517 VanDerWaalsContact O-N 3.12Å; D517-R1053 IonicContact OD2-NH2 3.63Å
518	L	76.6	Confident	77	Confident	16 Å²	16	49 Å²	49	8%	0.084	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-67.1	157.2	177.5	-62.1	175.9	0	0	0	112.4	D469 I471 V515 G516 Y524 F526 I548	D469-L518 PolarHBondContact O-N 3.01Å; I471-L518 HydrophobicContact CB-CD1 4.38Å; I471-L518 HydrophobicContact CD1-CD1 3.66Å; I471-L518 HydrophobicContact CG1-CD1 3.95Å; V515-L518 HydrophobicContact CG1-CD2 4.01Å; V515-L518 HydrophobicContact CG1-CG 4.42Å; G516-L518 PolarHBondContact O-N 2.72Å; L518-Y524 HydrophobicContact CB-CD2 4.46Å; L518-Y524 HydrophobicContact CB-CE2 3.94Å; L518-Y524 HydrophobicContact CD1-CD2 4.31Å; L518-Y524 HydrophobicContact CD2-CD1 4.24Å; L518-Y524 HydrophobicContact CD2-CD2 4.31Å; L518-Y524 HydrophobicContact CD2-CE1 4.1Å; L518-Y524 HydrophobicContact CD2-CE2 4.16Å; L518-Y524 HydrophobicContact CD2-CG 4.35Å; L518-Y524 HydrophobicContact CG-CE2 4.46Å; L518-F526 HydrophobicContact CD1-CZ 4.42Å; L518-I548 HydrophobicContact CB-CD1 4.47Å; L518-I548 HydrophobicContact CB-CG1 4.44Å; L518-I548 HydrophobicContact CD1-CD1 3.98Å
519	I	75.1	Confident	78.4	Confident	57 Å²	57	48.9 Å²	48.9	29%	0.292	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-87.3	141.6	-178.5	-50.5	178.4	0	0	0	109.9	H522 Y524 I548	I519-H522 HydrophobicContact CB-CB 4.33Å; I519-Y524 VanDerWaalsContact CB-OH 3.31Å; I519-Y524 WeakPolarHBondContact CB-OH 3.41Å; I519-Y524 WeakPolarHBondContact CG1-OH 3.2Å; I519-Y524 PolarHBondContact N-OH 2.99Å; I519-Y524 VanDerWaalsContact N-OH 3.17Å; I519-I548 VanDerWaalsContact O-CB 3.29Å; I519-I548 WeakPolarHBondContact O-CB 3.38Å; I519-I548 WeakPolarHBondContact O-CG1 3.35Å
520	M	74.8	Confident	78.9	Confident	65 Å²	65	41.5 Å²	41.5	32%	0.32	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	150.1	178.7	-61	-179	59.5	0	0	111.5	H522 I548 P550	M520-H522 PolarHBondContact O-CD2 3.28Å; M520-H522 PolarHBondContact O-N 3Å; M520-I548 HydrophobicContact CG-CG2 4.35Å; M520-P550 HydrophobicContact CE-CB 3.64Å; M520-P550 HydrophobicContact CE-CG 3.76Å
521	D	74.1	Confident	79.3	Confident	90 Å²	90	40.8 Å²	40.8	48%	0.481	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.1	18.1	-174.7	-50.5	-16.7	0	0	0	113.9	H547 I548	D521-H547 PolarHBondContact O-CE1 3.41Å; D521-I548 PolarHBondContact N-O 2.8Å
522	H	80.8	Confident	78.5	Confident	37 Å²	37	39.6 Å²	39.6	17%	0.171	21%	0.207	C	C	.	.			trans	-105.5	156.3	174.3	-78.4	-136.5	0	0	0	111.5	D493 I519 M520 Y524 I548	D493-H522 IonicContact OD1-CE1 2.75Å; D493-H522 IonicContact OD1-CG 3.18Å; D493-H522 IonicContact OD1-ND1 2.72Å; D493-H522 PolarHBondContact OD1-ND1 2.93Å; D493-H522 IonicContact OD2-CE1 3.35Å; D493-H522 IonicContact OD2-ND1 2.76Å; D493-H522 PolarHBondContact OD2-ND1 3.3Å; D493-H522 VanDerWaalsContact OD2-ND1 3.16Å; I519-H522 HydrophobicContact CB-CB 4.33Å; M520-H522 PolarHBondContact O-CD2 3.28Å; M520-H522 PolarHBondContact O-N 3Å; H522-Y524 HydrophobicContact CB-CD2 4.49Å; H522-Y524 HydrophobicContact CB-CE2 3.69Å; H522-I548 PolarHBondContact O-N 3.43Å
523	D	82.8	Confident	77.2	Confident	29 Å²	29	37.3 Å²	37.3	16%	0.155	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	126.8	176	-61.1	-57.4	0	0	0	110.7	L494 Q495 F545 V546 H547	L494-D523 HydrophobicContact CB-CB 4.25Å; L494-D523 HydrophobicContact CD1-CB 3.98Å; L494-D523 HydrophobicContact CG-CB 4.43Å; L494-D523 WeakPolarHBondContact CG-O 3.31Å; L494-D523 PolarHBondContact N-O 2.84Å; Q495-D523 PolarHBondContact NE2-OD2 3.2Å; D523-F545 HydrophobicContact CB-CB 4.49Å; D523-F545 HydrophobicContact CB-CD2 4.07Å; D523-V546 WeakPolarHBondContact CA-O 3.34Å; D523-H547 WeakPolarHBondContact OD1-CA 3.18Å; D523-H547 VanDerWaalsContact OD1-CB 3.27Å; D523-H547 WeakPolarHBondContact OD1-CB 3.24Å; D523-H547 IonicContact OD1-CE1 2.69Å; D523-H547 IonicContact OD1-CG 3.65Å; D523-H547 IonicContact OD1-ND1 3.48Å; D523-H547 PolarHBondContact OD1-ND1 3.01Å; D523-H547 IonicContact OD2-ND1 3.49Å
524	Y	86.2	Confident	75.8	Confident	3 Å²	3	39.4 Å²	39.4	1%	0.012	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	145.1	-178.8	-68.8	-76.8	0	0	0	112.5	F491 R492 D493 L518 I519 H522 F526 F545 V546 I548	F491-Y524 AromaticContact CD2-CD1 3.77Å; F491-Y524 HydrophobicContact CD2-CD1 3.77Å; F491-Y524 AromaticContact CD2-CE1 3.95Å; F491-Y524 HydrophobicContact CD2-CE1 3.95Å; F491-Y524 HydrophobicContact CE2-CD1 4.28Å; F491-Y524 AromaticContact CE2-CE1 3.98Å; F491-Y524 HydrophobicContact CE2-CE1 3.98Å; R492-Y524 WeakPolarHBondContact O-CA 3.44Å; R492-Y524 WeakPolarHBondContact O-CD1 3.44Å; D493-Y524 HydrophobicContact CB-CD1 4.2Å; D493-Y524 HydrophobicContact CB-CE1 3.59Å; D493-Y524 VanDerWaalsContact OD2-CE1 3.32Å; D493-Y524 WeakPolarHBondContact OD2-CE1 3.48Å; D493-Y524 PolarHBondContact OD2-OH 2.74Å; L518-Y524 HydrophobicContact CB-CD2 4.46Å; L518-Y524 HydrophobicContact CB-CE2 3.94Å; L518-Y524 HydrophobicContact CD1-CD2 4.31Å; L518-Y524 HydrophobicContact CD2-CD1 4.24Å; L518-Y524 HydrophobicContact CD2-CD2 4.31Å; L518-Y524 HydrophobicContact CD2-CE1 4.1Å; L518-Y524 HydrophobicContact CD2-CE2 4.16Å; L518-Y524 HydrophobicContact CD2-CG 4.35Å; L518-Y524 HydrophobicContact CG-CE2 4.46Å; I519-Y524 VanDerWaalsContact CB-OH 3.31Å; I519-Y524 WeakPolarHBondContact CB-OH 3.41Å; I519-Y524 WeakPolarHBondContact CG1-OH 3.2Å; I519-Y524 PolarHBondContact N-OH 2.99Å; I519-Y524 VanDerWaalsContact N-OH 3.17Å; H522-Y524 HydrophobicContact CB-CD2 4.49Å; H522-Y524 HydrophobicContact CB-CE2 3.69Å; Y524-F526 HydrophobicContact CG-CZ 4.46Å; Y524-F545 CarbonylContact O-C 3.57Å; Y524-F545 VanDerWaalsContact O-CA 3.31Å; Y524-F545 WeakPolarHBondContact O-CA 3.23Å; Y524-V546 PolarHBondContact N-O 3.41Å; Y524-V546 WeakPolarHBondContact O-CG1 3.37Å; Y524-V546 PolarHBondContact O-N 3.09Å; Y524-I548 HydrophobicContact CD2-CD1 4.06Å; Y524-I548 HydrophobicContact CD2-CG1 3.62Å; Y524-I548 HydrophobicContact CE2-CD1 4.49Å; Y524-I548 HydrophobicContact CE2-CG1 3.69Å
525	Q	90.8	Very high	74.4	Confident	27 Å²	27	37 Å²	37	13%	0.126	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	148.7	166	-72.7	-177.2	-68.5	0	0	110.4	F491 R492 L494 W500 S543 F545	F491-Q525 CarbonylContact C-O 3.56Å; F491-Q525 WeakPolarHBondContact CA-O 3.41Å; R492-Q525 HydrophobicContact CG-CB 4.08Å; R492-Q525 VanDerWaalsContact CZ-OE1 3.29Å; R492-Q525 PolarHBondContact N-O 3Å; R492-Q525 PolarHBondContact O-N 2.95Å; L494-Q525 HydrophobicContact CD1-CG 4.38Å; W500-Q525 HydrophobicContact CH2-CB 4.1Å; W500-Q525 WeakPolarHBondContact CZ3-O 3.21Å; Q525-S543 PolarHBondContact NE2-O 3.06Å; Q525-F545 HydrophobicContact CG-CB 3.7Å
526	F	91.5	Very high	73.2	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	151.2	-174.5	-59.7	-89.4	0	0	0	111.4	P461 F463 I471 I473 E490 F491 V515 L518 Y524 P542 S543 V546	P461-F526 HydrophobicContact CG-CB 4.14Å; P461-F526 WeakPolarHBondContact CG-O 3.14Å; F463-F526 AromaticContact CE1-CD2 3.61Å; F463-F526 HydrophobicContact CE1-CD2 3.61Å; F463-F526 AromaticContact CE1-CE2 3.89Å; F463-F526 HydrophobicContact CE1-CE2 3.89Å; F463-F526 HydrophobicContact CZ-CD2 4.06Å; F463-F526 HydrophobicContact CZ-CE2 4.45Å; I471-F526 HydrophobicContact CD1-CE2 3.82Å; I471-F526 HydrophobicContact CD1-CZ 3.97Å; I473-F526 HydrophobicContact CD1-CB 4.21Å; I473-F526 HydrophobicContact CG2-CB 4.47Å; I473-F526 HydrophobicContact CG2-CD2 4.26Å; I473-F526 HydrophobicContact CG2-CG 4.26Å; E490-F526 CarbonylContact O-C 3.48Å; E490-F526 VanDerWaalsContact O-CA 3.3Å; E490-F526 WeakPolarHBondContact O-CA 3.34Å; F491-F526 HydrophobicContact CB-CD1 3.58Å; F491-F526 HydrophobicContact CB-CE1 3.47Å; F491-F526 VanDerWaalsContact CB-CE1 3.47Å; F491-F526 HydrophobicContact CB-CZ 4.33Å; F491-F526 HydrophobicContact CG-CE1 4.44Å; V515-F526 HydrophobicContact CB-CE1 4.12Å; V515-F526 HydrophobicContact CG1-CE1 4.1Å; V515-F526 HydrophobicContact CG2-CD1 4.16Å; V515-F526 HydrophobicContact CG2-CE1 3.72Å; L518-F526 HydrophobicContact CD1-CZ 4.42Å; Y524-F526 HydrophobicContact CG-CZ 4.46Å; F526-P542 CarbonylContact O-C 3.58Å; F526-P542 WeakPolarHBondContact O-CA 3.48Å; F526-S543 PolarHBondContact N-OG 3.47Å; F526-S543 PolarHBondContact O-N 3.25Å; F526-V546 HydrophobicContact CE2-CG1 4.04Å
527	R	90.3	Very high	73.2	Confident	56 Å²	56	39.1 Å²	39.1	21%	0.211	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	160.3	170.7	72.3	-173.6	-171.8	176.8	1	110.8	E490 W500 P539 S540	E490-R527 HydrophobicContact CB-CG 4.1Å; E490-R527 PolarHBondContact N-O 3.43Å; E490-R527 PolarHBondContact O-N 3.07Å; E490-R527 IonicContact OE2-CZ 3.81Å; E490-R527 IonicContact OE2-NE 3.74Å; E490-R527 PolarHBondContact OE2-NE 2.99Å; E490-R527 IonicContact OE2-NH2 2.63Å; E490-R527 PolarHBondContact OE2-NH2 3.1Å; W500-R527 HydrophobicContact CD2-CG 4.24Å; W500-R527 HydrophobicContact CE3-CG 3.69Å; W500-R527 HydrophobicContact CH2-CB 4.15Å; W500-R527 HydrophobicContact CH2-CG 4.09Å; W500-R527 HydrophobicContact CZ3-CB 3.99Å; W500-R527 HydrophobicContact CZ3-CG 3.62Å; R527-P539 HydrophobicContact CG-CB 4.36Å; R527-S540 WeakPolarHBondContact CA-OG 3.33Å
528	V	86.6	Confident	73.5	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	141.7	-174.7	-170.3	0	0	0	0	110.5	I457 P461 W475 Y487 D488 V489 S540	I457-V528 HydrophobicContact CD1-CB 4.15Å; I457-V528 HydrophobicContact CD1-CG1 4.02Å; I457-V528 WeakPolarHBondContact CD1-O 3.38Å; P461-V528 HydrophobicContact CB-CG2 3.98Å; P461-V528 HydrophobicContact CG-CG2 4.06Å; W475-V528 HydrophobicContact CB-CG2 4.44Å; W475-V528 HydrophobicContact CD2-CG1 4.12Å; W475-V528 HydrophobicContact CD2-CG2 3.87Å; W475-V528 HydrophobicContact CE3-CG2 3.92Å; W475-V528 HydrophobicContact CG-CG1 4.33Å; W475-V528 HydrophobicContact CG-CG2 4.12Å; W475-V528 HydrophobicContact CZ2-CG1 4.23Å; W475-V528 HydrophobicContact CZ3-CG2 4.47Å; Y487-V528 HydrophobicContact CD1-CG1 3.74Å; Y487-V528 HydrophobicContact CG-CG1 4.21Å; D488-V528 CarbonylContact O-C 3.48Å; D488-V528 WeakPolarHBondContact O-CA 3.47Å; V489-V528 HydrophobicContact CG2-CG2 4.39Å; V528-S540 PolarHBondContact N-OG 3.19Å; V528-S540 PolarHBondContact O-N 3.44Å
529	L	85.8	Confident	73.7	Confident	28 Å²	28	43.1 Å²	43.1	15%	0.147	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	147.1	169.1	-57.4	83.1	0	0	0	108.2	Y487 D488 E490 P539	Y487-L529 CarbonylContact C-O 3.54Å; Y487-L529 WeakPolarHBondContact CA-O 3.42Å; D488-L529 HydrophobicContact CB-CB 4.39Å; D488-L529 PolarHBondContact N-O 3.3Å; D488-L529 PolarHBondContact O-N 2.95Å; E490-L529 HydrophobicContact CG-CD1 4.03Å; L529-P539 HydrophobicContact CD1-CB 4.43Å; L529-P539 HydrophobicContact CD2-CG 4.13Å; L529-P539 HydrophobicContact CG-CB 4.17Å; L529-P539 HydrophobicContact CG-CG 4.15Å
530	A	72	Confident	74.3	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	145.8	175.2	0	0	0	0	0	111.2	P455 I457 A478 V484 Y487 C536 S537	P455-A530 HydrophobicContact CB-CB 3.84Å; P455-A530 HydrophobicContact CG-CB 4.36Å; I457-A530 HydrophobicContact CD1-CB 3.88Å; I457-A530 HydrophobicContact CG1-CB 4.24Å; A478-A530 HydrophobicContact CB-CB 3.48Å; A478-A530 VanDerWaalsContact CB-CB 3.48Å; V484-A530 HydrophobicContact CG1-CB 4.13Å; Y487-A530 HydrophobicContact CD1-CB 3.77Å; Y487-A530 HydrophobicContact CE1-CB 3.7Å; A530-C536 CarbonylContact O-C 3.51Å; A530-C536 WeakPolarHBondContact O-CA 3.43Å; A530-S537 PolarHBondContact N-OG 2.96Å; A530-S537 PolarHBondContact O-N 3.19Å
531	H	66	Low	74.9	Confident	36 Å²	36	40.4 Å²	40.4	17%	0.167	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	140.7	179.6	-63.7	-78.9	0	0	0	111	V484 M485 G486 D488 C536	V484-H531 CarbonylContact C-O 3.58Å; V484-H531 VanDerWaalsContact CA-O 3.32Å; V484-H531 WeakPolarHBondContact CA-O 2.87Å; V484-H531 WeakPolarHBondContact CG1-O 3.41Å; M485-H531 PolarHBondContact N-O 3.05Å; G486-H531 PolarHBondContact O-N 3.39Å; D488-H531 VanDerWaalsContact CG-NE2 3.31Å; D488-H531 IonicContact OD2-CD2 2.69Å; D488-H531 IonicContact OD2-CE1 3.83Å; D488-H531 IonicContact OD2-NE2 3.69Å; D488-H531 PolarHBondContact OD2-NE2 2.8Å; H531-C536 VanDerWaalsContact CE1-SG 3.53Å; H531-C536 PolarHBondContact ND1-SG 3.38Å; H531-C536 VanDerWaalsContact ND1-SG 3.45Å
532	N	60.8	Low	75.6	Confident	9 Å²	9	38.9 Å²	38.9	5%	0.048	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	-178.4	162.2	76.9	9.8	0	0	0	110.7	P455 S480 L482 P483 S534 G535	P455-N532 WeakPolarHBondContact CD-ND2 3.4Å; P455-N532 HydrophobicContact CG-CB 3.77Å; P455-N532 WeakPolarHBondContact CG-ND2 3.4Å; S480-N532 PolarHBondContact OG-ND2 2.88Å; L482-N532 HydrophobicContact CB-CB 4.33Å; P483-N532 VanDerWaalsContact O-CB 3.32Å; P483-N532 WeakPolarHBondContact O-CB 3.41Å; N532-S534 PolarHBondContact O-N 3.44Å; N532-S534 WeakPolarHBondContact OD1-CA 3.36Å; N532-S534 WeakPolarHBondContact OD1-CB 3.46Å; N532-S534 PolarHBondContact OD1-N 3.32Å; N532-G535 PolarHBondContact N-O 2.9Å; N532-G535 PolarHBondContact O-N 3.17Å; N532-G535 PolarHBondContact OD1-N 3.4Å
533	A	46	Very low	76	Confident	82 Å²	82	37.2 Å²	37.2	68%	0.678	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-5.3	-179.9	0	0	0	0	0	115.2	M485	M485-A533 HydrophobicContact SD-CB 4.22Å
534	S	45.4	Very low	76.1	Confident	77 Å²	77	42.3 Å²	42.3	54%	0.538	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	0.4	171.1	-56	0	0	0	0	113.6	L482 N532	L482-S534 VanDerWaalsContact CD1-OG 3.23Å; L482-S534 WeakPolarHBondContact CD1-OG 3.41Å; N532-S534 PolarHBondContact O-N 3.44Å; N532-S534 WeakPolarHBondContact OD1-CA 3.36Å; N532-S534 WeakPolarHBondContact OD1-CB 3.46Å; N532-S534 PolarHBondContact OD1-N 3.32Å
535	G	52	Low	75.9	Confident	30 Å²	30	48.3 Å²	48.3	31%	0.309	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	120.8	-164.8	173.8	0	0	0	0	0	115	N532	N532-G535 PolarHBondContact N-O 2.9Å; N532-G535 PolarHBondContact O-N 3.17Å; N532-G535 PolarHBondContact OD1-N 3.4Å
536	C	53.1	Low	75.4	Confident	77 Å²	77	47.9 Å²	47.9	52%	0.52	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	148.1	-178.8	-41.6	0	0	0	0	111.8	A530 H531	A530-C536 CarbonylContact O-C 3.51Å; A530-C536 WeakPolarHBondContact O-CA 3.43Å; H531-C536 VanDerWaalsContact CE1-SG 3.53Å; H531-C536 PolarHBondContact ND1-SG 3.38Å; H531-C536 VanDerWaalsContact ND1-SG 3.45Å
537	S	75.7	Confident	75	Confident	9 Å²	9	51.9 Å²	51.9	6%	0.063	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-69.6	167.2	164.4	73.6	0	0	0	0	111.5	P455 A530	P455-S537 WeakPolarHBondContact O-CA 3.32Å; P455-S537 WeakPolarHBondContact O-CB 3.37Å; A530-S537 PolarHBondContact N-OG 2.96Å; A530-S537 PolarHBondContact O-N 3.19Å
538	Q	76.7	Confident	74.5	Confident	152 Å²	152	49.2 Å²	49.2	71%	0.71	29%	0.289	S	S	*	.	P	Polyproline II helix	trans	-61.8	150.5	153	-69.2	-63.6	-25.5	0	0	109.5
539	P	81.1	Confident	73.6	Confident	41 Å²	41	54.4 Å²	54.4	27%	0.266	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-59.7	145.4	170.2	-18.5	30.7	0	0	0	111	R527 L529	R527-P539 HydrophobicContact CG-CB 4.36Å; L529-P539 HydrophobicContact CD1-CB 4.43Å; L529-P539 HydrophobicContact CD2-CG 4.13Å; L529-P539 HydrophobicContact CG-CB 4.17Å; L529-P539 HydrophobicContact CG-CG 4.15Å
540	S	87.3	Confident	72	Confident	5 Å²	5	55.8 Å²	55.8	4%	0.035	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-55.2	160.2	170	75	0	0	0	0	110.9	R527 V528	R527-S540 WeakPolarHBondContact CA-OG 3.33Å; V528-S540 PolarHBondContact N-OG 3.19Å; V528-S540 PolarHBondContact O-N 3.44Å
541	P	87.9	Confident	70.6	Confident	60 Å²	60	60.8 Å²	60.8	39%	0.39	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-48.7	139.5	157.1	-23	34	0	0	0	109.9	A460	A460-P541 WeakPolarHBondContact CA-O 3.18Å; A460-P541 HydrophobicContact CB-CB 4.22Å
542	P	88.3	Confident	69.1	Low	58 Å²	58	63.8 Å²	63.8	38%	0.377	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-57.8	145.3	169.8	-26.2	36.3	0	0	0	111.4	A460 W500 F526	A460-P542 WeakPolarHBondContact CB-O 3.35Å; W500-P542 HydrophobicContact CH2-CB 3.96Å; W500-P542 HydrophobicContact CH2-CG 4.2Å; W500-P542 HydrophobicContact CZ2-CB 4.11Å; W500-P542 HydrophobicContact CZ2-CG 3.9Å; F526-P542 CarbonylContact O-C 3.58Å; F526-P542 WeakPolarHBondContact O-CA 3.48Å
543	S	89.9	Confident	68.1	Low	3 Å²	3	70.5 Å²	70.5	2%	0.021	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-57.8	164	165.1	69.6	0	0	0	0	111.3	P461 F463 Q525 F526	P461-S543 WeakPolarHBondContact O-CB 3.45Å; F463-S543 WeakPolarHBondContact CZ-OG 3.5Å; Q525-S543 PolarHBondContact NE2-O 3.06Å; F526-S543 PolarHBondContact N-OG 3.47Å; F526-S543 PolarHBondContact O-N 3.25Å
544	D	84.8	Confident	67.3	Low	136 Å²	136	76.4 Å²	76.4	73%	0.727	42%	0.42	S	S	*	.	P	Polyproline II helix	trans	-55.3	160.1	155.2	-75.2	-45.9	0	0	0	110.6	F463	F463-D544 VanDerWaalsContact CE2-O 3.31Å; F463-D544 WeakPolarHBondContact CE2-O 3.35Å; F463-D544 VanDerWaalsContact CZ-O 3.27Å; F463-D544 WeakPolarHBondContact CZ-O 3.46Å
545	F	81.6	Confident	66.6	Low	128 Å²	128	81.7 Å²	81.7	56%	0.561	43%	0.434	S	S	*	.	P	Polyproline II helix	trans	-80.9	144.9	175.8	70.7	-86.8	0	0	0	110.9	L494 D523 Y524 Q525	L494-F545 HydrophobicContact CD1-CB 3.83Å; L494-F545 HydrophobicContact CD1-CG 4.46Å; D523-F545 HydrophobicContact CB-CB 4.49Å; D523-F545 HydrophobicContact CB-CD2 4.07Å; Y524-F545 CarbonylContact O-C 3.57Å; Y524-F545 VanDerWaalsContact O-CA 3.31Å; Y524-F545 WeakPolarHBondContact O-CA 3.23Å; Q525-F545 HydrophobicContact CG-CB 3.7Å
546	V	81.2	Confident	65.4	Low	19 Å²	19	86.3 Å²	86.3	12%	0.115	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	126.2	179.8	53.3	0	0	0	0	110.9	F463 V466 I471 D523 Y524 F526	F463-V546 HydrophobicContact CD1-CG1 4.16Å; F463-V546 HydrophobicContact CD2-CB 4.3Å; F463-V546 HydrophobicContact CE1-CB 4.16Å; F463-V546 HydrophobicContact CE1-CG1 3.44Å; F463-V546 VanDerWaalsContact CE1-CG1 3.44Å; F463-V546 HydrophobicContact CE2-CB 3.82Å; F463-V546 HydrophobicContact CE2-CG1 3.92Å; F463-V546 HydrophobicContact CZ-CB 3.74Å; F463-V546 HydrophobicContact CZ-CG1 3.29Å; V466-V546 HydrophobicContact CG1-CG2 4.47Å; V466-V546 HydrophobicContact CG2-CG2 4.06Å; I471-V546 HydrophobicContact CD1-CB 4.45Å; I471-V546 HydrophobicContact CD1-CG1 3.4Å; I471-V546 HydrophobicContact CD1-CG2 4.18Å; D523-V546 WeakPolarHBondContact CA-O 3.34Å; Y524-V546 PolarHBondContact N-O 3.41Å; Y524-V546 WeakPolarHBondContact O-CG1 3.37Å; Y524-V546 PolarHBondContact O-N 3.09Å; F526-V546 HydrophobicContact CE2-CG1 4.04Å
547	H	82.3	Confident	64.5	Low	83 Å²	83	87.1 Å²	87.1	38%	0.384	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	130.7	-178.7	-164	69.7	0	0	0	111.5	D521 D523 E549	D521-H547 PolarHBondContact O-CE1 3.41Å; D523-H547 WeakPolarHBondContact OD1-CA 3.18Å; D523-H547 VanDerWaalsContact OD1-CB 3.27Å; D523-H547 WeakPolarHBondContact OD1-CB 3.24Å; D523-H547 IonicContact OD1-CE1 2.69Å; D523-H547 IonicContact OD1-CG 3.65Å; D523-H547 IonicContact OD1-ND1 3.48Å; D523-H547 PolarHBondContact OD1-ND1 3.01Å; D523-H547 IonicContact OD2-ND1 3.49Å; H547-E549 PolarHBondContact O-N 3.25Å; H547-E549 VanDerWaalsContact O-N 3.13Å
548	I	79.1	Confident	62.3	Low	1 Å²	1	93.6 Å²	93.6	1%	0.005	50%	0.501	C	S	.	.			trans	-85.1	82.5	177.8	-54.3	-59.1	0	0	0	110.7	G468 I471 L518 I519 M520 D521 H522 Y524	G468-I548 WeakPolarHBondContact O-CG2 3.48Å; I471-I548 HydrophobicContact CD1-CD1 3.59Å; I471-I548 HydrophobicContact CG1-CD1 4.05Å; L518-I548 HydrophobicContact CB-CD1 4.47Å; L518-I548 HydrophobicContact CB-CG1 4.44Å; L518-I548 HydrophobicContact CD1-CD1 3.98Å; I519-I548 VanDerWaalsContact O-CB 3.29Å; I519-I548 WeakPolarHBondContact O-CB 3.38Å; I519-I548 WeakPolarHBondContact O-CG1 3.35Å; M520-I548 HydrophobicContact CG-CG2 4.35Å; D521-I548 PolarHBondContact N-O 2.8Å; H522-I548 PolarHBondContact O-N 3.43Å; Y524-I548 HydrophobicContact CD2-CD1 4.06Å; Y524-I548 HydrophobicContact CD2-CG1 3.62Å; Y524-I548 HydrophobicContact CE2-CD1 4.49Å; Y524-I548 HydrophobicContact CE2-CG1 3.69Å
549	E	68.9	Low	60	Low	109 Å²	109	92.9 Å²	92.9	51%	0.509	51%	0.508	S	S	.	.			trans	-65	145.2	173.7	-77.2	-165.7	-179.9	0	0	112.6	H547 S551 R554	H547-E549 PolarHBondContact O-N 3.25Å; H547-E549 VanDerWaalsContact O-N 3.13Å; E549-S551 PolarHBondContact O-N 2.88Å; E549-R554 IonicContact OE2-NH2 3.9Å
550	P	51.5	Low	57.6	Low	57 Å²	57	98.7 Å²	98.7	37%	0.37	53%	0.533	S	S	.	.			trans	-60.2	126.3	163.8	-20.5	32	0	0	0	111.6	M520 T552	M520-P550 HydrophobicContact CE-CB 3.64Å; M520-P550 HydrophobicContact CE-CG 3.76Å; P550-T552 PolarHBondContact O-N 2.91Å
551	S	42.7	Very low	54.7	Low	104 Å²	104	107.6 Å²	107.6	73%	0.727	57%	0.574	S	S	*	*			trans	-64.2	95.8	-178.1	42.5	0	0	0	0	112.3	E549	E549-S551 PolarHBondContact O-N 2.88Å
552	T	34.3	Very low	51.6	Low	99 Å²	99	108.4 Å²	108.4	61%	0.607	58%	0.582	S	S	*	*			trans	-104.4	139	-177.2	48.3	0	0	0	0	112.2	P550 R554	P550-T552 PolarHBondContact O-N 2.91Å; T552-R554 PolarHBondContact O-N 3.01Å
553	N	40.6	Very low	48.8	Very low	151 Å²	151	111.3 Å²	111.3	81%	0.807	60%	0.601	S	S	*	*			trans	-75.7	92	-170.2	-172.3	7.5	0	0	0	112	F555	N553-F555 PolarHBondContact O-N 2.9Å; N553-F555 VanDerWaalsContact O-N 3.14Å
554	R	29	Very low	46.1	Very low	205 Å²	205	119.9 Å²	119.9	77%	0.774	64%	0.64	S	S	*	*			trans	-80.5	88.3	-179	-67.8	-165.8	-171.6	-170.7	7.2	112.9	E549 T552	E549-R554 IonicContact OE2-NH2 3.9Å; T552-R554 PolarHBondContact O-N 3.01Å
555	F	30.2	Very low	43.5	Very low	189 Å²	189	121.1 Å²	121.1	83%	0.829	65%	0.646	S	S	*	*			trans	-106	105.6	151.2	-96.1	-80.8	0	0	0	109.7	N553	N553-F555 PolarHBondContact O-N 2.9Å; N553-F555 VanDerWaalsContact O-N 3.14Å
556	S	27.9	Very low	40.9	Very low	126 Å²	126	117.3 Å²	117.3	88%	0.881	64%	0.642	S	S	*	*			trans	-167.8	148.9	156.5	-79.8	0	0	0	0	109.4
557	S	32.8	Very low	38.4	Very low	94 Å²	94	125.3 Å²	125.3	66%	0.657	68%	0.678	S	S	*	*			trans	-91.7	164.5	176.9	60.8	0	0	0	0	112
558	D	29.5	Very low	35.9	Very low	145 Å²	145	129.2 Å²	129.2	78%	0.775	70%	0.696	S	S	*	*			trans	68.7	137.4	167.4	-43.2	-60.8	0	0	0	114.7
559	T	29	Very low	33.6	Very low	137 Å²	137	132.6 Å²	132.6	84%	0.84	71%	0.714	S	S	*	*			cis	-136.1	164.9	17.9	-44.8	0	0	0	0	110.5
560	M	31.5	Very low	32	Very low	163 Å²	163	132.6 Å²	132.6	80%	0.803	72%	0.721	S	S	*	*			trans	-67.8	133.6	180	-63.8	177	67.4	0	0	113.5
561	E	25.2	Very low	31	Very low	192 Å²	192	133.5 Å²	133.5	90%	0.897	73%	0.726	S	S	*	*				-152.7	121.7	122.2	-119.5	172.6	-154.5	0	0	109
562	S	23.7	Very low	30.8	Very low	78 Å²	78	134.9 Å²	134.9	55%	0.545	72%	0.718	S	S	.	*			trans	-116.5	116.6	-174.5	-60.8	0	0	0	0	110.9	H564	S562-H564 PolarHBondContact O-N 3.35Å
563	P	30.1	Very low	30.9	Very low	119 Å²	119	134.2 Å²	134.2	77%	0.773	71%	0.705	S	S	*	*			trans	-68.6	112.7	158.4	28.6	-30.2	0	0	0	108	L565	P563-L565 PolarHBondContact O-N 3.03Å; P563-L565 VanDerWaalsContact O-N 3.08Å
564	H	31.3	Very low	30.6	Very low	183 Å²	183	132.2 Å²	132.2	85%	0.847	70%	0.698	S	S	*	*			trans	-72.9	99	-180	-74.3	-78.3	0	0	0	111.4	S562	S562-H564 PolarHBondContact O-N 3.35Å
565	L	31.4	Very low	30.8	Very low	162 Å²	162	129.4 Å²	129.4	85%	0.848	69%	0.694	S	S	*	*			trans	-93.1	126.5	155.7	-85.2	151.6	0	0	0	108.8	P563	P563-L565 PolarHBondContact O-N 3.03Å; P563-L565 VanDerWaalsContact O-N 3.08Å
566	G	26.2	Very low	30.9	Very low	47 Å²	47	123.9 Å²	123.9	49%	0.485	68%	0.683	S	S	.	*			trans	-82.2	156	-166.2	0	0	0	0	0	114.1	H568	G566-H568 PolarHBondContact O-N 3.42Å
567	H	29.5	Very low	31.2	Very low	188 Å²	188	127 Å²	127	87%	0.87	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	19.4	172.4	-97.9	38.6	0	0	0	114.9
568	H	29.8	Very low	31.2	Very low	164 Å²	164	132.4 Å²	132.4	76%	0.759	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.6	-25.7	-174.5	-90.7	-71.9	0	0	0	114.8	G566	G566-H568 PolarHBondContact O-N 3.42Å
569	D	31.1	Very low	31.2	Very low	73 Å²	73	135.7 Å²	135.7	39%	0.39	70%	0.698	S	S	.	*	S	Bend	trans	-90.2	-25.7	-171.7	-66.8	-74.8	0	0	0	114.2	V571 K572	D569-V571 PolarHBondContact O-N 3.44Å; D569-V571 VanDerWaalsContact O-N 3.09Å; D569-K572 WeakPolarHBondContact O-CB 3.22Å; D569-K572 PolarHBondContact O-N 3.26Å; D569-K572 VanDerWaalsContact O-N 3.13Å; D569-K572 WeakPolarHBondContact OD1-CE 3.28Å; D569-K572 IonicContact OD1-NZ 2.67Å; D569-K572 PolarHBondContact OD1-NZ 3.49Å
570	V	34.3	Very low	31	Very low	108 Å²	108	132.9 Å²	132.9	66%	0.655	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.2	-25.2	178.5	-175	0	0	0	0	112.7
571	V	31.9	Very low	30.7	Very low	77 Å²	77	130 Å²	130	47%	0.467	70%	0.697	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.6	-32.3	-179.5	-176.5	0	0	0	0	112.3	D569 Y573 V574 E575	D569-V571 PolarHBondContact O-N 3.44Å; D569-V571 VanDerWaalsContact O-N 3.09Å; V571-Y573 PolarHBondContact O-N 3.23Å; V571-V574 PolarHBondContact O-N 3.4Å; V571-V574 VanDerWaalsContact O-N 3.16Å; V571-E575 HydrophobicContact CG1-CG 4.36Å
572	K	36.7	Very low	30.7	Very low	132 Å²	132	127.3 Å²	127.3	57%	0.574	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.9	-35.5	-174.8	-70.3	171.2	174.7	166.5	0	113.2	D569 V574	D569-K572 WeakPolarHBondContact O-CB 3.22Å; D569-K572 PolarHBondContact O-N 3.26Å; D569-K572 VanDerWaalsContact O-N 3.13Å; D569-K572 WeakPolarHBondContact OD1-CE 3.28Å; D569-K572 IonicContact OD1-NZ 2.67Å; D569-K572 PolarHBondContact OD1-NZ 3.49Å; K572-V574 VanDerWaalsContact C-N 3.3Å; K572-V574 PolarHBondContact O-N 2.78Å
573	Y	38.2	Very low	31	Very low	86 Å²	86	129.1 Å²	129.1	34%	0.337	70%	0.704	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.4	-5.6	-174.7	-67.8	-78.1	0	0	0	114.3	E462 L476 V571	E462-Y573 PolarHBondContact OE2-OH 3.43Å; L476-Y573 HydrophobicContact CD2-CD1 3.96Å; L476-Y573 HydrophobicContact CD2-CE1 3.44Å; L476-Y573 VanDerWaalsContact CD2-CE1 3.44Å; L476-Y573 HydrophobicContact CG-CE1 3.89Å; V571-Y573 PolarHBondContact O-N 3.23Å
574	V	33.8	Very low	30.9	Very low	108 Å²	108	131.6 Å²	131.6	66%	0.655	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106	-24.6	-175.6	-176.8	0	0	0	0	112.7	V571 K572	V571-V574 PolarHBondContact O-N 3.4Å; V571-V574 VanDerWaalsContact O-N 3.16Å; K572-V574 VanDerWaalsContact C-N 3.3Å; K572-V574 PolarHBondContact O-N 2.78Å
575	E	32.9	Very low	30.7	Very low	147 Å²	147	131.3 Å²	131.3	69%	0.687	71%	0.714	S	S	*	*	G	3₁₀ helix	trans	-88.8	-4.8	-172.4	-60.7	-165.7	131	0	0	114.6	V571 E577	V571-E575 HydrophobicContact CG1-CG 4.36Å; E575-E577 VanDerWaalsContact C-N 3.31Å; E575-E577 PolarHBondContact O-N 3.1Å
576	A	31.5	Very low	30.4	Very low	73 Å²	73	131 Å²	131	60%	0.603	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-74.3	-9	-175.4	0	0	0	0	0	115.5	R578	A576-R578 PolarHBondContact O-N 2.96Å
577	E	34.3	Very low	30.7	Very low	191 Å²	191	136.2 Å²	136.2	89%	0.893	72%	0.72	S	S	*	*	G	3₁₀ helix	trans	-81.3	14.8	179.3	-64.7	-170.8	157.6	0	0	113.9	E575	E575-E577 VanDerWaalsContact C-N 3.31Å; E575-E577 PolarHBondContact O-N 3.1Å
578	R	34	Very low	30.7	Very low	208 Å²	208	135.3 Å²	135.3	79%	0.785	72%	0.716	S	S	*	*	S	Bend	trans	-138.7	151.1	179.1	-67.1	-173.2	174.9	-170.5	-2.6	112.8	A576	A576-R578 PolarHBondContact O-N 2.96Å
579	F	27.8	Very low	30.4	Very low	214 Å²	214	135.8 Å²	135.8	94%	0.939	72%	0.721	S	S	*	*			trans	76.6	113.7	-178.7	-55.3	-77.1	0	0	0	116.1
580	G	25.8	Very low	30.3	Very low	78 Å²	78	138 Å²	138	80%	0.804	74%	0.736	S	S	*	*			trans	-177.5	22.6	178.3	0	0	0	0	0	114
581	A	24.6	Very low	30	Very low	101 Å²	101	143.7 Å²	143.7	84%	0.835	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-83.8	129.3	180	0	0	0	0	0	110.9
582	V	26.8	Very low	29.8	Very low	136 Å²	136	148.5 Å²	148.5	82%	0.824	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-101.5	132.6	176.8	-176.8	0	0	0	0	109.5
583	P	29.5	Very low	29.7	Very low	117 Å²	117	147.7 Å²	147.7	76%	0.76	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-75.4	152.4	-176.9	-16	31.2	0	0	0	114.3
584	L	27.4	Very low	29.5	Very low	171 Å²	171	149.6 Å²	149.6	90%	0.895	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-71.1	144.8	163.9	-67.8	162.7	0	0	0	110.9
585	L	27.3	Very low	29.9	Very low	176 Å²	176	149.9 Å²	149.9	92%	0.921	80%	0.801	S	S	*	*			trans	-137.1	143.6	160.1	-75	176.1	0	0	0	109.6
586	Q	26.1	Very low	29.7	Very low	157 Å²	157	150.2 Å²	150.2	73%	0.734	81%	0.807	S	S	*	*			trans	-112.3	152.3	-178.5	-92.4	168.8	-104.6	0	0	110.7
587	E	32	Very low	29.9	Very low	156 Å²	156	152.6 Å²	152.6	73%	0.729	82%	0.816	S	S	*	*			trans	64.7	152.5	151	-71.7	151.4	-143	0	0	117.1
588	E	29	Very low	30.3	Very low	168 Å²	168	152.1 Å²	152.1	79%	0.785	81%	0.814	S	S	*	*			cis	-154.8	162.5	-6.5	-140.2	-174.3	-167.5	0	0	109.4
589	M	24	Very low	30.4	Very low	175 Å²	175	153.7 Å²	153.7	86%	0.862	82%	0.82	S	S	*	*			trans	158.3	152.8	131.3	-85.6	-166	72.8	0	0	113.5
590	V	28.3	Very low	30.6	Very low	118 Å²	118	149.9 Å²	149.9	72%	0.715	81%	0.809	S	S	*	*			trans	-118.9	150.5	-166.1	172.7	0	0	0	0	112.1
591	R	28.4	Very low	31.3	Very low	229 Å²	229	153.9 Å²	153.9	86%	0.864	81%	0.812	S	S	*	*			trans	-161.8	102.6	146	-112.4	162.9	-166.3	-178.7	5.2	116
592	E	27.4	Very low	31.7	Very low	178 Å²	178	153.3 Å²	153.3	83%	0.832	80%	0.802	S	S	*	*			trans	37.3	140.9	137.2	-59.2	-179.5	142.3	0	0	123.3
593	S	33.9	Very low	32.5	Very low	115 Å²	115	152.1 Å²	152.1	80%	0.804	80%	0.797	S	S	*	*			trans	-107	175.9	-175.6	-29.4	0	0	0	0	114.1
594	P	34	Very low	32.7	Very low	126 Å²	126	152.2 Å²	152.2	82%	0.818	80%	0.798	S	S	*	*			trans	-123.8	167.3	136.5	5.9	16.1	0	0	0	113.5
595	P	43.4	Very low	33.2	Very low	113 Å²	113	149.7 Å²	149.7	73%	0.734	79%	0.792	S	S	*	*			trans	-126.2	-174.4	-158.1	38.5	-21.6	0	0	0	117
596	L	28.2	Very low	33.5	Very low	154 Å²	154	150 Å²	150	81%	0.806	79%	0.793	S	S	*	*			trans	91.4	154.6	165.5	-57.3	172.8	0	0	0	117.7
597	P	36	Very low	34	Very low	123 Å²	123	153.2 Å²	153.2	80%	0.799	80%	0.799	S	S	*	*			cis	-119.1	172.7	1.3	41.1	-28.9	0	0	0	115.7
598	E	42.9	Very low	34.3	Very low	181 Å²	181	157.3 Å²	157.3	85%	0.846	81%	0.807	S	S	*	*			trans	-73.4	152.4	177.9	-57.4	167.7	143	0	0	113.5
599	R	35.8	Very low	34.6	Very low	241 Å²	241	153.6 Å²	153.6	91%	0.909	81%	0.806	S	S	*	*			trans	-139.5	156.6	156	-87.7	-167	167.1	-176.3	-4.6	110.8	D601	R599-D601 PolarHBondContact O-N 2.94Å
600	D	31.7	Very low	35.4	Very low	134 Å²	134	152.2 Å²	152.2	72%	0.717	80%	0.802	S	S	*	*			trans	-83.9	101.3	-159.6	-177.4	12.3	0	0	0	114.2	S602	D600-S602 VanDerWaalsContact C-N 3.32Å; D600-S602 PolarHBondContact O-N 3.17Å; D600-S602 VanDerWaalsContact OD1-CB 3.25Å; D600-S602 WeakPolarHBondContact OD1-CB 3.42Å; D600-S602 PolarHBondContact OD1-N 2.72Å; D600-S602 PolarHBondContact OD1-OG 3.01Å
601	D	40.5	Very low	36.4	Very low	162 Å²	162	153.4 Å²	153.4	87%	0.866	80%	0.804	S	S	*	*			trans	-83.9	64.8	172.1	-78.2	-42.7	0	0	0	112	R599 P603	R599-D601 PolarHBondContact O-N 2.94Å; D601-P603 WeakPolarHBondContact O-CD 3.34Å
602	S	33.8	Very low	37.6	Very low	90 Å²	90	150.5 Å²	150.5	63%	0.629	81%	0.806	S	S	*	*			trans	-101.4	99.3	179.4	-78.1	0	0	0	0	113.5	D600	D600-S602 VanDerWaalsContact C-N 3.32Å; D600-S602 PolarHBondContact O-N 3.17Å; D600-S602 VanDerWaalsContact OD1-CB 3.25Å; D600-S602 WeakPolarHBondContact OD1-CB 3.42Å; D600-S602 PolarHBondContact OD1-N 2.72Å; D600-S602 PolarHBondContact OD1-OG 3.01Å
603	P	41.8	Very low	38.9	Very low	110 Å²	110	146.8 Å²	146.8	71%	0.714	80%	0.795	S	S	*	*			trans	-72.2	153.3	169.8	30.1	-35.1	0	0	0	112.2	D601	D601-P603 WeakPolarHBondContact O-CD 3.34Å
604	P	33.7	Very low	40.1	Very low	120 Å²	120	150.1 Å²	150.1	78%	0.779	80%	0.798	S	S	*	*			trans	-68.8	147.3	-176	27.5	-34.9	0	0	0	113.3	L606	P604-L606 PolarHBondContact O-N 3.47Å
605	P	39	Very low	41.4	Very low	117 Å²	117	155.5 Å²	155.5	76%	0.76	80%	0.802	S	S	*	*			trans	-86.8	110.7	-166.2	32.5	-35.9	0	0	0	114.4
606	L	34.2	Very low	43.2	Very low	183 Å²	183	157 Å²	157	96%	0.958	79%	0.793	S	S	*	*			trans	-87.4	116.5	158.4	-66.1	179.1	0	0	0	109.5	P604	P604-L606 PolarHBondContact O-N 3.47Å
607	R	36.6	Very low	45.4	Very low	224 Å²	224	155.6 Å²	155.6	85%	0.845	79%	0.786	S	S	*	*			trans	-120	133.2	-166	-151.1	178.8	-167.7	-167.3	5.5	113.8
608	R	36.7	Very low	47.6	Very low	242 Å²	242	151.2 Å²	151.2	91%	0.913	76%	0.758	S	S	*	*			trans	89.8	138.3	177	-55.5	172.5	174.2	173.3	-1.4	113.5
609	A	35.3	Very low	49.9	Very low	91 Å²	91	145.6 Å²	145.6	75%	0.752	74%	0.739	S	S	*	*	S	Bend	cis	-131.8	160.3	13.2	0	0	0	0	0	114.8
610	N	42.3	Very low	52.5	Low	146 Å²	146	135 Å²	135	78%	0.781	70%	0.7	S	S	*	*			trans	58.9	85.4	168.4	-70.9	5.2	0	0	0	119.6
611	N	49.3	Very low	55.4	Low	142 Å²	142	134 Å²	134	76%	0.759	69%	0.689	S	S	*	*	S	Bend	trans	50.9	122.5	133.9	-57.8	1.1	0	0	0	120.9	V613	N611-V613 PolarHBondContact O-N 3.37Å
612	N	51.9	Low	57.8	Low	169 Å²	169	128.4 Å²	128.4	90%	0.904	66%	0.658	S	S	*	*	S	Bend	trans	69.4	2.8	160.9	-66.8	22.1	0	0	0	119.1
613	V	54.7	Low	60.7	Low	100 Å²	100	124.2 Å²	124.2	61%	0.606	63%	0.628	S	S	*	*			trans	-107.3	114.7	162.8	-177.1	0	0	0	0	109.4	N611 W615	N611-V613 PolarHBondContact O-N 3.37Å; V613-W615 HydrophobicContact CG1-CD2 4.27Å; V613-W615 HydrophobicContact CG1-CZ2 4.12Å
614	Q	60.2	Low	63.2	Low	184 Å²	184	119.1 Å²	119.1	86%	0.86	60%	0.595	S	S	*	*			trans	-87.7	122.4	164.6	-77	179.1	-36.1	0	0	108.5	R616	Q614-R616 PolarHBondContact O-N 2.9Å
615	W	61	Low	66.1	Low	239 Å²	239	119.3 Å²	119.3	91%	0.905	59%	0.586	S	S	*	*			trans	-83.5	108.4	171.1	-61.5	101.1	0	0	0	108.7	V613	V613-W615 HydrophobicContact CG1-CD2 4.27Å; V613-W615 HydrophobicContact CG1-CZ2 4.12Å
616	R	81.3	Confident	68.8	Low	144 Å²	144	117.6 Å²	117.6	54%	0.543	57%	0.565	S	S	.	*			trans	-130.7	149.1	166	70.6	174.4	179.9	100.1	-6.2	108.5	Q614 E622	Q614-R616 PolarHBondContact O-N 2.9Å; R616-E622 IonicContact CZ-OE1 2.98Å; R616-E622 VanDerWaalsContact CZ-OE1 3.26Å; R616-E622 IonicContact CZ-OE2 2.83Å; R616-E622 VanDerWaalsContact NH1-CD 3.34Å; R616-E622 IonicContact NH1-OE1 2.7Å; R616-E622 PolarHBondContact NH1-OE1 3.13Å; R616-E622 IonicContact NH1-OE2 2.66Å; R616-E622 PolarHBondContact NH1-OE2 2.89Å; R616-E622 IonicContact NH2-OE1 3.26Å; R616-E622 PolarHBondContact NH2-OE1 2.94Å
617	D	75.4	Confident	71.7	Confident	125 Å²	125	109 Å²	109	67%	0.668	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-72	129.2	164.7	-71.6	-72.5	0	0	0	109.4	Y641	D617-Y641 PolarHBondContact OD1-OH 2.81Å
618	P	82	Confident	74.5	Confident	32 Å²	32	101.9 Å²	101.9	21%	0.208	50%	0.504	C	S	.	.	P	Polyproline II helix	trans	-76.5	142	172.5	31.4	-33.6	0	0	0	110.3	E622 V623 Y626 Y641	P618-E622 HydrophobicContact CB-CB 4.27Å; P618-V623 HydrophobicContact CB-CG2 3.93Å; P618-V623 HydrophobicContact CG-CG2 3.58Å; P618-Y626 HydrophobicContact CB-CE2 4.21Å; P618-Y641 HydrophobicContact CG-CD1 4.27Å; P618-Y641 HydrophobicContact CG-CE1 3.82Å
619	S	90.2	Very high	77.2	Confident	62 Å²	62	91.8 Å²	91.8	43%	0.434	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-64.8	154.3	173	63.8	0	0	0	0	111.3	K621 E622 V623	S619-K621 PolarHBondContact O-N 2.87Å; S619-K621 VanDerWaalsContact O-N 3.1Å; S619-E622 WeakPolarHBondContact CB-OE2 3.41Å; S619-E622 PolarHBondContact N-OE2 2.77Å; S619-E622 WeakPolarHBondContact O-CB 3.35Å; S619-E622 PolarHBondContact O-N 2.88Å; S619-E622 VanDerWaalsContact OG-CG 3.29Å; S619-E622 WeakPolarHBondContact OG-CG 3.24Å; S619-E622 PolarHBondContact OG-OE2 2.82Å; S619-V623 WeakPolarHBondContact O-CG2 3.29Å; S619-V623 PolarHBondContact O-N 2.89Å
620	L	91.1	Very high	79.9	Confident	20 Å²	20	92.4 Å²	92.4	11%	0.105	48%	0.476	C	S	.	.	H	α-helix	trans	-55.1	-34.7	-177.6	-178	57.9	0	0	0	112.8	V623 I624 L642 L645 I652 E655 Y659	L620-V623 PolarHBondContact O-N 2.9Å; L620-I624 HydrophobicContact CD1-CD1 3.98Å; L620-I624 HydrophobicContact CD1-CG1 4.37Å; L620-I624 HydrophobicContact CG-CD1 3.94Å; L620-I624 WeakPolarHBondContact O-CB 3.2Å; L620-I624 VanDerWaalsContact O-CG1 3.27Å; L620-I624 WeakPolarHBondContact O-CG1 3.39Å; L620-I624 PolarHBondContact O-N 2.86Å; L620-L642 HydrophobicContact CD1-CD1 3.51Å; L620-L645 HydrophobicContact CD1-CD1 4.31Å; L620-I652 HydrophobicContact CD1-CG2 4.5Å; L620-I652 HydrophobicContact CD2-CD1 4.03Å; L620-I652 HydrophobicContact CD2-CG2 4.31Å; L620-E655 HydrophobicContact CD2-CB 3.55Å; L620-Y659 HydrophobicContact CB-CE2 4.49Å; L620-Y659 HydrophobicContact CD2-CD2 4.17Å; L620-Y659 HydrophobicContact CD2-CE2 4.05Å; L620-Y659 HydrophobicContact CG-CD2 4.15Å; L620-Y659 HydrophobicContact CG-CE2 4.31Å
621	K	92.9	Very high	82.4	Confident	111 Å²	111	88.2 Å²	88.2	48%	0.483	45%	0.453	S	S	.	.	H	α-helix	trans	-63.3	-48.4	174.3	-67.6	178.8	-179.5	175.2	0	112.1	S619 V623 I624 E625 Y659	S619-K621 PolarHBondContact O-N 2.87Å; S619-K621 VanDerWaalsContact O-N 3.1Å; K621-V623 VanDerWaalsContact C-N 3.34Å; K621-V623 PolarHBondContact O-N 2.88Å; K621-I624 PolarHBondContact O-N 3.39Å; K621-E625 WeakPolarHBondContact O-CG 3.37Å; K621-E625 PolarHBondContact O-N 2.85Å; K621-Y659 HydrophobicContact CD-CE1 4.4Å; K621-Y659 HydrophobicContact CG-CD1 4.27Å; K621-Y659 HydrophobicContact CG-CD2 3.73Å; K621-Y659 HydrophobicContact CG-CE1 4.41Å; K621-Y659 HydrophobicContact CG-CE2 3.86Å; K621-Y659 HydrophobicContact CG-CG 3.95Å
622	E	91.4	Very high	84.4	Confident	46 Å²	46	85.3 Å²	85.3	22%	0.215	43%	0.434	C	S	.	.	H	α-helix	trans	-62.2	-40.4	176.7	-66.5	170.8	106.2	0	0	111.9	R616 P618 S619 I624 E625 Y626	R616-E622 IonicContact CZ-OE1 2.98Å; R616-E622 VanDerWaalsContact CZ-OE1 3.26Å; R616-E622 IonicContact CZ-OE2 2.83Å; R616-E622 VanDerWaalsContact NH1-CD 3.34Å; R616-E622 IonicContact NH1-OE1 2.7Å; R616-E622 PolarHBondContact NH1-OE1 3.13Å; R616-E622 IonicContact NH1-OE2 2.66Å; R616-E622 PolarHBondContact NH1-OE2 2.89Å; R616-E622 IonicContact NH2-OE1 3.26Å; R616-E622 PolarHBondContact NH2-OE1 2.94Å; P618-E622 HydrophobicContact CB-CB 4.27Å; S619-E622 WeakPolarHBondContact CB-OE2 3.41Å; S619-E622 PolarHBondContact N-OE2 2.77Å; S619-E622 WeakPolarHBondContact O-CB 3.35Å; S619-E622 PolarHBondContact O-N 2.88Å; S619-E622 VanDerWaalsContact OG-CG 3.29Å; S619-E622 WeakPolarHBondContact OG-CG 3.24Å; S619-E622 PolarHBondContact OG-OE2 2.82Å; E622-I624 VanDerWaalsContact C-N 3.32Å; E622-I624 PolarHBondContact O-N 3.17Å; E622-E625 PolarHBondContact O-N 3.38Å; E622-Y626 HydrophobicContact CB-CE2 4.23Å; E622-Y626 WeakPolarHBondContact O-CD1 3.48Å; E622-Y626 WeakPolarHBondContact O-CD2 3.39Å; E622-Y626 PolarHBondContact O-N 2.9Å
623	V	92.9	Very high	86.2	Confident	1 Å²	1	82.4 Å²	82.4	1%	0.006	42%	0.418	C	S	.	.	H	α-helix	trans	-58.9	-45.2	174.6	177.3	0	0	0	0	110.7	P618 S619 L620 K621 Y626 L627 A638 Y641 L642	P618-V623 HydrophobicContact CB-CG2 3.93Å; P618-V623 HydrophobicContact CG-CG2 3.58Å; S619-V623 WeakPolarHBondContact O-CG2 3.29Å; S619-V623 PolarHBondContact O-N 2.89Å; L620-V623 PolarHBondContact O-N 2.9Å; K621-V623 VanDerWaalsContact C-N 3.34Å; K621-V623 PolarHBondContact O-N 2.88Å; V623-Y626 PolarHBondContact O-N 2.8Å; V623-L627 PolarHBondContact O-N 3.15Å; V623-A638 HydrophobicContact CG1-CB 4.4Å; V623-Y641 HydrophobicContact CG1-CD1 4.19Å; V623-Y641 HydrophobicContact CG2-CD1 3.6Å; V623-Y641 HydrophobicContact CG2-CE1 3.8Å; V623-L642 HydrophobicContact CG1-CB 3.89Å; V623-L642 HydrophobicContact CG1-CD1 4.45Å
624	I	95.9	Very high	87.9	Confident	4 Å²	4	82.5 Å²	82.5	2%	0.021	41%	0.411	C	S	.	.	H	α-helix	trans	-68.9	-34.4	178.8	-72.2	169.2	0	0	0	111.7	L620 K621 E622 L627 L642 T656 Y659 K664	L620-I624 HydrophobicContact CD1-CD1 3.98Å; L620-I624 HydrophobicContact CD1-CG1 4.37Å; L620-I624 HydrophobicContact CG-CD1 3.94Å; L620-I624 WeakPolarHBondContact O-CB 3.2Å; L620-I624 VanDerWaalsContact O-CG1 3.27Å; L620-I624 WeakPolarHBondContact O-CG1 3.39Å; L620-I624 PolarHBondContact O-N 2.86Å; K621-I624 PolarHBondContact O-N 3.39Å; E622-I624 VanDerWaalsContact C-N 3.32Å; E622-I624 PolarHBondContact O-N 3.17Å; I624-L627 WeakPolarHBondContact O-CB 3.32Å; I624-L627 PolarHBondContact O-N 3.44Å; I624-L642 HydrophobicContact CG1-CD2 4.23Å; I624-T656 HydrophobicContact CD1-CG2 4.19Å; I624-Y659 HydrophobicContact CD1-CD2 4.19Å; I624-Y659 WeakPolarHBondContact CG2-O 2.96Å; I624-K664 HydrophobicContact CG2-CD 3.58Å; I624-K664 WeakPolarHBondContact O-CD 3.41Å; I624-K664 PolarHBondContact O-NZ 2.61Å
625	E	94.7	Very high	89.5	Confident	123 Å²	123	74.7 Å²	74.7	58%	0.575	37%	0.374	S	S	*	.	H	α-helix	trans	-64.9	-42.9	170.4	-74.1	173.4	-166.6	0	0	112.1	K621 E622 L627 S628	K621-E625 WeakPolarHBondContact O-CG 3.37Å; K621-E625 PolarHBondContact O-N 2.85Å; E622-E625 PolarHBondContact O-N 3.38Å; E625-L627 PolarHBondContact O-N 3.44Å; E625-S628 WeakPolarHBondContact O-CA 3.48Å; E625-S628 WeakPolarHBondContact O-CB 3.18Å; E625-S628 PolarHBondContact O-N 2.87Å
626	Y	94.4	Very high	90.9	Very high	82 Å²	82	64.1 Å²	64.1	32%	0.322	34%	0.335	S	S	.	.	H	α-helix	trans	-63.8	-22.8	178.9	-61.9	-20.6	0	0	0	113.6	P618 E622 V623 S628 S629	P618-Y626 HydrophobicContact CB-CE2 4.21Å; E622-Y626 HydrophobicContact CB-CE2 4.23Å; E622-Y626 WeakPolarHBondContact O-CD1 3.48Å; E622-Y626 WeakPolarHBondContact O-CD2 3.39Å; E622-Y626 PolarHBondContact O-N 2.9Å; V623-Y626 PolarHBondContact O-N 2.8Å; Y626-S628 PolarHBondContact O-N 2.9Å; Y626-S629 WeakPolarHBondContact O-CB 3.47Å; Y626-S629 PolarHBondContact O-N 2.83Å; Y626-S629 VanDerWaalsContact O-N 3.07Å
627	L	95.8	Very high	91.2	Very high	2 Å²	2	62.5 Å²	62.5	1%	0.01	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-32	168.2	-57	178.7	0	0	0	112.2	V623 I624 E625 S629 Q635 A638 L642 K664 L665 L668	V623-L627 PolarHBondContact O-N 3.15Å; I624-L627 WeakPolarHBondContact O-CB 3.32Å; I624-L627 PolarHBondContact O-N 3.44Å; E625-L627 PolarHBondContact O-N 3.44Å; L627-S629 VanDerWaalsContact C-N 3.35Å; L627-Q635 PolarHBondContact O-NE2 3.09Å; L627-A638 HydrophobicContact CD2-CB 4.11Å; L627-L642 HydrophobicContact CD1-CD2 3.86Å; L627-K664 HydrophobicContact CB-CB 4.15Å; L627-K664 HydrophobicContact CD1-CB 4Å; L627-L665 HydrophobicContact CD1-CD2 3.94Å; L627-L665 HydrophobicContact CD1-CG 3.95Å; L627-L665 HydrophobicContact CD2-CD2 4.22Å; L627-L668 HydrophobicContact CB-CD1 4.13Å; L627-L668 HydrophobicContact CD2-CD1 3.88Å
628	S	94.9	Very high	91.9	Very high	74 Å²	74	57 Å²	57	52%	0.517	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	6.1	178.1	-57.4	0	0	0	0	113.5	E625 Y626 K664	E625-S628 WeakPolarHBondContact O-CA 3.48Å; E625-S628 WeakPolarHBondContact O-CB 3.18Å; E625-S628 PolarHBondContact O-N 2.87Å; Y626-S628 PolarHBondContact O-N 2.9Å; S628-K664 PolarHBondContact OG-NZ 2.91Å
629	S	94	Very high	92.5	Very high	30 Å²	30	55.4 Å²	55.4	21%	0.21	30%	0.299	C	S	.	.			trans	-66.4	144	179.6	-160.1	0	0	0	0	112.3	Y626 L627 D631 Q635	Y626-S629 WeakPolarHBondContact O-CB 3.47Å; Y626-S629 PolarHBondContact O-N 2.83Å; Y626-S629 VanDerWaalsContact O-N 3.07Å; L627-S629 VanDerWaalsContact C-N 3.35Å; S629-D631 PolarHBondContact O-N 2.94Å; S629-D631 PolarHBondContact OG-N 3.49Å; S629-Q635 WeakPolarHBondContact O-CG 3.37Å; S629-Q635 PolarHBondContact O-NE2 3.23Å; S629-Q635 VanDerWaalsContact O-NE2 3.07Å
630	A	91.8	Very high	92.2	Very high	104 Å²	104	53.7 Å²	53.7	86%	0.86	29%	0.291	S	S	*	.	S	Bend	trans	-70.1	-17.3	168.9	0	0	0	0	0	112.8
631	D	93.8	Very high	92.1	Very high	58 Å²	58	55.9 Å²	55.9	31%	0.31	30%	0.299	S	S	.	.			trans	-81.3	113.7	178.7	178.6	-26.5	0	0	0	110.4	S629 D633 K634 Q635	S629-D631 PolarHBondContact O-N 2.94Å; S629-D631 PolarHBondContact OG-N 3.49Å; D631-D633 VanDerWaalsContact C-N 3.33Å; D631-D633 PolarHBondContact O-N 3.03Å; D631-D633 PolarHBondContact OD1-N 2.98Å; D631-K634 HydrophobicContact CB-CB 4.02Å; D631-K634 HydrophobicContact CB-CD 4.02Å; D631-K634 HydrophobicContact CB-CG 4.03Å; D631-K634 PolarHBondContact O-N 3.49Å; D631-K634 PolarHBondContact OD1-N 3.06Å; D631-K634 WeakPolarHBondContact OD2-CE 3.46Å; D631-K634 WeakPolarHBondContact OD2-CG 3.45Å; D631-K634 IonicContact OD2-NZ 3.59Å; D631-K634 PolarHBondContact OD2-NZ 2.88Å; D631-Q635 WeakPolarHBondContact O-CG 3.33Å; D631-Q635 PolarHBondContact O-N 3.02Å
632	K	91.8	Very high	92.1	Very high	81 Å²	81	50.6 Å²	50.6	35%	0.352	28%	0.276	S	S	.	.	H	α-helix	trans	-64.5	-32.9	-176.3	-73.8	-73.2	167.2	-155.3	0	113.5	Q635 L636 S671 I676	K632-Q635 PolarHBondContact O-N 3.4Å; K632-L636 VanDerWaalsContact O-CB 3.25Å; K632-L636 WeakPolarHBondContact O-CB 3.49Å; K632-L636 PolarHBondContact O-N 3.08Å; K632-S671 PolarHBondContact NZ-OG 3.37Å; K632-I676 HydrophobicContact CB-CD1 4.43Å; K632-I676 HydrophobicContact CD-CD1 3.61Å
633	D	90.3	Very high	92.1	Very high	108 Å²	108	51 Å²	51	58%	0.578	28%	0.277	S	S	*	.	H	α-helix	trans	-74.6	-33.3	177.6	-71.9	-47	0	0	0	110.7	D631 N637	D631-D633 VanDerWaalsContact C-N 3.33Å; D631-D633 PolarHBondContact O-N 3.03Å; D631-D633 PolarHBondContact OD1-N 2.98Å; D633-N637 WeakPolarHBondContact O-CB 3.34Å; D633-N637 VanDerWaalsContact O-CG 3.29Å; D633-N637 PolarHBondContact O-N 3.49Å; D633-N637 PolarHBondContact O-ND2 3.07Å
634	K	90.1	Very high	91.7	Very high	102 Å²	102	57.5 Å²	57.5	44%	0.443	31%	0.308	S	S	.	.	H	α-helix	trans	-65.1	-46.3	168.2	-69.1	-175.1	-174.1	104.2	0	112.1	D631 L636 N637 A638	D631-K634 HydrophobicContact CB-CB 4.02Å; D631-K634 HydrophobicContact CB-CD 4.02Å; D631-K634 HydrophobicContact CB-CG 4.03Å; D631-K634 PolarHBondContact O-N 3.49Å; D631-K634 PolarHBondContact OD1-N 3.06Å; D631-K634 WeakPolarHBondContact OD2-CE 3.46Å; D631-K634 WeakPolarHBondContact OD2-CG 3.45Å; D631-K634 IonicContact OD2-NZ 3.59Å; D631-K634 PolarHBondContact OD2-NZ 2.88Å; K634-L636 VanDerWaalsContact C-N 3.31Å; K634-L636 PolarHBondContact O-N 2.81Å; K634-N637 PolarHBondContact O-N 3.01Å; K634-A638 WeakPolarHBondContact O-CB 3.26Å; K634-A638 PolarHBondContact O-N 2.83Å
635	Q	94.1	Very high	91.3	Very high	20 Å²	20	59.6 Å²	59.6	9%	0.093	32%	0.318	C	S	.	.	H	α-helix	trans	-58.4	-43	175.5	-69	-168.7	-49.4	0	0	112	L627 S629 D631 K632 S639 L668 I676	L627-Q635 PolarHBondContact O-NE2 3.09Å; S629-Q635 WeakPolarHBondContact O-CG 3.37Å; S629-Q635 PolarHBondContact O-NE2 3.23Å; S629-Q635 VanDerWaalsContact O-NE2 3.07Å; D631-Q635 WeakPolarHBondContact O-CG 3.33Å; D631-Q635 PolarHBondContact O-N 3.02Å; K632-Q635 PolarHBondContact O-N 3.4Å; Q635-S639 VanDerWaalsContact O-CB 3.32Å; Q635-S639 WeakPolarHBondContact O-CB 3.44Å; Q635-S639 PolarHBondContact O-N 3.05Å; Q635-S639 PolarHBondContact O-OG 2.89Å; Q635-L668 HydrophobicContact CB-CD2 4.35Å; Q635-L668 HydrophobicContact CG-CD2 4.28Å; Q635-I676 HydrophobicContact CB-CD1 4.02Å
636	L	89.6	Confident	91.2	Very high	17 Å²	17	53.7 Å²	53.7	9%	0.089	29%	0.291	C	S	.	.	H	α-helix	trans	-64.9	-48.2	179.3	178.1	61.4	0	0	0	112.3	K632 K634 S639 G640 R675 I676 N679	K632-L636 VanDerWaalsContact O-CB 3.25Å; K632-L636 WeakPolarHBondContact O-CB 3.49Å; K632-L636 PolarHBondContact O-N 3.08Å; K634-L636 VanDerWaalsContact C-N 3.31Å; K634-L636 PolarHBondContact O-N 2.81Å; L636-S639 PolarHBondContact O-OG 2.94Å; L636-S639 VanDerWaalsContact O-OG 3.08Å; L636-G640 PolarHBondContact O-N 2.94Å; L636-R675 HydrophobicContact CD1-CB 3.54Å; L636-I676 HydrophobicContact CB-CD1 4.38Å; L636-I676 HydrophobicContact CB-CG1 3.95Å; L636-I676 HydrophobicContact CD1-CG1 4.05Å; L636-N679 PolarHBondContact O-ND2 3.14Å; L636-N679 VanDerWaalsContact O-ND2 3.08Å
637	N	87.6	Confident	90.6	Very high	111 Å²	111	56.2 Å²	56.2	59%	0.594	30%	0.301	S	S	*	.	H	α-helix	trans	-70.5	-41.3	-179.3	-70.3	-45.5	0	0	0	111.8	D633 K634 G640 Y641	D633-N637 WeakPolarHBondContact O-CB 3.34Å; D633-N637 VanDerWaalsContact O-CG 3.29Å; D633-N637 PolarHBondContact O-N 3.49Å; D633-N637 PolarHBondContact O-ND2 3.07Å; K634-N637 PolarHBondContact O-N 3.01Å; N637-G640 PolarHBondContact O-N 3.3Å; N637-Y641 WeakPolarHBondContact O-CB 3.23Å; N637-Y641 PolarHBondContact O-N 2.66Å
638	A	91.6	Very high	89.8	Confident	8 Å²	8	61.6 Å²	61.6	7%	0.066	33%	0.334	C	S	.	.	H	α-helix	trans	-64.3	-43.7	177.7	0	0	0	0	0	112.5	V623 L627 K634 G640 Y641 L642	V623-A638 HydrophobicContact CG1-CB 4.4Å; L627-A638 HydrophobicContact CD2-CB 4.11Å; K634-A638 WeakPolarHBondContact O-CB 3.26Å; K634-A638 PolarHBondContact O-N 2.83Å; A638-G640 VanDerWaalsContact C-N 3.34Å; A638-G640 PolarHBondContact O-N 2.84Å; A638-Y641 PolarHBondContact O-N 2.86Å; A638-L642 WeakPolarHBondContact O-CB 3.47Å; A638-L642 PolarHBondContact O-N 3.34Å
639	S	92.9	Very high	89.3	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-66.8	-33.7	174.8	56.4	0	0	0	0	112.6	Q635 L636 Q643 N679 C683	Q635-S639 VanDerWaalsContact O-CB 3.32Å; Q635-S639 WeakPolarHBondContact O-CB 3.44Å; Q635-S639 PolarHBondContact O-N 3.05Å; Q635-S639 PolarHBondContact O-OG 2.89Å; L636-S639 PolarHBondContact O-OG 2.94Å; L636-S639 VanDerWaalsContact O-OG 3.08Å; S639-Q643 WeakPolarHBondContact O-CB 3.42Å; S639-Q643 PolarHBondContact O-N 3.12Å; S639-Q643 VanDerWaalsContact O-N 3.07Å; S639-N679 WeakPolarHBondContact OG-CB 3.37Å; S639-N679 PolarHBondContact OG-ND2 2.94Å; S639-C683 PolarHBondContact O-SG 2.94Å
640	G	83.9	Confident	89.1	Confident	26 Å²	26	62.9 Å²	62.9	27%	0.268	33%	0.333	S	S	.	.	H	α-helix	trans	-70	-39.1	174.3	0	0	0	0	0	113.3	L636 N637 A638 Q643 H644 N679	L636-G640 PolarHBondContact O-N 2.94Å; N637-G640 PolarHBondContact O-N 3.3Å; A638-G640 VanDerWaalsContact C-N 3.34Å; A638-G640 PolarHBondContact O-N 2.84Å; G640-Q643 WeakPolarHBondContact O-CB 3.16Å; G640-Q643 PolarHBondContact O-N 2.91Å; G640-H644 PolarHBondContact O-N 2.82Å; G640-N679 WeakPolarHBondContact CA-ND2 2.97Å; G640-N679 PolarHBondContact N-ND2 2.88Å
641	Y	89.3	Confident	88.9	Confident	66 Å²	66	64 Å²	64	26%	0.259	32%	0.32	S	S	.	.	H	α-helix	trans	-69.7	-43.9	176.3	-170.4	-106.9	0	0	0	111.2	D617 P618 V623 N637 A638 Q643 H644 L645	D617-Y641 PolarHBondContact OD1-OH 2.81Å; P618-Y641 HydrophobicContact CG-CD1 4.27Å; P618-Y641 HydrophobicContact CG-CE1 3.82Å; V623-Y641 HydrophobicContact CG1-CD1 4.19Å; V623-Y641 HydrophobicContact CG2-CD1 3.6Å; V623-Y641 HydrophobicContact CG2-CE1 3.8Å; N637-Y641 WeakPolarHBondContact O-CB 3.23Å; N637-Y641 PolarHBondContact O-N 2.66Å; A638-Y641 PolarHBondContact O-N 2.86Å; Y641-Q643 VanDerWaalsContact C-N 3.29Å; Y641-Q643 PolarHBondContact O-N 3.08Å; Y641-H644 WeakPolarHBondContact O-CB 3.26Å; Y641-H644 PolarHBondContact O-N 3.01Å; Y641-L645 HydrophobicContact CD1-CD1 3.84Å; Y641-L645 HydrophobicContact CD1-CG 4.26Å; Y641-L645 HydrophobicContact CE1-CD1 3.68Å; Y641-L645 HydrophobicContact CE1-CD2 4.38Å; Y641-L645 HydrophobicContact CE1-CG 4.2Å; Y641-L645 WeakPolarHBondContact O-CG 3.49Å; Y641-L645 PolarHBondContact O-N 2.97Å
642	L	93.7	Very high	88.7	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-62.7	-34.6	175	-171	58.7	0	0	0	112.7	L620 V623 I624 L627 A638 H644 L645 T646 T656 L665	L620-L642 HydrophobicContact CD1-CD1 3.51Å; V623-L642 HydrophobicContact CG1-CB 3.89Å; V623-L642 HydrophobicContact CG1-CD1 4.45Å; I624-L642 HydrophobicContact CG1-CD2 4.23Å; L627-L642 HydrophobicContact CD1-CD2 3.86Å; A638-L642 WeakPolarHBondContact O-CB 3.47Å; A638-L642 PolarHBondContact O-N 3.34Å; L642-H644 VanDerWaalsContact C-N 3.29Å; L642-H644 PolarHBondContact O-N 2.85Å; L642-L645 PolarHBondContact O-N 2.99Å; L642-T646 HydrophobicContact CD1-CG2 3.98Å; L642-T646 HydrophobicContact CG-CG2 4.25Å; L642-T646 WeakPolarHBondContact O-CB 3.43Å; L642-T646 VanDerWaalsContact O-CG2 3.31Å; L642-T646 WeakPolarHBondContact O-CG2 3.23Å; L642-T646 PolarHBondContact O-N 2.79Å; L642-T646 PolarHBondContact O-OG1 2.73Å; L642-T656 HydrophobicContact CD1-CG2 4.19Å; L642-T656 HydrophobicContact CD2-CG2 4.05Å; L642-L665 HydrophobicContact CD2-CD1 4.12Å; L642-L665 HydrophobicContact CD2-CD2 4.28Å; L642-L665 HydrophobicContact CD2-CG 4.43Å
643	Q	91.4	Very high	88.8	Confident	54 Å²	54	59.1 Å²	59.1	25%	0.252	30%	0.297	S	S	.	.	H	α-helix	trans	-60.1	-40.9	172	-175.5	-168.1	-24.3	0	0	111.5	S639 G640 Y641 T646 A682 C683 N686	S639-Q643 WeakPolarHBondContact O-CB 3.42Å; S639-Q643 PolarHBondContact O-N 3.12Å; S639-Q643 VanDerWaalsContact O-N 3.07Å; G640-Q643 WeakPolarHBondContact O-CB 3.16Å; G640-Q643 PolarHBondContact O-N 2.91Å; Y641-Q643 VanDerWaalsContact C-N 3.29Å; Y641-Q643 PolarHBondContact O-N 3.08Å; Q643-T646 PolarHBondContact O-OG1 2.91Å; Q643-A682 HydrophobicContact CG-CB 3.85Å; Q643-C683 VanDerWaalsContact CA-SG 3.58Å; Q643-C683 PolarHBondContact N-SG 2.95Å; Q643-C683 VanDerWaalsContact N-SG 3.38Å; Q643-N686 PolarHBondContact O-ND2 3.1Å
644	H	85.1	Confident	88.9	Confident	138 Å²	138	58.2 Å²	58.2	64%	0.639	29%	0.29	S	S	*	.	H	α-helix	trans	-66.4	-50.4	177.7	173.2	48.5	0	0	0	111.5	G640 Y641 L642 T646 Y647	G640-H644 PolarHBondContact O-N 2.82Å; Y641-H644 WeakPolarHBondContact O-CB 3.26Å; Y641-H644 PolarHBondContact O-N 3.01Å; L642-H644 VanDerWaalsContact C-N 3.29Å; L642-H644 PolarHBondContact O-N 2.85Å; H644-T646 VanDerWaalsContact C-N 3.31Å; H644-T646 PolarHBondContact O-N 2.91Å; H644-Y647 WeakPolarHBondContact O-CB 3.43Å; H644-Y647 PolarHBondContact O-N 2.77Å
645	L	87.3	Confident	89.1	Confident	47 Å²	47	55.3 Å²	55.3	25%	0.246	28%	0.278	C	S	.	.	H	α-helix	trans	-60.9	-37.2	-179.7	-60.1	178.8	0	0	0	112.7	L620 Y641 L642 Y647 I652	L620-L645 HydrophobicContact CD1-CD1 4.31Å; Y641-L645 HydrophobicContact CD1-CD1 3.84Å; Y641-L645 HydrophobicContact CD1-CG 4.26Å; Y641-L645 HydrophobicContact CE1-CD1 3.68Å; Y641-L645 HydrophobicContact CE1-CD2 4.38Å; Y641-L645 HydrophobicContact CE1-CG 4.2Å; Y641-L645 WeakPolarHBondContact O-CG 3.49Å; Y641-L645 PolarHBondContact O-N 2.97Å; L642-L645 PolarHBondContact O-N 2.99Å; L645-Y647 VanDerWaalsContact C-N 3.33Å; L645-Y647 PolarHBondContact O-N 3.34Å; L645-I652 HydrophobicContact CB-CG2 3.89Å
646	T	90.9	Very high	89.1	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-1.9	-176.7	52.7	0	0	0	0	115.1	L642 Q643 H644 I652 K653 L687	L642-T646 HydrophobicContact CD1-CG2 3.98Å; L642-T646 HydrophobicContact CG-CG2 4.25Å; L642-T646 WeakPolarHBondContact O-CB 3.43Å; L642-T646 VanDerWaalsContact O-CG2 3.31Å; L642-T646 WeakPolarHBondContact O-CG2 3.23Å; L642-T646 PolarHBondContact O-N 2.79Å; L642-T646 PolarHBondContact O-OG1 2.73Å; Q643-T646 PolarHBondContact O-OG1 2.91Å; H644-T646 VanDerWaalsContact C-N 3.31Å; H644-T646 PolarHBondContact O-N 2.91Å; T646-I652 HydrophobicContact CG2-CG2 4.07Å; T646-K653 WeakPolarHBondContact O-CE 3.07Å; T646-L687 HydrophobicContact CG2-CD2 3.86Å; T646-L687 HydrophobicContact CG2-CG 4.13Å
647	Y	83.6	Confident	89.4	Confident	135 Å²	135	56.5 Å²	56.5	53%	0.529	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-53	-168.3	-177.9	-121.3	0	0	0	113.8	H644 L645	H644-Y647 WeakPolarHBondContact O-CB 3.43Å; H644-Y647 PolarHBondContact O-N 2.77Å; L645-Y647 VanDerWaalsContact C-N 3.33Å; L645-Y647 PolarHBondContact O-N 3.34Å
648	T	78.1	Confident	89.8	Confident	115 Å²	115	56.9 Å²	56.9	71%	0.706	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.7	-15.2	-177.4	43.4	0	0	0	0	114.3
649	D	84	Confident	89.9	Confident	70 Å²	70	60.4 Å²	60.4	37%	0.374	29%	0.29	S	S	.	.			trans	-85.9	118.3	-177	-169.3	-44	0	0	0	110.8	Q651 I652 K653	D649-Q651 WeakPolarHBondContact OD1-CA 3.38Å; D649-Q651 WeakPolarHBondContact OD1-CB 3.36Å; D649-Q651 PolarHBondContact OD1-N 2.78Å; D649-I652 HydrophobicContact CB-CB 4Å; D649-I652 HydrophobicContact CB-CG1 3.96Å; D649-I652 VanDerWaalsContact CG-CG1 3.46Å; D649-I652 PolarHBondContact OD1-N 3.45Å; D649-K653 VanDerWaalsContact O-CG 3.28Å; D649-K653 WeakPolarHBondContact O-CG 3.33Å; D649-K653 PolarHBondContact O-N 2.76Å
650	N	89.1	Confident	90	Very high	61 Å²	61	61.7 Å²	61.7	33%	0.326	30%	0.304	S	S	.	.	H	α-helix	trans	-82.3	-27	179.4	-79.2	-14.6	0	0	0	113.4	K653 E654 E692 N693	N650-K653 PolarHBondContact O-N 2.78Å; N650-K653 WeakPolarHBondContact OD1-CD 3.38Å; N650-K653 WeakPolarHBondContact OD1-CE 3.23Å; N650-K653 PolarHBondContact OD1-NZ 3.01Å; N650-E654 PolarHBondContact O-N 3.38Å; N650-E654 VanDerWaalsContact O-N 3.08Å; N650-E692 VanDerWaalsContact ND2-CG 3.29Å; N650-E692 WeakPolarHBondContact ND2-CG 3.36Å; N650-E692 PolarHBondContact ND2-OE1 3.36Å; N650-N693 PolarHBondContact OD1-ND2 2.65Å
651	Q	89	Confident	90.6	Very high	127 Å²	127	60.5 Å²	60.5	59%	0.593	29%	0.291	S	S	*	.	H	α-helix	trans	-67.5	-44.2	173.5	-178.3	-175.2	-34.1	0	0	109.9	D649 K653 E654 E655	D649-Q651 WeakPolarHBondContact OD1-CA 3.38Å; D649-Q651 WeakPolarHBondContact OD1-CB 3.36Å; D649-Q651 PolarHBondContact OD1-N 2.78Å; Q651-K653 VanDerWaalsContact C-N 3.28Å; Q651-K653 PolarHBondContact O-N 3.28Å; Q651-E654 WeakPolarHBondContact O-CB 3.4Å; Q651-E654 PolarHBondContact O-N 3.43Å; Q651-E654 VanDerWaalsContact O-N 3.14Å; Q651-E655 HydrophobicContact CG-CG 4.47Å; Q651-E655 PolarHBondContact NE2-OE1 2.74Å; Q651-E655 PolarHBondContact O-N 2.76Å
652	I	89.9	Confident	91	Very high	32 Å²	32	57.4 Å²	57.4	16%	0.164	28%	0.279	C	S	.	.	H	α-helix	trans	-62.1	-35.9	175.9	-66.9	-67.5	0	0	0	111.7	L620 L645 T646 D649 T656	L620-I652 HydrophobicContact CD1-CG2 4.5Å; L620-I652 HydrophobicContact CD2-CD1 4.03Å; L620-I652 HydrophobicContact CD2-CG2 4.31Å; L645-I652 HydrophobicContact CB-CG2 3.89Å; T646-I652 HydrophobicContact CG2-CG2 4.07Å; D649-I652 HydrophobicContact CB-CB 4Å; D649-I652 HydrophobicContact CB-CG1 3.96Å; D649-I652 VanDerWaalsContact CG-CG1 3.46Å; D649-I652 PolarHBondContact OD1-N 3.45Å; I652-T656 WeakPolarHBondContact O-CB 3.45Å; I652-T656 PolarHBondContact O-N 2.72Å; I652-T656 PolarHBondContact O-OG1 3Å
653	K	93.7	Very high	91.2	Very high	4 Å²	4	60.7 Å²	60.7	2%	0.017	30%	0.3	C	S	.	.	H	α-helix	trans	-64	-42.8	174.1	-69.1	170.3	-161.5	170.7	0	111.7	T646 D649 N650 Q651 T656 R657 N686 L687 N693	T646-K653 WeakPolarHBondContact O-CE 3.07Å; D649-K653 VanDerWaalsContact O-CG 3.28Å; D649-K653 WeakPolarHBondContact O-CG 3.33Å; D649-K653 PolarHBondContact O-N 2.76Å; N650-K653 PolarHBondContact O-N 2.78Å; N650-K653 WeakPolarHBondContact OD1-CD 3.38Å; N650-K653 WeakPolarHBondContact OD1-CE 3.23Å; N650-K653 PolarHBondContact OD1-NZ 3.01Å; Q651-K653 VanDerWaalsContact C-N 3.28Å; Q651-K653 PolarHBondContact O-N 3.28Å; K653-T656 PolarHBondContact O-N 3.38Å; K653-R657 PolarHBondContact O-N 2.72Å; K653-R657 VanDerWaalsContact O-N 3.09Å; K653-N686 VanDerWaalsContact CE-O 3.23Å; K653-N686 WeakPolarHBondContact CE-O 3.5Å; K653-L687 HydrophobicContact CB-CD2 3.88Å; K653-L687 HydrophobicContact CG-CD2 4Å; K653-N693 WeakPolarHBondContact CD-OD1 3.4Å
654	E	92.8	Very high	91.5	Very high	90 Å²	90	60.9 Å²	60.9	42%	0.421	30%	0.3	S	S	.	.	H	α-helix	trans	-63.9	-51.2	175.9	178.2	134.2	-102.9	0	0	111.9	N650 Q651 T656 R657 E658	N650-E654 PolarHBondContact O-N 3.38Å; N650-E654 VanDerWaalsContact O-N 3.08Å; Q651-E654 WeakPolarHBondContact O-CB 3.4Å; Q651-E654 PolarHBondContact O-N 3.43Å; Q651-E654 VanDerWaalsContact O-N 3.14Å; E654-T656 PolarHBondContact O-N 3.39Å; E654-R657 WeakPolarHBondContact O-CA 3.41Å; E654-R657 VanDerWaalsContact O-CB 3.29Å; E654-R657 WeakPolarHBondContact O-CB 3.49Å; E654-R657 PolarHBondContact O-N 2.67Å; E654-R657 IonicContact OE1-CZ 3.09Å; E654-R657 IonicContact OE1-NH1 3.93Å; E654-R657 PolarHBondContact OE1-NH1 2.7Å; E654-R657 IonicContact OE1-NH2 2.68Å; E654-R657 PolarHBondContact OE1-NH2 3.08Å; E654-E658 WeakPolarHBondContact O-CG 3.35Å; E654-E658 PolarHBondContact O-N 2.65Å
655	E	92.9	Very high	92.1	Very high	41 Å²	41	54.3 Å²	54.3	19%	0.192	27%	0.27	C	S	.	.	H	α-helix	trans	-59.6	-34.5	174.1	-72.7	-169	-131.4	0	0	112.2	L620 Q651 R657 E658 Y659	L620-E655 HydrophobicContact CD2-CB 3.55Å; Q651-E655 HydrophobicContact CG-CG 4.47Å; Q651-E655 PolarHBondContact NE2-OE1 2.74Å; Q651-E655 PolarHBondContact O-N 2.76Å; E655-R657 VanDerWaalsContact C-N 3.34Å; E655-R657 PolarHBondContact O-N 3.34Å; E655-E658 PolarHBondContact O-N 3.33Å; E655-Y659 HydrophobicContact CB-CD2 4.26Å; E655-Y659 HydrophobicContact CB-CE2 3.76Å; E655-Y659 HydrophobicContact CG-CE2 4.28Å; E655-Y659 WeakPolarHBondContact O-CB 3.38Å; E655-Y659 VanDerWaalsContact O-CD2 3.22Å; E655-Y659 WeakPolarHBondContact O-CD2 3.27Å; E655-Y659 VanDerWaalsContact O-CG 3.3Å; E655-Y659 PolarHBondContact O-N 2.79Å; E655-Y659 VanDerWaalsContact OE2-CE2 3.27Å; E655-Y659 WeakPolarHBondContact OE2-CE2 3.43Å; E655-Y659 PolarHBondContact OE2-OH 3.15Å
656	T	94.3	Very high	92.6	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-67.5	-31.5	175.2	-60.9	0	0	0	0	112.7	I624 L642 I652 K653 E654 G661 L687	I624-T656 HydrophobicContact CD1-CG2 4.19Å; L642-T656 HydrophobicContact CD1-CG2 4.19Å; L642-T656 HydrophobicContact CD2-CG2 4.05Å; I652-T656 WeakPolarHBondContact O-CB 3.45Å; I652-T656 PolarHBondContact O-N 2.72Å; I652-T656 PolarHBondContact O-OG1 3Å; K653-T656 PolarHBondContact O-N 3.38Å; E654-T656 PolarHBondContact O-N 3.39Å; T656-G661 VanDerWaalsContact O-CA 3.28Å; T656-G661 WeakPolarHBondContact O-CA 3.35Å; T656-G661 PolarHBondContact O-N 3.28Å; T656-L687 HydrophobicContact CG2-CD1 4.04Å; T656-L687 HydrophobicContact CG2-CD2 3.77Å
657	R	96.9	Very high	92.9	Very high	62 Å²	62	55.1 Å²	55.1	23%	0.234	28%	0.283	C	S	.	.	H	α-helix	trans	-66.9	-51.2	168.9	175.2	-162.2	69.6	-140.1	8.3	109.8	K653 E654 E655 G660 I662 N696 A699	K653-R657 PolarHBondContact O-N 2.72Å; K653-R657 VanDerWaalsContact O-N 3.09Å; E654-R657 WeakPolarHBondContact O-CA 3.41Å; E654-R657 VanDerWaalsContact O-CB 3.29Å; E654-R657 WeakPolarHBondContact O-CB 3.49Å; E654-R657 PolarHBondContact O-N 2.67Å; E654-R657 IonicContact OE1-CZ 3.09Å; E654-R657 IonicContact OE1-NH1 3.93Å; E654-R657 PolarHBondContact OE1-NH1 2.7Å; E654-R657 IonicContact OE1-NH2 2.68Å; E654-R657 PolarHBondContact OE1-NH2 3.08Å; E655-R657 VanDerWaalsContact C-N 3.34Å; E655-R657 PolarHBondContact O-N 3.34Å; R657-G660 PolarHBondContact O-N 3.13Å; R657-I662 HydrophobicContact CB-CD1 3.93Å; R657-I662 HydrophobicContact CG-CD1 4.24Å; R657-N696 WeakPolarHBondContact CD-OD1 3.46Å; R657-A699 HydrophobicContact CG-CB 4.26Å
658	E	94.7	Very high	93.5	Very high	119 Å²	119	49 Å²	49	56%	0.556	26%	0.259	S	S	*	.	H	α-helix	trans	-67.3	-37.9	-171.8	-69.6	-179.9	-178.8	0	0	113.8	E654 E655 G660	E654-E658 WeakPolarHBondContact O-CG 3.35Å; E654-E658 PolarHBondContact O-N 2.65Å; E655-E658 PolarHBondContact O-N 3.33Å; E658-G660 PolarHBondContact O-N 3.45Å
659	Y	94.9	Very high	94.4	Very high	81 Å²	81	43.7 Å²	43.7	32%	0.318	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	12	172.9	-52.5	-32.9	0	0	0	113.4	L620 K621 I624 E655 G661	L620-Y659 HydrophobicContact CB-CE2 4.49Å; L620-Y659 HydrophobicContact CD2-CD2 4.17Å; L620-Y659 HydrophobicContact CD2-CE2 4.05Å; L620-Y659 HydrophobicContact CG-CD2 4.15Å; L620-Y659 HydrophobicContact CG-CE2 4.31Å; K621-Y659 HydrophobicContact CD-CE1 4.4Å; K621-Y659 HydrophobicContact CG-CD1 4.27Å; K621-Y659 HydrophobicContact CG-CD2 3.73Å; K621-Y659 HydrophobicContact CG-CE1 4.41Å; K621-Y659 HydrophobicContact CG-CE2 3.86Å; K621-Y659 HydrophobicContact CG-CG 3.95Å; I624-Y659 HydrophobicContact CD1-CD2 4.19Å; I624-Y659 WeakPolarHBondContact CG2-O 2.96Å; E655-Y659 HydrophobicContact CB-CD2 4.26Å; E655-Y659 HydrophobicContact CB-CE2 3.76Å; E655-Y659 HydrophobicContact CG-CE2 4.28Å; E655-Y659 WeakPolarHBondContact O-CB 3.38Å; E655-Y659 VanDerWaalsContact O-CD2 3.22Å; E655-Y659 WeakPolarHBondContact O-CD2 3.27Å; E655-Y659 VanDerWaalsContact O-CG 3.3Å; E655-Y659 PolarHBondContact O-N 2.79Å; E655-Y659 VanDerWaalsContact OE2-CE2 3.27Å; E655-Y659 WeakPolarHBondContact OE2-CE2 3.43Å; E655-Y659 PolarHBondContact OE2-OH 3.15Å; Y659-G661 VanDerWaalsContact C-N 3.35Å; Y659-G661 PolarHBondContact O-N 2.96Å
660	G	94.7	Very high	94.9	Very high	28 Å²	28	48.6 Å²	48.6	29%	0.289	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.7	23.6	174.7	0	0	0	0	0	114.6	R657 E658 P663 K664	R657-G660 PolarHBondContact O-N 3.13Å; E658-G660 PolarHBondContact O-N 3.45Å; G660-P663 WeakPolarHBondContact O-CD 3.11Å; G660-K664 WeakPolarHBondContact O-CD 3.14Å
661	G	96.8	Very high	95.2	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-66.3	-35	179.8	0	0	0	0	0	113.8	T656 Y659 K664 L665	T656-G661 VanDerWaalsContact O-CA 3.28Å; T656-G661 WeakPolarHBondContact O-CA 3.35Å; T656-G661 PolarHBondContact O-N 3.28Å; Y659-G661 VanDerWaalsContact C-N 3.35Å; Y659-G661 PolarHBondContact O-N 2.96Å; G661-K664 WeakPolarHBondContact O-CB 3.17Å; G661-K664 PolarHBondContact O-N 3.17Å; G661-L665 WeakPolarHBondContact O-CG 3.4Å; G661-L665 PolarHBondContact O-N 2.72Å
662	I	97.7	Very high	95.3	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-59.8	-53	-178.1	-72.3	170.8	0	0	0	112.6	R657 K664 L665 I666 L687 N696 A699 V700	R657-I662 HydrophobicContact CB-CD1 3.93Å; R657-I662 HydrophobicContact CG-CD1 4.24Å; I662-K664 VanDerWaalsContact C-N 3.27Å; I662-K664 PolarHBondContact O-N 3.08Å; I662-L665 PolarHBondContact O-N 2.89Å; I662-I666 HydrophobicContact CG2-CD1 3.76Å; I662-I666 WeakPolarHBondContact O-CG1 3.46Å; I662-I666 PolarHBondContact O-N 2.68Å; I662-L687 HydrophobicContact CG1-CD1 4.1Å; I662-N696 HydrophobicContact CD1-CB 4.02Å; I662-A699 HydrophobicContact CD1-CB 3.92Å; I662-A699 HydrophobicContact CG2-CB 4.27Å; I662-V700 HydrophobicContact CG2-CB 4.41Å; I662-V700 HydrophobicContact CG2-CG2 3.62Å
663	P	97.8	Very high	95.5	Very high	69 Å²	69	46.7 Å²	46.7	45%	0.448	24%	0.237	S	C	.	.	H	α-helix	trans	-56.9	-36.4	173.6	-27.8	34.6	0	0	0	114.2	G660 I666 A667 A703	G660-P663 WeakPolarHBondContact O-CD 3.11Å; P663-I666 PolarHBondContact O-N 3.35Å; P663-A667 PolarHBondContact O-N 3.18Å; P663-A703 HydrophobicContact CB-CB 4.38Å; P663-A703 HydrophobicContact CG-CB 4.19Å
664	K	97.8	Very high	95.5	Very high	58 Å²	58	49.2 Å²	49.2	25%	0.252	25%	0.253	S	S	.	.	H	α-helix	trans	-68.4	-42.2	178.4	-67.2	162.6	171.8	-93.1	0	111.7	I624 L627 S628 G660 G661 I662 I666 A667 L668	I624-K664 HydrophobicContact CG2-CD 3.58Å; I624-K664 WeakPolarHBondContact O-CD 3.41Å; I624-K664 PolarHBondContact O-NZ 2.61Å; L627-K664 HydrophobicContact CB-CB 4.15Å; L627-K664 HydrophobicContact CD1-CB 4Å; S628-K664 PolarHBondContact OG-NZ 2.91Å; G660-K664 WeakPolarHBondContact O-CD 3.14Å; G661-K664 WeakPolarHBondContact O-CB 3.17Å; G661-K664 PolarHBondContact O-N 3.17Å; I662-K664 VanDerWaalsContact C-N 3.27Å; I662-K664 PolarHBondContact O-N 3.08Å; K664-I666 VanDerWaalsContact C-N 3.32Å; K664-I666 PolarHBondContact O-N 3.3Å; K664-A667 WeakPolarHBondContact O-CB 3.18Å; K664-A667 PolarHBondContact O-N 3.17Å; K664-L668 PolarHBondContact O-N 3.2Å; K664-L668 VanDerWaalsContact O-N 3.11Å
665	L	98.1	Very high	95.5	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-62.1	-39.4	172.5	-71.3	168.5	0	0	0	111.8	L627 L642 G661 I662 A667 L668 L669 C683 L684 L687	L627-L665 HydrophobicContact CD1-CD2 3.94Å; L627-L665 HydrophobicContact CD1-CG 3.95Å; L627-L665 HydrophobicContact CD2-CD2 4.22Å; L642-L665 HydrophobicContact CD2-CD1 4.12Å; L642-L665 HydrophobicContact CD2-CD2 4.28Å; L642-L665 HydrophobicContact CD2-CG 4.43Å; G661-L665 WeakPolarHBondContact O-CG 3.4Å; G661-L665 PolarHBondContact O-N 2.72Å; I662-L665 PolarHBondContact O-N 2.89Å; L665-A667 VanDerWaalsContact C-N 3.35Å; L665-L668 WeakPolarHBondContact O-CB 3.02Å; L665-L668 PolarHBondContact O-N 3.49Å; L665-L669 PolarHBondContact O-N 3.4Å; L665-C683 HydrophobicContact CD1-CB 3.58Å; L665-C683 HydrophobicContact CD2-CB 3.74Å; L665-C683 HydrophobicContact CG-CB 4.28Å; L665-L684 HydrophobicContact CB-CD1 4.47Å; L665-L684 HydrophobicContact CB-CD2 4.07Å; L665-L684 HydrophobicContact CB-CG 4.18Å; L665-L684 HydrophobicContact CD1-CD2 4.43Å; L665-L687 HydrophobicContact CD1-CD1 3.41Å; L665-L687 VanDerWaalsContact CD1-CD1 3.41Å
666	I	98.1	Very high	95.6	Very high	4 Å²	4	51.2 Å²	51.2	2%	0.021	26%	0.255	C	S	.	.	H	α-helix	trans	-68.4	-33.8	176.9	-70.1	162.6	0	0	0	111.8	I662 P663 K664 L669 L684 V700 A703 L708	I662-I666 HydrophobicContact CG2-CD1 3.76Å; I662-I666 WeakPolarHBondContact O-CG1 3.46Å; I662-I666 PolarHBondContact O-N 2.68Å; P663-I666 PolarHBondContact O-N 3.35Å; K664-I666 VanDerWaalsContact C-N 3.32Å; K664-I666 PolarHBondContact O-N 3.3Å; I666-L669 HydrophobicContact CG1-CD1 4.5Å; I666-L669 HydrophobicContact CG2-CD1 4.41Å; I666-L669 WeakPolarHBondContact O-CB 3.16Å; I666-L669 PolarHBondContact O-N 3.13Å; I666-L684 HydrophobicContact CD1-CD2 4.38Å; I666-L684 HydrophobicContact CG1-CD1 3.94Å; I666-L684 HydrophobicContact CG1-CD2 3.98Å; I666-V700 HydrophobicContact CD1-CB 4.41Å; I666-V700 HydrophobicContact CD1-CG1 4.22Å; I666-V700 HydrophobicContact CD1-CG2 4.42Å; I666-A703 HydrophobicContact CD1-CB 3.56Å; I666-A703 WeakPolarHBondContact CG2-O 3.11Å; I666-L708 HydrophobicContact CG2-CB 4.45Å; I666-L708 HydrophobicContact CG2-CD1 3.43Å; I666-L708 VanDerWaalsContact CG2-CD1 3.43Å
667	A	96.4	Very high	95.7	Very high	60 Å²	60	52.2 Å²	52.2	50%	0.496	26%	0.26	S	S	.	.	H	α-helix	trans	-63.7	-38.9	170.1	0	0	0	0	0	112.3	P663 K664 L665 L669 R670	P663-A667 PolarHBondContact O-N 3.18Å; K664-A667 WeakPolarHBondContact O-CB 3.18Å; K664-A667 PolarHBondContact O-N 3.17Å; L665-A667 VanDerWaalsContact C-N 3.35Å; A667-L669 PolarHBondContact O-N 3.3Å; A667-R670 WeakPolarHBondContact O-CB 3.36Å; A667-R670 PolarHBondContact O-N 3.36Å; A667-R670 VanDerWaalsContact O-N 3.1Å
668	L	96.8	Very high	95.7	Very high	7 Å²	7	52.5 Å²	52.5	4%	0.037	26%	0.263	C	S	.	.	H	α-helix	trans	-63.5	-22.8	177.4	-71	-178.1	0	0	0	114.2	L627 Q635 K664 L665 R670 S671 I676 A680	L627-L668 HydrophobicContact CB-CD1 4.13Å; L627-L668 HydrophobicContact CD2-CD1 3.88Å; Q635-L668 HydrophobicContact CB-CD2 4.35Å; Q635-L668 HydrophobicContact CG-CD2 4.28Å; K664-L668 PolarHBondContact O-N 3.2Å; K664-L668 VanDerWaalsContact O-N 3.11Å; L665-L668 WeakPolarHBondContact O-CB 3.02Å; L665-L668 PolarHBondContact O-N 3.49Å; L668-R670 PolarHBondContact O-N 2.82Å; L668-R670 VanDerWaalsContact O-N 3.14Å; L668-S671 WeakPolarHBondContact O-CB 3.48Å; L668-S671 PolarHBondContact O-N 3Å; L668-I676 HydrophobicContact CB-CG2 4.03Å; L668-I676 HydrophobicContact CD1-CG2 4.26Å; L668-I676 HydrophobicContact CD2-CG2 3.87Å; L668-I676 HydrophobicContact CG-CG2 4.29Å; L668-A680 HydrophobicContact CB-CB 3.88Å
669	L	96.7	Very high	95.8	Very high	3 Å²	3	48 Å²	48	2%	0.016	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-26.7	172.3	-61.7	178.5	0	0	0	112.6	L665 I666 A667 S671 Q677 A680 C681 L684 L708 I709 V712	L665-L669 PolarHBondContact O-N 3.4Å; I666-L669 HydrophobicContact CG1-CD1 4.5Å; I666-L669 HydrophobicContact CG2-CD1 4.41Å; I666-L669 WeakPolarHBondContact O-CB 3.16Å; I666-L669 PolarHBondContact O-N 3.13Å; A667-L669 PolarHBondContact O-N 3.3Å; L669-S671 VanDerWaalsContact C-N 3.3Å; L669-S671 PolarHBondContact O-N 3.47Å; L669-Q677 PolarHBondContact O-NE2 3.17Å; L669-A680 HydrophobicContact CD2-CB 3.98Å; L669-C681 WeakPolarHBondContact CD2-SG 3.22Å; L669-L684 HydrophobicContact CD1-CD1 3.97Å; L669-L684 HydrophobicContact CD2-CD1 4.12Å; L669-L684 HydrophobicContact CG-CD1 4.25Å; L669-L708 HydrophobicContact CD1-CB 4.04Å; L669-I709 HydrophobicContact CD1-CG1 3.65Å; L669-V712 HydrophobicContact CB-CG2 3.9Å; L669-V712 HydrophobicContact CD2-CG2 4.4Å; L669-V712 WeakPolarHBondContact O-CG2 3.48Å
670	R	94.9	Very high	95.9	Very high	174 Å²	174	44.2 Å²	44.2	66%	0.657	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.9	0.9	178.1	-55.5	-177	-173.5	171.3	3.6	113.8	A667 L668 L708	A667-R670 WeakPolarHBondContact O-CB 3.36Å; A667-R670 PolarHBondContact O-N 3.36Å; A667-R670 VanDerWaalsContact O-N 3.1Å; L668-R670 PolarHBondContact O-N 2.82Å; L668-R670 VanDerWaalsContact O-N 3.14Å; R670-L708 HydrophobicContact CG-CD2 4.43Å
671	S	93.6	Very high	96.1	Very high	12 Å²	12	42.9 Å²	42.9	8%	0.084	21%	0.214	C	C	.	.			trans	-71.3	135.6	177.2	-153.9	0	0	0	0	111.4	K632 L668 L669 T673 Q677	K632-S671 PolarHBondContact NZ-OG 3.37Å; L668-S671 WeakPolarHBondContact O-CB 3.48Å; L668-S671 PolarHBondContact O-N 3Å; L669-S671 VanDerWaalsContact C-N 3.3Å; L669-S671 PolarHBondContact O-N 3.47Å; S671-T673 PolarHBondContact O-N 2.9Å; S671-Q677 VanDerWaalsContact O-CD 3.23Å; S671-Q677 WeakPolarHBondContact O-CG 2.83Å; S671-Q677 PolarHBondContact O-NE2 2.97Å
672	D	92.1	Very high	96	Very high	128 Å²	128	42.9 Å²	42.9	68%	0.684	21%	0.214	S	C	*	.	S	Bend	trans	-44.6	-18.5	159.7	58.9	-6.6	0	0	0	117.3	P674	D672-P674 WeakPolarHBondContact O-CD 3.41Å
673	T	93.3	Very high	96	Very high	40 Å²	40	42.8 Å²	42.8	25%	0.245	21%	0.214	C	C	.	.			trans	-103.1	107.4	-165.3	-60.6	0	0	0	0	110.1	S671 R675 I676 Q677	S671-T673 PolarHBondContact O-N 2.9Å; T673-R675 VanDerWaalsContact C-N 3.26Å; T673-R675 PolarHBondContact O-N 3.33Å; T673-R675 VanDerWaalsContact O-N 3.13Å; T673-I676 HydrophobicContact CG2-CB 4.28Å; T673-I676 HydrophobicContact CG2-CD1 3.88Å; T673-I676 HydrophobicContact CG2-CG1 3.79Å; T673-I676 PolarHBondContact O-N 2.75Å; T673-Q677 PolarHBondContact O-N 3.38Å; T673-Q677 VanDerWaalsContact O-N 3.1Å
674	P	94.1	Very high	96	Very high	56 Å²	56	39.6 Å²	39.6	36%	0.364	19%	0.193	S	C	.	.	H	α-helix	trans	-59.9	-32.2	-171.4	-27.5	36.4	0	0	0	114.1	D672 I676 Q677 K678 D718 V721	D672-P674 WeakPolarHBondContact O-CD 3.41Å; P674-I676 PolarHBondContact O-N 3.06Å; P674-Q677 PolarHBondContact O-N 2.72Å; P674-K678 WeakPolarHBondContact O-CB 3.39Å; P674-K678 PolarHBondContact O-N 3.35Å; P674-D718 HydrophobicContact CB-CB 4.19Å; P674-V721 HydrophobicContact CB-CG2 4.08Å; P674-V721 VanDerWaalsContact O-CG2 3.26Å; P674-V721 WeakPolarHBondContact O-CG2 3.29Å
675	R	93.4	Very high	95.9	Very high	173 Å²	173	39 Å²	39	65%	0.653	19%	0.19	S	C	*	.	H	α-helix	trans	-65.7	-36.7	176.1	-61.9	-177.7	67.6	-167.7	-0.6	112.5	L636 T673 N679	L636-R675 HydrophobicContact CD1-CB 3.54Å; T673-R675 VanDerWaalsContact C-N 3.26Å; T673-R675 PolarHBondContact O-N 3.33Å; T673-R675 VanDerWaalsContact O-N 3.13Å; R675-N679 VanDerWaalsContact O-CG 3.23Å; R675-N679 PolarHBondContact O-N 2.76Å; R675-N679 PolarHBondContact O-OD1 3.11Å
676	I	95.6	Very high	95.9	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-70.8	-44.7	175.6	-64.7	177.6	0	0	0	109.8	K632 Q635 L636 L668 T673 P674 K678 N679 A680	K632-I676 HydrophobicContact CB-CD1 4.43Å; K632-I676 HydrophobicContact CD-CD1 3.61Å; Q635-I676 HydrophobicContact CB-CD1 4.02Å; L636-I676 HydrophobicContact CB-CD1 4.38Å; L636-I676 HydrophobicContact CB-CG1 3.95Å; L636-I676 HydrophobicContact CD1-CG1 4.05Å; L668-I676 HydrophobicContact CB-CG2 4.03Å; L668-I676 HydrophobicContact CD1-CG2 4.26Å; L668-I676 HydrophobicContact CD2-CG2 3.87Å; L668-I676 HydrophobicContact CG-CG2 4.29Å; T673-I676 HydrophobicContact CG2-CB 4.28Å; T673-I676 HydrophobicContact CG2-CD1 3.88Å; T673-I676 HydrophobicContact CG2-CG1 3.79Å; T673-I676 PolarHBondContact O-N 2.75Å; P674-I676 PolarHBondContact O-N 3.06Å; I676-K678 VanDerWaalsContact C-N 3.31Å; I676-K678 PolarHBondContact O-N 3.22Å; I676-N679 PolarHBondContact O-N 2.85Å; I676-A680 WeakPolarHBondContact O-CB 3.19Å; I676-A680 PolarHBondContact O-N 2.73Å
677	Q	95.9	Very high	95.8	Very high	20 Å²	20	39.1 Å²	39.1	9%	0.093	19%	0.191	C	C	.	.	H	α-helix	trans	-57.4	-43.9	173.8	-64.7	-172.2	-50.9	0	0	111.7	L669 S671 T673 P674 A680 C681 V721	L669-Q677 PolarHBondContact O-NE2 3.17Å; S671-Q677 VanDerWaalsContact O-CD 3.23Å; S671-Q677 WeakPolarHBondContact O-CG 2.83Å; S671-Q677 PolarHBondContact O-NE2 2.97Å; T673-Q677 PolarHBondContact O-N 3.38Å; T673-Q677 VanDerWaalsContact O-N 3.1Å; P674-Q677 PolarHBondContact O-N 2.72Å; Q677-A680 PolarHBondContact O-N 2.8Å; Q677-C681 WeakPolarHBondContact O-CB 3.39Å; Q677-C681 PolarHBondContact O-N 2.68Å; Q677-C681 PolarHBondContact O-SG 2.67Å; Q677-V721 HydrophobicContact CB-CG1 3.89Å; Q677-V721 HydrophobicContact CB-CG2 4.32Å
678	K	95.8	Very high	95.8	Very high	69 Å²	69	36.3 Å²	36.3	30%	0.3	17%	0.168	S	C	.	.	H	α-helix	trans	-60.7	-52.9	178.1	-168.3	-174.7	-176.2	176.2	0	111.6	P674 I676 A680 C681 A682 V721 E724	P674-K678 WeakPolarHBondContact O-CB 3.39Å; P674-K678 PolarHBondContact O-N 3.35Å; I676-K678 VanDerWaalsContact C-N 3.31Å; I676-K678 PolarHBondContact O-N 3.22Å; K678-A680 VanDerWaalsContact C-N 3.28Å; K678-A680 PolarHBondContact O-N 2.79Å; K678-C681 PolarHBondContact O-N 2.78Å; K678-A682 WeakPolarHBondContact O-CB 3.24Å; K678-A682 PolarHBondContact O-N 2.85Å; K678-V721 HydrophobicContact CB-CG2 4Å; K678-E724 HydrophobicContact CG-CG 3.82Å
679	N	96.7	Very high	95.6	Very high	25 Å²	25	38.3 Å²	38.3	13%	0.134	18%	0.176	C	C	.	.	H	α-helix	trans	-59.8	-40.7	-179.9	-68.2	8.1	0	0	0	110.9	L636 S639 G640 R675 I676 A682 C683	L636-N679 PolarHBondContact O-ND2 3.14Å; L636-N679 VanDerWaalsContact O-ND2 3.08Å; S639-N679 WeakPolarHBondContact OG-CB 3.37Å; S639-N679 PolarHBondContact OG-ND2 2.94Å; G640-N679 WeakPolarHBondContact CA-ND2 2.97Å; G640-N679 PolarHBondContact N-ND2 2.88Å; R675-N679 VanDerWaalsContact O-CG 3.23Å; R675-N679 PolarHBondContact O-N 2.76Å; R675-N679 PolarHBondContact O-OD1 3.11Å; I676-N679 PolarHBondContact O-N 2.85Å; N679-A682 PolarHBondContact O-N 3.43Å; N679-C683 PolarHBondContact O-N 2.78Å; N679-C683 PolarHBondContact O-SG 3.04Å
680	A	97.8	Very high	95	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-63.3	-48.1	175.6	0	0	0	0	0	112.5	L668 L669 I676 Q677 K678 A682 C683 L684	L668-A680 HydrophobicContact CB-CB 3.88Å; L669-A680 HydrophobicContact CD2-CB 3.98Å; I676-A680 WeakPolarHBondContact O-CB 3.19Å; I676-A680 PolarHBondContact O-N 2.73Å; Q677-A680 PolarHBondContact O-N 2.8Å; K678-A680 VanDerWaalsContact C-N 3.28Å; K678-A680 PolarHBondContact O-N 2.79Å; A680-A682 VanDerWaalsContact C-N 3.3Å; A680-A682 PolarHBondContact O-N 2.86Å; A680-C683 PolarHBondContact O-N 2.85Å; A680-L684 VanDerWaalsContact O-CG 3.26Å; A680-L684 WeakPolarHBondContact O-CG 3.46Å; A680-L684 PolarHBondContact O-N 2.91Å
681	C	97.8	Very high	94.4	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-58.4	-41.3	173.4	-71	0	0	0	0	112.1	L669 Q677 K678 L684 K685 E724	L669-C681 WeakPolarHBondContact CD2-SG 3.22Å; Q677-C681 WeakPolarHBondContact O-CB 3.39Å; Q677-C681 PolarHBondContact O-N 2.68Å; Q677-C681 PolarHBondContact O-SG 2.67Å; K678-C681 PolarHBondContact O-N 2.78Å; C681-L684 PolarHBondContact O-N 2.9Å; C681-K685 WeakPolarHBondContact O-CB 3.35Å; C681-K685 PolarHBondContact O-N 2.86Å; C681-E724 HydrophobicContact CB-CB 3.63Å
682	A	95.3	Very high	93.9	Very high	0 Å²	0	41 Å²	41	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-71.4	-36.2	-179.5	0	0	0	0	0	112.8	Q643 K678 N679 A680 K685 N686 E724	Q643-A682 HydrophobicContact CG-CB 3.85Å; K678-A682 WeakPolarHBondContact O-CB 3.24Å; K678-A682 PolarHBondContact O-N 2.85Å; N679-A682 PolarHBondContact O-N 3.43Å; A680-A682 VanDerWaalsContact C-N 3.3Å; A680-A682 PolarHBondContact O-N 2.86Å; A682-K685 WeakPolarHBondContact O-CB 3.06Å; A682-K685 PolarHBondContact O-N 2.94Å; A682-N686 PolarHBondContact O-N 3.31Å; A682-N686 PolarHBondContact O-OD1 2.85Å; A682-E724 HydrophobicContact CB-CG 4.18Å
683	C	97.4	Very high	93.8	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-59.8	-49.3	167.7	-67.2	0	0	0	0	110.6	S639 Q643 L665 N679 A680 K685 N686 L687	S639-C683 PolarHBondContact O-SG 2.94Å; Q643-C683 VanDerWaalsContact CA-SG 3.58Å; Q643-C683 PolarHBondContact N-SG 2.95Å; Q643-C683 VanDerWaalsContact N-SG 3.38Å; L665-C683 HydrophobicContact CD1-CB 3.58Å; L665-C683 HydrophobicContact CD2-CB 3.74Å; L665-C683 HydrophobicContact CG-CB 4.28Å; N679-C683 PolarHBondContact O-N 2.78Å; N679-C683 PolarHBondContact O-SG 3.04Å; A680-C683 PolarHBondContact O-N 2.85Å; C683-K685 VanDerWaalsContact C-N 3.3Å; C683-K685 PolarHBondContact O-N 2.81Å; C683-N686 PolarHBondContact O-N 2.83Å; C683-N686 VanDerWaalsContact O-N 3.11Å; C683-L687 HydrophobicContact CB-CD1 4.38Å; C683-L687 WeakPolarHBondContact O-CB 3.4Å; C683-L687 WeakPolarHBondContact O-CD1 3.49Å; C683-L687 VanDerWaalsContact O-CG 3.27Å; C683-L687 WeakPolarHBondContact O-CG 3.48Å; C683-L687 PolarHBondContact O-N 2.83Å
684	L	98.1	Very high	93.6	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	16%	0.161	C	C	.	.	H	α-helix	trans	-64.1	-34.5	-179.1	-67.8	167.2	0	0	0	112.1	L665 I666 L669 A680 C681 S688 V700 I709	L665-L684 HydrophobicContact CB-CD1 4.47Å; L665-L684 HydrophobicContact CB-CD2 4.07Å; L665-L684 HydrophobicContact CB-CG 4.18Å; L665-L684 HydrophobicContact CD1-CD2 4.43Å; I666-L684 HydrophobicContact CD1-CD2 4.38Å; I666-L684 HydrophobicContact CG1-CD1 3.94Å; I666-L684 HydrophobicContact CG1-CD2 3.98Å; L669-L684 HydrophobicContact CD1-CD1 3.97Å; L669-L684 HydrophobicContact CD2-CD1 4.12Å; L669-L684 HydrophobicContact CG-CD1 4.25Å; A680-L684 VanDerWaalsContact O-CG 3.26Å; A680-L684 WeakPolarHBondContact O-CG 3.46Å; A680-L684 PolarHBondContact O-N 2.91Å; C681-L684 PolarHBondContact O-N 2.9Å; L684-S688 VanDerWaalsContact O-CB 3.31Å; L684-S688 WeakPolarHBondContact O-CB 3.39Å; L684-S688 PolarHBondContact O-N 3.39Å; L684-S688 VanDerWaalsContact O-N 3.09Å; L684-S688 PolarHBondContact O-OG 3.45Å; L684-V700 HydrophobicContact CD2-CG2 3.84Å; L684-I709 HydrophobicContact CD1-CD1 4.35Å
685	K	96.9	Very high	93.5	Very high	45 Å²	45	34.9 Å²	34.9	20%	0.196	16%	0.163	C	C	.	.	H	α-helix	trans	-58.9	-52.2	168.2	176.4	-166.2	71.4	-172.2	0	111.2	C681 A682 C683 S688 F689 E724 A727 A728 N731	C681-K685 WeakPolarHBondContact O-CB 3.35Å; C681-K685 PolarHBondContact O-N 2.86Å; A682-K685 WeakPolarHBondContact O-CB 3.06Å; A682-K685 PolarHBondContact O-N 2.94Å; C683-K685 VanDerWaalsContact C-N 3.3Å; C683-K685 PolarHBondContact O-N 2.81Å; K685-S688 PolarHBondContact O-N 2.84Å; K685-S688 PolarHBondContact O-OG 3.34Å; K685-S688 VanDerWaalsContact O-OG 3.14Å; K685-F689 PolarHBondContact O-N 2.76Å; K685-F689 VanDerWaalsContact O-N 3.17Å; K685-E724 WeakPolarHBondContact CD-OE2 3.35Å; K685-E724 WeakPolarHBondContact CE-OE2 3.18Å; K685-E724 IonicContact NZ-OE1 3Å; K685-E724 IonicContact NZ-OE2 3.62Å; K685-E724 PolarHBondContact NZ-OE2 2.85Å; K685-A727 HydrophobicContact CD-CB 3.54Å; K685-A727 HydrophobicContact CG-CB 3.93Å; K685-A728 HydrophobicContact CB-CB 4.17Å; K685-N731 PolarHBondContact O-ND2 3.5Å
686	N	97.3	Very high	93.6	Very high	8 Å²	8	26.7 Å²	26.7	4%	0.043	13%	0.132	C	C	.	.	H	α-helix	trans	-63.9	-45	-178.3	-67.6	2.4	0	0	0	111.9	Q643 K653 A682 C683 S688 F689	Q643-N686 PolarHBondContact O-ND2 3.1Å; K653-N686 VanDerWaalsContact CE-O 3.23Å; K653-N686 WeakPolarHBondContact CE-O 3.5Å; A682-N686 PolarHBondContact O-N 3.31Å; A682-N686 PolarHBondContact O-OD1 2.85Å; C683-N686 PolarHBondContact O-N 2.83Å; C683-N686 VanDerWaalsContact O-N 3.11Å; N686-S688 VanDerWaalsContact C-N 3.28Å; N686-S688 PolarHBondContact O-N 2.85Å; N686-F689 WeakPolarHBondContact O-CB 3.47Å; N686-F689 PolarHBondContact O-N 2.88Å
687	L	96.3	Very high	93.5	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-62.9	-30.1	177.7	-72.8	161	0	0	0	113.5	T646 K653 T656 I662 L665 C683 N696	T646-L687 HydrophobicContact CG2-CD2 3.86Å; T646-L687 HydrophobicContact CG2-CG 4.13Å; K653-L687 HydrophobicContact CB-CD2 3.88Å; K653-L687 HydrophobicContact CG-CD2 4Å; T656-L687 HydrophobicContact CG2-CD1 4.04Å; T656-L687 HydrophobicContact CG2-CD2 3.77Å; I662-L687 HydrophobicContact CG1-CD1 4.1Å; L665-L687 HydrophobicContact CD1-CD1 3.41Å; L665-L687 VanDerWaalsContact CD1-CD1 3.41Å; C683-L687 HydrophobicContact CB-CD1 4.38Å; C683-L687 WeakPolarHBondContact O-CB 3.4Å; C683-L687 WeakPolarHBondContact O-CD1 3.49Å; C683-L687 VanDerWaalsContact O-CG 3.27Å; C683-L687 WeakPolarHBondContact O-CG 3.48Å; C683-L687 PolarHBondContact O-N 2.83Å; L687-N696 VanDerWaalsContact O-CB 3.24Å; L687-N696 WeakPolarHBondContact O-CB 3.29Å; L687-N696 PolarHBondContact O-ND2 3.32Å; L687-N696 VanDerWaalsContact O-ND2 3.11Å
688	S	95.8	Very high	93.3	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.007	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	1	177.4	58.2	0	0	0	0	114.1	L684 K685 N686 K697 N731	L684-S688 VanDerWaalsContact O-CB 3.31Å; L684-S688 WeakPolarHBondContact O-CB 3.39Å; L684-S688 PolarHBondContact O-N 3.39Å; L684-S688 VanDerWaalsContact O-N 3.09Å; L684-S688 PolarHBondContact O-OG 3.45Å; K685-S688 PolarHBondContact O-N 2.84Å; K685-S688 PolarHBondContact O-OG 3.34Å; K685-S688 VanDerWaalsContact O-OG 3.14Å; N686-S688 VanDerWaalsContact C-N 3.28Å; N686-S688 PolarHBondContact O-N 2.85Å; S688-K697 WeakPolarHBondContact O-CE 3.32Å; S688-N731 VanDerWaalsContact OG-CB 3.3Å; S688-N731 WeakPolarHBondContact OG-CB 3.41Å
689	F	93.1	Very high	93.2	Very high	48 Å²	48	26.3 Å²	26.3	21%	0.211	14%	0.136	C	C	.	.			trans	-80.4	134.1	179.1	-175.5	-86.2	0	0	0	111.7	K685 N686 N693 M1112	K685-F689 PolarHBondContact O-N 2.76Å; K685-F689 VanDerWaalsContact O-N 3.17Å; N686-F689 WeakPolarHBondContact O-CB 3.47Å; N686-F689 PolarHBondContact O-N 2.88Å; F689-N693 WeakPolarHBondContact O-CB 3.33Å; F689-N693 PolarHBondContact O-ND2 2.85Å; F689-M1112 HydrophobicContact CE2-CB 4.02Å; F689-M1112 HydrophobicContact CE2-CE 4.35Å; F689-M1112 HydrophobicContact CZ-CB 4.48Å; F689-M1112 WeakPolarHBondContact CZ-O 3.41Å
690	G	83.9	Confident	93.1	Very high	4 Å²	4	25.1 Å²	25.1	4%	0.041	13%	0.13	C	C	.	.	S	Bend	trans	106.7	179.9	-174.9	0	0	0	0	0	112.7	E692 K697	G690-E692 VanDerWaalsContact CA-OE2 3.26Å; G690-E692 WeakPolarHBondContact CA-OE2 3.22Å; G690-K697 WeakPolarHBondContact O-CE 3.32Å; G690-K697 PolarHBondContact O-NZ 2.89Å
691	K	81.6	Confident	92.8	Very high	144 Å²	144	27.9 Å²	27.9	63%	0.626	14%	0.143	S	C	*	.	S	Bend	trans	-107.7	-34.2	168.1	-172.5	-176.1	176.2	-177.4	0	111	N693 D694	K691-N693 PolarHBondContact O-N 3.41Å; K691-N693 VanDerWaalsContact O-N 3.15Å; K691-D694 WeakPolarHBondContact CG-OD2 3.47Å; K691-D694 VanDerWaalsContact O-CB 3.25Å; K691-D694 WeakPolarHBondContact O-CB 3.38Å; K691-D694 PolarHBondContact O-N 2.76Å
692	E	84.8	Confident	92.5	Very high	97 Å²	97	34.7 Å²	34.7	45%	0.453	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-30	166.9	72.7	-69.2	176.1	0	0	112.6	N650 G690 D694	N650-E692 VanDerWaalsContact ND2-CG 3.29Å; N650-E692 WeakPolarHBondContact ND2-CG 3.36Å; N650-E692 PolarHBondContact ND2-OE1 3.36Å; G690-E692 VanDerWaalsContact CA-OE2 3.26Å; G690-E692 WeakPolarHBondContact CA-OE2 3.22Å; E692-D694 VanDerWaalsContact C-N 3.32Å; E692-D694 PolarHBondContact O-N 2.93Å
693	N	88.8	Confident	92.4	Very high	7 Å²	7	36 Å²	36	4%	0.037	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	16	174.9	-69	-71.7	0	0	0	114.4	N650 K653 F689 K691 A695 N696 K697	N650-N693 PolarHBondContact OD1-ND2 2.65Å; K653-N693 WeakPolarHBondContact CD-OD1 3.4Å; F689-N693 WeakPolarHBondContact O-CB 3.33Å; F689-N693 PolarHBondContact O-ND2 2.85Å; K691-N693 PolarHBondContact O-N 3.41Å; K691-N693 VanDerWaalsContact O-N 3.15Å; N693-A695 PolarHBondContact O-N 2.95Å; N693-N696 WeakPolarHBondContact O-CB 3.36Å; N693-N696 PolarHBondContact O-N 2.95Å; N693-N696 PolarHBondContact OD1-ND2 3.25Å; N693-K697 PolarHBondContact O-N 2.9Å
694	D	89.6	Confident	92.2	Very high	40 Å²	40	38.8 Å²	38.8	21%	0.214	20%	0.201	C	C	.	.	H	α-helix	trans	-58.5	-32.5	177.8	-80.7	-10.9	0	0	0	112.6	K691 E692 N696 K697 L698	K691-D694 WeakPolarHBondContact CG-OD2 3.47Å; K691-D694 VanDerWaalsContact O-CB 3.25Å; K691-D694 WeakPolarHBondContact O-CB 3.38Å; K691-D694 PolarHBondContact O-N 2.76Å; E692-D694 VanDerWaalsContact C-N 3.32Å; E692-D694 PolarHBondContact O-N 2.93Å; D694-N696 VanDerWaalsContact C-N 3.27Å; D694-N696 PolarHBondContact O-N 2.6Å; D694-K697 WeakPolarHBondContact O-CB 3.3Å; D694-K697 PolarHBondContact O-N 3.13Å; D694-K697 VanDerWaalsContact O-N 3.14Å; D694-K697 WeakPolarHBondContact OD1-CD 3.48Å; D694-K697 WeakPolarHBondContact OD1-CE 3.33Å; D694-K697 IonicContact OD1-NZ 2.73Å; D694-K697 PolarHBondContact OD1-NZ 3.44Å; D694-L698 PolarHBondContact O-N 2.85Å
695	A	91.4	Very high	92	Very high	49 Å²	49	38.7 Å²	38.7	41%	0.405	20%	0.2	S	C	.	.	H	α-helix	trans	-62.7	-31.7	172.7	0	0	0	0	0	113	N693 L698 A699	N693-A695 PolarHBondContact O-N 2.95Å; A695-L698 PolarHBondContact O-N 3.04Å; A695-A699 PolarHBondContact O-N 3.12Å
696	N	95.5	Very high	92	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-74.7	-35	174.7	-56.8	-16.1	0	0	0	110.8	R657 I662 L687 N693 D694 L698 A699 V700	R657-N696 WeakPolarHBondContact CD-OD1 3.46Å; I662-N696 HydrophobicContact CD1-CB 4.02Å; L687-N696 VanDerWaalsContact O-CB 3.24Å; L687-N696 WeakPolarHBondContact O-CB 3.29Å; L687-N696 PolarHBondContact O-ND2 3.32Å; L687-N696 VanDerWaalsContact O-ND2 3.11Å; N693-N696 WeakPolarHBondContact O-CB 3.36Å; N693-N696 PolarHBondContact O-N 2.95Å; N693-N696 PolarHBondContact OD1-ND2 3.25Å; D694-N696 VanDerWaalsContact C-N 3.27Å; D694-N696 PolarHBondContact O-N 2.6Å; N696-L698 VanDerWaalsContact C-N 3.3Å; N696-L698 PolarHBondContact O-N 2.8Å; N696-A699 PolarHBondContact O-N 2.71Å; N696-V700 VanDerWaalsContact O-CG2 3.31Å; N696-V700 WeakPolarHBondContact O-CG2 3.33Å; N696-V700 PolarHBondContact O-N 3.12Å
697	K	94.7	Very high	91.9	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.009	21%	0.21	C	C	.	.	H	α-helix	trans	-62.1	-40.8	172.3	-57	176.5	-169.2	160.9	0	110.8	S688 G690 N693 D694 V700 M701 L732 S734 A735 L738	S688-K697 WeakPolarHBondContact O-CE 3.32Å; G690-K697 WeakPolarHBondContact O-CE 3.32Å; G690-K697 PolarHBondContact O-NZ 2.89Å; N693-K697 PolarHBondContact O-N 2.9Å; D694-K697 WeakPolarHBondContact O-CB 3.3Å; D694-K697 PolarHBondContact O-N 3.13Å; D694-K697 VanDerWaalsContact O-N 3.14Å; D694-K697 WeakPolarHBondContact OD1-CD 3.48Å; D694-K697 WeakPolarHBondContact OD1-CE 3.33Å; D694-K697 IonicContact OD1-NZ 2.73Å; D694-K697 PolarHBondContact OD1-NZ 3.44Å; K697-V700 PolarHBondContact O-N 3.4Å; K697-M701 PolarHBondContact O-N 2.75Å; K697-M701 VanDerWaalsContact O-N 3.08Å; K697-L732 HydrophobicContact CB-CD2 3.93Å; K697-L732 HydrophobicContact CG-CD2 4.11Å; K697-S734 PolarHBondContact NZ-OG 2.83Å; K697-A735 HydrophobicContact CD-CB 3.67Å; K697-L738 HydrophobicContact CB-CD1 4.01Å; K697-L738 HydrophobicContact CB-CD2 4.34Å
698	L	90.9	Very high	92	Very high	64 Å²	64	42.2 Å²	42.2	34%	0.335	21%	0.213	S	C	.	.	H	α-helix	trans	-61.4	-49.8	173.8	-177.8	61.6	0	0	0	111.5	D694 A695 N696 V700 M701 E702	D694-L698 PolarHBondContact O-N 2.85Å; A695-L698 PolarHBondContact O-N 3.04Å; N696-L698 VanDerWaalsContact C-N 3.3Å; N696-L698 PolarHBondContact O-N 2.8Å; L698-V700 PolarHBondContact O-N 3.39Å; L698-M701 HydrophobicContact CD1-CE 3.75Å; L698-M701 WeakPolarHBondContact O-CA 3.15Å; L698-M701 VanDerWaalsContact O-CB 3.3Å; L698-M701 WeakPolarHBondContact O-CB 3.47Å; L698-M701 PolarHBondContact O-N 2.79Å; L698-E702 HydrophobicContact CD1-CG 4.42Å; L698-E702 HydrophobicContact CG-CG 4.43Å; L698-E702 WeakPolarHBondContact O-CG 3.32Å; L698-E702 PolarHBondContact O-N 3.14Å
699	A	94.4	Very high	92.1	Very high	16 Å²	16	42.2 Å²	42.2	13%	0.132	21%	0.213	C	C	.	.	H	α-helix	trans	-59.3	-32.5	176.1	0	0	0	0	0	113.3	R657 I662 A695 N696 A703	R657-A699 HydrophobicContact CG-CB 4.26Å; I662-A699 HydrophobicContact CD1-CB 3.92Å; I662-A699 HydrophobicContact CG2-CB 4.27Å; A695-A699 PolarHBondContact O-N 3.12Å; N696-A699 PolarHBondContact O-N 2.71Å; A699-A703 WeakPolarHBondContact O-CB 3.48Å; A699-A703 PolarHBondContact O-N 2.87Å
700	V	94.9	Very high	92.2	Very high	1 Å²	1	40 Å²	40	1%	0.006	20%	0.203	C	C	.	.	H	α-helix	trans	-69.1	-31.8	172.1	171.7	0	0	0	0	112.2	I662 I666 L684 N696 K697 L698 G705 I709 L732	I662-V700 HydrophobicContact CG2-CB 4.41Å; I662-V700 HydrophobicContact CG2-CG2 3.62Å; I666-V700 HydrophobicContact CD1-CB 4.41Å; I666-V700 HydrophobicContact CD1-CG1 4.22Å; I666-V700 HydrophobicContact CD1-CG2 4.42Å; L684-V700 HydrophobicContact CD2-CG2 3.84Å; N696-V700 VanDerWaalsContact O-CG2 3.31Å; N696-V700 WeakPolarHBondContact O-CG2 3.33Å; N696-V700 PolarHBondContact O-N 3.12Å; K697-V700 PolarHBondContact O-N 3.4Å; L698-V700 PolarHBondContact O-N 3.39Å; V700-G705 WeakPolarHBondContact O-CA 3.48Å; V700-G705 PolarHBondContact O-N 2.77Å; V700-I709 HydrophobicContact CG1-CD1 4.4Å; V700-L732 HydrophobicContact CB-CD2 3.95Å; V700-L732 HydrophobicContact CG1-CD1 3.85Å; V700-L732 HydrophobicContact CG1-CD2 3.76Å; V700-L732 HydrophobicContact CG1-CG 4.48Å; V700-L732 HydrophobicContact CG2-CD2 4.5Å
701	M	91.5	Very high	92.8	Very high	58 Å²	58	43.1 Å²	43.1	29%	0.286	22%	0.217	S	C	.	.	H	α-helix	trans	-73.1	-46.7	174.4	-170.6	-175.3	80.8	0	0	111.7	K697 L698 A703 D704 L738 V741	K697-M701 PolarHBondContact O-N 2.75Å; K697-M701 VanDerWaalsContact O-N 3.08Å; L698-M701 HydrophobicContact CD1-CE 3.75Å; L698-M701 WeakPolarHBondContact O-CA 3.15Å; L698-M701 VanDerWaalsContact O-CB 3.3Å; L698-M701 WeakPolarHBondContact O-CB 3.47Å; L698-M701 PolarHBondContact O-N 2.79Å; M701-A703 VanDerWaalsContact C-N 3.27Å; M701-A703 PolarHBondContact O-N 2.78Å; M701-D704 PolarHBondContact O-N 3.42Å; M701-L738 HydrophobicContact CB-CD2 4.26Å; M701-L738 HydrophobicContact CB-CG 4.23Å; M701-L738 HydrophobicContact CG-CG 4.44Å; M701-L738 HydrophobicContact SD-CG 4.09Å; M701-V741 HydrophobicContact CG-CG2 4.45Å; M701-V741 HydrophobicContact SD-CG2 4.12Å
702	E	91.4	Very high	93.4	Very high	142 Å²	142	36.5 Å²	36.5	66%	0.664	19%	0.188	S	C	*	.	H	α-helix	trans	-59.3	-37.1	179.3	-69.4	172.3	160.9	0	0	112.3	L698 D704	L698-E702 HydrophobicContact CD1-CG 4.42Å; L698-E702 HydrophobicContact CG-CG 4.43Å; L698-E702 WeakPolarHBondContact O-CG 3.32Å; L698-E702 PolarHBondContact O-N 3.14Å; E702-D704 PolarHBondContact O-N 3.42Å
703	A	92.5	Very high	93.9	Very high	27 Å²	27	32 Å²	32	22%	0.223	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	17.6	175.6	0	0	0	0	0	114.5	P663 I666 A699 M701 G705	P663-A703 HydrophobicContact CB-CB 4.38Å; P663-A703 HydrophobicContact CG-CB 4.19Å; I666-A703 HydrophobicContact CD1-CB 3.56Å; I666-A703 WeakPolarHBondContact CG2-O 3.11Å; A699-A703 WeakPolarHBondContact O-CB 3.48Å; A699-A703 PolarHBondContact O-N 2.87Å; M701-A703 VanDerWaalsContact C-N 3.27Å; M701-A703 PolarHBondContact O-N 2.78Å; A703-G705 PolarHBondContact O-N 3.47Å; A703-G705 VanDerWaalsContact O-N 3.13Å
704	D	92.6	Very high	94.2	Very high	59 Å²	59	36.9 Å²	36.9	32%	0.316	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.5	20.2	179.3	-176.1	45.9	0	0	0	113.7	M701 E702 V706 R707 L708	M701-D704 PolarHBondContact O-N 3.42Å; E702-D704 PolarHBondContact O-N 3.42Å; D704-V706 PolarHBondContact O-N 3.36Å; D704-R707 VanDerWaalsContact CG-NE 3.32Å; D704-R707 PolarHBondContact O-N 3.43Å; D704-R707 VanDerWaalsContact OD1-CB 3.27Å; D704-R707 WeakPolarHBondContact OD1-CB 3.45Å; D704-R707 WeakPolarHBondContact OD1-CD 3.43Å; D704-R707 IonicContact OD1-CZ 3.09Å; D704-R707 IonicContact OD1-NE 3.66Å; D704-R707 PolarHBondContact OD1-NE 2.91Å; D704-R707 IonicContact OD1-NH2 2.65Å; D704-R707 IonicContact OD2-CZ 3.54Å; D704-R707 VanDerWaalsContact OD2-CZ 3.24Å; D704-R707 IonicContact OD2-NE 2.76Å; D704-R707 PolarHBondContact OD2-NE 3.32Å; D704-R707 IonicContact OD2-NH2 3.08Å; D704-R707 PolarHBondContact OD2-NH2 2.81Å; D704-L708 HydrophobicContact CB-CD1 4.49Å; D704-L708 WeakPolarHBondContact O-CG 3.29Å; D704-L708 PolarHBondContact O-N 2.77Å
705	G	95	Very high	94.4	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-64.5	-39.4	-173.7	0	0	0	0	0	113.6	V700 A703 R707 L708 I709	V700-G705 WeakPolarHBondContact O-CA 3.48Å; V700-G705 PolarHBondContact O-N 2.77Å; A703-G705 PolarHBondContact O-N 3.47Å; A703-G705 VanDerWaalsContact O-N 3.13Å; G705-R707 VanDerWaalsContact C-N 3.3Å; G705-R707 PolarHBondContact O-N 3.27Å; G705-L708 PolarHBondContact O-N 3.49Å; G705-L708 VanDerWaalsContact O-N 3.17Å; G705-I709 WeakPolarHBondContact O-CB 3.32Å; G705-I709 WeakPolarHBondContact O-CD1 3.41Å; G705-I709 WeakPolarHBondContact O-CG1 3.45Å; G705-I709 PolarHBondContact O-N 3.03Å
706	V	96.3	Very high	94.5	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.012	18%	0.18	C	C	.	.	H	α-helix	trans	-55.8	-45.8	178.6	176.3	0	0	0	0	111.6	D704 A710 L729 L738 V741 I742	D704-V706 PolarHBondContact O-N 3.36Å; V706-A710 WeakPolarHBondContact O-CB 3.48Å; V706-A710 PolarHBondContact O-N 3.15Å; V706-A710 VanDerWaalsContact O-N 3.09Å; V706-L729 HydrophobicContact CG1-CD2 4.33Å; V706-L738 HydrophobicContact CG2-CD2 3.85Å; V706-V741 HydrophobicContact CB-CG1 4Å; V706-V741 HydrophobicContact CG1-CB 4.3Å; V706-V741 HydrophobicContact CG1-CG1 3.81Å; V706-I742 HydrophobicContact CG1-CB 4.44Å; V706-I742 HydrophobicContact CG1-CG1 3.56Å
707	R	95.9	Very high	94.2	Very high	113 Å²	113	45.4 Å²	45.4	43%	0.426	22%	0.221	S	C	.	.	H	α-helix	trans	-70.2	-36.4	-179.7	-166.7	-171.3	65.4	81.8	1	111.7	D704 G705 A710 E711	D704-R707 VanDerWaalsContact CG-NE 3.32Å; D704-R707 PolarHBondContact O-N 3.43Å; D704-R707 VanDerWaalsContact OD1-CB 3.27Å; D704-R707 WeakPolarHBondContact OD1-CB 3.45Å; D704-R707 WeakPolarHBondContact OD1-CD 3.43Å; D704-R707 IonicContact OD1-CZ 3.09Å; D704-R707 IonicContact OD1-NE 3.66Å; D704-R707 PolarHBondContact OD1-NE 2.91Å; D704-R707 IonicContact OD1-NH2 2.65Å; D704-R707 IonicContact OD2-CZ 3.54Å; D704-R707 VanDerWaalsContact OD2-CZ 3.24Å; D704-R707 IonicContact OD2-NE 2.76Å; D704-R707 PolarHBondContact OD2-NE 3.32Å; D704-R707 IonicContact OD2-NH2 3.08Å; D704-R707 PolarHBondContact OD2-NH2 2.81Å; G705-R707 VanDerWaalsContact C-N 3.3Å; G705-R707 PolarHBondContact O-N 3.27Å; R707-A710 WeakPolarHBondContact O-CB 3.19Å; R707-A710 PolarHBondContact O-N 2.8Å; R707-E711 PolarHBondContact O-N 3.31Å
708	L	96.9	Very high	94.1	Very high	12 Å²	12	48.1 Å²	48.1	6%	0.063	24%	0.235	C	C	.	.	H	α-helix	trans	-74.6	-37.5	179.1	-69.4	165.1	0	0	0	112.7	I666 L669 R670 D704 G705 A710 E711 V712	I666-L708 HydrophobicContact CG2-CB 4.45Å; I666-L708 HydrophobicContact CG2-CD1 3.43Å; I666-L708 VanDerWaalsContact CG2-CD1 3.43Å; L669-L708 HydrophobicContact CD1-CB 4.04Å; R670-L708 HydrophobicContact CG-CD2 4.43Å; D704-L708 HydrophobicContact CB-CD1 4.49Å; D704-L708 WeakPolarHBondContact O-CG 3.29Å; D704-L708 PolarHBondContact O-N 2.77Å; G705-L708 PolarHBondContact O-N 3.49Å; G705-L708 VanDerWaalsContact O-N 3.17Å; L708-A710 VanDerWaalsContact C-N 3.31Å; L708-E711 PolarHBondContact O-N 3.38Å; L708-V712 WeakPolarHBondContact O-CG2 3.22Å; L708-V712 PolarHBondContact O-N 3.41Å
709	I	98.1	Very high	94	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-64	-39.5	171	-62	161.7	0	0	0	110	L669 L684 V700 G705 V712 L713 A725 A728 L729 L732	L669-I709 HydrophobicContact CD1-CG1 3.65Å; L684-I709 HydrophobicContact CD1-CD1 4.35Å; V700-I709 HydrophobicContact CG1-CD1 4.4Å; G705-I709 WeakPolarHBondContact O-CB 3.32Å; G705-I709 WeakPolarHBondContact O-CD1 3.41Å; G705-I709 WeakPolarHBondContact O-CG1 3.45Å; G705-I709 PolarHBondContact O-N 3.03Å; I709-V712 PolarHBondContact O-N 2.89Å; I709-L713 PolarHBondContact O-N 3.21Å; I709-A725 HydrophobicContact CG2-CB 3.8Å; I709-A725 VanDerWaalsContact CG2-O 3.31Å; I709-A725 WeakPolarHBondContact CG2-O 3.36Å; I709-A728 HydrophobicContact CD1-CB 4.31Å; I709-L729 HydrophobicContact CB-CD2 4.22Å; I709-L729 HydrophobicContact CB-CG 4.49Å; I709-L729 HydrophobicContact CG2-CD1 4.4Å; I709-L729 HydrophobicContact CG2-CD2 4.01Å; I709-L729 HydrophobicContact CG2-CG 3.76Å; I709-L732 HydrophobicContact CD1-CD1 3.75Å
710	A	96.4	Very high	93.9	Very high	1 Å²	1	49 Å²	49	1%	0.008	25%	0.25	C	C	.	.	H	α-helix	trans	-62.8	-39.6	171.9	0	0	0	0	0	112.2	V706 R707 L708 L713 R714 A746 I749	V706-A710 WeakPolarHBondContact O-CB 3.48Å; V706-A710 PolarHBondContact O-N 3.15Å; V706-A710 VanDerWaalsContact O-N 3.09Å; R707-A710 WeakPolarHBondContact O-CB 3.19Å; R707-A710 PolarHBondContact O-N 2.8Å; L708-A710 VanDerWaalsContact C-N 3.31Å; A710-L713 WeakPolarHBondContact O-CB 3.4Å; A710-L713 PolarHBondContact O-N 3.28Å; A710-R714 PolarHBondContact O-N 3.02Å; A710-A746 HydrophobicContact CB-CB 4Å; A710-I749 HydrophobicContact CB-CD1 3.78Å; A710-I749 WeakPolarHBondContact O-CD1 3.2Å
711	E	95.3	Very high	93.9	Very high	71 Å²	71	48.9 Å²	48.9	33%	0.332	25%	0.249	S	C	.	.	H	α-helix	trans	-66.9	-38.1	175.1	-168.6	59.1	-156.6	0	0	112.8	R707 L708 L713 R714 T715	R707-E711 PolarHBondContact O-N 3.31Å; L708-E711 PolarHBondContact O-N 3.38Å; E711-L713 VanDerWaalsContact C-N 3.35Å; E711-L713 PolarHBondContact O-N 3.4Å; E711-R714 WeakPolarHBondContact O-CB 3.29Å; E711-R714 PolarHBondContact O-N 3.46Å; E711-R714 VanDerWaalsContact O-N 3.17Å; E711-R714 WeakPolarHBondContact OE2-CD 3.23Å; E711-R714 IonicContact OE2-CZ 2.67Å; E711-R714 IonicContact OE2-NE 2.7Å; E711-R714 IonicContact OE2-NH1 3.89Å; E711-R714 PolarHBondContact OE2-NH1 3.21Å; E711-T715 HydrophobicContact CG-CG2 4.25Å; E711-T715 WeakPolarHBondContact O-CB 3.29Å; E711-T715 WeakPolarHBondContact O-CG2 3.38Å; E711-T715 PolarHBondContact O-N 2.92Å; E711-T715 PolarHBondContact O-OG1 2.83Å; E711-T715 WeakPolarHBondContact OE1-CG2 3.43Å
712	V	95.6	Very high	94.1	Very high	5 Å²	5	47.5 Å²	47.5	3%	0.03	24%	0.242	C	C	.	.	H	α-helix	trans	-59.2	-46.3	170.9	170.6	0	0	0	0	110.6	L669 L708 I709 R714 T715 T716 V721 A725	L669-V712 HydrophobicContact CB-CG2 3.9Å; L669-V712 HydrophobicContact CD2-CG2 4.4Å; L669-V712 WeakPolarHBondContact O-CG2 3.48Å; L708-V712 WeakPolarHBondContact O-CG2 3.22Å; L708-V712 PolarHBondContact O-N 3.41Å; I709-V712 PolarHBondContact O-N 2.89Å; V712-R714 VanDerWaalsContact C-N 3.3Å; V712-R714 PolarHBondContact O-N 3.28Å; V712-T715 PolarHBondContact O-N 2.84Å; V712-T716 HydrophobicContact CG1-CG2 4.39Å; V712-T716 WeakPolarHBondContact O-CB 3.41Å; V712-T716 VanDerWaalsContact O-CG2 3.23Å; V712-T716 WeakPolarHBondContact O-CG2 3.41Å; V712-T716 PolarHBondContact O-N 2.91Å; V712-V721 HydrophobicContact CG1-CG1 3.44Å; V712-V721 VanDerWaalsContact CG1-CG1 3.44Å; V712-A725 HydrophobicContact CG1-CB 4.39Å
713	L	95.1	Very high	94.3	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-60	-37.3	174.5	-79.9	161.7	0	0	0	112.8	I709 A710 E711 K722 A725 A726 L729 I749 L750 Q753	I709-L713 PolarHBondContact O-N 3.21Å; A710-L713 WeakPolarHBondContact O-CB 3.4Å; A710-L713 PolarHBondContact O-N 3.28Å; E711-L713 VanDerWaalsContact C-N 3.35Å; E711-L713 PolarHBondContact O-N 3.4Å; L713-K722 HydrophobicContact CD2-CB 3.9Å; L713-K722 HydrophobicContact CD2-CG 4.19Å; L713-K722 WeakPolarHBondContact CD2-O 2.96Å; L713-K722 PolarHBondContact O-NZ 3.28Å; L713-A725 HydrophobicContact CD1-CB 4.2Å; L713-A725 HydrophobicContact CD2-CB 3.99Å; L713-A725 HydrophobicContact CG-CB 3.72Å; L713-A726 HydrophobicContact CD2-CB 4.33Å; L713-L729 HydrophobicContact CD1-CD1 3.45Å; L713-L729 VanDerWaalsContact CD1-CD1 3.45Å; L713-L729 HydrophobicContact CD1-CG 4.34Å; L713-I749 HydrophobicContact CB-CG2 4.33Å; L713-L750 HydrophobicContact CD1-CD2 3.97Å; L713-L750 HydrophobicContact CD2-CD2 4.47Å; L713-Q753 PolarHBondContact O-OE1 3.47Å
714	R	94.8	Very high	94.4	Very high	109 Å²	109	43.6 Å²	43.6	41%	0.411	22%	0.219	S	C	.	.	H	α-helix	trans	-68.1	-42.6	177.8	-179	179	-74.8	102.2	1.5	112.5	A710 E711 V712 I749 Q753	A710-R714 PolarHBondContact O-N 3.02Å; E711-R714 WeakPolarHBondContact O-CB 3.29Å; E711-R714 PolarHBondContact O-N 3.46Å; E711-R714 VanDerWaalsContact O-N 3.17Å; E711-R714 WeakPolarHBondContact OE2-CD 3.23Å; E711-R714 IonicContact OE2-CZ 2.67Å; E711-R714 IonicContact OE2-NE 2.7Å; E711-R714 IonicContact OE2-NH1 3.89Å; E711-R714 PolarHBondContact OE2-NH1 3.21Å; V712-R714 VanDerWaalsContact C-N 3.3Å; V712-R714 PolarHBondContact O-N 3.28Å; R714-I749 HydrophobicContact CB-CD1 4.23Å; R714-I749 HydrophobicContact CB-CG2 4.26Å; R714-I749 VanDerWaalsContact NH2-CD1 3.33Å; R714-Q753 PolarHBondContact O-NE2 3.15Å
715	T	93.3	Very high	94.7	Very high	71 Å²	71	40.8 Å²	40.8	44%	0.436	20%	0.204	S	C	.	.	H	α-helix	trans	-98.3	-36.9	-165.2	53.3	0	0	0	0	114.6	E711 V712	E711-T715 HydrophobicContact CG-CG2 4.25Å; E711-T715 WeakPolarHBondContact O-CB 3.29Å; E711-T715 WeakPolarHBondContact O-CG2 3.38Å; E711-T715 PolarHBondContact O-N 2.92Å; E711-T715 PolarHBondContact O-OG1 2.83Å; E711-T715 WeakPolarHBondContact OE1-CG2 3.43Å; V712-T715 PolarHBondContact O-N 2.84Å
716	T	92.7	Very high	94.8	Very high	13 Å²	13	40.8 Å²	40.8	8%	0.08	20%	0.204	C	C	.	.			trans	-69.3	153.8	-172.9	-160.4	0	0	0	0	112.5	V712 D718 V721 K722	V712-T716 HydrophobicContact CG1-CG2 4.39Å; V712-T716 WeakPolarHBondContact O-CB 3.41Å; V712-T716 VanDerWaalsContact O-CG2 3.23Å; V712-T716 WeakPolarHBondContact O-CG2 3.41Å; V712-T716 PolarHBondContact O-N 2.91Å; T716-D718 PolarHBondContact OG1-N 3.3Å; T716-V721 HydrophobicContact CG2-CB 4.07Å; T716-V721 HydrophobicContact CG2-CG1 3.96Å; T716-K722 HydrophobicContact CG2-CD 4.33Å; T716-K722 HydrophobicContact CG2-CG 3.45Å; T716-K722 VanDerWaalsContact CG2-CG 3.45Å; T716-K722 WeakPolarHBondContact O-CE 3.29Å; T716-K722 PolarHBondContact O-NZ 2.92Å
717	H	90	Very high	94.8	Very high	186 Å²	186	41.2 Å²	41.2	86%	0.861	21%	0.208	S	C	*	.			trans	-109.4	-7.5	172	-60.1	-22.6	0	0	0	112.3	A719	H717-A719 PolarHBondContact O-N 3Å
718	D	91.7	Very high	94.9	Very high	58 Å²	58	35.9 Å²	35.9	31%	0.31	19%	0.187	S	C	.	.			trans	-79.4	118.3	176.2	-171.6	-62	0	0	0	110.4	P674 T716 S720 V721 K722	P674-D718 HydrophobicContact CB-CB 4.19Å; T716-D718 PolarHBondContact OG1-N 3.3Å; D718-S720 VanDerWaalsContact C-N 3.28Å; D718-S720 PolarHBondContact O-N 3.18Å; D718-S720 WeakPolarHBondContact OD1-CA 3.33Å; D718-S720 WeakPolarHBondContact OD1-CB 3.25Å; D718-S720 PolarHBondContact OD1-N 3.07Å; D718-S720 PolarHBondContact OD1-OG 3.2Å; D718-V721 HydrophobicContact CB-CB 4.04Å; D718-V721 HydrophobicContact CB-CG2 3.7Å; D718-V721 PolarHBondContact O-N 3Å; D718-V721 PolarHBondContact OD1-N 3.23Å; D718-K722 PolarHBondContact O-N 3.35Å; D718-K722 VanDerWaalsContact O-N 3.15Å
719	A	90.3	Very high	94.9	Very high	65 Å²	65	35.3 Å²	35.3	54%	0.537	18%	0.184	S	C	.	.	H	α-helix	trans	-61.9	-35.9	-179	0	0	0	0	0	112.5	H717 K722 E723	H717-A719 PolarHBondContact O-N 3Å; A719-K722 PolarHBondContact O-N 2.85Å; A719-E723 WeakPolarHBondContact O-CG 3.4Å; A719-E723 PolarHBondContact O-N 2.86Å
720	S	92.4	Very high	94.9	Very high	33 Å²	33	36.3 Å²	36.3	23%	0.231	19%	0.188	C	C	.	.	H	α-helix	trans	-76.8	-27.5	-178.2	79	0	0	0	0	112.8	D718 E724	D718-S720 VanDerWaalsContact C-N 3.28Å; D718-S720 PolarHBondContact O-N 3.18Å; D718-S720 WeakPolarHBondContact OD1-CA 3.33Å; D718-S720 WeakPolarHBondContact OD1-CB 3.25Å; D718-S720 PolarHBondContact OD1-N 3.07Å; D718-S720 PolarHBondContact OD1-OG 3.2Å; S720-E724 WeakPolarHBondContact O-CG 3.24Å; S720-E724 PolarHBondContact O-N 2.83Å
721	V	95.3	Very high	94.9	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-66.4	-42.4	166.6	179.6	0	0	0	0	110.3	P674 Q677 K678 V712 T716 D718 E723 A725	P674-V721 HydrophobicContact CB-CG2 4.08Å; P674-V721 VanDerWaalsContact O-CG2 3.26Å; P674-V721 WeakPolarHBondContact O-CG2 3.29Å; Q677-V721 HydrophobicContact CB-CG1 3.89Å; Q677-V721 HydrophobicContact CB-CG2 4.32Å; K678-V721 HydrophobicContact CB-CG2 4Å; V712-V721 HydrophobicContact CG1-CG1 3.44Å; V712-V721 VanDerWaalsContact CG1-CG1 3.44Å; T716-V721 HydrophobicContact CG2-CB 4.07Å; T716-V721 HydrophobicContact CG2-CG1 3.96Å; D718-V721 HydrophobicContact CB-CB 4.04Å; D718-V721 HydrophobicContact CB-CG2 3.7Å; D718-V721 PolarHBondContact O-N 3Å; D718-V721 PolarHBondContact OD1-N 3.23Å; V721-E723 PolarHBondContact O-N 3.17Å; V721-A725 VanDerWaalsContact O-CB 3.23Å; V721-A725 WeakPolarHBondContact O-CB 3.35Å; V721-A725 PolarHBondContact O-N 3.45Å
722	K	95.1	Very high	95	Very high	28 Å²	28	33.9 Å²	33.9	12%	0.122	18%	0.177	C	C	.	.	H	α-helix	trans	-63.5	-39.1	175	-64.5	-162.5	-164.9	-117.9	0	112.3	L713 T716 D718 A719 A725 A726 L774	L713-K722 HydrophobicContact CD2-CB 3.9Å; L713-K722 HydrophobicContact CD2-CG 4.19Å; L713-K722 WeakPolarHBondContact CD2-O 2.96Å; L713-K722 PolarHBondContact O-NZ 3.28Å; T716-K722 HydrophobicContact CG2-CD 4.33Å; T716-K722 HydrophobicContact CG2-CG 3.45Å; T716-K722 VanDerWaalsContact CG2-CG 3.45Å; T716-K722 WeakPolarHBondContact O-CE 3.29Å; T716-K722 PolarHBondContact O-NZ 2.92Å; D718-K722 PolarHBondContact O-N 3.35Å; D718-K722 VanDerWaalsContact O-N 3.15Å; A719-K722 PolarHBondContact O-N 2.85Å; K722-A725 PolarHBondContact O-N 3.19Å; K722-A726 VanDerWaalsContact O-CB 3.28Å; K722-A726 WeakPolarHBondContact O-CB 3.48Å; K722-A726 PolarHBondContact O-N 3.47Å; K722-L774 HydrophobicContact CB-CD1 3.8Å; K722-L774 HydrophobicContact CB-CD2 3.83Å; K722-L774 HydrophobicContact CB-CG 4.48Å; K722-L774 HydrophobicContact CD-CD2 4.23Å; K722-L774 WeakPolarHBondContact O-CD1 3.36Å
723	E	94.3	Very high	95	Very high	58 Å²	58	33.6 Å²	33.6	27%	0.271	18%	0.176	S	C	.	.	H	α-helix	trans	-62.3	-47	179.1	-77.4	-177.5	150.7	0	0	112.8	A719 V721 A726 A727 T773 L774 N777	A719-E723 WeakPolarHBondContact O-CG 3.4Å; A719-E723 PolarHBondContact O-N 2.86Å; V721-E723 PolarHBondContact O-N 3.17Å; E723-A726 PolarHBondContact O-N 2.85Å; E723-A727 WeakPolarHBondContact O-CB 3.3Å; E723-A727 PolarHBondContact O-N 3.07Å; E723-T773 WeakPolarHBondContact OE1-CB 3.45Å; E723-T773 PolarHBondContact OE1-N 2.97Å; E723-L774 HydrophobicContact CG-CB 3.7Å; E723-L774 PolarHBondContact OE1-N 2.8Å; E723-N777 PolarHBondContact O-ND2 3.28Å
724	E	96	Very high	94.9	Very high	30 Å²	30	35.5 Å²	35.5	14%	0.14	19%	0.189	C	C	.	.	H	α-helix	trans	-68.7	-38.8	176.6	-62.8	-68.7	-174.7	0	0	111.9	K678 C681 A682 K685 S720 A727 A728	K678-E724 HydrophobicContact CG-CG 3.82Å; C681-E724 HydrophobicContact CB-CB 3.63Å; A682-E724 HydrophobicContact CB-CG 4.18Å; K685-E724 WeakPolarHBondContact CD-OE2 3.35Å; K685-E724 WeakPolarHBondContact CE-OE2 3.18Å; K685-E724 IonicContact NZ-OE1 3Å; K685-E724 IonicContact NZ-OE2 3.62Å; K685-E724 PolarHBondContact NZ-OE2 2.85Å; S720-E724 WeakPolarHBondContact O-CG 3.24Å; S720-E724 PolarHBondContact O-N 2.83Å; E724-A727 WeakPolarHBondContact O-CB 3.41Å; E724-A727 PolarHBondContact O-N 3.1Å; E724-A728 PolarHBondContact O-N 3.02Å
725	A	97.6	Very high	94.5	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-64.4	-41.4	175.9	0	0	0	0	0	112.1	I709 V712 L713 V721 K722 A728 L729	I709-A725 HydrophobicContact CG2-CB 3.8Å; I709-A725 VanDerWaalsContact CG2-O 3.31Å; I709-A725 WeakPolarHBondContact CG2-O 3.36Å; V712-A725 HydrophobicContact CG1-CB 4.39Å; L713-A725 HydrophobicContact CD1-CB 4.2Å; L713-A725 HydrophobicContact CD2-CB 3.99Å; L713-A725 HydrophobicContact CG-CB 3.72Å; V721-A725 VanDerWaalsContact O-CB 3.23Å; V721-A725 WeakPolarHBondContact O-CB 3.35Å; V721-A725 PolarHBondContact O-N 3.45Å; K722-A725 PolarHBondContact O-N 3.19Å; A725-A728 PolarHBondContact O-N 3.2Å; A725-L729 PolarHBondContact O-N 3.32Å
726	A	97.4	Very high	94	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-69.1	-32.8	174	0	0	0	0	0	112.4	L713 K722 E723 W730 L750 L774 N777	L713-A726 HydrophobicContact CD2-CB 4.33Å; K722-A726 VanDerWaalsContact O-CB 3.28Å; K722-A726 WeakPolarHBondContact O-CB 3.48Å; K722-A726 PolarHBondContact O-N 3.47Å; E723-A726 PolarHBondContact O-N 2.85Å; A726-W730 PolarHBondContact O-N 3.36Å; A726-L750 HydrophobicContact CB-CD2 4.49Å; A726-L774 HydrophobicContact CB-CD1 3.78Å; A726-N777 HydrophobicContact CB-CB 3.81Å
727	A	96.6	Very high	93.7	Very high	11 Å²	11	36 Å²	36	9%	0.091	20%	0.195	C	C	.	.	H	α-helix	trans	-66.3	-45.4	173.3	0	0	0	0	0	111.8	K685 E723 E724 L729 W730 N731 N777	K685-A727 HydrophobicContact CD-CB 3.54Å; K685-A727 HydrophobicContact CG-CB 3.93Å; E723-A727 WeakPolarHBondContact O-CB 3.3Å; E723-A727 PolarHBondContact O-N 3.07Å; E724-A727 WeakPolarHBondContact O-CB 3.41Å; E724-A727 PolarHBondContact O-N 3.1Å; A727-L729 PolarHBondContact O-N 3.45Å; A727-W730 WeakPolarHBondContact O-CB 3.44Å; A727-W730 PolarHBondContact O-N 3.32Å; A727-W730 VanDerWaalsContact O-N 3.09Å; A727-N731 PolarHBondContact O-N 3.23Å; A727-N777 WeakPolarHBondContact CB-ND2 3.47Å
728	A	97.7	Very high	93.6	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-59.2	-46.3	174.2	0	0	0	0	0	111.3	K685 I709 E724 A725 W730 N731 L732	K685-A728 HydrophobicContact CB-CB 4.17Å; I709-A728 HydrophobicContact CD1-CB 4.31Å; E724-A728 PolarHBondContact O-N 3.02Å; A725-A728 PolarHBondContact O-N 3.2Å; A728-W730 VanDerWaalsContact C-N 3.28Å; A728-W730 PolarHBondContact O-N 3.47Å; A728-N731 PolarHBondContact O-N 3.02Å; A728-L732 WeakPolarHBondContact O-CB 3.29Å; A728-L732 WeakPolarHBondContact O-CD1 3.39Å; A728-L732 WeakPolarHBondContact O-CG 3.18Å; A728-L732 PolarHBondContact O-N 3.09Å
729	L	98.1	Very high	93.5	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-61.5	-32.6	173.4	-72.4	-173.6	0	0	0	113.2	V706 I709 L713 A725 A727 L732 S733 A746 L750 V781	V706-L729 HydrophobicContact CG1-CD2 4.33Å; I709-L729 HydrophobicContact CB-CD2 4.22Å; I709-L729 HydrophobicContact CB-CG 4.49Å; I709-L729 HydrophobicContact CG2-CD1 4.4Å; I709-L729 HydrophobicContact CG2-CD2 4.01Å; I709-L729 HydrophobicContact CG2-CG 3.76Å; L713-L729 HydrophobicContact CD1-CD1 3.45Å; L713-L729 VanDerWaalsContact CD1-CD1 3.45Å; L713-L729 HydrophobicContact CD1-CG 4.34Å; A725-L729 PolarHBondContact O-N 3.32Å; A727-L729 PolarHBondContact O-N 3.45Å; L729-L732 HydrophobicContact CD2-CD1 4.32Å; L729-S733 WeakPolarHBondContact O-CB 3.25Å; L729-S733 PolarHBondContact O-N 3.04Å; L729-S733 PolarHBondContact O-OG 2.92Å; L729-A746 HydrophobicContact CD1-CB 3.59Å; L729-L750 HydrophobicContact CD1-CD1 4.42Å; L729-V781 HydrophobicContact CB-CG2 3.8Å
730	W	97.4	Very high	93.4	Very high	22 Å²	22	24.8 Å²	24.8	8%	0.083	14%	0.137	C	C	.	.	H	α-helix	trans	-67.5	-47.1	177.9	-167.6	8.3	0	0	0	110.6	A726 A727 A728 L732 S733 S734 K776 N777 G780 V781 N826 M1112	A726-W730 PolarHBondContact O-N 3.36Å; A727-W730 WeakPolarHBondContact O-CB 3.44Å; A727-W730 PolarHBondContact O-N 3.32Å; A727-W730 VanDerWaalsContact O-N 3.09Å; A728-W730 VanDerWaalsContact C-N 3.28Å; A728-W730 PolarHBondContact O-N 3.47Å; W730-L732 PolarHBondContact O-N 3.45Å; W730-S733 PolarHBondContact O-N 2.87Å; W730-S733 PolarHBondContact O-OG 3.06Å; W730-S734 PolarHBondContact O-N 2.95Å; W730-K776 HydrophobicContact CH2-CG 4.36Å; W730-K776 HydrophobicContact CZ3-CD 4.42Å; W730-K776 HydrophobicContact CZ3-CG 4.16Å; W730-N777 HydrophobicContact CE3-CB 4.17Å; W730-G780 VanDerWaalsContact CD1-C 3.43Å; W730-G780 PolarHBondContact NE1-O 3.46Å; W730-V781 HydrophobicContact CB-CG2 3.93Å; W730-N826 WeakPolarHBondContact CH2-ND2 3.11Å; W730-N826 VanDerWaalsContact CZ2-ND2 3.27Å; W730-N826 WeakPolarHBondContact CZ2-ND2 3.22Å; W730-M1112 HydrophobicContact CH2-SD 4.35Å; W730-M1112 HydrophobicContact CZ3-SD 4.4Å
731	N	97.1	Very high	93.3	Very high	19 Å²	19	25.7 Å²	25.7	10%	0.102	14%	0.141	C	C	.	.	H	α-helix	trans	-59.4	-47.3	174.2	-72.5	-0.3	0	0	0	111.7	K685 S688 A727 A728 S733 S734	K685-N731 PolarHBondContact O-ND2 3.5Å; S688-N731 VanDerWaalsContact OG-CB 3.3Å; S688-N731 WeakPolarHBondContact OG-CB 3.41Å; A727-N731 PolarHBondContact O-N 3.23Å; A728-N731 PolarHBondContact O-N 3.02Å; N731-S733 VanDerWaalsContact C-N 3.34Å; N731-S733 PolarHBondContact O-N 3.33Å; N731-S734 WeakPolarHBondContact O-CB 3.36Å; N731-S734 PolarHBondContact O-N 3.46Å; N731-S734 PolarHBondContact O-OG 3.49Å
732	L	96.9	Very high	93.3	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-61	-38.7	176.4	-67.9	165.3	0	0	0	112.5	K697 V700 I709 A728 L729 W730 S734 A735 L738 I742	K697-L732 HydrophobicContact CB-CD2 3.93Å; K697-L732 HydrophobicContact CG-CD2 4.11Å; V700-L732 HydrophobicContact CB-CD2 3.95Å; V700-L732 HydrophobicContact CG1-CD1 3.85Å; V700-L732 HydrophobicContact CG1-CD2 3.76Å; V700-L732 HydrophobicContact CG1-CG 4.48Å; V700-L732 HydrophobicContact CG2-CD2 4.5Å; I709-L732 HydrophobicContact CD1-CD1 3.75Å; A728-L732 WeakPolarHBondContact O-CB 3.29Å; A728-L732 WeakPolarHBondContact O-CD1 3.39Å; A728-L732 WeakPolarHBondContact O-CG 3.18Å; A728-L732 PolarHBondContact O-N 3.09Å; L729-L732 HydrophobicContact CD2-CD1 4.32Å; W730-L732 PolarHBondContact O-N 3.45Å; L732-S734 PolarHBondContact O-N 3.42Å; L732-A735 PolarHBondContact O-N 2.75Å; L732-L738 HydrophobicContact CB-CD2 3.81Å; L732-L738 HydrophobicContact CD2-CD2 3.58Å; L732-L738 HydrophobicContact CG-CD2 4.21Å; L732-I742 HydrophobicContact CB-CD1 4.1Å
733	S	95.6	Very high	93.2	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-10.9	179.6	72.7	0	0	0	0	115.1	L729 W730 N731 A735 K739 I742 N784	L729-S733 WeakPolarHBondContact O-CB 3.25Å; L729-S733 PolarHBondContact O-N 3.04Å; L729-S733 PolarHBondContact O-OG 2.92Å; W730-S733 PolarHBondContact O-N 2.87Å; W730-S733 PolarHBondContact O-OG 3.06Å; N731-S733 VanDerWaalsContact C-N 3.34Å; N731-S733 PolarHBondContact O-N 3.33Å; S733-A735 VanDerWaalsContact C-N 3.27Å; S733-K739 VanDerWaalsContact O-CE 3.24Å; S733-K739 WeakPolarHBondContact O-CE 3.42Å; S733-K739 WeakPolarHBondContact O-CG 3.47Å; S733-I742 VanDerWaalsContact CA-CD1 3.49Å; S733-N784 WeakPolarHBondContact O-CB 3.14Å; S733-N784 WeakPolarHBondContact OG-CB 3.05Å; S733-N784 PolarHBondContact OG-ND2 3.31Å
734	S	92.4	Very high	93	Very high	42 Å²	42	28.4 Å²	28.4	29%	0.294	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-22.6	174.5	65.6	0	0	0	0	113.3	K697 W730 N731 L732	K697-S734 PolarHBondContact NZ-OG 2.83Å; W730-S734 PolarHBondContact O-N 2.95Å; N731-S734 WeakPolarHBondContact O-CB 3.36Å; N731-S734 PolarHBondContact O-N 3.46Å; N731-S734 PolarHBondContact O-OG 3.49Å; L732-S734 PolarHBondContact O-N 3.42Å
735	A	86.1	Confident	92.8	Very high	4 Å²	4	28.1 Å²	28.1	3%	0.033	16%	0.155	C	C	.	.	S	Bend	trans	-98.2	128.4	-177.5	0	0	0	0	0	111.5	K697 L732 S733 M737 L738	K697-A735 HydrophobicContact CD-CB 3.67Å; L732-A735 PolarHBondContact O-N 2.75Å; S733-A735 VanDerWaalsContact C-N 3.27Å; A735-M737 HydrophobicContact CB-SD 3.76Å; A735-M737 PolarHBondContact O-N 2.79Å; A735-L738 HydrophobicContact CB-CD1 4.06Å; A735-L738 PolarHBondContact O-N 2.83Å; A735-L738 VanDerWaalsContact O-N 3.15Å
736	D	83.8	Confident	92.7	Very high	101 Å²	101	28.1 Å²	28.1	54%	0.54	16%	0.155	S	C	.	.	G	3₁₀ helix	trans	-53.9	-47	-170.3	-79.3	-64.8	0	0	0	114.6	L738 K739 P740	D736-L738 PolarHBondContact O-N 3.3Å; D736-L738 VanDerWaalsContact O-N 3.16Å; D736-K739 WeakPolarHBondContact O-CB 3.4Å; D736-K739 PolarHBondContact O-N 2.72Å; D736-K739 VanDerWaalsContact O-N 3.08Å; D736-K739 IonicContact OD1-NZ 2.75Å; D736-K739 PolarHBondContact OD1-NZ 2.81Å; D736-K739 IonicContact OD2-NZ 2.68Å; D736-P740 WeakPolarHBondContact O-CD 3.39Å
737	M	85.4	Confident	92.6	Very high	98 Å²	98	28.1 Å²	28.1	48%	0.483	16%	0.155	S	C	.	.	G	3₁₀ helix	trans	-65	-20.2	-175.9	70.3	-64.8	-92.1	0	0	113.5	A735	A735-M737 HydrophobicContact CB-SD 3.76Å; A735-M737 PolarHBondContact O-N 2.79Å
738	L	89.1	Confident	92.4	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-88.1	-20.8	175.4	-75.9	89.5	0	0	0	113.4	K697 M701 V706 L732 A735 D736 V741 I742	K697-L738 HydrophobicContact CB-CD1 4.01Å; K697-L738 HydrophobicContact CB-CD2 4.34Å; M701-L738 HydrophobicContact CB-CD2 4.26Å; M701-L738 HydrophobicContact CB-CG 4.23Å; M701-L738 HydrophobicContact CG-CG 4.44Å; M701-L738 HydrophobicContact SD-CG 4.09Å; V706-L738 HydrophobicContact CG2-CD2 3.85Å; L732-L738 HydrophobicContact CB-CD2 3.81Å; L732-L738 HydrophobicContact CD2-CD2 3.58Å; L732-L738 HydrophobicContact CG-CD2 4.21Å; A735-L738 HydrophobicContact CB-CD1 4.06Å; A735-L738 PolarHBondContact O-N 2.83Å; A735-L738 VanDerWaalsContact O-N 3.15Å; D736-L738 PolarHBondContact O-N 3.3Å; D736-L738 VanDerWaalsContact O-N 3.16Å; L738-V741 PolarHBondContact O-N 2.7Å; L738-V741 VanDerWaalsContact O-N 3.13Å; L738-I742 HydrophobicContact CB-CD1 4.01Å; L738-I742 WeakPolarHBondContact O-CG1 3.5Å; L738-I742 PolarHBondContact O-N 2.8Å
739	K	88.8	Confident	92.3	Very high	1 Å²	1	33.9 Å²	33.9	0%	0.004	18%	0.181	C	C	.	.	H	α-helix	trans	-57.9	-39	-175.1	-63.3	172.3	-166.4	163.8	0	113.4	S733 D736 L743 A788 E1108	S733-K739 VanDerWaalsContact O-CE 3.24Å; S733-K739 WeakPolarHBondContact O-CE 3.42Å; S733-K739 WeakPolarHBondContact O-CG 3.47Å; D736-K739 WeakPolarHBondContact O-CB 3.4Å; D736-K739 PolarHBondContact O-N 2.72Å; D736-K739 VanDerWaalsContact O-N 3.08Å; D736-K739 IonicContact OD1-NZ 2.75Å; D736-K739 PolarHBondContact OD1-NZ 2.81Å; D736-K739 IonicContact OD2-NZ 2.68Å; K739-L743 WeakPolarHBondContact O-CB 3.49Å; K739-L743 PolarHBondContact O-N 3.07Å; K739-A788 HydrophobicContact CB-CB 3.74Å; K739-A788 HydrophobicContact CD-CB 3.85Å; K739-A788 HydrophobicContact CG-CB 4.39Å; K739-E1108 IonicContact NZ-OE1 2.99Å; K739-E1108 PolarHBondContact NZ-OE1 2.81Å; K739-E1108 IonicContact NZ-OE2 3.63Å; K739-E1108 PolarHBondContact NZ-OE2 3.47Å
740	P	87.4	Confident	92.2	Very high	73 Å²	73	33.9 Å²	33.9	47%	0.474	18%	0.181	S	C	.	.	H	α-helix	trans	-63.1	-45.6	173.1	-22.9	34.8	0	0	0	113.1	D736 I742 L743 E744	D736-P740 WeakPolarHBondContact O-CD 3.39Å; P740-I742 VanDerWaalsContact C-N 3.3Å; P740-I742 PolarHBondContact O-N 3Å; P740-L743 VanDerWaalsContact O-CB 3.31Å; P740-L743 WeakPolarHBondContact O-CB 3.45Å; P740-L743 PolarHBondContact O-N 2.76Å; P740-E744 WeakPolarHBondContact O-CG 3.47Å; P740-E744 PolarHBondContact O-N 2.85Å
741	V	90.7	Very high	92	Very high	51 Å²	51	32.9 Å²	32.9	31%	0.309	18%	0.177	S	C	.	.	H	α-helix	trans	-64.9	-37.1	-178.6	-170.7	0	0	0	0	111.3	M701 V706 L738 E744 S745	M701-V741 HydrophobicContact CG-CG2 4.45Å; M701-V741 HydrophobicContact SD-CG2 4.12Å; V706-V741 HydrophobicContact CB-CG1 4Å; V706-V741 HydrophobicContact CG1-CB 4.3Å; V706-V741 HydrophobicContact CG1-CG1 3.81Å; L738-V741 PolarHBondContact O-N 2.7Å; L738-V741 VanDerWaalsContact O-N 3.13Å; V741-E744 PolarHBondContact O-N 2.96Å; V741-S745 VanDerWaalsContact O-CB 3.22Å; V741-S745 WeakPolarHBondContact O-CB 3.39Å; V741-S745 PolarHBondContact O-N 3.06Å; V741-S745 PolarHBondContact O-OG 2.95Å
742	I	95.1	Very high	91.8	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-71.1	-39.5	175.5	-61.7	167.2	0	0	0	111	V706 L732 S733 L738 P740 E744 S745 A746 T747 V781 V785	V706-I742 HydrophobicContact CG1-CB 4.44Å; V706-I742 HydrophobicContact CG1-CG1 3.56Å; L732-I742 HydrophobicContact CB-CD1 4.1Å; S733-I742 VanDerWaalsContact CA-CD1 3.49Å; L738-I742 HydrophobicContact CB-CD1 4.01Å; L738-I742 WeakPolarHBondContact O-CG1 3.5Å; L738-I742 PolarHBondContact O-N 2.8Å; P740-I742 VanDerWaalsContact C-N 3.3Å; P740-I742 PolarHBondContact O-N 3Å; I742-E744 VanDerWaalsContact C-N 3.27Å; I742-E744 PolarHBondContact O-N 3.43Å; I742-S745 PolarHBondContact O-N 3.35Å; I742-A746 HydrophobicContact CG2-CB 4.18Å; I742-A746 PolarHBondContact O-N 2.79Å; I742-T747 PolarHBondContact O-N 2.84Å; I742-V781 HydrophobicContact CG2-CG1 3.67Å; I742-V785 HydrophobicContact CB-CG2 4.1Å; I742-V785 HydrophobicContact CG2-CG2 3.71Å
743	L	92.8	Very high	91.5	Very high	12 Å²	12	39.2 Å²	39.2	6%	0.063	21%	0.206	C	C	.	.	H	α-helix	trans	-53.6	-45.7	172.5	177.2	66.8	0	0	0	111.2	K739 P740 T747 V785 A792 R795 L796	K739-L743 WeakPolarHBondContact O-CB 3.49Å; K739-L743 PolarHBondContact O-N 3.07Å; P740-L743 VanDerWaalsContact O-CB 3.31Å; P740-L743 WeakPolarHBondContact O-CB 3.45Å; P740-L743 PolarHBondContact O-N 2.76Å; L743-T747 HydrophobicContact CD1-CG2 4.19Å; L743-T747 PolarHBondContact O-OG1 3.08Å; L743-V785 HydrophobicContact CB-CG1 3.72Å; L743-V785 HydrophobicContact CD1-CG1 3.78Å; L743-V785 HydrophobicContact CG-CG1 4.32Å; L743-A792 HydrophobicContact CD1-CB 4.09Å; L743-A792 HydrophobicContact CD2-CB 3.82Å; L743-R795 HydrophobicContact CD1-CB 4.29Å; L743-R795 HydrophobicContact CD1-CG 4.31Å; L743-L796 HydrophobicContact CD1-CG 4.42Å
744	E	90.3	Very high	91.2	Very high	131 Å²	131	39.4 Å²	39.4	61%	0.612	21%	0.207	S	C	*	.	H	α-helix	trans	-75.6	-44	-178.9	-61.9	-159.6	147.8	0	0	113.6	P740 V741 I742 R795	P740-E744 WeakPolarHBondContact O-CG 3.47Å; P740-E744 PolarHBondContact O-N 2.85Å; V741-E744 PolarHBondContact O-N 2.96Å; I742-E744 VanDerWaalsContact C-N 3.27Å; I742-E744 PolarHBondContact O-N 3.43Å; E744-R795 PolarHBondContact O-NH2 3.1Å
745	S	92.3	Very high	91.2	Very high	24 Å²	24	37.4 Å²	37.4	17%	0.168	19%	0.193	C	C	.	.	H	α-helix	trans	-84.3	-38.1	-168.8	-57.6	0	0	0	0	114.2	V741 I742 I749	V741-S745 VanDerWaalsContact O-CB 3.22Å; V741-S745 WeakPolarHBondContact O-CB 3.39Å; V741-S745 PolarHBondContact O-N 3.06Å; V741-S745 PolarHBondContact O-OG 2.95Å; I742-S745 PolarHBondContact O-N 3.35Å; S745-I749 WeakPolarHBondContact O-CD1 3.45Å
746	A	95.6	Very high	91.4	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.1	-30.2	-159.7	0	0	0	0	0	115.7	A710 L729 I742 E748 I749 L750	A710-A746 HydrophobicContact CB-CB 4Å; L729-A746 HydrophobicContact CD1-CB 3.59Å; I742-A746 HydrophobicContact CG2-CB 4.18Å; I742-A746 PolarHBondContact O-N 2.79Å; A746-E748 VanDerWaalsContact C-N 3.33Å; A746-E748 PolarHBondContact O-N 3.35Å; A746-I749 WeakPolarHBondContact O-CB 3.2Å; A746-I749 PolarHBondContact O-N 2.87Å; A746-L750 HydrophobicContact CB-CD1 4.33Å; A746-L750 WeakPolarHBondContact O-CG 3.25Å; A746-L750 PolarHBondContact O-N 2.8Å
747	T	94.9	Very high	91.7	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-60.3	-38.5	-167.6	58	0	0	0	0	114.1	I742 L743 S751 L782 V785 L796	I742-T747 PolarHBondContact O-N 2.84Å; L743-T747 HydrophobicContact CD1-CG2 4.19Å; L743-T747 PolarHBondContact O-OG1 3.08Å; T747-S751 VanDerWaalsContact O-CB 3.27Å; T747-S751 WeakPolarHBondContact O-CB 3.28Å; T747-S751 PolarHBondContact O-N 3.09Å; T747-S751 PolarHBondContact O-OG 3.41Å; T747-L782 HydrophobicContact CG2-CD2 3.64Å; T747-V785 HydrophobicContact CG2-CB 4.48Å; T747-V785 HydrophobicContact CG2-CG1 3.96Å; T747-L796 HydrophobicContact CG2-CD2 4.02Å
748	E	93.5	Very high	91.6	Very high	119 Å²	119	30.8 Å²	30.8	56%	0.556	16%	0.163	S	C	*	.	H	α-helix	trans	-68.4	-36.5	176.5	-171.4	176.4	179.5	0	0	112.2	A746 S751 Q752	A746-E748 VanDerWaalsContact C-N 3.33Å; A746-E748 PolarHBondContact O-N 3.35Å; E748-S751 PolarHBondContact O-N 2.96Å; E748-Q752 HydrophobicContact CG-CG 4.2Å; E748-Q752 WeakPolarHBondContact O-CB 3.37Å; E748-Q752 WeakPolarHBondContact O-CG 3.43Å; E748-Q752 PolarHBondContact O-N 3.18Å
749	I	94.8	Very high	91.4	Very high	13 Å²	13	33.4 Å²	33.4	7%	0.067	18%	0.177	C	C	.	.	H	α-helix	trans	-65	-51.3	177	-41.5	172.5	0	0	0	109.9	A710 L713 R714 S745 A746 S751 Q752 Q753	A710-I749 HydrophobicContact CB-CD1 3.78Å; A710-I749 WeakPolarHBondContact O-CD1 3.2Å; L713-I749 HydrophobicContact CB-CG2 4.33Å; R714-I749 HydrophobicContact CB-CD1 4.23Å; R714-I749 HydrophobicContact CB-CG2 4.26Å; R714-I749 VanDerWaalsContact NH2-CD1 3.33Å; S745-I749 WeakPolarHBondContact O-CD1 3.45Å; A746-I749 WeakPolarHBondContact O-CB 3.2Å; A746-I749 PolarHBondContact O-N 2.87Å; I749-S751 VanDerWaalsContact C-N 3.27Å; I749-S751 PolarHBondContact O-N 3.42Å; I749-Q752 PolarHBondContact O-N 2.85Å; I749-Q753 HydrophobicContact CG2-CG 4.09Å; I749-Q753 WeakPolarHBondContact O-CA 3.23Å; I749-Q753 VanDerWaalsContact O-CB 3.27Å; I749-Q753 WeakPolarHBondContact O-CB 3.3Å; I749-Q753 PolarHBondContact O-N 2.74Å
750	L	96	Very high	90.8	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.005	20%	0.198	C	C	.	.	I	π-helix	trans	-60.4	-40.8	178.8	-64.3	170.9	0	0	0	110.6	L713 A726 L729 A746 V754 I755 V781 L782	L713-L750 HydrophobicContact CD1-CD2 3.97Å; L713-L750 HydrophobicContact CD2-CD2 4.47Å; A726-L750 HydrophobicContact CB-CD2 4.49Å; L729-L750 HydrophobicContact CD1-CD1 4.42Å; A746-L750 HydrophobicContact CB-CD1 4.33Å; A746-L750 WeakPolarHBondContact O-CG 3.25Å; A746-L750 PolarHBondContact O-N 2.8Å; L750-V754 WeakPolarHBondContact O-CA 3.21Å; L750-V754 VanDerWaalsContact O-CB 3.26Å; L750-V754 WeakPolarHBondContact O-CB 3.37Å; L750-V754 PolarHBondContact O-N 2.97Å; L750-V754 VanDerWaalsContact O-N 3.15Å; L750-I755 PolarHBondContact O-N 3.13Å; L750-V781 HydrophobicContact CD1-CB 3.78Å; L750-V781 HydrophobicContact CD1-CG1 3.58Å; L750-V781 HydrophobicContact CD1-CG2 4.1Å; L750-L782 HydrophobicContact CD1-CD2 4.47Å
751	S	94.4	Very high	89.2	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.22	C	C	.	.	I	π-helix	trans	-67.8	-51.7	177.7	-57.1	0	0	0	0	112.5	T747 E748 I749 I755 A756	T747-S751 VanDerWaalsContact O-CB 3.27Å; T747-S751 WeakPolarHBondContact O-CB 3.28Å; T747-S751 PolarHBondContact O-N 3.09Å; T747-S751 PolarHBondContact O-OG 3.41Å; E748-S751 PolarHBondContact O-N 2.96Å; I749-S751 VanDerWaalsContact C-N 3.27Å; I749-S751 PolarHBondContact O-N 3.42Å; S751-I755 PolarHBondContact O-N 2.94Å; S751-A756 VanDerWaalsContact O-CB 3.25Å; S751-A756 WeakPolarHBondContact O-CB 3.38Å; S751-A756 PolarHBondContact O-N 3.45Å
752	Q	91.2	Very high	87.4	Confident	69 Å²	69	41.1 Å²	41.1	32%	0.322	24%	0.244	S	C	.	.	I	π-helix	trans	-84	-30.1	-172.4	-62.8	-56.5	-36.3	0	0	114.2	E748 I749 P757 P800	E748-Q752 HydrophobicContact CG-CG 4.2Å; E748-Q752 WeakPolarHBondContact O-CB 3.37Å; E748-Q752 WeakPolarHBondContact O-CG 3.43Å; E748-Q752 PolarHBondContact O-N 3.18Å; I749-Q752 PolarHBondContact O-N 2.85Å; Q752-P757 WeakPolarHBondContact O-CD 3.21Å; Q752-P757 VanDerWaalsContact O-CG 3.27Å; Q752-P757 WeakPolarHBondContact O-CG 3.26Å; Q752-P800 PolarHBondContact NE2-O 2.76Å
753	Q	90.6	Very high	85.1	Confident	84 Å²	84	44.8 Å²	44.8	39%	0.393	27%	0.266	S	S	.	.	I	π-helix	trans	-93.4	-24.5	177.7	-61.5	-159.7	10.2	0	0	114.1	L713 R714 I749	L713-Q753 PolarHBondContact O-OE1 3.47Å; R714-Q753 PolarHBondContact O-NE2 3.15Å; I749-Q753 HydrophobicContact CG2-CG 4.09Å; I749-Q753 WeakPolarHBondContact O-CA 3.23Å; I749-Q753 VanDerWaalsContact O-CB 3.27Å; I749-Q753 WeakPolarHBondContact O-CB 3.3Å; I749-Q753 PolarHBondContact O-N 2.74Å
754	V	90.9	Very high	83.1	Confident	5 Å²	5	49.4 Å²	49.4	3%	0.03	30%	0.299	C	S	.	.	I	π-helix	trans	-112.5	-53.3	-179.2	-173.4	0	0	0	0	112.4	L750 H769 L774 F775	L750-V754 WeakPolarHBondContact O-CA 3.21Å; L750-V754 VanDerWaalsContact O-CB 3.26Å; L750-V754 WeakPolarHBondContact O-CB 3.37Å; L750-V754 PolarHBondContact O-N 2.97Å; L750-V754 VanDerWaalsContact O-N 3.15Å; V754-H769 PolarHBondContact O-CE1 3.25Å; V754-H769 VanDerWaalsContact O-CE1 3.31Å; V754-H769 PolarHBondContact O-NE2 3.15Å; V754-L774 HydrophobicContact CG1-CD2 4.37Å; V754-L774 HydrophobicContact CG1-CG 3.81Å; V754-L774 HydrophobicContact CG2-CD1 4.1Å; V754-L774 HydrophobicContact CG2-CD2 4.01Å; V754-L774 HydrophobicContact CG2-CG 3.88Å; V754-F775 HydrophobicContact CG1-CB 4.35Å; V754-F775 HydrophobicContact CG1-CD2 4.35Å
755	I	92.6	Very high	81.6	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	29%	0.293	C	S	.	.	I	π-helix	trans	-85	-55.1	-166.4	-62.1	167	0	0	0	112.5	L750 S751 P757 V758 F775 T779 L782 L802 A805 L806	L750-I755 PolarHBondContact O-N 3.13Å; S751-I755 PolarHBondContact O-N 2.94Å; I755-P757 VanDerWaalsContact C-CD 3.41Å; I755-V758 VanDerWaalsContact O-CG1 3.28Å; I755-V758 WeakPolarHBondContact O-CG1 3.37Å; I755-V758 PolarHBondContact O-N 3.22Å; I755-F775 HydrophobicContact CB-CE2 4.23Å; I755-F775 HydrophobicContact CG1-CD2 4.32Å; I755-F775 HydrophobicContact CG1-CE2 4.15Å; I755-F775 HydrophobicContact CG2-CE2 4.01Å; I755-F775 HydrophobicContact CG2-CZ 4.25Å; I755-T779 HydrophobicContact CD1-CG2 3.89Å; I755-T779 HydrophobicContact CG1-CG2 4.3Å; I755-L782 HydrophobicContact CD1-CD1 3.52Å; I755-L782 HydrophobicContact CD1-CG 4.36Å; I755-L802 HydrophobicContact CB-CD1 4.26Å; I755-L802 HydrophobicContact CD1-CD1 4.08Å; I755-L802 HydrophobicContact CG2-CD1 3.85Å; I755-A805 HydrophobicContact CG2-CB 3.77Å; I755-L806 HydrophobicContact CG2-CD2 4.46Å; I755-L806 HydrophobicContact CG2-CG 4.49Å
756	A	90.1	Very high	80.2	Confident	9 Å²	9	47.7 Å²	47.7	7%	0.074	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-59.4	-33.7	-177.7	0	0	0	0	0	116	S751 V758 L759 N801	S751-A756 VanDerWaalsContact O-CB 3.25Å; S751-A756 WeakPolarHBondContact O-CB 3.38Å; S751-A756 PolarHBondContact O-N 3.45Å; A756-V758 PolarHBondContact O-N 2.93Å; A756-L759 PolarHBondContact O-N 2.61Å; A756-L759 VanDerWaalsContact O-N 3.1Å; A756-N801 HydrophobicContact CB-CB 3.95Å
757	P	88.6	Confident	78.6	Confident	49 Å²	49	49.8 Å²	49.8	32%	0.318	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-57.5	-18.7	178.9	-29.7	38.2	0	0	0	115	Q752 I755 L759 A760	Q752-P757 WeakPolarHBondContact O-CD 3.21Å; Q752-P757 VanDerWaalsContact O-CG 3.27Å; Q752-P757 WeakPolarHBondContact O-CG 3.26Å; I755-P757 VanDerWaalsContact C-CD 3.41Å; P757-L759 PolarHBondContact O-N 2.69Å; P757-L759 VanDerWaalsContact O-N 3.15Å; P757-A760 WeakPolarHBondContact O-CB 3.39Å; P757-A760 PolarHBondContact O-N 3.3Å
758	V	83.8	Confident	77.3	Confident	5 Å²	5	59.8 Å²	59.8	3%	0.03	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-71.5	-2.9	177.6	86.8	0	0	0	0	114.3	I755 A756 P766 H769 F770 F775 A805 H808	I755-V758 VanDerWaalsContact O-CG1 3.28Å; I755-V758 WeakPolarHBondContact O-CG1 3.37Å; I755-V758 PolarHBondContact O-N 3.22Å; A756-V758 PolarHBondContact O-N 2.93Å; V758-P766 HydrophobicContact CG2-CB 4Å; V758-H769 HydrophobicContact CG2-CB 4.13Å; V758-F770 HydrophobicContact CB-CE1 4.03Å; V758-F770 HydrophobicContact CB-CZ 4.49Å; V758-F770 HydrophobicContact CG1-CE1 3.63Å; V758-F770 HydrophobicContact CG1-CZ 4.18Å; V758-F770 HydrophobicContact CG2-CD1 3.8Å; V758-F770 HydrophobicContact CG2-CE1 3.29Å; V758-F770 HydrophobicContact CG2-CE2 4.21Å; V758-F770 HydrophobicContact CG2-CG 4.46Å; V758-F770 HydrophobicContact CG2-CZ 3.53Å; V758-F775 HydrophobicContact CG1-CE2 4.48Å; V758-A805 HydrophobicContact CG1-CB 4.04Å; V758-H808 PolarHBondContact O-CE1 2.82Å; V758-H808 PolarHBondContact O-ND1 3.46Å
759	L	84.3	Confident	76.4	Confident	56 Å²	56	57 Å²	57	29%	0.293	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-91.7	-5.7	167.2	-59.3	-177.6	0	0	0	113.3	A756 P757 V761 N801 E804 A805 H808	A756-L759 PolarHBondContact O-N 2.61Å; A756-L759 VanDerWaalsContact O-N 3.1Å; P757-L759 PolarHBondContact O-N 2.69Å; P757-L759 VanDerWaalsContact O-N 3.15Å; L759-V761 PolarHBondContact O-N 2.89Å; L759-N801 HydrophobicContact CD1-CB 3.85Å; L759-E804 HydrophobicContact CD1-CB 3.58Å; L759-A805 HydrophobicContact CD1-CB 4.3Å; L759-A805 HydrophobicContact CD2-CB 4.48Å; L759-A805 HydrophobicContact CG-CB 4.11Å; L759-H808 HydrophobicContact CD2-CB 3.63Å
760	A	76.8	Confident	75.6	Confident	53 Å²	53	56.8 Å²	56.8	44%	0.438	33%	0.33	S	S	.	.			trans	-71.8	97.9	-177.2	0	0	0	0	0	111.2	P757 G762 T763	P757-A760 WeakPolarHBondContact O-CB 3.39Å; P757-A760 PolarHBondContact O-N 3.3Å; A760-G762 PolarHBondContact O-N 2.87Å; A760-T763 HydrophobicContact CB-CG2 4.27Å; A760-T763 PolarHBondContact O-N 3.19Å; A760-T763 PolarHBondContact O-OG1 3.31Å
761	V	53.8	Low	74.3	Confident	155 Å²	155	59.9 Å²	59.9	94%	0.939	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	97.1	179.1	-176.9	0	0	0	0	110.5	L759	L759-V761 PolarHBondContact O-N 2.89Å
762	G	53.4	Low	73.9	Confident	78 Å²	78	61.2 Å²	61.2	80%	0.804	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	147.3	-15.6	-178.4	0	0	0	0	0	115	A760	A760-G762 PolarHBondContact O-N 2.87Å
763	T	46.8	Very low	73.9	Confident	78 Å²	78	61 Å²	61	48%	0.479	38%	0.375	S	S	.	.	S	Bend	trans	-67.1	135.5	174.8	55	0	0	0	0	111.8	A760 D765	A760-T763 HydrophobicContact CB-CG2 4.27Å; A760-T763 PolarHBondContact O-N 3.19Å; A760-T763 PolarHBondContact O-OG1 3.31Å; T763-D765 PolarHBondContact O-N 3.49Å
764	S	51.2	Low	74	Confident	108 Å²	108	58.1 Å²	58.1	76%	0.755	36%	0.363	S	S	*	.	S	Bend	trans	-62.9	115.1	177	39.4	0	0	0	0	112.3
765	D	58.3	Low	74.1	Confident	88 Å²	88	57.9 Å²	57.9	47%	0.471	36%	0.361	S	S	.	.			trans	35	99.1	-179.5	-168.5	11.2	0	0	0	116.1	T763 T767 R768	T763-D765 PolarHBondContact O-N 3.49Å; D765-T767 PolarHBondContact O-N 3.22Å; D765-T767 VanDerWaalsContact OD1-CG2 3.26Å; D765-T767 WeakPolarHBondContact OD1-CG2 3.34Å; D765-T767 PolarHBondContact OD1-N 3.42Å; D765-T767 PolarHBondContact OD1-OG1 3.13Å; D765-T767 PolarHBondContact OD2-OG1 3.31Å; D765-R768 PolarHBondContact O-N 2.79Å
766	P	61.8	Low	74.2	Confident	32 Å²	32	60.4 Å²	60.4	21%	0.208	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-9.5	-176.7	28.7	-36.2	0	0	0	114.4	V758 R768 H769 F770	V758-P766 HydrophobicContact CG2-CB 4Å; P766-R768 PolarHBondContact O-N 2.93Å; P766-H769 PolarHBondContact O-N 3.39Å; P766-F770 HydrophobicContact CB-CD2 4.12Å; P766-F770 HydrophobicContact CB-CE2 3.77Å; P766-F770 HydrophobicContact CB-CZ 4.37Å; P766-F770 HydrophobicContact CG-CE2 4.2Å; P766-F770 WeakPolarHBondContact O-CD2 3.23Å; P766-F770 WeakPolarHBondContact O-CG 3.29Å; P766-F770 PolarHBondContact O-N 3.42Å
767	T	62.7	Low	74.5	Confident	44 Å²	44	60.3 Å²	60.3	27%	0.27	37%	0.371	S	S	.	.	H	α-helix	trans	-50.9	-41.2	169.8	61.6	0	0	0	0	112.1	D765 H769 G771 H812	D765-T767 PolarHBondContact O-N 3.22Å; D765-T767 VanDerWaalsContact OD1-CG2 3.26Å; D765-T767 WeakPolarHBondContact OD1-CG2 3.34Å; D765-T767 PolarHBondContact OD1-N 3.42Å; D765-T767 PolarHBondContact OD1-OG1 3.13Å; D765-T767 PolarHBondContact OD2-OG1 3.31Å; T767-H769 PolarHBondContact O-N 3.41Å; T767-G771 PolarHBondContact O-N 3.15Å; T767-H812 WeakPolarHBondContact CG2-NE2 3.44Å
768	R	66.7	Low	74.9	Confident	209 Å²	209	58 Å²	58	79%	0.789	36%	0.355	S	S	*	.	H	α-helix	trans	-64.7	-29.8	179.8	-69.1	-173.3	172.9	-154.5	-2.1	112.9	D765 P766	D765-R768 PolarHBondContact O-N 2.79Å; P766-R768 PolarHBondContact O-N 2.93Å
769	H	75.8	Confident	75.5	Confident	60 Å²	60	57.8 Å²	57.8	28%	0.278	35%	0.354	S	S	.	.	H	α-helix	trans	-83.2	-47.6	-179.6	-165.6	84.4	0	0	0	111.1	V754 V758 P766 T767 G771 S772 F775	V754-H769 PolarHBondContact O-CE1 3.25Å; V754-H769 VanDerWaalsContact O-CE1 3.31Å; V754-H769 PolarHBondContact O-NE2 3.15Å; V758-H769 HydrophobicContact CG2-CB 4.13Å; P766-H769 PolarHBondContact O-N 3.39Å; T767-H769 PolarHBondContact O-N 3.41Å; H769-G771 VanDerWaalsContact C-N 3.31Å; H769-G771 PolarHBondContact O-N 3.45Å; H769-S772 WeakPolarHBondContact O-CB 3.26Å; H769-S772 PolarHBondContact O-N 2.74Å; H769-S772 VanDerWaalsContact O-N 3.16Å; H769-S772 PolarHBondContact O-OG 2.85Å; H769-F775 AromaticContact CD2-CD2 3.73Å; H769-F775 AromaticContact NE2-CD2 3.75Å
770	F	77.7	Confident	76.1	Confident	9 Å²	9	55.1 Å²	55.1	4%	0.039	34%	0.34	C	S	.	.	H	α-helix	trans	-62.9	-34.5	177.1	-65.2	-45.3	0	0	0	113.2	V758 P766 S772 F775 H808 F809 H812	V758-F770 HydrophobicContact CB-CE1 4.03Å; V758-F770 HydrophobicContact CB-CZ 4.49Å; V758-F770 HydrophobicContact CG1-CE1 3.63Å; V758-F770 HydrophobicContact CG1-CZ 4.18Å; V758-F770 HydrophobicContact CG2-CD1 3.8Å; V758-F770 HydrophobicContact CG2-CE1 3.29Å; V758-F770 HydrophobicContact CG2-CE2 4.21Å; V758-F770 HydrophobicContact CG2-CG 4.46Å; V758-F770 HydrophobicContact CG2-CZ 3.53Å; P766-F770 HydrophobicContact CB-CD2 4.12Å; P766-F770 HydrophobicContact CB-CE2 3.77Å; P766-F770 HydrophobicContact CB-CZ 4.37Å; P766-F770 HydrophobicContact CG-CE2 4.2Å; P766-F770 WeakPolarHBondContact O-CD2 3.23Å; P766-F770 WeakPolarHBondContact O-CG 3.29Å; P766-F770 PolarHBondContact O-N 3.42Å; F770-S772 VanDerWaalsContact C-N 3.29Å; F770-S772 PolarHBondContact O-N 2.93Å; F770-F775 HydrophobicContact CD1-CE1 4.48Å; F770-F775 HydrophobicContact CD1-CE2 4.45Å; F770-F775 HydrophobicContact CD1-CZ 4.18Å; F770-H808 AromaticContact CZ-ND1 3.78Å; F770-F809 HydrophobicContact CB-CD2 3.89Å; F770-F809 HydrophobicContact CB-CE2 4.04Å; F770-F809 HydrophobicContact CD1-CB 3.83Å; F770-F809 AromaticContact CD1-CD2 3.36Å; F770-F809 HydrophobicContact CD1-CD2 3.36Å; F770-F809 HydrophobicContact CD1-CE2 4.32Å; F770-F809 AromaticContact CD1-CG 3.94Å; F770-F809 HydrophobicContact CD1-CG 3.94Å; F770-F809 HydrophobicContact CD2-CD2 4.41Å; F770-F809 VanDerWaalsContact CE1-CA 3.48Å; F770-F809 HydrophobicContact CE1-CB 3.47Å; F770-F809 VanDerWaalsContact CE1-CB 3.47Å; F770-F809 AromaticContact CE1-CD2 3.87Å; F770-F809 HydrophobicContact CE1-CD2 3.87Å; F770-F809 HydrophobicContact CE1-CG 4.11Å; F770-F809 AromaticContact CG-CD2 3.67Å; F770-F809 HydrophobicContact CG-CD2 3.67Å; F770-F809 HydrophobicContact CG-CE2 4.32Å; F770-F809 HydrophobicContact CZ-CB 4.2Å; F770-H812 HydrophobicContact CD2-CB 4.06Å; F770-H812 AromaticContact CD2-CD2 3.63Å; F770-H812 AromaticContact CD2-CG 3.69Å; F770-H812 HydrophobicContact CE2-CB 3.54Å; F770-H812 AromaticContact CE2-CD2 3.91Å; F770-H812 AromaticContact CE2-CG 3.46Å; F770-H812 VanDerWaalsContact CE2-CG 3.46Å; F770-H812 AromaticContact CE2-ND1 3.74Å; F770-H812 HydrophobicContact CZ-CB 4.18Å
771	G	68.6	Low	77	Confident	67 Å²	67	52.6 Å²	52.6	69%	0.691	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	1.6	176.1	0	0	0	0	0	115.2	T767 H769	T767-G771 PolarHBondContact O-N 3.15Å; H769-G771 VanDerWaalsContact C-N 3.31Å; H769-G771 PolarHBondContact O-N 3.45Å
772	S	86.1	Confident	79.1	Confident	27 Å²	27	45.2 Å²	45.2	19%	0.189	27%	0.274	C	S	.	.			trans	-77.9	141.7	-176.8	68.8	0	0	0	0	113	H769 F770 L774 F775 K776	H769-S772 WeakPolarHBondContact O-CB 3.26Å; H769-S772 PolarHBondContact O-N 2.74Å; H769-S772 VanDerWaalsContact O-N 3.16Å; H769-S772 PolarHBondContact O-OG 2.85Å; F770-S772 VanDerWaalsContact C-N 3.29Å; F770-S772 PolarHBondContact O-N 2.93Å; S772-L774 PolarHBondContact O-N 2.92Å; S772-F775 PolarHBondContact O-N 2.74Å; S772-F775 VanDerWaalsContact O-N 3.14Å; S772-F775 VanDerWaalsContact OG-CB 3.28Å; S772-F775 WeakPolarHBondContact OG-CB 3.34Å; S772-F775 PolarHBondContact OG-N 2.7Å; S772-K776 PolarHBondContact O-N 3.31Å; S772-K776 VanDerWaalsContact O-N 3.1Å
773	T	90.5	Very high	81.2	Confident	64 Å²	64	41.9 Å²	41.9	39%	0.393	24%	0.238	S	C	.	.	H	α-helix	trans	-61	-33.7	172.6	-62.6	0	0	0	0	110.5	E723 F775 K776 N777	E723-T773 WeakPolarHBondContact OE1-CB 3.45Å; E723-T773 PolarHBondContact OE1-N 2.97Å; T773-F775 PolarHBondContact O-N 3.36Å; T773-K776 WeakPolarHBondContact O-CB 3.35Å; T773-K776 PolarHBondContact O-N 3.46Å; T773-N777 WeakPolarHBondContact O-CB 3.38Å; T773-N777 PolarHBondContact O-N 2.89Å; T773-N777 PolarHBondContact O-OD1 2.79Å
774	L	92.7	Very high	83.5	Confident	24 Å²	24	39.1 Å²	39.1	13%	0.126	22%	0.22	C	C	.	.	H	α-helix	trans	-57.3	-44.1	173.4	-173.6	52	0	0	0	112.8	K722 E723 A726 V754 S772 S778	K722-L774 HydrophobicContact CB-CD1 3.8Å; K722-L774 HydrophobicContact CB-CD2 3.83Å; K722-L774 HydrophobicContact CB-CG 4.48Å; K722-L774 HydrophobicContact CD-CD2 4.23Å; K722-L774 WeakPolarHBondContact O-CD1 3.36Å; E723-L774 HydrophobicContact CG-CB 3.7Å; E723-L774 PolarHBondContact OE1-N 2.8Å; A726-L774 HydrophobicContact CB-CD1 3.78Å; V754-L774 HydrophobicContact CG1-CD2 4.37Å; V754-L774 HydrophobicContact CG1-CG 3.81Å; V754-L774 HydrophobicContact CG2-CD1 4.1Å; V754-L774 HydrophobicContact CG2-CD2 4.01Å; V754-L774 HydrophobicContact CG2-CG 3.88Å; S772-L774 PolarHBondContact O-N 2.92Å; L774-S778 VanDerWaalsContact O-CB 3.24Å; L774-S778 WeakPolarHBondContact O-CB 3.48Å; L774-S778 PolarHBondContact O-N 3.46Å; L774-S778 PolarHBondContact O-OG 3.37Å
775	F	93.9	Very high	85.5	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-72.2	-38.8	178.3	-168.9	-81.9	0	0	0	111.9	V754 I755 V758 H769 F770 S772 T773 T779 F809 T823	V754-F775 HydrophobicContact CG1-CB 4.35Å; V754-F775 HydrophobicContact CG1-CD2 4.35Å; I755-F775 HydrophobicContact CB-CE2 4.23Å; I755-F775 HydrophobicContact CG1-CD2 4.32Å; I755-F775 HydrophobicContact CG1-CE2 4.15Å; I755-F775 HydrophobicContact CG2-CE2 4.01Å; I755-F775 HydrophobicContact CG2-CZ 4.25Å; V758-F775 HydrophobicContact CG1-CE2 4.48Å; H769-F775 AromaticContact CD2-CD2 3.73Å; H769-F775 AromaticContact NE2-CD2 3.75Å; F770-F775 HydrophobicContact CD1-CE1 4.48Å; F770-F775 HydrophobicContact CD1-CE2 4.45Å; F770-F775 HydrophobicContact CD1-CZ 4.18Å; S772-F775 PolarHBondContact O-N 2.74Å; S772-F775 VanDerWaalsContact O-N 3.14Å; S772-F775 VanDerWaalsContact OG-CB 3.28Å; S772-F775 WeakPolarHBondContact OG-CB 3.34Å; S772-F775 PolarHBondContact OG-N 2.7Å; T773-F775 PolarHBondContact O-N 3.36Å; F775-T779 HydrophobicContact CD1-CG2 4.06Å; F775-T779 HydrophobicContact CE1-CG2 3.81Å; F775-T779 HydrophobicContact CZ-CG2 4.3Å; F775-T779 WeakPolarHBondContact O-CG2 3.41Å; F775-T779 PolarHBondContact O-N 2.94Å; F775-T779 PolarHBondContact O-OG1 3.49Å; F775-F809 HydrophobicContact CE1-CB 4.4Å; F775-F809 HydrophobicContact CE1-CD1 4.03Å; F775-F809 HydrophobicContact CE1-CD2 4.26Å; F775-F809 HydrophobicContact CE1-CE1 4.44Å; F775-F809 AromaticContact CE1-CG 3.93Å; F775-F809 HydrophobicContact CE1-CG 3.93Å; F775-F809 HydrophobicContact CZ-CB 4.12Å; F775-F809 HydrophobicContact CZ-CG 4.16Å; F775-T823 HydrophobicContact CD1-CG2 3.53Å; F775-T823 HydrophobicContact CE1-CG2 3.81Å
776	K	94.8	Very high	87.2	Confident	54 Å²	54	29.8 Å²	29.8	24%	0.235	16%	0.161	C	C	.	.	H	α-helix	trans	-55.1	-51.5	170.9	-176.7	-172	68.2	165.9	0	111.5	W730 S772 T773 T779 G780 N826	W730-K776 HydrophobicContact CH2-CG 4.36Å; W730-K776 HydrophobicContact CZ3-CD 4.42Å; W730-K776 HydrophobicContact CZ3-CG 4.16Å; S772-K776 PolarHBondContact O-N 3.31Å; S772-K776 VanDerWaalsContact O-N 3.1Å; T773-K776 WeakPolarHBondContact O-CB 3.35Å; T773-K776 PolarHBondContact O-N 3.46Å; K776-T779 PolarHBondContact O-OG1 3.43Å; K776-G780 PolarHBondContact O-N 3.11Å; K776-G780 VanDerWaalsContact O-N 3.09Å; K776-N826 PolarHBondContact O-ND2 2.76Å
777	N	96.2	Very high	88.4	Confident	7 Å²	7	28.8 Å²	28.8	4%	0.037	16%	0.156	C	C	.	.	H	α-helix	trans	-69.1	-43.3	-176.6	-62.1	-2.9	0	0	0	111.1	E723 A726 A727 W730 T773 T779 G780 V781	E723-N777 PolarHBondContact O-ND2 3.28Å; A726-N777 HydrophobicContact CB-CB 3.81Å; A727-N777 WeakPolarHBondContact CB-ND2 3.47Å; W730-N777 HydrophobicContact CE3-CB 4.17Å; T773-N777 WeakPolarHBondContact O-CB 3.38Å; T773-N777 PolarHBondContact O-N 2.89Å; T773-N777 PolarHBondContact O-OD1 2.79Å; N777-T779 PolarHBondContact O-N 2.71Å; N777-G780 WeakPolarHBondContact O-CA 3.35Å; N777-G780 PolarHBondContact O-N 3.49Å; N777-G780 VanDerWaalsContact O-N 3.12Å; N777-V781 WeakPolarHBondContact O-CG2 3.37Å; N777-V781 PolarHBondContact O-N 3.36Å
778	S	96.9	Very high	89.2	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-61	-43.9	178.4	-59.6	0	0	0	0	112.4	L774 G780 V781 L782	L774-S778 VanDerWaalsContact O-CB 3.24Å; L774-S778 WeakPolarHBondContact O-CB 3.48Å; L774-S778 PolarHBondContact O-N 3.46Å; L774-S778 PolarHBondContact O-OG 3.37Å; S778-G780 VanDerWaalsContact C-N 3.3Å; S778-G780 PolarHBondContact O-N 3.26Å; S778-V781 PolarHBondContact O-N 3.41Å; S778-L782 WeakPolarHBondContact O-CG 3.21Å; S778-L782 PolarHBondContact O-N 2.8Å
779	T	96.4	Very high	89.8	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-67.1	-31.9	175.2	51.5	0	0	0	0	112.2	I755 F775 K776 N777 L782 R783 L806	I755-T779 HydrophobicContact CD1-CG2 3.89Å; I755-T779 HydrophobicContact CG1-CG2 4.3Å; F775-T779 HydrophobicContact CD1-CG2 4.06Å; F775-T779 HydrophobicContact CE1-CG2 3.81Å; F775-T779 HydrophobicContact CZ-CG2 4.3Å; F775-T779 WeakPolarHBondContact O-CG2 3.41Å; F775-T779 PolarHBondContact O-N 2.94Å; F775-T779 PolarHBondContact O-OG1 3.49Å; K776-T779 PolarHBondContact O-OG1 3.43Å; N777-T779 PolarHBondContact O-N 2.71Å; T779-L782 PolarHBondContact O-N 3.03Å; T779-R783 WeakPolarHBondContact O-CB 3.4Å; T779-R783 PolarHBondContact O-N 2.86Å; T779-L806 HydrophobicContact CG2-CD2 3.95Å
780	G	96.3	Very high	90.1	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-63.6	-45.8	172	0	0	0	0	0	114.2	W730 K776 N777 S778 L782 R783 N784 N826	W730-G780 VanDerWaalsContact CD1-C 3.43Å; W730-G780 PolarHBondContact NE1-O 3.46Å; K776-G780 PolarHBondContact O-N 3.11Å; K776-G780 VanDerWaalsContact O-N 3.09Å; N777-G780 WeakPolarHBondContact O-CA 3.35Å; N777-G780 PolarHBondContact O-N 3.49Å; N777-G780 VanDerWaalsContact O-N 3.12Å; S778-G780 VanDerWaalsContact C-N 3.3Å; S778-G780 PolarHBondContact O-N 3.26Å; G780-L782 PolarHBondContact O-N 3.27Å; G780-R783 WeakPolarHBondContact O-CB 3.49Å; G780-R783 PolarHBondContact O-N 2.99Å; G780-N784 PolarHBondContact O-N 3.16Å; G780-N826 VanDerWaalsContact CA-ND2 3.33Å; G780-N826 WeakPolarHBondContact CA-ND2 3.28Å; G780-N826 PolarHBondContact N-ND2 3.07Å
781	V	97.4	Very high	90.3	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-57.5	-49.3	173.2	177.8	0	0	0	0	110.6	L729 W730 I742 L750 N777 S778 R783 N784 V785	L729-V781 HydrophobicContact CB-CG2 3.8Å; W730-V781 HydrophobicContact CB-CG2 3.93Å; I742-V781 HydrophobicContact CG2-CG1 3.67Å; L750-V781 HydrophobicContact CD1-CB 3.78Å; L750-V781 HydrophobicContact CD1-CG1 3.58Å; L750-V781 HydrophobicContact CD1-CG2 4.1Å; N777-V781 WeakPolarHBondContact O-CG2 3.37Å; N777-V781 PolarHBondContact O-N 3.36Å; S778-V781 PolarHBondContact O-N 3.41Å; V781-R783 PolarHBondContact O-N 2.85Å; V781-N784 PolarHBondContact O-N 3.03Å; V781-V785 HydrophobicContact CG1-CG2 4.32Å; V781-V785 WeakPolarHBondContact O-CG2 3.14Å; V781-V785 PolarHBondContact O-N 3.23Å
782	L	97.4	Very high	91.2	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-66.7	-37	-178	-62.8	-167.4	0	0	0	112.2	T747 L750 I755 S778 T779 G780 N784 S786 L796 L802 L830	T747-L782 HydrophobicContact CG2-CD2 3.64Å; L750-L782 HydrophobicContact CD1-CD2 4.47Å; I755-L782 HydrophobicContact CD1-CD1 3.52Å; I755-L782 HydrophobicContact CD1-CG 4.36Å; S778-L782 WeakPolarHBondContact O-CG 3.21Å; S778-L782 PolarHBondContact O-N 2.8Å; T779-L782 PolarHBondContact O-N 3.03Å; G780-L782 PolarHBondContact O-N 3.27Å; L782-N784 PolarHBondContact O-N 2.83Å; L782-S786 VanDerWaalsContact O-CB 3.23Å; L782-S786 WeakPolarHBondContact O-CB 3.49Å; L782-S786 PolarHBondContact O-N 3.48Å; L782-S786 PolarHBondContact O-OG 3.07Å; L782-L796 HydrophobicContact CD2-CD2 4Å; L782-L802 HydrophobicContact CD1-CD1 3.73Å; L782-L802 HydrophobicContact CD1-CD2 4.01Å; L782-L830 HydrophobicContact CB-CD1 4.18Å; L782-L830 HydrophobicContact CB-CD2 3.61Å; L782-L830 HydrophobicContact CD1-CD2 4.29Å
783	R	96.1	Very high	91.4	Very high	8 Å²	8	22.7 Å²	22.7	3%	0.03	12%	0.124	C	C	.	.	H	α-helix	trans	-51.9	-56	171.1	170.7	-172.2	-179	168.1	2.3	110.3	T779 G780 V781 S786 E825 N826 C829 E912	T779-R783 WeakPolarHBondContact O-CB 3.4Å; T779-R783 PolarHBondContact O-N 2.86Å; G780-R783 WeakPolarHBondContact O-CB 3.49Å; G780-R783 PolarHBondContact O-N 2.99Å; V781-R783 PolarHBondContact O-N 2.85Å; R783-S786 PolarHBondContact O-N 3.03Å; R783-S786 PolarHBondContact O-OG 3.39Å; R783-E825 IonicContact CZ-OE1 2.77Å; R783-E825 IonicContact NH1-OE1 2.67Å; R783-E825 PolarHBondContact NH1-OE1 3.39Å; R783-E825 IonicContact NH2-OE1 3.28Å; R783-N826 VanDerWaalsContact CD-OD1 3.31Å; R783-N826 WeakPolarHBondContact CD-OD1 3.49Å; R783-N826 PolarHBondContact NH1-OD1 3.48Å; R783-C829 HydrophobicContact CG-CB 3.79Å; R783-C829 VanDerWaalsContact CZ-SG 3.53Å; R783-E912 IonicContact NH2-OE2 3.24Å; R783-E912 PolarHBondContact NH2-OE2 2.64Å
784	N	94.9	Very high	91.3	Very high	20 Å²	20	24.8 Å²	24.8	11%	0.107	13%	0.125	C	C	.	.	H	α-helix	trans	-64.6	-47.5	-176.1	-67	-1.7	0	0	0	111.8	S733 G780 V781 L782 S786 A787	S733-N784 WeakPolarHBondContact O-CB 3.14Å; S733-N784 WeakPolarHBondContact OG-CB 3.05Å; S733-N784 PolarHBondContact OG-ND2 3.31Å; G780-N784 PolarHBondContact O-N 3.16Å; V781-N784 PolarHBondContact O-N 3.03Å; L782-N784 PolarHBondContact O-N 2.83Å; N784-S786 VanDerWaalsContact C-N 3.26Å; N784-S786 PolarHBondContact O-N 3.17Å; N784-A787 WeakPolarHBondContact O-CB 3.49Å; N784-A787 PolarHBondContact O-N 2.97Å; N784-A787 VanDerWaalsContact O-N 3.15Å
785	V	94.4	Very high	91.2	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-62.8	-31.8	178.7	174.8	0	0	0	0	112.3	I742 L743 T747 V781 A787 A788 A792	I742-V785 HydrophobicContact CB-CG2 4.1Å; I742-V785 HydrophobicContact CG2-CG2 3.71Å; L743-V785 HydrophobicContact CB-CG1 3.72Å; L743-V785 HydrophobicContact CD1-CG1 3.78Å; L743-V785 HydrophobicContact CG-CG1 4.32Å; T747-V785 HydrophobicContact CG2-CB 4.48Å; T747-V785 HydrophobicContact CG2-CG1 3.96Å; V781-V785 HydrophobicContact CG1-CG2 4.32Å; V781-V785 WeakPolarHBondContact O-CG2 3.14Å; V781-V785 PolarHBondContact O-N 3.23Å; V785-A787 PolarHBondContact O-N 3.33Å; V785-A788 WeakPolarHBondContact O-CB 3.39Å; V785-A788 PolarHBondContact O-N 3.01Å; V785-A792 WeakPolarHBondContact O-CB 3.24Å
786	S	93.5	Very high	91.1	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-68.8	-15.5	177.8	74.5	0	0	0	0	114.9	L782 R783 N784 R793 N833	L782-S786 VanDerWaalsContact O-CB 3.23Å; L782-S786 WeakPolarHBondContact O-CB 3.49Å; L782-S786 PolarHBondContact O-N 3.48Å; L782-S786 PolarHBondContact O-OG 3.07Å; R783-S786 PolarHBondContact O-N 3.03Å; R783-S786 PolarHBondContact O-OG 3.39Å; N784-S786 VanDerWaalsContact C-N 3.26Å; N784-S786 PolarHBondContact O-N 3.17Å; S786-R793 WeakPolarHBondContact O-CG 3.22Å; S786-R793 PolarHBondContact O-NH1 3.42Å; S786-N833 WeakPolarHBondContact OG-CB 3.36Å; S786-N833 PolarHBondContact OG-ND2 3.18Å
787	A	87.6	Confident	91	Very high	11 Å²	11	25.4 Å²	25.4	9%	0.091	12%	0.124	C	C	.	.	H	α-helix	trans	-78.1	-39	174	0	0	0	0	0	111.9	N784 V785 S789 R793 Q1105 E1108	N784-A787 WeakPolarHBondContact O-CB 3.49Å; N784-A787 PolarHBondContact O-N 2.97Å; N784-A787 VanDerWaalsContact O-N 3.15Å; V785-A787 PolarHBondContact O-N 3.33Å; A787-S789 PolarHBondContact O-N 3.29Å; A787-S789 VanDerWaalsContact O-N 3.15Å; A787-R793 PolarHBondContact O-NH1 3.14Å; A787-Q1105 PolarHBondContact O-OE1 3Å; A787-E1108 HydrophobicContact CB-CG 4.23Å; A787-E1108 WeakPolarHBondContact CB-OE1 3.37Å
788	A	79.1	Confident	90.8	Very high	42 Å²	42	30.2 Å²	30.2	35%	0.347	15%	0.15	S	C	.	.	H	α-helix	trans	-49	-46.2	-166.9	0	0	0	0	0	116.3	K739 V785	K739-A788 HydrophobicContact CB-CB 3.74Å; K739-A788 HydrophobicContact CD-CB 3.85Å; K739-A788 HydrophobicContact CG-CB 4.39Å; V785-A788 WeakPolarHBondContact O-CB 3.39Å; V785-A788 PolarHBondContact O-N 3.01Å
789	S	80.4	Confident	90.6	Very high	40 Å²	40	31 Å²	31	28%	0.28	15%	0.154	S	C	.	.			trans	-160	166.9	-177.7	78.1	0	0	0	0	114.3	A787 Q791 A792 R793	A787-S789 PolarHBondContact O-N 3.29Å; A787-S789 VanDerWaalsContact O-N 3.15Å; S789-Q791 VanDerWaalsContact C-N 3.26Å; S789-Q791 PolarHBondContact O-N 3.15Å; S789-Q791 PolarHBondContact OG-N 3.39Å; S789-A792 WeakPolarHBondContact O-CB 3.47Å; S789-A792 PolarHBondContact O-N 3.15Å; S789-A792 PolarHBondContact OG-N 2.94Å; S789-R793 VanDerWaalsContact C-CZ 3.49Å; S789-R793 VanDerWaalsContact O-CZ 3.25Å; S789-R793 PolarHBondContact O-N 3.44Å; S789-R793 VanDerWaalsContact O-N 3.13Å; S789-R793 PolarHBondContact O-NH1 2.87Å
790	Q	80.8	Confident	90.3	Very high	61 Å²	61	35 Å²	35	29%	0.285	18%	0.18	S	C	.	.	H	α-helix	trans	-63.9	-32.6	171	-172	173.9	25.3	0	0	112	R793 R794 E840	Q790-R793 PolarHBondContact O-N 3.26Å; Q790-R794 WeakPolarHBondContact O-CB 3.48Å; Q790-R794 WeakPolarHBondContact O-CG 3.48Å; Q790-R794 PolarHBondContact O-N 2.9Å; Q790-E840 PolarHBondContact NE2-OE2 2.96Å
791	Q	81.7	Confident	90.1	Very high	138 Å²	138	38.4 Å²	38.4	65%	0.645	20%	0.198	S	C	*	.	H	α-helix	trans	-66.4	-40.6	174.6	-174.4	-178.1	2.4	0	0	111.4	S789 R793 R794 R795	S789-Q791 VanDerWaalsContact C-N 3.26Å; S789-Q791 PolarHBondContact O-N 3.15Å; S789-Q791 PolarHBondContact OG-N 3.39Å; Q791-R793 PolarHBondContact O-N 3.16Å; Q791-R794 PolarHBondContact O-N 3.3Å; Q791-R795 WeakPolarHBondContact O-CB 3.39Å; Q791-R795 PolarHBondContact O-N 3.08Å
792	A	87.6	Confident	90	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.008	20%	0.198	C	C	.	.	H	α-helix	trans	-59.7	-46.4	173.2	0	0	0	0	0	111.3	L743 V785 S789 R795 L796	L743-A792 HydrophobicContact CD1-CB 4.09Å; L743-A792 HydrophobicContact CD2-CB 3.82Å; V785-A792 WeakPolarHBondContact O-CB 3.24Å; S789-A792 WeakPolarHBondContact O-CB 3.47Å; S789-A792 PolarHBondContact O-N 3.15Å; S789-A792 PolarHBondContact OG-N 2.94Å; A792-R795 PolarHBondContact O-N 3.38Å; A792-L796 WeakPolarHBondContact O-CB 3.47Å; A792-L796 VanDerWaalsContact O-CG 3.25Å; A792-L796 WeakPolarHBondContact O-CG 3.13Å; A792-L796 PolarHBondContact O-N 3.32Å
793	R	91.3	Very high	89.9	Confident	7 Å²	7	38.5 Å²	38.5	3%	0.026	20%	0.199	C	C	.	.	H	α-helix	trans	-65	-37.7	176.2	-71.9	178.6	-74.5	-87.2	9.6	113.7	S786 A787 S789 Q790 Q791 R797 N833 Q1105	S786-R793 WeakPolarHBondContact O-CG 3.22Å; S786-R793 PolarHBondContact O-NH1 3.42Å; A787-R793 PolarHBondContact O-NH1 3.14Å; S789-R793 VanDerWaalsContact C-CZ 3.49Å; S789-R793 VanDerWaalsContact O-CZ 3.25Å; S789-R793 PolarHBondContact O-N 3.44Å; S789-R793 VanDerWaalsContact O-N 3.13Å; S789-R793 PolarHBondContact O-NH1 2.87Å; Q790-R793 PolarHBondContact O-N 3.26Å; Q791-R793 PolarHBondContact O-N 3.16Å; R793-R797 VanDerWaalsContact O-CB 3.28Å; R793-R797 WeakPolarHBondContact O-CB 3.45Å; R793-R797 WeakPolarHBondContact O-CD 3.34Å; R793-R797 WeakPolarHBondContact O-CG 3.4Å; R793-R797 PolarHBondContact O-N 2.82Å; R793-N833 WeakPolarHBondContact CD-O 3.4Å; R793-Q1105 VanDerWaalsContact NH2-CD 3.28Å
794	R	87.6	Confident	89.8	Confident	107 Å²	107	39.6 Å²	39.6	40%	0.404	20%	0.204	S	C	.	.	H	α-helix	trans	-60.7	-58.7	172	-78	172.5	176.9	170.2	-1.2	110	Q790 Q791 L796 R797 D798 E840 V841	Q790-R794 WeakPolarHBondContact O-CB 3.48Å; Q790-R794 WeakPolarHBondContact O-CG 3.48Å; Q790-R794 PolarHBondContact O-N 2.9Å; Q791-R794 PolarHBondContact O-N 3.3Å; R794-L796 VanDerWaalsContact C-N 3.31Å; R794-L796 PolarHBondContact O-N 3.13Å; R794-R797 WeakPolarHBondContact O-CA 3.46Å; R794-R797 VanDerWaalsContact O-CB 3.29Å; R794-R797 WeakPolarHBondContact O-CB 3.24Å; R794-R797 PolarHBondContact O-N 2.7Å; R794-D798 PolarHBondContact O-N 3.49Å; R794-D798 VanDerWaalsContact O-N 3.08Å; R794-D798 VanDerWaalsContact O-OD2 3.07Å; R794-E840 PolarHBondContact NH2-O 3.05Å; R794-V841 HydrophobicContact CG-CG1 4.24Å; R794-V841 HydrophobicContact CG-CG2 3.69Å
795	R	90.3	Very high	89.7	Confident	88 Å²	88	38.6 Å²	38.6	33%	0.332	20%	0.199	S	C	.	.	H	α-helix	trans	-55.5	-42.2	-179.7	-177.2	169.4	175.8	167.8	-2.8	112.9	L743 E744 Q791 A792 D798 I799	L743-R795 HydrophobicContact CD1-CB 4.29Å; L743-R795 HydrophobicContact CD1-CG 4.31Å; E744-R795 PolarHBondContact O-NH2 3.1Å; Q791-R795 WeakPolarHBondContact O-CB 3.39Å; Q791-R795 PolarHBondContact O-N 3.08Å; A792-R795 PolarHBondContact O-N 3.38Å; R795-D798 PolarHBondContact O-N 3.08Å; R795-I799 WeakPolarHBondContact O-CG1 3.37Å; R795-I799 PolarHBondContact O-N 2.97Å
796	L	93.5	Very high	89.8	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-69.3	-34	176.8	-69.6	171.9	0	0	0	113.5	L743 T747 L782 A792 R794 D798 I799 L802 L834	L743-L796 HydrophobicContact CD1-CG 4.42Å; T747-L796 HydrophobicContact CG2-CD2 4.02Å; L782-L796 HydrophobicContact CD2-CD2 4Å; A792-L796 WeakPolarHBondContact O-CB 3.47Å; A792-L796 VanDerWaalsContact O-CG 3.25Å; A792-L796 WeakPolarHBondContact O-CG 3.13Å; A792-L796 PolarHBondContact O-N 3.32Å; R794-L796 VanDerWaalsContact C-N 3.31Å; R794-L796 PolarHBondContact O-N 3.13Å; L796-D798 VanDerWaalsContact C-N 3.26Å; L796-D798 PolarHBondContact O-N 3.37Å; L796-I799 HydrophobicContact CD2-CD1 3.89Å; L796-I799 PolarHBondContact O-N 2.7Å; L796-L802 HydrophobicContact CD2-CD2 4.34Å; L796-L834 HydrophobicContact CB-CD2 3.63Å; L796-L834 HydrophobicContact CD1-CD2 4.37Å
797	R	92.5	Very high	89.9	Confident	3 Å²	3	39.3 Å²	39.3	1%	0.011	20%	0.203	C	C	.	.	H	α-helix	trans	-63.4	-32.6	172.3	-86.3	170.8	-168.5	156.2	10.6	112.6	R793 R794 L834 Y836 R837 P889	R793-R797 VanDerWaalsContact O-CB 3.28Å; R793-R797 WeakPolarHBondContact O-CB 3.45Å; R793-R797 WeakPolarHBondContact O-CD 3.34Å; R793-R797 WeakPolarHBondContact O-CG 3.4Å; R793-R797 PolarHBondContact O-N 2.82Å; R794-R797 WeakPolarHBondContact O-CA 3.46Å; R794-R797 VanDerWaalsContact O-CB 3.29Å; R794-R797 WeakPolarHBondContact O-CB 3.24Å; R794-R797 PolarHBondContact O-N 2.7Å; R797-L834 HydrophobicContact CG-CD2 4.32Å; R797-L834 PolarHBondContact NE-O 2.72Å; R797-L834 PolarHBondContact NH2-O 2.96Å; R797-Y836 PolarHBondContact NH2-O 3.23Å; R797-R837 PolarHBondContact NH1-O 2.89Å; R797-P889 HydrophobicContact CB-CG 3.82Å; R797-P889 HydrophobicContact CG-CG 4.16Å
798	D	91.1	Very high	90.2	Very high	109 Å²	109	42.1 Å²	42.1	58%	0.583	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-10.3	-175.9	-57.1	-31	0	0	0	112.9	R794 R795 L796 P800	R794-D798 PolarHBondContact O-N 3.49Å; R794-D798 VanDerWaalsContact O-N 3.08Å; R794-D798 VanDerWaalsContact O-OD2 3.07Å; R795-D798 PolarHBondContact O-N 3.08Å; L796-D798 VanDerWaalsContact C-N 3.26Å; L796-D798 PolarHBondContact O-N 3.37Å; D798-P800 WeakPolarHBondContact O-CD 3.19Å
799	I	92.3	Very high	90.9	Very high	17 Å²	17	40.4 Å²	40.4	9%	0.087	20%	0.199	C	C	.	.	S	Bend	trans	-69.3	119.6	176.6	-58.5	-176	0	0	0	110	R795 L796 N801 L802	R795-I799 WeakPolarHBondContact O-CG1 3.37Å; R795-I799 PolarHBondContact O-N 2.97Å; L796-I799 HydrophobicContact CD2-CD1 3.89Å; L796-I799 PolarHBondContact O-N 2.7Å; I799-N801 PolarHBondContact O-N 3.47Å; I799-L802 HydrophobicContact CB-CB 4.22Å; I799-L802 HydrophobicContact CB-CD2 4.35Å; I799-L802 HydrophobicContact CD1-CD2 4.4Å; I799-L802 HydrophobicContact CG2-CB 4.23Å; I799-L802 PolarHBondContact O-N 3.26Å
800	P	91.4	Very high	91.7	Very high	83 Å²	83	38.6 Å²	38.6	54%	0.539	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	137.7	-178.3	-25.9	35.1	0	0	0	112.8	Q752 D798 L802	Q752-P800 PolarHBondContact NE2-O 2.76Å; D798-P800 WeakPolarHBondContact O-CD 3.19Å; P800-L802 PolarHBondContact O-N 3.5Å; P800-L802 VanDerWaalsContact O-N 3.11Å
801	N	91.5	Very high	92.3	Very high	72 Å²	72	36.8 Å²	36.8	39%	0.385	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.6	-1	174.9	-55.6	-58.7	0	0	0	116.8	A756 L759 I799 E804 A805	A756-N801 HydrophobicContact CB-CB 3.95Å; L759-N801 HydrophobicContact CD1-CB 3.85Å; I799-N801 PolarHBondContact O-N 3.47Å; N801-E804 VanDerWaalsContact CA-OE2 3.24Å; N801-E804 WeakPolarHBondContact CA-OE2 3.27Å; N801-A805 VanDerWaalsContact O-CB 3.22Å; N801-A805 WeakPolarHBondContact O-CB 3.38Å; N801-A805 PolarHBondContact O-N 2.97Å
802	L	94.9	Very high	92.8	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-64.3	-48.3	-177.7	175.3	59.6	0	0	0	111.7	I755 L782 L796 I799 P800 A805 L806	I755-L802 HydrophobicContact CB-CD1 4.26Å; I755-L802 HydrophobicContact CD1-CD1 4.08Å; I755-L802 HydrophobicContact CG2-CD1 3.85Å; L782-L802 HydrophobicContact CD1-CD1 3.73Å; L782-L802 HydrophobicContact CD1-CD2 4.01Å; L796-L802 HydrophobicContact CD2-CD2 4.34Å; I799-L802 HydrophobicContact CB-CB 4.22Å; I799-L802 HydrophobicContact CB-CD2 4.35Å; I799-L802 HydrophobicContact CD1-CD2 4.4Å; I799-L802 HydrophobicContact CG2-CB 4.23Å; I799-L802 PolarHBondContact O-N 3.26Å; P800-L802 PolarHBondContact O-N 3.5Å; P800-L802 VanDerWaalsContact O-N 3.11Å; L802-A805 PolarHBondContact O-N 3.29Å; L802-L806 HydrophobicContact CD1-CD1 4.04Å; L802-L806 HydrophobicContact CD1-CG 4.37Å; L802-L806 HydrophobicContact CG-CD1 4.14Å; L802-L806 WeakPolarHBondContact O-CD1 3.35Å; L802-L806 VanDerWaalsContact O-CG 3.26Å; L802-L806 WeakPolarHBondContact O-CG 3.45Å; L802-L806 PolarHBondContact O-N 3.27Å; L802-L806 VanDerWaalsContact O-N 3.13Å
803	I	95.4	Very high	93.1	Very high	2 Å²	2	31.3 Å²	31.3	1%	0.01	15%	0.153	C	C	.	.	H	α-helix	trans	-68.4	-42.1	-177.8	-64.2	172	0	0	0	110.1	A805 L806 V807 L831 L834 V891 L892	I803-A805 PolarHBondContact O-N 2.73Å; I803-L806 PolarHBondContact O-N 3Å; I803-V807 WeakPolarHBondContact O-CB 3.48Å; I803-V807 WeakPolarHBondContact O-CG2 3.43Å; I803-V807 PolarHBondContact O-N 3.2Å; I803-L831 HydrophobicContact CG2-CD2 4.18Å; I803-L834 HydrophobicContact CG1-CD1 4.12Å; I803-V891 HydrophobicContact CG2-CB 3.87Å; I803-V891 HydrophobicContact CG2-CG1 4.05Å; I803-L892 HydrophobicContact CD1-CD1 3.94Å; I803-L892 HydrophobicContact CD1-CG 4.28Å; I803-L892 HydrophobicContact CG2-CD2 3.98Å; I803-L892 HydrophobicContact CG2-CG 3.89Å
804	E	94.2	Very high	93.2	Very high	30 Å²	30	32.2 Å²	32.2	14%	0.14	16%	0.159	C	C	.	.	H	α-helix	trans	-59.8	-43.7	176.4	-65.5	89	154.4	0	0	111.9	L759 N801 V807 H808 T887 G888 V891	L759-E804 HydrophobicContact CD1-CB 3.58Å; N801-E804 VanDerWaalsContact CA-OE2 3.24Å; N801-E804 WeakPolarHBondContact CA-OE2 3.27Å; E804-V807 PolarHBondContact O-N 3.18Å; E804-H808 WeakPolarHBondContact O-CB 3.42Å; E804-H808 PolarHBondContact O-N 3.14Å; E804-T887 WeakPolarHBondContact OE1-CA 3.42Å; E804-T887 VanDerWaalsContact OE1-CB 3.24Å; E804-T887 WeakPolarHBondContact OE1-CB 3.5Å; E804-G888 PolarHBondContact OE1-N 2.9Å; E804-V891 HydrophobicContact CG-CG2 4.13Å
805	A	93.8	Very high	93.5	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-67	-40.1	178.1	0	0	0	0	0	112.6	I755 V758 L759 N801 L802 I803 H808 F809	I755-A805 HydrophobicContact CG2-CB 3.77Å; V758-A805 HydrophobicContact CG1-CB 4.04Å; L759-A805 HydrophobicContact CD1-CB 4.3Å; L759-A805 HydrophobicContact CD2-CB 4.48Å; L759-A805 HydrophobicContact CG-CB 4.11Å; N801-A805 VanDerWaalsContact O-CB 3.22Å; N801-A805 WeakPolarHBondContact O-CB 3.38Å; N801-A805 PolarHBondContact O-N 2.97Å; L802-A805 PolarHBondContact O-N 3.29Å; I803-A805 PolarHBondContact O-N 2.73Å; A805-H808 PolarHBondContact O-N 3.15Å; A805-F809 WeakPolarHBondContact O-CB 3.43Å; A805-F809 PolarHBondContact O-N 2.68Å
806	L	96.2	Very high	93.5	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-64.9	-42.1	174.3	-67.5	165.2	0	0	0	111.6	I755 T779 L802 I803 F809 L810 A827 L830 L831	I755-L806 HydrophobicContact CG2-CD2 4.46Å; I755-L806 HydrophobicContact CG2-CG 4.49Å; T779-L806 HydrophobicContact CG2-CD2 3.95Å; L802-L806 HydrophobicContact CD1-CD1 4.04Å; L802-L806 HydrophobicContact CD1-CG 4.37Å; L802-L806 HydrophobicContact CG-CD1 4.14Å; L802-L806 WeakPolarHBondContact O-CD1 3.35Å; L802-L806 VanDerWaalsContact O-CG 3.26Å; L802-L806 WeakPolarHBondContact O-CG 3.45Å; L802-L806 PolarHBondContact O-N 3.27Å; L802-L806 VanDerWaalsContact O-N 3.13Å; I803-L806 PolarHBondContact O-N 3Å; L806-F809 WeakPolarHBondContact O-CB 3.41Å; L806-F809 PolarHBondContact O-N 3.07Å; L806-L810 WeakPolarHBondContact O-CG 3.33Å; L806-L810 PolarHBondContact O-N 3.38Å; L806-A827 HydrophobicContact CD2-CB 3.9Å; L806-L830 HydrophobicContact CD1-CD2 3.56Å; L806-L830 HydrophobicContact CD1-CG 3.96Å; L806-L830 HydrophobicContact CD2-CD2 4.11Å; L806-L830 HydrophobicContact CG-CD2 4.49Å; L806-L831 HydrophobicContact CB-CD1 4.17Å; L806-L831 HydrophobicContact CB-CD2 3.98Å; L806-L831 HydrophobicContact CB-CG 4.2Å; L806-L831 HydrophobicContact CD1-CD2 3.95Å; L806-L831 HydrophobicContact CD1-CG 4.32Å
807	V	95.6	Very high	93.4	Very high	14 Å²	14	40.1 Å²	40.1	9%	0.085	21%	0.214	C	C	.	.	H	α-helix	trans	-67.4	-38.7	176.1	166.3	0	0	0	0	111.8	I803 E804 L810 T811 L831 V891 V897 L900	I803-V807 WeakPolarHBondContact O-CB 3.48Å; I803-V807 WeakPolarHBondContact O-CG2 3.43Å; I803-V807 PolarHBondContact O-N 3.2Å; E804-V807 PolarHBondContact O-N 3.18Å; V807-L810 PolarHBondContact O-N 2.93Å; V807-T811 WeakPolarHBondContact O-CB 3.34Å; V807-T811 PolarHBondContact O-N 3.01Å; V807-T811 PolarHBondContact O-OG1 3.28Å; V807-L831 HydrophobicContact CG2-CD1 4.35Å; V807-V891 HydrophobicContact CB-CG1 4.47Å; V807-V891 HydrophobicContact CG1-CG1 4.5Å; V807-V891 HydrophobicContact CG2-CG1 4.05Å; V807-V897 HydrophobicContact CG1-CG2 3.76Å; V807-V897 HydrophobicContact CG2-CG1 4.14Å; V807-V897 HydrophobicContact CG2-CG2 3.89Å; V807-L900 HydrophobicContact CG1-CD1 4Å
808	H	93.3	Very high	93.3	Very high	70 Å²	70	45.6 Å²	45.6	32%	0.324	24%	0.24	S	C	.	.	H	α-helix	trans	-63.1	-43.7	173.2	-178	-135.8	0	0	0	111.5	V758 L759 F770 E804 A805 T811 H812	V758-H808 PolarHBondContact O-CE1 2.82Å; V758-H808 PolarHBondContact O-ND1 3.46Å; L759-H808 HydrophobicContact CD2-CB 3.63Å; F770-H808 AromaticContact CZ-ND1 3.78Å; E804-H808 WeakPolarHBondContact O-CB 3.42Å; E804-H808 PolarHBondContact O-N 3.14Å; A805-H808 PolarHBondContact O-N 3.15Å; H808-T811 PolarHBondContact O-N 3.26Å; H808-H812 PolarHBondContact O-N 2.98Å
809	F	94.4	Very high	93.4	Very high	7 Å²	7	40.9 Å²	40.9	3%	0.031	21%	0.214	C	C	.	.	H	α-helix	trans	-58.5	-52.6	173.4	167.4	-119.6	0	0	0	112.4	F770 F775 A805 L806 T811 H812 A813 T823 V824 A827	F770-F809 HydrophobicContact CB-CD2 3.89Å; F770-F809 HydrophobicContact CB-CE2 4.04Å; F770-F809 HydrophobicContact CD1-CB 3.83Å; F770-F809 AromaticContact CD1-CD2 3.36Å; F770-F809 HydrophobicContact CD1-CD2 3.36Å; F770-F809 HydrophobicContact CD1-CE2 4.32Å; F770-F809 AromaticContact CD1-CG 3.94Å; F770-F809 HydrophobicContact CD1-CG 3.94Å; F770-F809 HydrophobicContact CD2-CD2 4.41Å; F770-F809 VanDerWaalsContact CE1-CA 3.48Å; F770-F809 HydrophobicContact CE1-CB 3.47Å; F770-F809 VanDerWaalsContact CE1-CB 3.47Å; F770-F809 AromaticContact CE1-CD2 3.87Å; F770-F809 HydrophobicContact CE1-CD2 3.87Å; F770-F809 HydrophobicContact CE1-CG 4.11Å; F770-F809 AromaticContact CG-CD2 3.67Å; F770-F809 HydrophobicContact CG-CD2 3.67Å; F770-F809 HydrophobicContact CG-CE2 4.32Å; F770-F809 HydrophobicContact CZ-CB 4.2Å; F775-F809 HydrophobicContact CE1-CB 4.4Å; F775-F809 HydrophobicContact CE1-CD1 4.03Å; F775-F809 HydrophobicContact CE1-CD2 4.26Å; F775-F809 HydrophobicContact CE1-CE1 4.44Å; F775-F809 AromaticContact CE1-CG 3.93Å; F775-F809 HydrophobicContact CE1-CG 3.93Å; F775-F809 HydrophobicContact CZ-CB 4.12Å; F775-F809 HydrophobicContact CZ-CG 4.16Å; A805-F809 WeakPolarHBondContact O-CB 3.43Å; A805-F809 PolarHBondContact O-N 2.68Å; L806-F809 WeakPolarHBondContact O-CB 3.41Å; L806-F809 PolarHBondContact O-N 3.07Å; F809-T811 VanDerWaalsContact C-N 3.28Å; F809-T811 PolarHBondContact O-N 2.85Å; F809-H812 WeakPolarHBondContact O-CB 3.37Å; F809-H812 PolarHBondContact O-N 3.22Å; F809-A813 HydrophobicContact CE2-CB 4.16Å; F809-A813 HydrophobicContact CZ-CB 4.33Å; F809-A813 PolarHBondContact O-N 3.02Å; F809-T823 HydrophobicContact CE1-CG2 3.67Å; F809-T823 WeakPolarHBondContact CE1-O 3.28Å; F809-T823 HydrophobicContact CE2-CG2 4.12Å; F809-T823 HydrophobicContact CZ-CG2 3.43Å; F809-T823 VanDerWaalsContact CZ-CG2 3.43Å; F809-V824 HydrophobicContact CE1-CG2 3.93Å; F809-V824 HydrophobicContact CZ-CG2 3.7Å; F809-A827 HydrophobicContact CD1-CB 3.75Å; F809-A827 HydrophobicContact CE1-CB 3.8Å
810	L	95.8	Very high	93.4	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-60.9	-38.8	179.4	-68.6	-174.1	0	0	0	112	L806 V807 H812 A813 I814 V824 A827 V828 L831 L900 L904	L806-L810 WeakPolarHBondContact O-CG 3.33Å; L806-L810 PolarHBondContact O-N 3.38Å; V807-L810 PolarHBondContact O-N 2.93Å; L810-H812 VanDerWaalsContact C-N 3.32Å; L810-H812 PolarHBondContact O-N 3.46Å; L810-A813 PolarHBondContact O-N 2.96Å; L810-I814 WeakPolarHBondContact O-CB 3.44Å; L810-I814 WeakPolarHBondContact O-CD1 3.48Å; L810-I814 VanDerWaalsContact O-CG1 3.29Å; L810-I814 WeakPolarHBondContact O-CG1 3.34Å; L810-I814 PolarHBondContact O-N 2.82Å; L810-V824 HydrophobicContact CD2-CB 4.21Å; L810-V824 HydrophobicContact CD2-CG1 3.81Å; L810-V824 HydrophobicContact CD2-CG2 4.01Å; L810-A827 HydrophobicContact CD2-CB 4.03Å; L810-A827 HydrophobicContact CG-CB 4.41Å; L810-V828 HydrophobicContact CD1-CG2 3.75Å; L810-V828 HydrophobicContact CD2-CG2 3.85Å; L810-V828 HydrophobicContact CG-CG2 4.48Å; L810-L831 HydrophobicContact CD1-CD1 3.57Å; L810-L900 HydrophobicContact CB-CD1 4.3Å; L810-L904 HydrophobicContact CD1-CD1 4.41Å
811	T	94.8	Very high	93.4	Very high	23 Å²	23	40.4 Å²	40.4	14%	0.141	21%	0.211	C	C	.	.	H	α-helix	trans	-59.4	-43.4	173.8	-57.1	0	0	0	0	111.4	V807 H808 F809 Q815 L900	V807-T811 WeakPolarHBondContact O-CB 3.34Å; V807-T811 PolarHBondContact O-N 3.01Å; V807-T811 PolarHBondContact O-OG1 3.28Å; H808-T811 PolarHBondContact O-N 3.26Å; F809-T811 VanDerWaalsContact C-N 3.28Å; F809-T811 PolarHBondContact O-N 2.85Å; T811-Q815 WeakPolarHBondContact O-CB 2.97Å; T811-Q815 WeakPolarHBondContact O-CG 3.39Å; T811-Q815 PolarHBondContact O-N 3Å; T811-Q815 VanDerWaalsContact O-N 3.09Å; T811-L900 WeakPolarHBondContact OG1-CD1 3.31Å
812	H	92.3	Very high	93.4	Very high	22 Å²	22	39.3 Å²	39.3	10%	0.102	21%	0.207	C	C	.	.	H	α-helix	trans	-67.8	-45.9	176.5	-170.9	99.9	0	0	0	112.3	T767 F770 H808 F809 L810 I814 Q815 K816	T767-H812 WeakPolarHBondContact CG2-NE2 3.44Å; F770-H812 HydrophobicContact CD2-CB 4.06Å; F770-H812 AromaticContact CD2-CD2 3.63Å; F770-H812 AromaticContact CD2-CG 3.69Å; F770-H812 HydrophobicContact CE2-CB 3.54Å; F770-H812 AromaticContact CE2-CD2 3.91Å; F770-H812 AromaticContact CE2-CG 3.46Å; F770-H812 VanDerWaalsContact CE2-CG 3.46Å; F770-H812 AromaticContact CE2-ND1 3.74Å; F770-H812 HydrophobicContact CZ-CB 4.18Å; H808-H812 PolarHBondContact O-N 2.98Å; F809-H812 WeakPolarHBondContact O-CB 3.37Å; F809-H812 PolarHBondContact O-N 3.22Å; L810-H812 VanDerWaalsContact C-N 3.32Å; L810-H812 PolarHBondContact O-N 3.46Å; H812-I814 VanDerWaalsContact C-N 3.34Å; H812-I814 PolarHBondContact O-N 3.01Å; H812-Q815 CarbonylContact O-C 3.59Å; H812-Q815 WeakPolarHBondContact O-CB 3.43Å; H812-Q815 PolarHBondContact O-N 3.14Å; H812-Q815 VanDerWaalsContact O-N 3.14Å; H812-K816 WeakPolarHBondContact NE2-CE 3.47Å; H812-K816 WeakPolarHBondContact O-CG 3.34Å; H812-K816 PolarHBondContact O-N 3.08Å
813	A	92.7	Very high	93.4	Very high	2 Å²	2	40 Å²	40	2%	0.017	21%	0.211	C	C	.	.	H	α-helix	trans	-60	-43.1	179.9	0	0	0	0	0	111.7	F809 L810 K816 S817 Q818 V824	F809-A813 HydrophobicContact CE2-CB 4.16Å; F809-A813 HydrophobicContact CZ-CB 4.33Å; F809-A813 PolarHBondContact O-N 3.02Å; L810-A813 PolarHBondContact O-N 2.96Å; A813-K816 CarbonylContact O-C 3.58Å; A813-K816 PolarHBondContact O-N 3.49Å; A813-S817 PolarHBondContact O-N 2.82Å; A813-S817 VanDerWaalsContact O-N 3.07Å; A813-Q818 PolarHBondContact O-N 3.11Å; A813-V824 HydrophobicContact CB-CG2 3.54Å
814	I	94.7	Very high	93.4	Very high	27 Å²	27	39.9 Å²	39.9	14%	0.138	21%	0.211	C	C	.	.	H	α-helix	trans	-64.7	-42.1	174.3	-68.4	160.6	0	0	0	111.1	L810 H812 K816 S817 V819 L900 K903 L904	L810-I814 WeakPolarHBondContact O-CB 3.44Å; L810-I814 WeakPolarHBondContact O-CD1 3.48Å; L810-I814 VanDerWaalsContact O-CG1 3.29Å; L810-I814 WeakPolarHBondContact O-CG1 3.34Å; L810-I814 PolarHBondContact O-N 2.82Å; H812-I814 VanDerWaalsContact C-N 3.34Å; H812-I814 PolarHBondContact O-N 3.01Å; I814-K816 PolarHBondContact O-N 3.25Å; I814-S817 PolarHBondContact O-N 2.9Å; I814-S817 VanDerWaalsContact O-N 3.15Å; I814-V819 HydrophobicContact CG1-CG1 3.93Å; I814-L900 HydrophobicContact CD1-CB 4.08Å; I814-L900 HydrophobicContact CD1-CD2 3.86Å; I814-K903 HydrophobicContact CG2-CG 3.72Å; I814-L904 HydrophobicContact CD1-CD2 4.07Å; I814-L904 HydrophobicContact CD1-CG 3.99Å; I814-L904 HydrophobicContact CG1-CD2 3.97Å; I814-L904 HydrophobicContact CG1-CG 4.41Å
815	Q	92.6	Very high	93.5	Very high	145 Å²	145	38.8 Å²	38.8	68%	0.678	21%	0.206	S	C	*	.	H	α-helix	trans	-64.6	-19.9	174.9	-75.3	172.4	8.1	0	0	114.1	T811 H812	T811-Q815 WeakPolarHBondContact O-CB 2.97Å; T811-Q815 WeakPolarHBondContact O-CG 3.39Å; T811-Q815 PolarHBondContact O-N 3Å; T811-Q815 VanDerWaalsContact O-N 3.09Å; H812-Q815 CarbonylContact O-C 3.59Å; H812-Q815 WeakPolarHBondContact O-CB 3.43Å; H812-Q815 PolarHBondContact O-N 3.14Å; H812-Q815 VanDerWaalsContact O-N 3.14Å
816	K	90.2	Very high	93.6	Very high	111 Å²	111	38.8 Å²	38.8	48%	0.483	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	1.1	176.1	-64.9	-66.3	-172.5	172	0	113.6	H812 A813 I814 Q818	H812-K816 WeakPolarHBondContact NE2-CE 3.47Å; H812-K816 WeakPolarHBondContact O-CG 3.34Å; H812-K816 PolarHBondContact O-N 3.08Å; A813-K816 CarbonylContact O-C 3.58Å; A813-K816 PolarHBondContact O-N 3.49Å; I814-K816 PolarHBondContact O-N 3.25Å; K816-Q818 HydrophobicContact CB-CB 4.46Å; K816-Q818 HydrophobicContact CB-CG 4.01Å; K816-Q818 PolarHBondContact O-N 2.66Å
817	S	91.9	Very high	93.6	Very high	104 Å²	104	38.8 Å²	38.8	73%	0.727	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	57	28.4	-171.6	-51.8	0	0	0	0	114.5	A813 I814 V819	A813-S817 PolarHBondContact O-N 2.82Å; A813-S817 VanDerWaalsContact O-N 3.07Å; I814-S817 PolarHBondContact O-N 2.9Å; I814-S817 VanDerWaalsContact O-N 3.15Å; S817-V819 VanDerWaalsContact C-N 3.33Å; S817-V819 PolarHBondContact O-N 2.75Å
818	Q	90.6	Very high	93.7	Very high	119 Å²	119	38.1 Å²	38.1	56%	0.556	20%	0.202	S	C	*	.			trans	-97.6	38.5	-178.9	-68.6	-180	-20.6	0	0	112.4	A813 K816 D820 S821	A813-Q818 PolarHBondContact O-N 3.11Å; K816-Q818 HydrophobicContact CB-CB 4.46Å; K816-Q818 HydrophobicContact CB-CG 4.01Å; K816-Q818 PolarHBondContact O-N 2.66Å; Q818-D820 VanDerWaalsContact C-N 3.34Å; Q818-D820 PolarHBondContact O-N 2.87Å; Q818-S821 PolarHBondContact O-N 2.67Å; Q818-S821 PolarHBondContact O-OG 3.24Å; Q818-S821 VanDerWaalsContact O-OG 3.13Å
819	V	92.7	Very high	93.9	Very high	9 Å²	9	34.8 Å²	34.8	6%	0.055	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-26	-169.8	-65.1	0	0	0	0	114.6	I814 S817 V824 L904 D907	I814-V819 HydrophobicContact CG1-CG1 3.93Å; S817-V819 VanDerWaalsContact C-N 3.33Å; S817-V819 PolarHBondContact O-N 2.75Å; V819-V824 WeakPolarHBondContact O-CB 3.42Å; V819-V824 WeakPolarHBondContact O-CG1 3.17Å; V819-L904 HydrophobicContact CB-CD2 3.96Å; V819-L904 HydrophobicContact CG1-CD2 3.92Å; V819-D907 HydrophobicContact CG1-CB 4.32Å; V819-D907 HydrophobicContact CG2-CB 4.11Å
820	D	92.3	Very high	94	Very high	56 Å²	56	34.5 Å²	34.5	30%	0.299	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	9.2	-176.9	-70.3	-31	0	0	0	114.3	Q818 S908 S909 N910	Q818-D820 VanDerWaalsContact C-N 3.34Å; Q818-D820 PolarHBondContact O-N 2.87Å; D820-S908 WeakPolarHBondContact OD1-CA 3.49Å; D820-S908 WeakPolarHBondContact OD1-CB 3.21Å; D820-S908 PolarHBondContact OD1-OG 3Å; D820-S909 VanDerWaalsContact CG-N 3.28Å; D820-S909 PolarHBondContact OD1-N 2.65Å; D820-S909 WeakPolarHBondContact OD2-CB 3.38Å; D820-S909 PolarHBondContact OD2-N 3.5Å; D820-S909 PolarHBondContact OD2-OG 2.61Å; D820-N910 HydrophobicContact CB-CB 4.23Å; D820-N910 WeakPolarHBondContact OD1-CB 3.27Å; D820-N910 PolarHBondContact OD1-N 3.3Å
821	S	91.9	Very high	94.1	Very high	35 Å²	35	34.5 Å²	34.5	25%	0.245	19%	0.185	C	C	.	.	S	Bend	trans	-67.8	143.3	178.2	62.6	0	0	0	0	112.3	Q818 T823 V824 E825	Q818-S821 PolarHBondContact O-N 2.67Å; Q818-S821 PolarHBondContact O-OG 3.24Å; Q818-S821 VanDerWaalsContact O-OG 3.13Å; S821-T823 PolarHBondContact O-N 3.42Å; S821-V824 WeakPolarHBondContact O-CA 3.5Å; S821-V824 WeakPolarHBondContact O-CB 3.43Å; S821-V824 PolarHBondContact O-N 3.27Å; S821-V824 WeakPolarHBondContact OG-CG2 3.43Å; S821-V824 PolarHBondContact OG-N 3.5Å; S821-E825 PolarHBondContact O-N 2.89Å; S821-E825 VanDerWaalsContact O-N 3.12Å
822	P	91.3	Very high	94.2	Very high	49 Å²	49	33.5 Å²	33.5	32%	0.318	18%	0.179	S	C	.	.	H	α-helix	trans	-57.7	-23.5	176.1	-27.3	35.5	0	0	0	114.1	N826	P822-N826 WeakPolarHBondContact O-CB 3.3Å; P822-N826 PolarHBondContact O-N 3.17Å
823	T	94.2	Very high	94.3	Very high	14 Å²	14	32.9 Å²	32.9	9%	0.086	18%	0.176	C	C	.	.	H	α-helix	trans	-70.5	-38.7	173.1	-47.2	0	0	0	0	111.8	F775 F809 S821 A827	F775-T823 HydrophobicContact CD1-CG2 3.53Å; F775-T823 HydrophobicContact CE1-CG2 3.81Å; F809-T823 HydrophobicContact CE1-CG2 3.67Å; F809-T823 WeakPolarHBondContact CE1-O 3.28Å; F809-T823 HydrophobicContact CE2-CG2 4.12Å; F809-T823 HydrophobicContact CZ-CG2 3.43Å; F809-T823 VanDerWaalsContact CZ-CG2 3.43Å; S821-T823 PolarHBondContact O-N 3.42Å; T823-A827 WeakPolarHBondContact O-CB 3.48Å; T823-A827 PolarHBondContact O-N 3.13Å
824	V	96.4	Very high	94.4	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-64.3	-47.9	171.6	167.9	0	0	0	0	110.2	F809 L810 A813 V819 S821 N826 A827 V828 L904 T913	F809-V824 HydrophobicContact CE1-CG2 3.93Å; F809-V824 HydrophobicContact CZ-CG2 3.7Å; L810-V824 HydrophobicContact CD2-CB 4.21Å; L810-V824 HydrophobicContact CD2-CG1 3.81Å; L810-V824 HydrophobicContact CD2-CG2 4.01Å; A813-V824 HydrophobicContact CB-CG2 3.54Å; V819-V824 WeakPolarHBondContact O-CB 3.42Å; V819-V824 WeakPolarHBondContact O-CG1 3.17Å; S821-V824 WeakPolarHBondContact O-CA 3.5Å; S821-V824 WeakPolarHBondContact O-CB 3.43Å; S821-V824 PolarHBondContact O-N 3.27Å; S821-V824 WeakPolarHBondContact OG-CG2 3.43Å; S821-V824 PolarHBondContact OG-N 3.5Å; V824-N826 VanDerWaalsContact C-N 3.33Å; V824-N826 PolarHBondContact O-N 3.26Å; V824-A827 PolarHBondContact O-N 3.17Å; V824-A827 VanDerWaalsContact O-N 3.17Å; V824-V828 HydrophobicContact CG1-CG2 3.93Å; V824-V828 VanDerWaalsContact O-CG2 3.23Å; V824-V828 WeakPolarHBondContact O-CG2 3.43Å; V824-V828 PolarHBondContact O-N 3.45Å; V824-L904 HydrophobicContact CG1-CD2 3.89Å; V824-T913 HydrophobicContact CG1-CG2 4.03Å
825	E	95.4	Very high	94.4	Very high	6 Å²	6	31.5 Å²	31.5	3%	0.028	17%	0.169	C	C	.	.	H	α-helix	trans	-51.1	-51.4	174.8	-174.5	-163.1	115	0	0	111.5	R783 S821 C829 N910 E912 R1109	R783-E825 IonicContact CZ-OE1 2.77Å; R783-E825 IonicContact NH1-OE1 2.67Å; R783-E825 PolarHBondContact NH1-OE1 3.39Å; R783-E825 IonicContact NH2-OE1 3.28Å; S821-E825 PolarHBondContact O-N 2.89Å; S821-E825 VanDerWaalsContact O-N 3.12Å; E825-C829 VanDerWaalsContact O-CB 3.3Å; E825-C829 WeakPolarHBondContact O-CB 3.41Å; E825-C829 PolarHBondContact O-N 2.83Å; E825-C829 PolarHBondContact O-SG 3.35Å; E825-N910 PolarHBondContact OE2-ND2 2.98Å; E825-E912 HydrophobicContact CG-CB 3.64Å; E825-R1109 IonicContact OE1-CZ 3.8Å; E825-R1109 IonicContact OE1-NH1 3.21Å; E825-R1109 PolarHBondContact OE1-NH1 3.26Å; E825-R1109 IonicContact OE1-NH2 3.4Å
826	N	96.3	Very high	94.3	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-61.3	-45.7	177.6	-80.9	-14.3	0	0	0	112.9	W730 K776 G780 R783 P822 V824 L830	W730-N826 WeakPolarHBondContact CH2-ND2 3.11Å; W730-N826 VanDerWaalsContact CZ2-ND2 3.27Å; W730-N826 WeakPolarHBondContact CZ2-ND2 3.22Å; K776-N826 PolarHBondContact O-ND2 2.76Å; G780-N826 VanDerWaalsContact CA-ND2 3.33Å; G780-N826 WeakPolarHBondContact CA-ND2 3.28Å; G780-N826 PolarHBondContact N-ND2 3.07Å; R783-N826 VanDerWaalsContact CD-OD1 3.31Å; R783-N826 WeakPolarHBondContact CD-OD1 3.49Å; R783-N826 PolarHBondContact NH1-OD1 3.48Å; P822-N826 WeakPolarHBondContact O-CB 3.3Å; P822-N826 PolarHBondContact O-N 3.17Å; V824-N826 VanDerWaalsContact C-N 3.33Å; V824-N826 PolarHBondContact O-N 3.26Å; N826-L830 WeakPolarHBondContact O-CB 3.43Å; N826-L830 PolarHBondContact O-N 2.84Å
827	A	97.1	Very high	94	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-66	-41.3	-179.4	0	0	0	0	0	112.7	L806 F809 L810 T823 V824 L830 L831	L806-A827 HydrophobicContact CD2-CB 3.9Å; F809-A827 HydrophobicContact CD1-CB 3.75Å; F809-A827 HydrophobicContact CE1-CB 3.8Å; L810-A827 HydrophobicContact CD2-CB 4.03Å; L810-A827 HydrophobicContact CG-CB 4.41Å; T823-A827 WeakPolarHBondContact O-CB 3.48Å; T823-A827 PolarHBondContact O-N 3.13Å; V824-A827 PolarHBondContact O-N 3.17Å; V824-A827 VanDerWaalsContact O-N 3.17Å; A827-L830 PolarHBondContact O-N 3.38Å; A827-L831 VanDerWaalsContact O-CG 3.28Å; A827-L831 WeakPolarHBondContact O-CG 3.23Å; A827-L831 PolarHBondContact O-N 2.91Å
828	V	97.4	Very high	93.7	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-69.1	-43.3	177.2	-178.5	0	0	0	0	110.6	L810 V824 L830 L831 R832 L904 A916 S917	L810-V828 HydrophobicContact CD1-CG2 3.75Å; L810-V828 HydrophobicContact CD2-CG2 3.85Å; L810-V828 HydrophobicContact CG-CG2 4.48Å; V824-V828 HydrophobicContact CG1-CG2 3.93Å; V824-V828 VanDerWaalsContact O-CG2 3.23Å; V824-V828 WeakPolarHBondContact O-CG2 3.43Å; V824-V828 PolarHBondContact O-N 3.45Å; V828-L830 VanDerWaalsContact C-N 3.32Å; V828-L830 PolarHBondContact O-N 3.41Å; V828-L831 PolarHBondContact O-N 2.85Å; V828-R832 WeakPolarHBondContact O-CB 3.38Å; V828-R832 PolarHBondContact O-N 2.77Å; V828-L904 HydrophobicContact CG2-CD1 3.51Å; V828-A916 HydrophobicContact CB-CB 4.29Å; V828-A916 HydrophobicContact CG1-CB 3.65Å; V828-S917 WeakPolarHBondContact CG1-OG 3.28Å
829	C	96.4	Very high	93.2	Very high	1 Å²	1	15.3 Å²	15.3	1%	0.007	8%	0.078	C	C	.	.	H	α-helix	trans	-58.7	-43.3	175.1	-73.7	0	0	0	0	112.2	R783 E825 R832 N833 A916	R783-C829 HydrophobicContact CG-CB 3.79Å; R783-C829 VanDerWaalsContact CZ-SG 3.53Å; E825-C829 VanDerWaalsContact O-CB 3.3Å; E825-C829 WeakPolarHBondContact O-CB 3.41Å; E825-C829 PolarHBondContact O-N 2.83Å; E825-C829 PolarHBondContact O-SG 3.35Å; C829-R832 PolarHBondContact O-N 2.87Å; C829-N833 PolarHBondContact O-N 3.5Å; C829-A916 HydrophobicContact CB-CB 4.47Å; C829-A916 VanDerWaalsContact SG-CB 3.58Å
830	L	97.3	Very high	92.1	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-61.5	-49.8	174.3	176.1	54.1	0	0	0	111.5	L782 L806 N826 A827 V828 R832 N833 L834	L782-L830 HydrophobicContact CB-CD1 4.18Å; L782-L830 HydrophobicContact CB-CD2 3.61Å; L782-L830 HydrophobicContact CD1-CD2 4.29Å; L806-L830 HydrophobicContact CD1-CD2 3.56Å; L806-L830 HydrophobicContact CD1-CG 3.96Å; L806-L830 HydrophobicContact CD2-CD2 4.11Å; L806-L830 HydrophobicContact CG-CD2 4.49Å; N826-L830 WeakPolarHBondContact O-CB 3.43Å; N826-L830 PolarHBondContact O-N 2.84Å; A827-L830 PolarHBondContact O-N 3.38Å; V828-L830 VanDerWaalsContact C-N 3.32Å; V828-L830 PolarHBondContact O-N 3.41Å; L830-R832 VanDerWaalsContact C-N 3.31Å; L830-R832 PolarHBondContact O-N 2.83Å; L830-N833 PolarHBondContact O-N 3.5Å; L830-L834 HydrophobicContact CD1-CD1 3.97Å; L830-L834 HydrophobicContact CD1-CD2 4.43Å; L830-L834 HydrophobicContact CD1-CG 3.97Å; L830-L834 HydrophobicContact CG-CD1 4.12Å; L830-L834 HydrophobicContact CG-CG 4.49Å; L830-L834 VanDerWaalsContact O-CG 3.32Å; L830-L834 WeakPolarHBondContact O-CG 3.47Å; L830-L834 PolarHBondContact O-N 3Å
831	L	97.3	Very high	91.1	Very high	1 Å²	1	16.1 Å²	16.1	1%	0.005	8%	0.082	C	C	.	.	H	α-helix	trans	-63.2	-34.7	177.8	-67.4	170.6	0	0	0	112.8	I803 L806 V807 L810 A827 V828 L834 S835 L892 Y901	I803-L831 HydrophobicContact CG2-CD2 4.18Å; L806-L831 HydrophobicContact CB-CD1 4.17Å; L806-L831 HydrophobicContact CB-CD2 3.98Å; L806-L831 HydrophobicContact CB-CG 4.2Å; L806-L831 HydrophobicContact CD1-CD2 3.95Å; L806-L831 HydrophobicContact CD1-CG 4.32Å; V807-L831 HydrophobicContact CG2-CD1 4.35Å; L810-L831 HydrophobicContact CD1-CD1 3.57Å; A827-L831 VanDerWaalsContact O-CG 3.28Å; A827-L831 WeakPolarHBondContact O-CG 3.23Å; A827-L831 PolarHBondContact O-N 2.91Å; V828-L831 PolarHBondContact O-N 2.85Å; L831-L834 CarbonylContact O-C 3.51Å; L831-L834 PolarHBondContact O-N 3.33Å; L831-S835 WeakPolarHBondContact O-CB 3.45Å; L831-S835 PolarHBondContact O-N 3.46Å; L831-S835 PolarHBondContact O-OG 2.95Å; L831-L892 HydrophobicContact CB-CD2 4.21Å; L831-L892 HydrophobicContact CD2-CD2 3.57Å; L831-L892 HydrophobicContact CG-CD2 4.46Å; L831-Y901 HydrophobicContact CB-CE1 4.48Å; L831-Y901 HydrophobicContact CD1-CE1 4.49Å
832	R	96.4	Very high	90.3	Very high	3 Å²	3	17.2 Å²	17.2	1%	0.011	9%	0.087	C	C	.	.	H	α-helix	trans	-62.6	-43.7	172.8	175	-93.1	-69.7	-83.3	-7.7	111.8	V828 C829 L830 S835 Y836 E915 A916 A920 N923	V828-R832 WeakPolarHBondContact O-CB 3.38Å; V828-R832 PolarHBondContact O-N 2.77Å; C829-R832 PolarHBondContact O-N 2.87Å; L830-R832 VanDerWaalsContact C-N 3.31Å; L830-R832 PolarHBondContact O-N 2.83Å; R832-S835 WeakPolarHBondContact O-CB 3.49Å; R832-S835 PolarHBondContact O-N 2.8Å; R832-Y836 PolarHBondContact O-N 2.71Å; R832-E915 IonicContact CZ-OE1 2.88Å; R832-E915 IonicContact CZ-OE2 2.72Å; R832-E915 IonicContact NH1-OE1 3.87Å; R832-E915 PolarHBondContact NH1-OE1 2.78Å; R832-E915 IonicContact NH1-OE2 2.67Å; R832-E915 PolarHBondContact NH1-OE2 2.98Å; R832-E915 IonicContact NH2-OE1 2.73Å; R832-E915 IonicContact NH2-OE2 3.58Å; R832-E915 PolarHBondContact NH2-OE2 2.71Å; R832-A916 WeakPolarHBondContact CB-O 3.48Å; R832-A920 HydrophobicContact CB-CB 4.09Å; R832-A920 HydrophobicContact CG-CB 4.49Å; R832-N923 PolarHBondContact O-ND2 3.25Å
833	N	95.6	Very high	89.3	Confident	8 Å²	8	17.4 Å²	17.4	4%	0.043	9%	0.086	C	C	.	.	H	α-helix	trans	-68.1	-43.3	175.5	-73.9	-7.7	0	0	0	111.1	S786 R793 C829 L830 S835 Y836 G1106	S786-N833 WeakPolarHBondContact OG-CB 3.36Å; S786-N833 PolarHBondContact OG-ND2 3.18Å; R793-N833 WeakPolarHBondContact CD-O 3.4Å; C829-N833 PolarHBondContact O-N 3.5Å; L830-N833 PolarHBondContact O-N 3.5Å; N833-S835 PolarHBondContact O-N 2.89Å; N833-Y836 WeakPolarHBondContact O-CB 3.39Å; N833-Y836 PolarHBondContact O-N 3.27Å; N833-G1106 PolarHBondContact OD1-N 3.49Å
834	L	94.6	Very high	87.9	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-65.1	-16.8	173.5	-63.1	178.9	0	0	0	113.1	L796 R797 I803 L830 L831 L892	L796-L834 HydrophobicContact CB-CD2 3.63Å; L796-L834 HydrophobicContact CD1-CD2 4.37Å; R797-L834 HydrophobicContact CG-CD2 4.32Å; R797-L834 PolarHBondContact NE-O 2.72Å; R797-L834 PolarHBondContact NH2-O 2.96Å; I803-L834 HydrophobicContact CG1-CD1 4.12Å; L830-L834 HydrophobicContact CD1-CD1 3.97Å; L830-L834 HydrophobicContact CD1-CD2 4.43Å; L830-L834 HydrophobicContact CD1-CG 3.97Å; L830-L834 HydrophobicContact CG-CD1 4.12Å; L830-L834 HydrophobicContact CG-CG 4.49Å; L830-L834 VanDerWaalsContact O-CG 3.32Å; L830-L834 WeakPolarHBondContact O-CG 3.47Å; L830-L834 PolarHBondContact O-N 3Å; L831-L834 CarbonylContact O-C 3.51Å; L831-L834 PolarHBondContact O-N 3.33Å; L834-L892 HydrophobicContact CB-CD1 4.08Å
835	S	93.9	Very high	86.2	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-84.4	-17.7	172	-59.7	0	0	0	0	114.2	L831 R832 N833 R837	L831-S835 WeakPolarHBondContact O-CB 3.45Å; L831-S835 PolarHBondContact O-N 3.46Å; L831-S835 PolarHBondContact O-OG 2.95Å; R832-S835 WeakPolarHBondContact O-CB 3.49Å; R832-S835 PolarHBondContact O-N 2.8Å; N833-S835 PolarHBondContact O-N 2.89Å; S835-R837 PolarHBondContact O-N 3.44Å
836	Y	91.5	Very high	84.7	Confident	26 Å²	26	31 Å²	31	10%	0.102	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	121.7	-176.5	177.3	-101.6	0	0	0	112.7	R797 R832 N833 I838 S1103 S1104 Q1105	R797-Y836 PolarHBondContact NH2-O 3.23Å; R832-Y836 PolarHBondContact O-N 2.71Å; N833-Y836 WeakPolarHBondContact O-CB 3.39Å; N833-Y836 PolarHBondContact O-N 3.27Å; Y836-I838 PolarHBondContact O-N 2.81Å; Y836-S1103 WeakPolarHBondContact CE2-OG 3.26Å; Y836-S1104 VanDerWaalsContact CD2-O 3.26Å; Y836-S1104 WeakPolarHBondContact CD2-O 3.26Å; Y836-Q1105 HydrophobicContact CD1-CG 3.58Å; Y836-Q1105 HydrophobicContact CD2-CG 4.01Å; Y836-Q1105 HydrophobicContact CE1-CG 3.47Å; Y836-Q1105 VanDerWaalsContact CE1-CG 3.47Å; Y836-Q1105 HydrophobicContact CE2-CG 3.92Å; Y836-Q1105 HydrophobicContact CG-CG 3.83Å
837	R	83.3	Confident	82.9	Confident	98 Å²	98	34.8 Å²	34.8	37%	0.37	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.5	58.5	-175	-66.1	176.2	177.4	-118.8	16.4	111.7	R797 S835 E840	R797-R837 PolarHBondContact NH1-O 2.89Å; S835-R837 PolarHBondContact O-N 3.44Å; R837-E840 HydrophobicContact CB-CG 4.43Å; R837-E840 WeakPolarHBondContact CD-OE1 3.33Å; R837-E840 WeakPolarHBondContact CD-OE2 3.46Å; R837-E840 VanDerWaalsContact CG-OE1 3.28Å; R837-E840 WeakPolarHBondContact CG-OE1 3.33Å; R837-E840 IonicContact CZ-OE1 2.99Å; R837-E840 IonicContact NE-OE1 3.42Å; R837-E840 IonicContact NH1-OE1 3.58Å; R837-E840 PolarHBondContact NH1-OE1 3.16Å; R837-E840 IonicContact NH1-OE2 2.71Å; R837-E840 PolarHBondContact NH1-OE2 3.19Å
838	I	85.5	Confident	80.7	Confident	4 Å²	4	38.5 Å²	38.5	2%	0.021	21%	0.206	C	C	.	.			trans	-81.5	-30.7	178.2	-167.1	160.9	0	0	0	112.3	Y836 E840 V841 V842 P889 L892 W893 L924	Y836-I838 PolarHBondContact O-N 2.81Å; I838-E840 VanDerWaalsContact C-N 3.33Å; I838-E840 PolarHBondContact O-N 2.68Å; I838-V841 PolarHBondContact O-N 3.15Å; I838-V842 HydrophobicContact CG1-CG2 3.89Å; I838-V842 WeakPolarHBondContact O-CG2 3.49Å; I838-V842 PolarHBondContact O-N 2.93Å; I838-V842 VanDerWaalsContact O-N 3.09Å; I838-P889 HydrophobicContact CD1-CB 4.26Å; I838-L892 HydrophobicContact CD1-CB 4.15Å; I838-L892 HydrophobicContact CD1-CD1 3.46Å; I838-L892 VanDerWaalsContact CD1-CD1 3.46Å; I838-L892 HydrophobicContact CD1-CG 4.42Å; I838-W893 HydrophobicContact CD1-CE3 3.96Å; I838-W893 HydrophobicContact CD1-CZ3 3.73Å; I838-W893 HydrophobicContact CG1-CZ3 4.06Å; I838-L924 HydrophobicContact CG2-CD2 4.33Å
839	Q	79.3	Confident	78.1	Confident	12 Å²	12	41.6 Å²	41.6	6%	0.056	23%	0.232	C	C	.	.	H	α-helix	trans	-58.7	-41.3	177.4	69.6	-71.4	-4.6	0	0	112.4	V841 V842 D843 Y846 C927 F929	Q839-V841 PolarHBondContact O-N 2.98Å; Q839-V842 PolarHBondContact O-N 3.19Å; Q839-D843 PolarHBondContact O-N 3.05Å; Q839-Y846 HydrophobicContact CB-CD1 4.26Å; Q839-Y846 HydrophobicContact CB-CD2 4.31Å; Q839-Y846 HydrophobicContact CB-CG 4.16Å; Q839-Y846 HydrophobicContact CG-CD1 3.46Å; Q839-Y846 VanDerWaalsContact CG-CD1 3.46Å; Q839-Y846 HydrophobicContact CG-CD2 4.22Å; Q839-Y846 HydrophobicContact CG-CE1 3.49Å; Q839-Y846 VanDerWaalsContact CG-CE1 3.49Å; Q839-Y846 HydrophobicContact CG-CE2 4.26Å; Q839-Y846 HydrophobicContact CG-CG 3.86Å; Q839-C927 HydrophobicContact CG-CB 4.46Å; Q839-F929 HydrophobicContact CB-CB 4.42Å; Q839-F929 HydrophobicContact CB-CD1 3.9Å; Q839-F929 HydrophobicContact CB-CD2 4.46Å; Q839-F929 HydrophobicContact CB-CE1 4.23Å; Q839-F929 HydrophobicContact CB-CG 4.05Å
840	E	71	Confident	75.8	Confident	43 Å²	43	44 Å²	44	20%	0.201	25%	0.251	C	S	.	.	H	α-helix	trans	-67.6	10.4	176.8	-58.7	170.7	-156.1	0	0	115.1	Q790 R794 R837 I838 Y846	Q790-E840 PolarHBondContact NE2-OE2 2.96Å; R794-E840 PolarHBondContact NH2-O 3.05Å; R837-E840 HydrophobicContact CB-CG 4.43Å; R837-E840 WeakPolarHBondContact CD-OE1 3.33Å; R837-E840 WeakPolarHBondContact CD-OE2 3.46Å; R837-E840 VanDerWaalsContact CG-OE1 3.28Å; R837-E840 WeakPolarHBondContact CG-OE1 3.33Å; R837-E840 IonicContact CZ-OE1 2.99Å; R837-E840 IonicContact NE-OE1 3.42Å; R837-E840 IonicContact NH1-OE1 3.58Å; R837-E840 PolarHBondContact NH1-OE1 3.16Å; R837-E840 IonicContact NH1-OE2 2.71Å; R837-E840 PolarHBondContact NH1-OE2 3.19Å; I838-E840 VanDerWaalsContact C-N 3.33Å; I838-E840 PolarHBondContact O-N 2.68Å; E840-Y846 HydrophobicContact CG-CD1 4.45Å
841	V	71.7	Confident	73.3	Confident	39 Å²	39	44.6 Å²	44.6	24%	0.236	26%	0.256	C	S	.	.	H	α-helix	trans	-135.5	-31.6	179.7	-178.7	0	0	0	0	110.9	R794 I838 Q839	R794-V841 HydrophobicContact CG-CG1 4.24Å; R794-V841 HydrophobicContact CG-CG2 3.69Å; I838-V841 PolarHBondContact O-N 3.15Å; Q839-V841 PolarHBondContact O-N 2.98Å
842	V	74	Confident	70.6	Confident	58 Å²	58	49.2 Å²	49.2	35%	0.352	28%	0.278	S	S	.	.	H	α-helix	trans	-82.4	-33.5	176.1	177.9	0	0	0	0	111.9	I838 Q839 W893 F929	I838-V842 HydrophobicContact CG1-CG2 3.89Å; I838-V842 WeakPolarHBondContact O-CG2 3.49Å; I838-V842 PolarHBondContact O-N 2.93Å; I838-V842 VanDerWaalsContact O-N 3.09Å; Q839-V842 PolarHBondContact O-N 3.19Å; V842-W893 HydrophobicContact CB-CH2 4.18Å; V842-W893 HydrophobicContact CG1-CH2 3.61Å; V842-W893 HydrophobicContact CG1-CZ2 4.23Å; V842-W893 HydrophobicContact CG1-CZ3 4.5Å; V842-W893 HydrophobicContact CG2-CH2 3.49Å; V842-W893 VanDerWaalsContact CG2-CH2 3.49Å; V842-W893 HydrophobicContact CG2-CZ3 3.63Å; V842-F929 HydrophobicContact CB-CZ 4.13Å; V842-F929 HydrophobicContact CG1-CE1 4.43Å; V842-F929 HydrophobicContact CG1-CZ 3.78Å
843	D	71.1	Confident	67.5	Low	53 Å²	53	53.5 Å²	53.5	28%	0.283	31%	0.308	S	S	.	.			trans	-125.9	98.7	175.8	-178.4	1.4	0	0	0	109.2	Q839 N845 Y846 F929	Q839-D843 PolarHBondContact O-N 3.05Å; D843-N845 PolarHBondContact O-N 3.39Å; D843-N845 VanDerWaalsContact O-N 3.14Å; D843-N845 WeakPolarHBondContact OD1-CA 3.06Å; D843-N845 PolarHBondContact OD1-N 3.01Å; D843-Y846 WeakPolarHBondContact O-CB 3.34Å; D843-Y846 PolarHBondContact O-N 2.96Å; D843-Y846 PolarHBondContact OD1-N 3.36Å; D843-F929 HydrophobicContact CB-CE2 4.02Å
844	P	64.9	Low	64.3	Low	116 Å²	116	57.4 Å²	57.4	75%	0.753	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-14.4	177.1	-24.4	35.4	0	0	0	114.3
845	N	60	Low	61.2	Low	145 Å²	145	62.3 Å²	62.3	78%	0.775	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	13.5	176.1	-53.2	-58.4	0	0	0	112	D843 D847	D843-N845 PolarHBondContact O-N 3.39Å; D843-N845 VanDerWaalsContact O-N 3.14Å; D843-N845 WeakPolarHBondContact OD1-CA 3.06Å; D843-N845 PolarHBondContact OD1-N 3.01Å; N845-D847 PolarHBondContact O-N 3.38Å
846	Y	64	Low	58.2	Low	43 Å²	43	67.7 Å²	67.7	17%	0.169	41%	0.408	C	S	.	.			trans	-66	98.5	178.4	179.8	-99.7	0	0	0	111.1	Q839 E840 D843 P848 F929	Q839-Y846 HydrophobicContact CB-CD1 4.26Å; Q839-Y846 HydrophobicContact CB-CD2 4.31Å; Q839-Y846 HydrophobicContact CB-CG 4.16Å; Q839-Y846 HydrophobicContact CG-CD1 3.46Å; Q839-Y846 VanDerWaalsContact CG-CD1 3.46Å; Q839-Y846 HydrophobicContact CG-CD2 4.22Å; Q839-Y846 HydrophobicContact CG-CE1 3.49Å; Q839-Y846 VanDerWaalsContact CG-CE1 3.49Å; Q839-Y846 HydrophobicContact CG-CE2 4.26Å; Q839-Y846 HydrophobicContact CG-CG 3.86Å; E840-Y846 HydrophobicContact CG-CD1 4.45Å; D843-Y846 WeakPolarHBondContact O-CB 3.34Å; D843-Y846 PolarHBondContact O-N 2.96Å; D843-Y846 PolarHBondContact OD1-N 3.36Å; Y846-P848 HydrophobicContact CD1-CG 4.48Å; Y846-P848 HydrophobicContact CE1-CB 4.42Å; Y846-P848 HydrophobicContact CE1-CG 4.13Å; Y846-P848 WeakPolarHBondContact O-CD 3.31Å; Y846-F929 HydrophobicContact CE2-CB 4.47Å
847	D	57.6	Low	55.3	Low	80 Å²	80	75.8 Å²	75.8	43%	0.428	44%	0.444	S	S	.	.			trans	-83	117.8	171	175.2	21.6	0	0	0	111.2	N845 A849 A850	N845-D847 PolarHBondContact O-N 3.38Å; D847-A849 VanDerWaalsContact C-N 3.26Å; D847-A849 PolarHBondContact O-N 3.24Å; D847-A849 WeakPolarHBondContact OD1-CB 3.48Å; D847-A849 PolarHBondContact OD1-N 3.29Å; D847-A850 HydrophobicContact CB-CB 4.05Å; D847-A850 WeakPolarHBondContact OD2-CA 3.21Å; D847-A850 WeakPolarHBondContact OD2-CB 3.47Å; D847-A850 PolarHBondContact OD2-N 3.33Å
848	P	52.5	Low	52.7	Low	79 Å²	79	78.1 Å²	78.1	51%	0.513	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-26.7	172.6	-19.6	33.4	0	0	0	113.8	Y846 H852	Y846-P848 HydrophobicContact CD1-CG 4.48Å; Y846-P848 HydrophobicContact CE1-CB 4.42Å; Y846-P848 HydrophobicContact CE1-CG 4.13Å; Y846-P848 WeakPolarHBondContact O-CD 3.31Å; P848-H852 PolarHBondContact O-CD2 2.97Å
849	A	42.6	Very low	49.8	Very low	65 Å²	65	86.9 Å²	86.9	54%	0.537	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-44.1	-175.8	0	0	0	0	0	112.6	D847 A851 H852	D847-A849 VanDerWaalsContact C-N 3.26Å; D847-A849 PolarHBondContact O-N 3.24Å; D847-A849 WeakPolarHBondContact OD1-CB 3.48Å; D847-A849 PolarHBondContact OD1-N 3.29Å; A849-A851 PolarHBondContact O-N 3.33Å; A849-A851 VanDerWaalsContact O-N 3.12Å; A849-H852 PolarHBondContact O-N 2.91Å
850	A	47.5	Very low	47.3	Very low	51 Å²	51	94.7 Å²	94.7	42%	0.421	54%	0.54	S	S	.	.	G	3₁₀ helix	trans	-50.7	-38.3	176.8	0	0	0	0	0	112.7	D847 H852 S853	D847-A850 HydrophobicContact CB-CB 4.05Å; D847-A850 WeakPolarHBondContact OD2-CA 3.21Å; D847-A850 WeakPolarHBondContact OD2-CB 3.47Å; D847-A850 PolarHBondContact OD2-N 3.33Å; A850-H852 PolarHBondContact O-N 3.41Å; A850-H852 VanDerWaalsContact O-N 3.14Å; A850-S853 WeakPolarHBondContact O-CB 3.38Å; A850-S853 PolarHBondContact O-N 2.98Å; A850-S853 VanDerWaalsContact O-N 3.12Å; A850-S853 PolarHBondContact O-OG 2.81Å
851	A	43.9	Very low	45.4	Very low	13 Å²	13	102.1 Å²	102.1	11%	0.107	58%	0.575	C	S	.	*	G	3₁₀ helix	trans	-52.6	-32.5	174.7	0	0	0	0	0	113.9	A849 Q928	A849-A851 PolarHBondContact O-N 3.33Å; A849-A851 VanDerWaalsContact O-N 3.12Å; A851-Q928 HydrophobicContact CB-CB 3.9Å; A851-Q928 HydrophobicContact CB-CG 4.3Å; A851-Q928 PolarHBondContact O-NE2 2.55Å; A851-Q928 PolarHBondContact O-OE1 2.94Å
852	H	41.8	Very low	43.2	Very low	97 Å²	97	106.8 Å²	106.8	45%	0.449	60%	0.603	S	S	.	*	G	3₁₀ helix	trans	-94.5	-6.3	-176.4	-69.2	-71.4	0	0	0	114	P848 A849 A850 S854	P848-H852 PolarHBondContact O-CD2 2.97Å; A849-H852 PolarHBondContact O-N 2.91Å; A850-H852 PolarHBondContact O-N 3.41Å; A850-H852 VanDerWaalsContact O-N 3.14Å; H852-S854 PolarHBondContact O-N 3.33Å
853	S	30.9	Very low	40.9	Very low	93 Å²	93	108 Å²	108	65%	0.65	62%	0.619	S	S	*	*			trans	-75.2	-16.7	-178.9	70	0	0	0	0	115.1	A850 S855	A850-S853 WeakPolarHBondContact O-CB 3.38Å; A850-S853 PolarHBondContact O-N 2.98Å; A850-S853 VanDerWaalsContact O-N 3.12Å; A850-S853 PolarHBondContact O-OG 2.81Å; S853-S855 PolarHBondContact O-N 3.17Å
854	S	29.5	Very low	38.7	Very low	91 Å²	91	111 Å²	111	64%	0.636	64%	0.644	S	S	*	*			trans	-77.9	29.3	-169.5	61.5	0	0	0	0	115.3	H852 S856	H852-S854 PolarHBondContact O-N 3.33Å; S854-S856 PolarHBondContact O-N 3.14Å
855	S	28	Very low	37	Very low	102 Å²	102	111.4 Å²	111.4	71%	0.713	65%	0.647	S	S	*	*			trans	-77.9	87.3	178.8	63.2	0	0	0	0	112.8	S853	S853-S855 PolarHBondContact O-N 3.17Å
856	S	31.6	Very low	35.3	Very low	113 Å²	113	113.7 Å²	113.7	79%	0.79	65%	0.65	S	S	*	*	S	Bend	trans	45.3	86.7	155.5	-162.4	0	0	0	0	117.8	S854	S854-S856 PolarHBondContact O-N 3.14Å
857	K	31.1	Very low	33.7	Very low	196 Å²	196	118 Å²	118	85%	0.852	68%	0.683	S	S	*	*			trans	-150	136.5	147.5	-102.6	143.3	-172.3	173.9	0	109.7
858	N	28.1	Very low	32.3	Very low	147 Å²	147	122.3 Å²	122.3	79%	0.786	70%	0.701	S	S	*	*			trans	64.9	45.7	174.3	-65.6	-26.5	0	0	0	119.1	K860	N858-K860 PolarHBondContact O-N 3.28Å
859	M	24.5	Very low	31.5	Very low	189 Å²	189	128.2 Å²	128.2	93%	0.931	72%	0.719	S	S	*	*			trans	-81.4	91.5	141	-83.3	-166.8	72.6	0	0	109.4
860	K	27.6	Very low	30.9	Very low	176 Å²	176	134.1 Å²	134.1	77%	0.765	73%	0.732	S	S	*	*			trans	-71.6	149.8	161.1	-75.1	-175.9	176.4	178.8	0	109.1	N858 V862	N858-K860 PolarHBondContact O-N 3.28Å; K860-V862 PolarHBondContact O-N 2.82Å; K860-V862 VanDerWaalsContact O-N 3.15Å
861	H	30.7	Very low	30	Very low	199 Å²	199	141.2 Å²	141.2	92%	0.921	75%	0.753	S	S	*	*			trans	-50.9	117.8	-175.9	-69.2	-83	0	0	0	113.3
862	V	25.4	Very low	29.7	Very low	136 Å²	136	150.1 Å²	150.1	82%	0.824	79%	0.79	S	S	*	*			trans	-102.8	111.4	151.3	179.7	0	0	0	0	105.9	K860	K860-V862 PolarHBondContact O-N 2.82Å; K860-V862 VanDerWaalsContact O-N 3.15Å
863	A	25.8	Very low	29.3	Very low	85 Å²	85	153.4 Å²	153.4	70%	0.702	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-74.3	139.4	-174.4	0	0	0	0	0	111.7
864	S	25	Very low	29.8	Very low	114 Å²	114	158.4 Å²	158.4	80%	0.797	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-61	123.9	175.6	-47.6	0	0	0	0	111.1	K866	S864-K866 PolarHBondContact O-N 2.98Å
865	P	29	Very low	29.8	Very low	126 Å²	126	163.5 Å²	163.5	82%	0.818	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-68.3	128.5	173.9	27.3	-32.6	0	0	0	110.3
866	K	24.5	Very low	30.3	Very low	192 Å²	192	168 Å²	168	84%	0.835	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-71.7	150.9	173.4	-72.3	-177.2	178.1	179.2	0	110.7	S864 E868	S864-K866 PolarHBondContact O-N 2.98Å; K866-E868 PolarHBondContact O-N 2.79Å; K866-E868 VanDerWaalsContact O-N 3.17Å
867	P	30.3	Very low	30.4	Very low	134 Å²	134	172.5 Å²	172.5	87%	0.87	85%	0.846	S	S	*	*			trans	-77.5	100.3	179.7	30.8	-34.5	0	0	0	111.9
868	E	27.2	Very low	30.6	Very low	170 Å²	170	171.5 Å²	171.5	79%	0.794	84%	0.842	S	S	*	*			trans	-86.1	138	166.7	-73.9	-145.2	146.2	0	0	112.4	K866	K866-E868 PolarHBondContact O-N 2.79Å; K866-E868 VanDerWaalsContact O-N 3.17Å
869	K	37	Very low	30.8	Very low	204 Å²	204	172 Å²	172	89%	0.887	85%	0.845	S	S	*	*			trans	-84.6	119.9	171.5	-64.9	174.1	179.6	174.4	0	110
870	K	30.7	Very low	31.4	Very low	189 Å²	189	171.7 Å²	171.7	82%	0.822	84%	0.838	S	S	*	*			trans	-150.6	145.6	154.3	-109.8	148.7	-167.3	166.9	0	114.2
871	K	28.3	Very low	31.6	Very low	200 Å²	200	169.7 Å²	169.7	87%	0.87	84%	0.836	S	S	*	*			trans	-28.3	151.6	-173.5	-65.6	176.7	172.8	-177.6	0	119.1
872	K	37.3	Very low	32	Very low	199 Å²	199	165 Å²	165	87%	0.865	82%	0.823	S	S	*	*			trans	-49.1	141.6	152	-62.6	169.6	178.4	170.1	0	110.1
873	D	32.8	Very low	33	Very low	166 Å²	166	167.9 Å²	167.9	89%	0.888	83%	0.825	S	S	*	*				-141.9	162	126.9	-107.3	-45.9	0	0	0	110.4
874	K	40.8	Very low	34.1	Very low	199 Å²	199	170.5 Å²	170.5	87%	0.865	83%	0.827	S	S	*	*			trans	-100.9	130.6	-172.2	-64.6	169.1	-178.6	165.9	0	110.9
875	E	30.8	Very low	35.9	Very low	198 Å²	198	172.2 Å²	172.2	93%	0.925	83%	0.825	S	S	*	*			trans	-145.7	151.2	136.7	-137.1	173.5	-151	0	0	112.5
876	K	37.5	Very low	38.3	Very low	197 Å²	197	168.9 Å²	168.9	86%	0.857	80%	0.802	S	S	*	*			trans	-107.3	113.5	-176.3	-70.5	175	178.6	172.1	0	109.8
877	K	33.1	Very low	41.1	Very low	206 Å²	206	163.5 Å²	163.5	90%	0.896	79%	0.786	S	S	*	*			trans	-110	130.4	147.1	-88.4	-176.9	173.6	177.2	0	109.8
878	K	36.6	Very low	43.7	Very low	176 Å²	176	158 Å²	158	77%	0.765	75%	0.754	S	S	*	*			trans	-94.3	92.6	178.5	-69.2	174.2	-178.4	168.3	0	108.4	K880	K878-K880 PolarHBondContact O-N 2.94Å
879	D	31.3	Very low	46.7	Very low	157 Å²	157	151.3 Å²	151.3	84%	0.84	73%	0.725	S	S	*	*			trans	-81.2	72.2	155.2	-70.1	-46.4	0	0	0	108.7	N881	D879-N881 PolarHBondContact O-N 3.1Å
880	K	38.4	Very low	49.2	Very low	183 Å²	183	143.3 Å²	143.3	80%	0.796	69%	0.694	S	S	*	*			trans	-76	61.4	161.6	-86.3	-158.9	170.7	-161.9	0	108.8	K878	K878-K880 PolarHBondContact O-N 2.94Å
881	N	32.3	Very low	52.1	Low	133 Å²	133	134.9 Å²	134.9	71%	0.711	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-66.7	130.2	156.1	-140.2	15.2	0	0	0	106.1	D879	D879-N881 PolarHBondContact O-N 3.1Å
882	P	38.5	Very low	55.2	Low	101 Å²	101	125.4 Å²	125.4	66%	0.656	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-57.7	149.4	171	26.6	-33.5	0	0	0	108.7	N884	P882-N884 PolarHBondContact O-N 3.03Å; P882-N884 VanDerWaalsContact O-N 3.09Å
883	K	44.9	Very low	57.8	Low	197 Å²	197	117.1 Å²	117.1	86%	0.857	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-54.4	122.2	173.5	-64	179.8	180	-178.7	0	107.6	I885	K883-I885 PolarHBondContact O-N 3.18Å
884	N	49.1	Very low	60.6	Low	140 Å²	140	111.7 Å²	111.7	75%	0.749	55%	0.55	S	S	*	*	P	Polyproline II helix	trans	-54.3	119.1	167.7	-85.6	-0.2	0	0	0	107	P882 V886	P882-N884 PolarHBondContact O-N 3.03Å; P882-N884 VanDerWaalsContact O-N 3.09Å; N884-V886 PolarHBondContact O-N 3.36Å; N884-V886 VanDerWaalsContact O-N 3.09Å
885	I	63.7	Low	63.1	Low	150 Å²	150	105.3 Å²	105.3	77%	0.769	53%	0.529	S	S	*	.			trans	-73.2	106.5	175.1	-58.5	177.7	0	0	0	105.1	K883 T887	K883-I885 PolarHBondContact O-N 3.18Å; I885-T887 HydrophobicContact CG2-CG2 4.11Å; I885-T887 PolarHBondContact O-N 3.3Å
886	V	79.4	Confident	66	Low	55 Å²	55	100.8 Å²	100.8	33%	0.333	51%	0.508	S	S	.	.			trans	-68.4	127	178.2	-177.1	0	0	0	0	107.9	N884 S890 V891 Q894	N884-V886 PolarHBondContact O-N 3.36Å; N884-V886 VanDerWaalsContact O-N 3.09Å; V886-S890 WeakPolarHBondContact CG1-O 3.4Å; V886-S890 WeakPolarHBondContact CG1-OG 3.3Å; V886-V891 HydrophobicContact CG1-CG2 4.11Å; V886-V891 WeakPolarHBondContact O-CG2 3.32Å; V886-Q894 HydrophobicContact CB-CG 4.43Å; V886-Q894 HydrophobicContact CG1-CG 3.87Å
887	T	83.6	Confident	68.8	Low	79 Å²	79	91.6 Å²	91.6	49%	0.485	47%	0.468	S	S	.	.			trans	-136.5	165.5	-175.6	52.4	0	0	0	0	112.1	E804 I885 S890	E804-T887 WeakPolarHBondContact OE1-CA 3.42Å; E804-T887 VanDerWaalsContact OE1-CB 3.24Å; E804-T887 WeakPolarHBondContact OE1-CB 3.5Å; I885-T887 HydrophobicContact CG2-CG2 4.11Å; I885-T887 PolarHBondContact O-N 3.3Å; T887-S890 PolarHBondContact O-OG 3.09Å
888	G	85.4	Confident	71.8	Confident	19 Å²	19	81.8 Å²	81.8	20%	0.196	43%	0.426	C	S	.	.	G	3₁₀ helix	trans	61.2	-147.6	-179.3	0	0	0	0	0	112.8	E804 S890 V891	E804-G888 PolarHBondContact OE1-N 2.9Å; G888-S890 PolarHBondContact O-N 2.89Å; G888-V891 WeakPolarHBondContact O-CB 3.39Å; G888-V891 WeakPolarHBondContact O-CG2 3.45Å; G888-V891 PolarHBondContact O-N 3.33Å; G888-V891 VanDerWaalsContact O-N 3.13Å
889	P	88.8	Confident	74.6	Confident	29 Å²	29	77.9 Å²	77.9	19%	0.188	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-56.4	-27.2	-175.7	-29.3	38.7	0	0	0	114.4	R797 I838 V891 L892 W893	R797-P889 HydrophobicContact CB-CG 3.82Å; R797-P889 HydrophobicContact CG-CG 4.16Å; I838-P889 HydrophobicContact CD1-CB 4.26Å; P889-V891 PolarHBondContact O-N 3.5Å; P889-V891 VanDerWaalsContact O-N 3.14Å; P889-L892 WeakPolarHBondContact O-CB 3.33Å; P889-L892 PolarHBondContact O-N 3.17Å; P889-L892 VanDerWaalsContact O-N 3.12Å; P889-W893 VanDerWaalsContact O-CZ3 3.28Å; P889-W893 WeakPolarHBondContact O-CZ3 3.33Å
890	S	89.8	Confident	77.8	Confident	36 Å²	36	70.9 Å²	70.9	25%	0.252	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-66.3	-12.6	-178.5	71.6	0	0	0	0	115.3	V886 T887 G888 Q894	V886-S890 WeakPolarHBondContact CG1-O 3.4Å; V886-S890 WeakPolarHBondContact CG1-OG 3.3Å; T887-S890 PolarHBondContact O-OG 3.09Å; G888-S890 PolarHBondContact O-N 2.89Å; S890-Q894 WeakPolarHBondContact O-CG 3.37Å; S890-Q894 PolarHBondContact O-NE2 3.39Å
891	V	92.6	Very high	80.6	Confident	13 Å²	13	62.2 Å²	62.2	8%	0.079	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-69.2	-34.6	172.7	178.9	0	0	0	0	111.6	I803 E804 V807 V886 G888 P889 W893 Q894 V897	I803-V891 HydrophobicContact CG2-CB 3.87Å; I803-V891 HydrophobicContact CG2-CG1 4.05Å; E804-V891 HydrophobicContact CG-CG2 4.13Å; V807-V891 HydrophobicContact CB-CG1 4.47Å; V807-V891 HydrophobicContact CG1-CG1 4.5Å; V807-V891 HydrophobicContact CG2-CG1 4.05Å; V886-V891 HydrophobicContact CG1-CG2 4.11Å; V886-V891 WeakPolarHBondContact O-CG2 3.32Å; G888-V891 WeakPolarHBondContact O-CB 3.39Å; G888-V891 WeakPolarHBondContact O-CG2 3.45Å; G888-V891 PolarHBondContact O-N 3.33Å; G888-V891 VanDerWaalsContact O-N 3.13Å; P889-V891 PolarHBondContact O-N 3.5Å; P889-V891 VanDerWaalsContact O-N 3.14Å; V891-W893 VanDerWaalsContact C-N 3.29Å; V891-W893 PolarHBondContact O-N 3.18Å; V891-Q894 WeakPolarHBondContact O-CB 3.25Å; V891-Q894 WeakPolarHBondContact O-CG 3.46Å; V891-Q894 PolarHBondContact O-N 3.36Å; V891-Q894 VanDerWaalsContact O-N 3.12Å; V891-V897 HydrophobicContact CG1-CG2 4.14Å; V891-V897 VanDerWaalsContact O-CG2 3.31Å; V891-V897 WeakPolarHBondContact O-CG2 3.28Å
892	L	92.9	Very high	83.8	Confident	0 Å²	0	56 Å²	56	0%	0	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-32.6	-170.6	-74.1	165	0	0	0	114.2	I803 L831 L834 I838 P889 L924	I803-L892 HydrophobicContact CD1-CD1 3.94Å; I803-L892 HydrophobicContact CD1-CG 4.28Å; I803-L892 HydrophobicContact CG2-CD2 3.98Å; I803-L892 HydrophobicContact CG2-CG 3.89Å; L831-L892 HydrophobicContact CB-CD2 4.21Å; L831-L892 HydrophobicContact CD2-CD2 3.57Å; L831-L892 HydrophobicContact CG-CD2 4.46Å; L834-L892 HydrophobicContact CB-CD1 4.08Å; I838-L892 HydrophobicContact CD1-CB 4.15Å; I838-L892 HydrophobicContact CD1-CD1 3.46Å; I838-L892 VanDerWaalsContact CD1-CD1 3.46Å; I838-L892 HydrophobicContact CD1-CG 4.42Å; P889-L892 WeakPolarHBondContact O-CB 3.33Å; P889-L892 PolarHBondContact O-N 3.17Å; P889-L892 VanDerWaalsContact O-N 3.12Å; L892-L924 HydrophobicContact CB-CD2 4.4Å; L892-L924 WeakPolarHBondContact O-CD1 3.5Å
893	W	90.8	Very high	86.6	Confident	25 Å²	25	54.8 Å²	54.8	10%	0.095	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	5.2	-179.5	62.4	83.1	0	0	0	114.4	I838 V842 P889 V891 L924 P931 V935	I838-W893 HydrophobicContact CD1-CE3 3.96Å; I838-W893 HydrophobicContact CD1-CZ3 3.73Å; I838-W893 HydrophobicContact CG1-CZ3 4.06Å; V842-W893 HydrophobicContact CB-CH2 4.18Å; V842-W893 HydrophobicContact CG1-CH2 3.61Å; V842-W893 HydrophobicContact CG1-CZ2 4.23Å; V842-W893 HydrophobicContact CG1-CZ3 4.5Å; V842-W893 HydrophobicContact CG2-CH2 3.49Å; V842-W893 VanDerWaalsContact CG2-CH2 3.49Å; V842-W893 HydrophobicContact CG2-CZ3 3.63Å; P889-W893 VanDerWaalsContact O-CZ3 3.28Å; P889-W893 WeakPolarHBondContact O-CZ3 3.33Å; V891-W893 VanDerWaalsContact C-N 3.29Å; V891-W893 PolarHBondContact O-N 3.18Å; W893-L924 HydrophobicContact CB-CD2 4.27Å; W893-P931 HydrophobicContact CB-CB 4.41Å; W893-P931 HydrophobicContact CD2-CB 4.01Å; W893-P931 HydrophobicContact CD2-CG 4.5Å; W893-P931 HydrophobicContact CG-CB 3.82Å; W893-P931 HydrophobicContact CZ2-CG 4.23Å; W893-V935 HydrophobicContact CB-CG2 3.77Å
894	Q	92.8	Very high	89.1	Confident	52 Å²	52	45.4 Å²	45.4	24%	0.243	24%	0.244	C	C	.	.			trans	-64.3	141.4	-179.3	-66.1	-56.3	-54.2	0	0	111.2	V886 S890 V891 H896 V897 V898	V886-Q894 HydrophobicContact CB-CG 4.43Å; V886-Q894 HydrophobicContact CG1-CG 3.87Å; S890-Q894 WeakPolarHBondContact O-CG 3.37Å; S890-Q894 PolarHBondContact O-NE2 3.39Å; V891-Q894 WeakPolarHBondContact O-CB 3.25Å; V891-Q894 WeakPolarHBondContact O-CG 3.46Å; V891-Q894 PolarHBondContact O-N 3.36Å; V891-Q894 VanDerWaalsContact O-N 3.12Å; Q894-H896 PolarHBondContact O-N 3.04Å; Q894-V897 HydrophobicContact CB-CG2 4.37Å; Q894-V897 PolarHBondContact O-N 3.23Å; Q894-V898 PolarHBondContact O-N 2.9Å; Q894-V898 VanDerWaalsContact O-N 3.09Å
895	P	91.9	Very high	91.4	Very high	65 Å²	65	39 Å²	39	42%	0.422	21%	0.21	S	C	.	.	H	α-helix	trans	-54.4	-30.7	-178.6	-29.2	35.6	0	0	0	114.4	K899 A938	P895-K899 WeakPolarHBondContact O-CB 3.35Å; P895-K899 PolarHBondContact O-N 3.08Å; P895-A938 HydrophobicContact CB-CB 4.24Å
896	H	93.3	Very high	93	Very high	103 Å²	103	36.6 Å²	36.6	48%	0.477	20%	0.195	S	C	.	.	H	α-helix	trans	-64.2	-42.5	173	-179.9	16.7	0	0	0	112.6	Q894 K899 L900	Q894-H896 PolarHBondContact O-N 3.04Å; H896-K899 VanDerWaalsContact O-CB 3.3Å; H896-K899 WeakPolarHBondContact O-CB 3.28Å; H896-K899 PolarHBondContact O-N 3.02Å; H896-L900 WeakPolarHBondContact O-CG 3.48Å; H896-L900 PolarHBondContact O-N 2.92Å
897	V	95.6	Very high	93.7	Very high	4 Å²	4	37.2 Å²	37.2	2%	0.024	20%	0.197	C	C	.	.	H	α-helix	trans	-71.2	-38.6	-179.8	-178.5	0	0	0	0	110.6	V807 V891 Q894 K899 L900 Y901	V807-V897 HydrophobicContact CG1-CG2 3.76Å; V807-V897 HydrophobicContact CG2-CG1 4.14Å; V807-V897 HydrophobicContact CG2-CG2 3.89Å; V891-V897 HydrophobicContact CG1-CG2 4.14Å; V891-V897 VanDerWaalsContact O-CG2 3.31Å; V891-V897 WeakPolarHBondContact O-CG2 3.28Å; Q894-V897 HydrophobicContact CB-CG2 4.37Å; Q894-V897 PolarHBondContact O-N 3.23Å; V897-K899 VanDerWaalsContact C-N 3.26Å; V897-K899 PolarHBondContact O-N 3.13Å; V897-L900 WeakPolarHBondContact O-CA 3.29Å; V897-L900 WeakPolarHBondContact O-CB 3.19Å; V897-L900 PolarHBondContact O-N 3.28Å; V897-Y901 HydrophobicContact CG1-CD2 4.49Å; V897-Y901 HydrophobicContact CG1-CE2 3.72Å; V897-Y901 WeakPolarHBondContact O-CD2 3.17Å; V897-Y901 PolarHBondContact O-N 3.01Å; V897-Y901 VanDerWaalsContact O-N 3.13Å
898	V	95.6	Very high	94.3	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.006	18%	0.178	C	C	.	.	H	α-helix	trans	-55.9	-41.9	169	179	0	0	0	0	111.2	Q894 L900 Y901 L902 V935 A938 V939	Q894-V898 PolarHBondContact O-N 2.9Å; Q894-V898 VanDerWaalsContact O-N 3.09Å; V898-L900 VanDerWaalsContact C-N 3.33Å; V898-L900 PolarHBondContact O-N 2.94Å; V898-Y901 PolarHBondContact O-N 3.2Å; V898-L902 HydrophobicContact CG1-CD1 4.35Å; V898-L902 WeakPolarHBondContact O-CG 3.38Å; V898-L902 PolarHBondContact O-N 2.89Å; V898-V935 HydrophobicContact CG2-CG1 4.15Å; V898-V935 HydrophobicContact CG2-CG2 4.01Å; V898-A938 HydrophobicContact CB-CB 4.4Å; V898-A938 HydrophobicContact CG1-CB 4.15Å; V898-V939 HydrophobicContact CG1-CG2 3.5Å; V898-V939 VanDerWaalsContact CG1-CG2 3.5Å
899	K	96.2	Very high	94.8	Very high	93 Å²	93	36.8 Å²	36.8	40%	0.404	19%	0.194	S	C	.	.	H	α-helix	trans	-64.5	-32.4	174.4	-167	-165.5	-171	79.6	0	112.8	P895 H896 V897 K903 E942	P895-K899 WeakPolarHBondContact O-CB 3.35Å; P895-K899 PolarHBondContact O-N 3.08Å; H896-K899 VanDerWaalsContact O-CB 3.3Å; H896-K899 WeakPolarHBondContact O-CB 3.28Å; H896-K899 PolarHBondContact O-N 3.02Å; V897-K899 VanDerWaalsContact C-N 3.26Å; V897-K899 PolarHBondContact O-N 3.13Å; K899-K903 WeakPolarHBondContact O-CB 3.41Å; K899-K903 PolarHBondContact O-N 2.99Å; K899-E942 HydrophobicContact CB-CG 4.29Å; K899-E942 WeakPolarHBondContact CD-OE1 3.48Å; K899-E942 HydrophobicContact CG-CG 4.25Å; K899-E942 IonicContact NZ-OE1 3.83Å; K899-E942 PolarHBondContact NZ-OE1 3.15Å; K899-E942 IonicContact NZ-OE2 2.66Å; K899-E942 PolarHBondContact NZ-OE2 3.48Å
900	L	97.7	Very high	95	Very high	11 Å²	11	37 Å²	37	6%	0.058	19%	0.193	C	C	.	.	H	α-helix	trans	-65.3	-49.2	174	-58.6	179.7	0	0	0	110.9	V807 L810 T811 I814 H896 V897 V898 L902 K903 L904	V807-L900 HydrophobicContact CG1-CD1 4Å; L810-L900 HydrophobicContact CB-CD1 4.3Å; T811-L900 WeakPolarHBondContact OG1-CD1 3.31Å; I814-L900 HydrophobicContact CD1-CB 4.08Å; I814-L900 HydrophobicContact CD1-CD2 3.86Å; H896-L900 WeakPolarHBondContact O-CG 3.48Å; H896-L900 PolarHBondContact O-N 2.92Å; V897-L900 WeakPolarHBondContact O-CA 3.29Å; V897-L900 WeakPolarHBondContact O-CB 3.19Å; V897-L900 PolarHBondContact O-N 3.28Å; V898-L900 VanDerWaalsContact C-N 3.33Å; V898-L900 PolarHBondContact O-N 2.94Å; L900-L902 VanDerWaalsContact C-N 3.32Å; L900-L902 PolarHBondContact O-N 2.73Å; L900-K903 PolarHBondContact O-N 2.85Å; L900-L904 WeakPolarHBondContact O-CG 3.21Å; L900-L904 PolarHBondContact O-N 2.98Å
901	Y	98.3	Very high	95.2	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-58.8	-43.3	176.2	-57	-46.1	0	0	0	111.7	L831 V897 V898 K903 L904 L905 A920 I921 L924	L831-Y901 HydrophobicContact CB-CE1 4.48Å; L831-Y901 HydrophobicContact CD1-CE1 4.49Å; V897-Y901 HydrophobicContact CG1-CD2 4.49Å; V897-Y901 HydrophobicContact CG1-CE2 3.72Å; V897-Y901 WeakPolarHBondContact O-CD2 3.17Å; V897-Y901 PolarHBondContact O-N 3.01Å; V897-Y901 VanDerWaalsContact O-N 3.13Å; V898-Y901 PolarHBondContact O-N 3.2Å; Y901-K903 VanDerWaalsContact C-N 3.28Å; Y901-K903 PolarHBondContact O-N 3.04Å; Y901-L904 PolarHBondContact O-N 2.9Å; Y901-L905 WeakPolarHBondContact O-CB 3.23Å; Y901-L905 VanDerWaalsContact O-CG 3.26Å; Y901-L905 WeakPolarHBondContact O-CG 3.32Å; Y901-L905 PolarHBondContact O-N 3.32Å; Y901-A920 HydrophobicContact CD1-CB 4.14Å; Y901-A920 HydrophobicContact CD2-CB 4.08Å; Y901-A920 HydrophobicContact CE1-CB 3.92Å; Y901-A920 HydrophobicContact CE2-CB 3.85Å; Y901-A920 HydrophobicContact CG-CB 4.24Å; Y901-I921 HydrophobicContact CD2-CG1 4.23Å; Y901-L924 HydrophobicContact CE2-CD1 3.9Å
902	L	97.9	Very high	95.2	Very high	4 Å²	4	39.9 Å²	39.9	2%	0.021	20%	0.203	C	C	.	.	H	α-helix	trans	-65	-29.1	175.7	-71.2	178.4	0	0	0	113.7	V898 L900 L905 Q906 I921 V939 E942	V898-L902 HydrophobicContact CG1-CD1 4.35Å; V898-L902 WeakPolarHBondContact O-CG 3.38Å; V898-L902 PolarHBondContact O-N 2.89Å; L900-L902 VanDerWaalsContact C-N 3.32Å; L900-L902 PolarHBondContact O-N 2.73Å; L902-L905 HydrophobicContact CD2-CD1 4.24Å; L902-Q906 WeakPolarHBondContact O-CG 3.39Å; L902-Q906 PolarHBondContact O-N 3.27Å; L902-I921 HydrophobicContact CD2-CD1 3.65Å; L902-I921 HydrophobicContact CG-CD1 4.09Å; L902-V939 HydrophobicContact CD1-CG1 4.44Å; L902-V939 HydrophobicContact CD1-CG2 4.41Å; L902-V939 HydrophobicContact CD2-CG1 4.4Å; L902-E942 HydrophobicContact CD1-CB 3.76Å
903	K	97.6	Very high	95.4	Very high	75 Å²	75	39.9 Å²	39.9	33%	0.326	20%	0.203	S	C	.	.	H	α-helix	trans	-78	-36.4	176.8	-167.6	48.7	168	147.4	0	111.9	I814 K899 L900 Y901 L905 Q906 D907	I814-K903 HydrophobicContact CG2-CG 3.72Å; K899-K903 WeakPolarHBondContact O-CB 3.41Å; K899-K903 PolarHBondContact O-N 2.99Å; L900-K903 PolarHBondContact O-N 2.85Å; Y901-K903 VanDerWaalsContact C-N 3.28Å; Y901-K903 PolarHBondContact O-N 3.04Å; K903-L905 VanDerWaalsContact C-N 3.34Å; K903-Q906 HydrophobicContact CD-CB 4.46Å; K903-Q906 PolarHBondContact O-N 3.21Å; K903-Q906 VanDerWaalsContact O-N 3.14Å; K903-D907 VanDerWaalsContact CD-OD2 3.27Å; K903-D907 WeakPolarHBondContact CD-OD2 3.27Å; K903-D907 WeakPolarHBondContact CE-OD2 3.22Å; K903-D907 IonicContact NZ-OD1 3.01Å; K903-D907 PolarHBondContact NZ-OD1 3.18Å; K903-D907 IonicContact NZ-OD2 3.98Å; K903-D907 PolarHBondContact NZ-OD2 3.32Å; K903-D907 WeakPolarHBondContact O-CB 3.45Å; K903-D907 PolarHBondContact O-N 3.4Å
904	L	97.9	Very high	95.6	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-61.8	-42.5	169.3	-66.3	167.2	0	0	0	111.3	L810 I814 V819 V824 V828 L900 Y901 Q906 D907 S908 T913	L810-L904 HydrophobicContact CD1-CD1 4.41Å; I814-L904 HydrophobicContact CD1-CD2 4.07Å; I814-L904 HydrophobicContact CD1-CG 3.99Å; I814-L904 HydrophobicContact CG1-CD2 3.97Å; I814-L904 HydrophobicContact CG1-CG 4.41Å; V819-L904 HydrophobicContact CB-CD2 3.96Å; V819-L904 HydrophobicContact CG1-CD2 3.92Å; V824-L904 HydrophobicContact CG1-CD2 3.89Å; V828-L904 HydrophobicContact CG2-CD1 3.51Å; L900-L904 WeakPolarHBondContact O-CG 3.21Å; L900-L904 PolarHBondContact O-N 2.98Å; Y901-L904 PolarHBondContact O-N 2.9Å; L904-Q906 PolarHBondContact O-N 2.86Å; L904-Q906 VanDerWaalsContact O-N 3.17Å; L904-D907 PolarHBondContact O-N 3.24Å; L904-S908 WeakPolarHBondContact O-CB 3.24Å; L904-S908 PolarHBondContact O-N 2.92Å; L904-T913 HydrophobicContact CB-CG2 4.29Å; L904-T913 HydrophobicContact CD2-CG2 4.23Å
905	L	97.9	Very high	95.8	Very high	6 Å²	6	37.5 Å²	37.5	3%	0.031	19%	0.194	C	C	.	.	H	α-helix	trans	-64.6	-13.3	174	-70	165.5	0	0	0	114.6	Y901 L902 K903 L914 A918 I921 V947 L948 L951	Y901-L905 WeakPolarHBondContact O-CB 3.23Å; Y901-L905 VanDerWaalsContact O-CG 3.26Å; Y901-L905 WeakPolarHBondContact O-CG 3.32Å; Y901-L905 PolarHBondContact O-N 3.32Å; L902-L905 HydrophobicContact CD2-CD1 4.24Å; K903-L905 VanDerWaalsContact C-N 3.34Å; L905-L914 HydrophobicContact CD2-CD2 4.16Å; L905-L914 WeakPolarHBondContact CD2-O 3.45Å; L905-A918 HydrophobicContact CD2-CB 4.2Å; L905-I921 HydrophobicContact CD1-CD1 3.68Å; L905-V947 HydrophobicContact CB-CG1 3.95Å; L905-V947 WeakPolarHBondContact O-CG1 3.38Å; L905-L948 HydrophobicContact CD1-CD2 3.95Å; L905-L951 HydrophobicContact CB-CD1 4.05Å; L905-L951 HydrophobicContact CD2-CD1 3.58Å; L905-L951 HydrophobicContact CG-CD1 4.35Å
906	Q	96.3	Very high	96	Very high	99 Å²	99	34.4 Å²	34.4	46%	0.463	17%	0.174	S	C	.	.	H	α-helix	trans	-97.4	-38.2	173.9	-73.7	170.2	4.2	0	0	112.9	L902 K903 L904 V947	L902-Q906 WeakPolarHBondContact O-CG 3.39Å; L902-Q906 PolarHBondContact O-N 3.27Å; K903-Q906 HydrophobicContact CD-CB 4.46Å; K903-Q906 PolarHBondContact O-N 3.21Å; K903-Q906 VanDerWaalsContact O-N 3.14Å; L904-Q906 PolarHBondContact O-N 2.86Å; L904-Q906 VanDerWaalsContact O-N 3.17Å; Q906-V947 HydrophobicContact CG-CG1 3.89Å; Q906-V947 HydrophobicContact CG-CG2 3.81Å
907	D	95.7	Very high	96.2	Very high	68 Å²	68	29.5 Å²	29.5	36%	0.364	15%	0.151	S	C	.	.	H	α-helix	trans	-106	-21.4	-165.3	-64.8	-7	0	0	0	113.9	V819 K903 L904	V819-D907 HydrophobicContact CG1-CB 4.32Å; V819-D907 HydrophobicContact CG2-CB 4.11Å; K903-D907 VanDerWaalsContact CD-OD2 3.27Å; K903-D907 WeakPolarHBondContact CD-OD2 3.27Å; K903-D907 WeakPolarHBondContact CE-OD2 3.22Å; K903-D907 IonicContact NZ-OD1 3.01Å; K903-D907 PolarHBondContact NZ-OD1 3.18Å; K903-D907 IonicContact NZ-OD2 3.98Å; K903-D907 PolarHBondContact NZ-OD2 3.32Å; K903-D907 WeakPolarHBondContact O-CB 3.45Å; K903-D907 PolarHBondContact O-N 3.4Å; L904-D907 PolarHBondContact O-N 3.24Å
908	S	96.3	Very high	96.3	Very high	13 Å²	13	29.3 Å²	29.3	9%	0.091	15%	0.15	C	C	.	.			trans	-83.2	136.5	-173.6	-171.3	0	0	0	0	112	D820 L904 N910 T913	D820-S908 WeakPolarHBondContact OD1-CA 3.49Å; D820-S908 WeakPolarHBondContact OD1-CB 3.21Å; D820-S908 PolarHBondContact OD1-OG 3Å; L904-S908 WeakPolarHBondContact O-CB 3.24Å; L904-S908 PolarHBondContact O-N 2.92Å; S908-N910 PolarHBondContact OG-N 3.33Å; S908-T913 WeakPolarHBondContact OG-CB 3.31Å; S908-T913 VanDerWaalsContact OG-CG2 3.29Å; S908-T913 WeakPolarHBondContact OG-CG2 3.31Å
909	S	94.2	Very high	96.3	Very high	76 Å²	76	29.2 Å²	29.2	53%	0.531	15%	0.149	S	C	.	.			trans	-98.7	-14.7	167.1	69.9	0	0	0	0	113.4	D820 I911	D820-S909 VanDerWaalsContact CG-N 3.28Å; D820-S909 PolarHBondContact OD1-N 2.65Å; D820-S909 WeakPolarHBondContact OD2-CB 3.38Å; D820-S909 PolarHBondContact OD2-N 3.5Å; D820-S909 PolarHBondContact OD2-OG 2.61Å; S909-I911 PolarHBondContact O-N 3.49Å
910	N	94.3	Very high	96.4	Very high	33 Å²	33	24.8 Å²	24.8	18%	0.176	13%	0.13	C	C	.	.			trans	-69.9	116.7	174.9	-179.8	-31.8	0	0	0	111	D820 E825 S908 E912 T913 L914	D820-N910 HydrophobicContact CB-CB 4.23Å; D820-N910 WeakPolarHBondContact OD1-CB 3.27Å; D820-N910 PolarHBondContact OD1-N 3.3Å; E825-N910 PolarHBondContact OE2-ND2 2.98Å; S908-N910 PolarHBondContact OG-N 3.33Å; N910-E912 VanDerWaalsContact C-N 3.34Å; N910-E912 PolarHBondContact O-N 2.83Å; N910-E912 WeakPolarHBondContact OD1-CB 3.36Å; N910-E912 PolarHBondContact OD1-N 2.74Å; N910-T913 WeakPolarHBondContact O-CB 3.48Å; N910-T913 PolarHBondContact O-N 3.38Å; N910-T913 VanDerWaalsContact O-N 3.15Å; N910-T913 PolarHBondContact OD1-N 2.9Å; N910-L914 WeakPolarHBondContact O-CG 3.42Å; N910-L914 PolarHBondContact O-N 2.63Å
911	I	93.6	Very high	96.3	Very high	62 Å²	62	24.3 Å²	24.3	32%	0.318	13%	0.128	S	C	.	.	H	α-helix	trans	-63.3	-36.9	-174.6	-51.7	164.2	0	0	0	112	S909 L914 E915 E956 F958 V959	S909-I911 PolarHBondContact O-N 3.49Å; I911-L914 PolarHBondContact O-N 2.91Å; I911-E915 PolarHBondContact O-N 3.43Å; I911-E956 HydrophobicContact CD1-CG 3.96Å; I911-E956 HydrophobicContact CG1-CG 4.27Å; I911-E956 HydrophobicContact CG2-CB 3.96Å; I911-E956 HydrophobicContact CG2-CG 3.79Å; I911-F958 HydrophobicContact CB-CZ 4.27Å; I911-F958 HydrophobicContact CG2-CE1 4.1Å; I911-F958 HydrophobicContact CG2-CE2 3.61Å; I911-F958 HydrophobicContact CG2-CZ 3.32Å; I911-V959 HydrophobicContact CG2-CG2 3.4Å
912	E	92.8	Very high	96.2	Very high	47 Å²	47	24.5 Å²	24.5	22%	0.22	13%	0.128	C	C	.	.	H	α-helix	trans	-68.1	-39.3	175.4	-68.4	-84.3	123.3	0	0	111.2	R783 E825 N910 L914 E915 A916	R783-E912 IonicContact NH2-OE2 3.24Å; R783-E912 PolarHBondContact NH2-OE2 2.64Å; E825-E912 HydrophobicContact CG-CB 3.64Å; N910-E912 VanDerWaalsContact C-N 3.34Å; N910-E912 PolarHBondContact O-N 2.83Å; N910-E912 WeakPolarHBondContact OD1-CB 3.36Å; N910-E912 PolarHBondContact OD1-N 2.74Å; E912-L914 VanDerWaalsContact C-N 3.33Å; E912-L914 PolarHBondContact O-N 3.2Å; E912-E915 PolarHBondContact O-N 3.47Å; E912-A916 WeakPolarHBondContact O-CB 3.3Å; E912-A916 PolarHBondContact O-N 3.09Å
913	T	95.9	Very high	96	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-64.4	-37.8	174	-64.7	0	0	0	0	111.6	V824 L904 S908 N910 S917	V824-T913 HydrophobicContact CG1-CG2 4.03Å; L904-T913 HydrophobicContact CB-CG2 4.29Å; L904-T913 HydrophobicContact CD2-CG2 4.23Å; S908-T913 WeakPolarHBondContact OG-CB 3.31Å; S908-T913 VanDerWaalsContact OG-CG2 3.29Å; S908-T913 WeakPolarHBondContact OG-CG2 3.31Å; N910-T913 WeakPolarHBondContact O-CB 3.48Å; N910-T913 PolarHBondContact O-N 3.38Å; N910-T913 VanDerWaalsContact O-N 3.15Å; N910-T913 PolarHBondContact OD1-N 2.9Å; T913-S917 VanDerWaalsContact O-CB 3.23Å; T913-S917 WeakPolarHBondContact O-CB 3.32Å; T913-S917 PolarHBondContact O-N 2.92Å; T913-S917 PolarHBondContact O-OG 3.24Å
914	L	97.1	Very high	95.8	Very high	13 Å²	13	21 Å²	21	7%	0.068	11%	0.113	C	C	.	.	H	α-helix	trans	-66.3	-51.2	174.5	-67.1	175.9	0	0	0	111.8	L905 N910 I911 E912 A916 S917 A918 L951 L954 V959	L905-L914 HydrophobicContact CD2-CD2 4.16Å; L905-L914 WeakPolarHBondContact CD2-O 3.45Å; N910-L914 WeakPolarHBondContact O-CG 3.42Å; N910-L914 PolarHBondContact O-N 2.63Å; I911-L914 PolarHBondContact O-N 2.91Å; E912-L914 VanDerWaalsContact C-N 3.33Å; E912-L914 PolarHBondContact O-N 3.2Å; L914-A916 PolarHBondContact O-N 3.35Å; L914-S917 PolarHBondContact O-N 3.49Å; L914-A918 WeakPolarHBondContact O-CB 3Å; L914-A918 PolarHBondContact O-N 3.34Å; L914-L951 HydrophobicContact CD1-CD2 4.43Å; L914-L954 HydrophobicContact CD1-CD1 4.33Å; L914-V959 HydrophobicContact CB-CG1 4.21Å; L914-V959 HydrophobicContact CB-CG2 4.42Å
915	E	95.7	Very high	95.5	Very high	14 Å²	14	21 Å²	21	7%	0.065	11%	0.113	C	C	.	.	H	α-helix	trans	-61.8	-43.1	178.5	-173.8	-87.1	167.8	0	0	111.7	R832 I911 E912 S917 A918 G919 F958 V959 A962	R832-E915 IonicContact CZ-OE1 2.88Å; R832-E915 IonicContact CZ-OE2 2.72Å; R832-E915 IonicContact NH1-OE1 3.87Å; R832-E915 PolarHBondContact NH1-OE1 2.78Å; R832-E915 IonicContact NH1-OE2 2.67Å; R832-E915 PolarHBondContact NH1-OE2 2.98Å; R832-E915 IonicContact NH2-OE1 2.73Å; R832-E915 IonicContact NH2-OE2 3.58Å; R832-E915 PolarHBondContact NH2-OE2 2.71Å; I911-E915 PolarHBondContact O-N 3.43Å; E912-E915 PolarHBondContact O-N 3.47Å; E915-S917 PolarHBondContact O-N 3.14Å; E915-A918 PolarHBondContact O-N 3.09Å; E915-G919 PolarHBondContact O-N 3.35Å; E915-F958 HydrophobicContact CB-CD2 4.05Å; E915-F958 HydrophobicContact CB-CE2 4.44Å; E915-F958 HydrophobicContact CG-CD2 3.99Å; E915-V959 HydrophobicContact CB-CG2 4.14Å; E915-A962 HydrophobicContact CG-CB 3.9Å
916	A	96.3	Very high	94.9	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-67.9	-36.8	179.2	0	0	0	0	0	112.4	V828 C829 R832 E912 L914 G919 A920	V828-A916 HydrophobicContact CB-CB 4.29Å; V828-A916 HydrophobicContact CG1-CB 3.65Å; C829-A916 HydrophobicContact CB-CB 4.47Å; C829-A916 VanDerWaalsContact SG-CB 3.58Å; R832-A916 WeakPolarHBondContact CB-O 3.48Å; E912-A916 WeakPolarHBondContact O-CB 3.3Å; E912-A916 PolarHBondContact O-N 3.09Å; L914-A916 PolarHBondContact O-N 3.35Å; A916-G919 PolarHBondContact O-N 3.04Å; A916-A920 WeakPolarHBondContact O-CB 3.23Å; A916-A920 PolarHBondContact O-N 3.02Å
917	S	98	Very high	93.9	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-67.1	-41.6	174.8	-61.7	0	0	0	0	111.7	V828 T913 L914 E915 A920 I921	V828-S917 WeakPolarHBondContact CG1-OG 3.28Å; T913-S917 VanDerWaalsContact O-CB 3.23Å; T913-S917 WeakPolarHBondContact O-CB 3.32Å; T913-S917 PolarHBondContact O-N 2.92Å; T913-S917 PolarHBondContact O-OG 3.24Å; L914-S917 PolarHBondContact O-N 3.49Å; E915-S917 PolarHBondContact O-N 3.14Å; S917-A920 PolarHBondContact O-N 3.45Å; S917-I921 PolarHBondContact O-N 3.28Å
918	A	97.5	Very high	92.8	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-64.8	-44.2	173.8	0	0	0	0	0	111.4	L905 L914 E915 A920 I921 Q922 A962 V963	L905-A918 HydrophobicContact CD2-CB 4.2Å; L914-A918 WeakPolarHBondContact O-CB 3Å; L914-A918 PolarHBondContact O-N 3.34Å; E915-A918 PolarHBondContact O-N 3.09Å; A918-A920 PolarHBondContact O-N 2.68Å; A918-I921 PolarHBondContact O-N 3.17Å; A918-Q922 WeakPolarHBondContact O-CB 3.43Å; A918-Q922 PolarHBondContact O-N 3.36Å; A918-A962 HydrophobicContact CB-CB 4.01Å; A918-V963 HydrophobicContact CB-CG2 3.64Å
919	G	96.1	Very high	91.9	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-64.8	-32.5	177.4	0	0	0	0	0	113.8	E915 A916 N923	E915-G919 PolarHBondContact O-N 3.35Å; A916-G919 PolarHBondContact O-N 3.04Å; G919-N923 WeakPolarHBondContact O-CB 3.27Å; G919-N923 PolarHBondContact O-N 3.41Å; G919-N923 PolarHBondContact O-ND2 2.96Å
920	A	96.9	Very high	91.4	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-63.8	-49.5	171	0	0	0	0	0	110.9	R832 Y901 A916 S917 A918 Q922 N923 L924	R832-A920 HydrophobicContact CB-CB 4.09Å; R832-A920 HydrophobicContact CG-CB 4.49Å; Y901-A920 HydrophobicContact CD1-CB 4.14Å; Y901-A920 HydrophobicContact CD2-CB 4.08Å; Y901-A920 HydrophobicContact CE1-CB 3.92Å; Y901-A920 HydrophobicContact CE2-CB 3.85Å; Y901-A920 HydrophobicContact CG-CB 4.24Å; A916-A920 WeakPolarHBondContact O-CB 3.23Å; A916-A920 PolarHBondContact O-N 3.02Å; S917-A920 PolarHBondContact O-N 3.45Å; A918-A920 PolarHBondContact O-N 2.68Å; A920-Q922 VanDerWaalsContact C-N 3.34Å; A920-Q922 PolarHBondContact O-N 2.91Å; A920-N923 PolarHBondContact O-N 3.49Å; A920-L924 WeakPolarHBondContact O-CB 3.37Å; A920-L924 VanDerWaalsContact O-CG 3.24Å; A920-L924 WeakPolarHBondContact O-CG 3.45Å; A920-L924 PolarHBondContact O-N 2.84Å
921	I	96.8	Very high	91.1	Very high	1 Å²	1	17.9 Å²	17.9	1%	0.005	10%	0.096	C	C	.	.	H	α-helix	trans	-62.1	-41.9	176	-65.3	173.9	0	0	0	111.1	Y901 L902 L905 S917 A918 L924 A925 V939 L970	Y901-I921 HydrophobicContact CD2-CG1 4.23Å; L902-I921 HydrophobicContact CD2-CD1 3.65Å; L902-I921 HydrophobicContact CG-CD1 4.09Å; L905-I921 HydrophobicContact CD1-CD1 3.68Å; S917-I921 PolarHBondContact O-N 3.28Å; A918-I921 PolarHBondContact O-N 3.17Å; I921-L924 PolarHBondContact O-N 3.09Å; I921-A925 VanDerWaalsContact O-CB 3.23Å; I921-A925 WeakPolarHBondContact O-CB 3.37Å; I921-A925 PolarHBondContact O-N 3.02Å; I921-V939 HydrophobicContact CG2-CG2 4.05Å; I921-L970 HydrophobicContact CG2-CD1 4.09Å; I921-L970 HydrophobicContact CG2-CD2 4.34Å; I921-L970 HydrophobicContact CG2-CG 4.46Å
922	Q	94.9	Very high	91	Very high	4 Å²	4	15.1 Å²	15.1	2%	0.019	8%	0.083	C	C	.	.	H	α-helix	trans	-54.5	-55	175.3	-176.7	-160.3	-39.1	0	0	111	A918 A920 A925 A926 T965 A966 N969 I1102 S1104	A918-Q922 WeakPolarHBondContact O-CB 3.43Å; A918-Q922 PolarHBondContact O-N 3.36Å; A920-Q922 VanDerWaalsContact C-N 3.34Å; A920-Q922 PolarHBondContact O-N 2.91Å; Q922-A925 PolarHBondContact O-N 3.47Å; Q922-A926 WeakPolarHBondContact O-CB 3.44Å; Q922-A926 PolarHBondContact O-N 3.5Å; Q922-A926 VanDerWaalsContact O-N 3.13Å; Q922-T965 HydrophobicContact CG-CG2 3.73Å; Q922-A966 HydrophobicContact CB-CB 3.94Å; Q922-N969 PolarHBondContact O-ND2 3.1Å; Q922-I1102 PolarHBondContact NE2-O 2.99Å; Q922-S1104 PolarHBondContact NE2-OG 2.98Å; Q922-S1104 PolarHBondContact OE1-OG 2.86Å
923	N	94.2	Very high	90.8	Very high	1 Å²	1	15 Å²	15	1%	0.005	9%	0.09	C	C	.	.	H	α-helix	trans	-63.5	-43.4	-178	-77.9	-20	0	0	0	112.1	R832 G919 A920 A925 A926 S1103 S1104	R832-N923 PolarHBondContact O-ND2 3.25Å; G919-N923 WeakPolarHBondContact O-CB 3.27Å; G919-N923 PolarHBondContact O-N 3.41Å; G919-N923 PolarHBondContact O-ND2 2.96Å; A920-N923 PolarHBondContact O-N 3.49Å; N923-A925 VanDerWaalsContact C-N 3.31Å; N923-A925 PolarHBondContact O-N 3.37Å; N923-A926 VanDerWaalsContact O-CB 3.3Å; N923-A926 WeakPolarHBondContact O-CB 3.49Å; N923-A926 PolarHBondContact O-N 2.83Å; N923-S1103 VanDerWaalsContact OD1-CA 3.23Å; N923-S1103 WeakPolarHBondContact OD1-CA 3.35Å; N923-S1103 WeakPolarHBondContact OD1-CB 3.25Å; N923-S1104 PolarHBondContact ND2-O 2.7Å; N923-S1104 PolarHBondContact OD1-N 2.96Å; N923-S1104 PolarHBondContact OD1-O 3.06Å
924	L	93.4	Very high	90.5	Very high	4 Å²	4	20.1 Å²	20.1	2%	0.021	11%	0.114	C	C	.	.	H	α-helix	trans	-68.4	-28.3	178.5	-66.6	170.5	0	0	0	112.9	I838 L892 W893 Y901 A920 I921 S932 V935	I838-L924 HydrophobicContact CG2-CD2 4.33Å; L892-L924 HydrophobicContact CB-CD2 4.4Å; L892-L924 WeakPolarHBondContact O-CD1 3.5Å; W893-L924 HydrophobicContact CB-CD2 4.27Å; Y901-L924 HydrophobicContact CE2-CD1 3.9Å; A920-L924 WeakPolarHBondContact O-CB 3.37Å; A920-L924 VanDerWaalsContact O-CG 3.24Å; A920-L924 WeakPolarHBondContact O-CG 3.45Å; A920-L924 PolarHBondContact O-N 2.84Å; I921-L924 PolarHBondContact O-N 3.09Å; L924-S932 WeakPolarHBondContact O-CA 3.44Å; L924-S932 WeakPolarHBondContact O-CB 3.23Å; L924-S932 PolarHBondContact O-OG 2.85Å; L924-V935 HydrophobicContact CB-CG1 4.01Å; L924-V935 HydrophobicContact CB-CG2 4.23Å
925	A	92.8	Very high	90.4	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-3.4	174.9	0	0	0	0	0	114.1	I921 Q922 N923 C927 R936 N969 L970	I921-A925 VanDerWaalsContact O-CB 3.23Å; I921-A925 WeakPolarHBondContact O-CB 3.37Å; I921-A925 PolarHBondContact O-N 3.02Å; Q922-A925 PolarHBondContact O-N 3.47Å; N923-A925 VanDerWaalsContact C-N 3.31Å; N923-A925 PolarHBondContact O-N 3.37Å; A925-C927 VanDerWaalsContact C-N 3.31Å; A925-C927 PolarHBondContact O-N 3.18Å; A925-C927 VanDerWaalsContact O-N 3.15Å; A925-R936 HydrophobicContact CB-CG 4.21Å; A925-R936 PolarHBondContact O-NH1 2.84Å; A925-N969 HydrophobicContact CB-CB 3.84Å; A925-L970 HydrophobicContact CB-CD2 4.25Å; A925-L970 HydrophobicContact CB-CG 4.48Å
926	A	85.1	Confident	90.4	Very high	10 Å²	10	19.5 Å²	19.5	8%	0.083	11%	0.11	C	C	.	.	S	Bend	trans	-77.1	7.8	-164.4	0	0	0	0	0	117.1	Q922 N923 N969 P1101	Q922-A926 WeakPolarHBondContact O-CB 3.44Å; Q922-A926 PolarHBondContact O-N 3.5Å; Q922-A926 VanDerWaalsContact O-N 3.13Å; N923-A926 VanDerWaalsContact O-CB 3.3Å; N923-A926 WeakPolarHBondContact O-CB 3.49Å; N923-A926 PolarHBondContact O-N 2.83Å; A926-N969 WeakPolarHBondContact CA-ND2 3.46Å; A926-P1101 WeakPolarHBondContact O-CB 3.3Å
927	C	74.8	Confident	90.2	Very high	6 Å²	6	20.7 Å²	20.7	4%	0.041	12%	0.12	C	C	.	.	S	Bend	trans	-149.4	170.2	-179.9	58.8	0	0	0	0	114.4	Q839 A925 F929 S932 R936	Q839-C927 HydrophobicContact CG-CB 4.46Å; A925-C927 VanDerWaalsContact C-N 3.31Å; A925-C927 PolarHBondContact O-N 3.18Å; A925-C927 VanDerWaalsContact O-N 3.15Å; C927-F929 PolarHBondContact O-N 2.95Å; C927-F929 WeakPolarHBondContact SG-CB 3.44Å; C927-S932 WeakPolarHBondContact O-CB 3.48Å; C927-S932 PolarHBondContact SG-OG 3.27Å; C927-R936 PolarHBondContact O-NH1 3.17Å; C927-R936 PolarHBondContact O-NH2 2.83Å
928	Q	72.8	Confident	90.1	Very high	91 Å²	91	21.2 Å²	21.2	43%	0.425	12%	0.124	S	C	.	.	S	Bend	trans	-89.6	56.6	172.9	-62.1	-169.1	58.6	0	0	110.9	A851	A851-Q928 HydrophobicContact CB-CB 3.9Å; A851-Q928 HydrophobicContact CB-CG 4.3Å; A851-Q928 PolarHBondContact O-NE2 2.55Å; A851-Q928 PolarHBondContact O-OE1 2.94Å
929	F	77.4	Confident	90.1	Very high	18 Å²	18	21.2 Å²	21.2	8%	0.079	12%	0.124	C	C	.	.	S	Bend	trans	-108.1	144.5	175.9	-178.7	-131.4	0	0	0	108.6	Q839 V842 D843 Y846 C927 P931 S932 A933	Q839-F929 HydrophobicContact CB-CB 4.42Å; Q839-F929 HydrophobicContact CB-CD1 3.9Å; Q839-F929 HydrophobicContact CB-CD2 4.46Å; Q839-F929 HydrophobicContact CB-CE1 4.23Å; Q839-F929 HydrophobicContact CB-CG 4.05Å; V842-F929 HydrophobicContact CB-CZ 4.13Å; V842-F929 HydrophobicContact CG1-CE1 4.43Å; V842-F929 HydrophobicContact CG1-CZ 3.78Å; D843-F929 HydrophobicContact CB-CE2 4.02Å; Y846-F929 HydrophobicContact CE2-CB 4.47Å; C927-F929 PolarHBondContact O-N 2.95Å; C927-F929 WeakPolarHBondContact SG-CB 3.44Å; F929-P931 HydrophobicContact CD1-CB 3.84Å; F929-P931 HydrophobicContact CD1-CG 3.85Å; F929-P931 HydrophobicContact CE1-CB 3.75Å; F929-P931 HydrophobicContact CE1-CG 3.44Å; F929-P931 VanDerWaalsContact CE1-CG 3.44Å; F929-P931 HydrophobicContact CZ-CG 3.81Å; F929-S932 WeakPolarHBondContact O-CA 3.29Å; F929-S932 WeakPolarHBondContact O-CB 3.16Å; F929-S932 PolarHBondContact O-N 3.17Å; F929-A933 PolarHBondContact O-N 2.96Å; F929-A933 VanDerWaalsContact O-N 3.08Å
930	P	83.8	Confident	90	Very high	86 Å²	86	23.5 Å²	23.5	56%	0.558	13%	0.133	S	C	*	.	H	α-helix	trans	-59.5	-43.9	-174.3	-22.1	32.6	0	0	0	113.8	S932 A933 E934	P930-S932 VanDerWaalsContact C-N 3.29Å; P930-S932 PolarHBondContact O-N 3.35Å; P930-A933 CarbonylContact O-C 3.51Å; P930-A933 WeakPolarHBondContact O-CA 3.27Å; P930-A933 WeakPolarHBondContact O-CB 3.43Å; P930-A933 PolarHBondContact O-N 3.39Å; P930-E934 PolarHBondContact O-N 3.07Å
931	P	88.3	Confident	89.8	Confident	18 Å²	18	28.8 Å²	28.8	12%	0.117	17%	0.165	C	C	.	.	H	α-helix	trans	-53.5	-37.4	168	-34.2	41.1	0	0	0	115.2	W893 F929 A933 E934 V935	W893-P931 HydrophobicContact CB-CB 4.41Å; W893-P931 HydrophobicContact CD2-CB 4.01Å; W893-P931 HydrophobicContact CD2-CG 4.5Å; W893-P931 HydrophobicContact CG-CB 3.82Å; W893-P931 HydrophobicContact CZ2-CG 4.23Å; F929-P931 HydrophobicContact CD1-CB 3.84Å; F929-P931 HydrophobicContact CD1-CG 3.85Å; F929-P931 HydrophobicContact CE1-CB 3.75Å; F929-P931 HydrophobicContact CE1-CG 3.44Å; F929-P931 VanDerWaalsContact CE1-CG 3.44Å; F929-P931 HydrophobicContact CZ-CG 3.81Å; P931-A933 VanDerWaalsContact C-N 3.31Å; P931-A933 PolarHBondContact O-N 3.13Å; P931-E934 WeakPolarHBondContact O-CB 3.36Å; P931-E934 PolarHBondContact O-N 3.34Å; P931-V935 WeakPolarHBondContact O-CG2 3.22Å; P931-V935 PolarHBondContact O-N 3.04Å
932	S	89.7	Confident	89.7	Confident	4 Å²	4	31.8 Å²	31.8	3%	0.028	18%	0.179	C	C	.	.	H	α-helix	trans	-68.9	-29.8	174.5	-62.2	0	0	0	0	112.6	L924 C927 F929 P930 R936	L924-S932 WeakPolarHBondContact O-CA 3.44Å; L924-S932 WeakPolarHBondContact O-CB 3.23Å; L924-S932 PolarHBondContact O-OG 2.85Å; C927-S932 WeakPolarHBondContact O-CB 3.48Å; C927-S932 PolarHBondContact SG-OG 3.27Å; F929-S932 WeakPolarHBondContact O-CA 3.29Å; F929-S932 WeakPolarHBondContact O-CB 3.16Å; F929-S932 PolarHBondContact O-N 3.17Å; P930-S932 VanDerWaalsContact C-N 3.29Å; P930-S932 PolarHBondContact O-N 3.35Å; S932-R936 WeakPolarHBondContact O-CB 3.43Å; S932-R936 VanDerWaalsContact O-CG 3.27Å; S932-R936 WeakPolarHBondContact O-CG 2.88Å; S932-R936 PolarHBondContact O-N 2.99Å; S932-R936 PolarHBondContact O-NE 3.33Å
933	A	88.8	Confident	89.6	Confident	46 Å²	46	39.4 Å²	39.4	38%	0.38	21%	0.212	S	C	.	.	H	α-helix	trans	-71.5	-36.2	170.5	0	0	0	0	0	112	F929 P930 P931 R936 A937	F929-A933 PolarHBondContact O-N 2.96Å; F929-A933 VanDerWaalsContact O-N 3.08Å; P930-A933 CarbonylContact O-C 3.51Å; P930-A933 WeakPolarHBondContact O-CA 3.27Å; P930-A933 WeakPolarHBondContact O-CB 3.43Å; P930-A933 PolarHBondContact O-N 3.39Å; P931-A933 VanDerWaalsContact C-N 3.31Å; P931-A933 PolarHBondContact O-N 3.13Å; A933-R936 PolarHBondContact O-N 3.47Å; A933-A937 WeakPolarHBondContact O-CB 3.45Å; A933-A937 PolarHBondContact O-N 3Å
934	E	90.6	Very high	89.6	Confident	107 Å²	107	39.4 Å²	39.4	50%	0.5	21%	0.212	S	C	.	.	H	α-helix	trans	-64.1	-44.9	171.8	-68.5	174.7	-168.4	0	0	111.6	P930 P931 A937 A938	P930-E934 PolarHBondContact O-N 3.07Å; P931-E934 WeakPolarHBondContact O-CB 3.36Å; P931-E934 PolarHBondContact O-N 3.34Å; E934-A937 CarbonylContact O-C 3.53Å; E934-A937 WeakPolarHBondContact O-CB 3.29Å; E934-A937 PolarHBondContact O-N 3.22Å; E934-A937 VanDerWaalsContact O-N 3.13Å; E934-A938 WeakPolarHBondContact O-CB 3.48Å; E934-A938 PolarHBondContact O-N 3.03Å
935	V	94.6	Very high	89.6	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.8	-45.6	174.7	170.8	0	0	0	0	111.2	W893 V898 L924 P931 A937 A938 V939	W893-V935 HydrophobicContact CB-CG2 3.77Å; V898-V935 HydrophobicContact CG2-CG1 4.15Å; V898-V935 HydrophobicContact CG2-CG2 4.01Å; L924-V935 HydrophobicContact CB-CG1 4.01Å; L924-V935 HydrophobicContact CB-CG2 4.23Å; P931-V935 WeakPolarHBondContact O-CG2 3.22Å; P931-V935 PolarHBondContact O-N 3.04Å; V935-A937 PolarHBondContact O-N 2.75Å; V935-A938 PolarHBondContact O-N 3.42Å; V935-V939 WeakPolarHBondContact O-CG2 3.44Å; V935-V939 PolarHBondContact O-N 3.4Å
936	R	95.1	Very high	89.6	Confident	13 Å²	13	43.6 Å²	43.6	5%	0.049	24%	0.239	C	C	.	.	H	α-helix	trans	-57	-35	173.4	-78.6	-175.3	-70.8	-97.2	-1.6	112.6	A925 C927 S932 A933 N969 L970 D973 N976	A925-R936 HydrophobicContact CB-CG 4.21Å; A925-R936 PolarHBondContact O-NH1 2.84Å; C927-R936 PolarHBondContact O-NH1 3.17Å; C927-R936 PolarHBondContact O-NH2 2.83Å; S932-R936 WeakPolarHBondContact O-CB 3.43Å; S932-R936 VanDerWaalsContact O-CG 3.27Å; S932-R936 WeakPolarHBondContact O-CG 2.88Å; S932-R936 PolarHBondContact O-N 2.99Å; S932-R936 PolarHBondContact O-NE 3.33Å; A933-R936 PolarHBondContact O-N 3.47Å; R936-N969 WeakPolarHBondContact CD-O 3.22Å; R936-L970 HydrophobicContact CG-CD2 4.18Å; R936-D973 HydrophobicContact CB-CB 4.38Å; R936-N976 PolarHBondContact O-ND2 3.43Å
937	A	93.3	Very high	90.1	Very high	26 Å²	26	44 Å²	44	22%	0.215	24%	0.24	C	C	.	.	H	α-helix	trans	-77.9	-39.8	175.3	0	0	0	0	0	112.8	A933 E934 V935 R940 V941	A933-A937 WeakPolarHBondContact O-CB 3.45Å; A933-A937 PolarHBondContact O-N 3Å; E934-A937 CarbonylContact O-C 3.53Å; E934-A937 WeakPolarHBondContact O-CB 3.29Å; E934-A937 PolarHBondContact O-N 3.22Å; E934-A937 VanDerWaalsContact O-N 3.13Å; V935-A937 PolarHBondContact O-N 2.75Å; A937-R940 WeakPolarHBondContact O-CB 3.12Å; A937-R940 PolarHBondContact O-N 3.06Å; A937-V941 WeakPolarHBondContact O-CG2 3.5Å; A937-V941 PolarHBondContact O-N 3.17Å
938	A	94.9	Very high	91.1	Very high	10 Å²	10	43.7 Å²	43.7	8%	0.083	24%	0.238	C	C	.	.	H	α-helix	trans	-62.4	-44.6	179.4	0	0	0	0	0	111.5	P895 V898 E934 V935 R940 V941 E942	P895-A938 HydrophobicContact CB-CB 4.24Å; V898-A938 HydrophobicContact CB-CB 4.4Å; V898-A938 HydrophobicContact CG1-CB 4.15Å; E934-A938 WeakPolarHBondContact O-CB 3.48Å; E934-A938 PolarHBondContact O-N 3.03Å; V935-A938 PolarHBondContact O-N 3.42Å; A938-R940 PolarHBondContact O-N 3.39Å; A938-V941 PolarHBondContact O-N 3.12Å; A938-V941 VanDerWaalsContact O-N 3.16Å; A938-E942 WeakPolarHBondContact O-CB 3.34Å; A938-E942 PolarHBondContact O-N 2.89Å
939	V	96.8	Very high	92.1	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-59.1	-35.7	176.2	172.3	0	0	0	0	112.1	V898 L902 I921 V935 K943 G944 L945 L948 L970	V898-V939 HydrophobicContact CG1-CG2 3.5Å; V898-V939 VanDerWaalsContact CG1-CG2 3.5Å; L902-V939 HydrophobicContact CD1-CG1 4.44Å; L902-V939 HydrophobicContact CD1-CG2 4.41Å; L902-V939 HydrophobicContact CD2-CG1 4.4Å; I921-V939 HydrophobicContact CG2-CG2 4.05Å; V935-V939 WeakPolarHBondContact O-CG2 3.44Å; V935-V939 PolarHBondContact O-N 3.4Å; V939-K943 PolarHBondContact O-N 3.05Å; V939-G944 PolarHBondContact O-N 2.95Å; V939-L945 HydrophobicContact CG1-CD2 4Å; V939-L945 HydrophobicContact CG1-CG 4.42Å; V939-L948 HydrophobicContact CG1-CD1 4.36Å; V939-L970 HydrophobicContact CB-CD2 3.88Å; V939-L970 HydrophobicContact CG1-CD1 3.92Å; V939-L970 HydrophobicContact CG1-CD2 3.98Å; V939-L970 HydrophobicContact CG2-CD2 3.97Å
940	R	94.3	Very high	92.8	Very high	49 Å²	49	45.7 Å²	45.7	19%	0.185	25%	0.249	C	C	.	.	H	α-helix	trans	-71.3	-44.6	174.7	-178.2	178.8	57.1	-114.4	-0.2	112.5	A937 A938 E942 K943 L945 D973 R975 N976 L979	A937-R940 WeakPolarHBondContact O-CB 3.12Å; A937-R940 PolarHBondContact O-N 3.06Å; A938-R940 PolarHBondContact O-N 3.39Å; R940-E942 VanDerWaalsContact C-N 3.34Å; R940-K943 PolarHBondContact O-N 2.97Å; R940-L945 HydrophobicContact CB-CD1 4.33Å; R940-L945 HydrophobicContact CG-CD1 4.35Å; R940-D973 IonicContact CZ-OD2 2.6Å; R940-D973 VanDerWaalsContact NH1-CG 3.32Å; R940-D973 IonicContact NH1-OD1 3.93Å; R940-D973 IonicContact NH1-OD2 2.81Å; R940-D973 PolarHBondContact NH1-OD2 3.49Å; R940-D973 IonicContact NH2-OD2 2.67Å; R940-R975 VanDerWaalsContact NH2-CZ 3.29Å; R940-N976 WeakPolarHBondContact CB-OD1 3.41Å; R940-N976 WeakPolarHBondContact CD-OD1 3.47Å; R940-N976 PolarHBondContact NH1-OD1 2.6Å; R940-L979 HydrophobicContact CG-CD1 3.66Å
941	V	93.4	Very high	93.3	Very high	110 Å²	110	42.5 Å²	42.5	67%	0.667	23%	0.227	S	C	*	.	H	α-helix	trans	-63.5	-40.9	179.8	169.2	0	0	0	0	111.4	A937 A938 K943	A937-V941 WeakPolarHBondContact O-CG2 3.5Å; A937-V941 PolarHBondContact O-N 3.17Å; A938-V941 PolarHBondContact O-N 3.12Å; A938-V941 VanDerWaalsContact O-N 3.16Å; V941-K943 PolarHBondContact O-N 2.61Å
942	E	93.8	Very high	93.6	Very high	64 Å²	64	41.7 Å²	41.7	30%	0.299	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	11.7	177.4	-69	-69	-175.7	0	0	113.7	K899 L902 A938 R940 G944	K899-E942 HydrophobicContact CB-CG 4.29Å; K899-E942 WeakPolarHBondContact CD-OE1 3.48Å; K899-E942 HydrophobicContact CG-CG 4.25Å; K899-E942 IonicContact NZ-OE1 3.83Å; K899-E942 PolarHBondContact NZ-OE1 3.15Å; K899-E942 IonicContact NZ-OE2 2.66Å; K899-E942 PolarHBondContact NZ-OE2 3.48Å; L902-E942 HydrophobicContact CD1-CB 3.76Å; A938-E942 WeakPolarHBondContact O-CB 3.34Å; A938-E942 PolarHBondContact O-N 2.89Å; R940-E942 VanDerWaalsContact C-N 3.34Å; E942-G944 VanDerWaalsContact C-N 3.26Å; E942-G944 PolarHBondContact O-N 3.38Å
943	K	93.1	Very high	93.7	Very high	165 Å²	165	47.8 Å²	47.8	72%	0.717	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.9	36.6	178.7	-55.5	179.8	-179.7	178.6	0	113.9	V939 R940 V941 P946	V939-K943 PolarHBondContact O-N 3.05Å; R940-K943 PolarHBondContact O-N 2.97Å; V941-K943 PolarHBondContact O-N 2.61Å; K943-P946 WeakPolarHBondContact O-CD 3.49Å
944	G	94.7	Very high	93.9	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-77.2	-19.2	178.8	0	0	0	0	0	115.2	V939 E942 V947 L948	V939-G944 PolarHBondContact O-N 2.95Å; E942-G944 VanDerWaalsContact C-N 3.26Å; E942-G944 PolarHBondContact O-N 3.38Å; G944-V947 WeakPolarHBondContact O-CB 3.38Å; G944-V947 PolarHBondContact O-N 2.81Å; G944-L948 PolarHBondContact O-N 3.37Å; G944-L948 VanDerWaalsContact O-N 3.11Å
945	L	94.6	Very high	93.9	Very high	8 Å²	8	46.9 Å²	46.9	4%	0.042	24%	0.242	C	C	.	.	H	α-helix	trans	-62.2	-45.4	-178.1	-58.8	174.2	0	0	0	113	V939 R940 V947 L948 V949 L970 N976 L979 I980	V939-L945 HydrophobicContact CG1-CD2 4Å; V939-L945 HydrophobicContact CG1-CG 4.42Å; R940-L945 HydrophobicContact CB-CD1 4.33Å; R940-L945 HydrophobicContact CG-CD1 4.35Å; L945-V947 PolarHBondContact O-N 2.67Å; L945-L948 PolarHBondContact O-N 3.22Å; L945-V949 WeakPolarHBondContact O-CG2 3.41Å; L945-V949 PolarHBondContact O-N 3.29Å; L945-L970 HydrophobicContact CD2-CB 4.27Å; L945-L970 HydrophobicContact CD2-CD1 4.04Å; L945-N976 HydrophobicContact CD1-CB 4.03Å; L945-N976 HydrophobicContact CD2-CB 4.46Å; L945-L979 HydrophobicContact CD1-CB 4.05Å; L945-L979 HydrophobicContact CD1-CD1 4.34Å; L945-I980 HydrophobicContact CB-CG1 4.47Å; L945-I980 HydrophobicContact CD1-CG1 4.44Å; L945-I980 HydrophobicContact CD2-CD1 4.27Å; L945-I980 HydrophobicContact CD2-CG1 4.25Å
946	P	92.7	Very high	93.7	Very high	85 Å²	85	49.6 Å²	49.6	55%	0.552	26%	0.255	S	S	*	.	H	α-helix	trans	-60.6	-39.1	173	-25.9	36.1	0	0	0	114.1	K943 L948 V949 E950	K943-P946 WeakPolarHBondContact O-CD 3.49Å; P946-L948 PolarHBondContact O-N 3.3Å; P946-V949 PolarHBondContact O-N 3.38Å; P946-E950 WeakPolarHBondContact O-CB 3.48Å; P946-E950 PolarHBondContact O-N 3.46Å
947	V	94.4	Very high	93.5	Very high	18 Å²	18	50.3 Å²	50.3	11%	0.109	26%	0.259	C	S	.	.	H	α-helix	trans	-59.4	-49.3	178.5	-173.1	0	0	0	0	110.2	L905 Q906 G944 L945 V949 E950 L951	L905-V947 HydrophobicContact CB-CG1 3.95Å; L905-V947 WeakPolarHBondContact O-CG1 3.38Å; Q906-V947 HydrophobicContact CG-CG1 3.89Å; Q906-V947 HydrophobicContact CG-CG2 3.81Å; G944-V947 WeakPolarHBondContact O-CB 3.38Å; G944-V947 PolarHBondContact O-N 2.81Å; L945-V947 PolarHBondContact O-N 2.67Å; V947-V949 PolarHBondContact O-N 3.48Å; V947-E950 PolarHBondContact O-N 3.03Å; V947-L951 HydrophobicContact CG1-CD1 4.28Å; V947-L951 WeakPolarHBondContact O-CG 3.28Å; V947-L951 PolarHBondContact O-N 2.96Å
948	L	95.5	Very high	93.3	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-64.8	-37.7	177.8	-71	167.1	0	0	0	111.9	L905 V939 G944 L945 P946 L951 I952 V963 L967 L970	L905-L948 HydrophobicContact CD1-CD2 3.95Å; V939-L948 HydrophobicContact CG1-CD1 4.36Å; G944-L948 PolarHBondContact O-N 3.37Å; G944-L948 VanDerWaalsContact O-N 3.11Å; L945-L948 PolarHBondContact O-N 3.22Å; P946-L948 PolarHBondContact O-N 3.3Å; L948-L951 PolarHBondContact O-N 3.01Å; L948-I952 PolarHBondContact O-N 3.2Å; L948-V963 HydrophobicContact CB-CG1 4.21Å; L948-V963 HydrophobicContact CD2-CG1 4.12Å; L948-V963 HydrophobicContact CD2-CG2 4.24Å; L948-V963 WeakPolarHBondContact O-CG1 3.5Å; L948-L967 HydrophobicContact CB-CD1 4.19Å; L948-L967 HydrophobicContact CB-CD2 3.6Å; L948-L967 HydrophobicContact CB-CG 3.85Å; L948-L967 HydrophobicContact CD1-CD2 4.22Å; L948-L970 HydrophobicContact CD1-CD1 3.41Å; L948-L970 VanDerWaalsContact CD1-CD1 3.41Å
949	V	93.5	Very high	93.2	Very high	18 Å²	18	51.1 Å²	51.1	11%	0.109	26%	0.256	C	S	.	.	H	α-helix	trans	-66.2	-37.5	174.7	168.6	0	0	0	0	111.8	L945 P946 V947 I952 L967 I980 A986	L945-V949 WeakPolarHBondContact O-CG2 3.41Å; L945-V949 PolarHBondContact O-N 3.29Å; P946-V949 PolarHBondContact O-N 3.38Å; V947-V949 PolarHBondContact O-N 3.48Å; V949-I952 WeakPolarHBondContact O-CB 3.45Å; V949-I952 PolarHBondContact O-N 3.03Å; V949-L967 HydrophobicContact CG2-CD1 4.15Å; V949-L967 HydrophobicContact CG2-CD2 4.24Å; V949-I980 HydrophobicContact CG2-CG2 4.33Å; V949-A986 HydrophobicContact CG1-CB 3.7Å; V949-A986 HydrophobicContact CG2-CB 4.12Å
950	E	92.5	Very high	93.1	Very high	132 Å²	132	51.1 Å²	51.1	62%	0.617	26%	0.257	S	S	*	.	H	α-helix	trans	-65.3	-41	176.8	-173.4	166	-172.2	0	0	111.8	P946 V947 I952 R953	P946-E950 WeakPolarHBondContact O-CB 3.48Å; P946-E950 PolarHBondContact O-N 3.46Å; V947-E950 PolarHBondContact O-N 3.03Å; E950-I952 PolarHBondContact O-N 3.13Å; E950-R953 WeakPolarHBondContact O-CB 3.36Å; E950-R953 PolarHBondContact O-N 3.44Å
951	L	94.9	Very high	93.1	Very high	19 Å²	19	49.3 Å²	49.3	10%	0.099	25%	0.251	C	S	.	.	H	α-helix	trans	-65.6	-15.3	177.1	-67.9	169.5	0	0	0	114.3	L905 L914 V947 L948 R953 L954 V963	L905-L951 HydrophobicContact CB-CD1 4.05Å; L905-L951 HydrophobicContact CD2-CD1 3.58Å; L905-L951 HydrophobicContact CG-CD1 4.35Å; L914-L951 HydrophobicContact CD1-CD2 4.43Å; V947-L951 HydrophobicContact CG1-CD1 4.28Å; V947-L951 WeakPolarHBondContact O-CG 3.28Å; V947-L951 PolarHBondContact O-N 2.96Å; L948-L951 PolarHBondContact O-N 3.01Å; L951-R953 PolarHBondContact O-N 3.08Å; L951-L954 HydrophobicContact CB-CD1 4.39Å; L951-L954 HydrophobicContact CD2-CD1 3.61Å; L951-L954 HydrophobicContact CD2-CG 4.28Å; L951-L954 WeakPolarHBondContact O-CB 3.41Å; L951-L954 WeakPolarHBondContact O-CG 3.44Å; L951-L954 PolarHBondContact O-N 2.99Å; L951-V963 HydrophobicContact CB-CG1 4.17Å; L951-V963 HydrophobicContact CB-CG2 4.07Å; L951-V963 HydrophobicContact CD1-CG2 4.39Å
952	I	94.7	Very high	93.2	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.005	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-27	169.8	-66.3	-71.1	0	0	0	111.4	L948 V949 E950 L954 V960 V963 A964 L967 D989 F990 K993	L948-I952 PolarHBondContact O-N 3.2Å; V949-I952 WeakPolarHBondContact O-CB 3.45Å; V949-I952 PolarHBondContact O-N 3.03Å; E950-I952 PolarHBondContact O-N 3.13Å; I952-L954 VanDerWaalsContact C-N 3.25Å; I952-L954 PolarHBondContact O-N 3.34Å; I952-V960 HydrophobicContact CD1-CG1 4.26Å; I952-V963 HydrophobicContact CD1-CB 4.31Å; I952-V963 HydrophobicContact CD1-CG1 3.72Å; I952-V963 HydrophobicContact CG1-CG1 3.96Å; I952-A964 HydrophobicContact CD1-CB 3.93Å; I952-L967 HydrophobicContact CD1-CD1 4.14Å; I952-L967 HydrophobicContact CG1-CD1 3.93Å; I952-D989 HydrophobicContact CG2-CB 4.11Å; I952-F990 HydrophobicContact CD1-CD1 4.43Å; I952-F990 HydrophobicContact CD1-CE1 4.14Å; I952-F990 HydrophobicContact CG1-CD1 4.4Å; I952-F990 HydrophobicContact CG1-CE1 3.96Å; I952-F990 HydrophobicContact CG2-CD1 4.28Å; I952-K993 HydrophobicContact CG2-CG 4.15Å; I952-K993 WeakPolarHBondContact O-CE 3.43Å
953	R	92.3	Very high	93.3	Very high	132 Å²	132	41.2 Å²	41.2	50%	0.498	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-11.3	-178	-61.5	-175.3	-178.8	130.8	13.6	114.1	E950 L951 D989	E950-R953 WeakPolarHBondContact O-CB 3.36Å; E950-R953 PolarHBondContact O-N 3.44Å; L951-R953 PolarHBondContact O-N 3.08Å; R953-D989 IonicContact CZ-OD1 2.66Å; R953-D989 IonicContact CZ-OD2 2.7Å; R953-D989 IonicContact NE-OD1 2.73Å; R953-D989 PolarHBondContact NE-OD1 3.38Å; R953-D989 IonicContact NE-OD2 3.15Å; R953-D989 VanDerWaalsContact NH2-CG 3.32Å; R953-D989 IonicContact NH2-OD1 2.72Å; R953-D989 PolarHBondContact NH2-OD1 2.73Å; R953-D989 VanDerWaalsContact NH2-OD1 3.11Å; R953-D989 IonicContact NH2-OD2 2.89Å; R953-D989 PolarHBondContact NH2-OD2 3.35Å
954	L	91.8	Very high	93.5	Very high	29 Å²	29	33.4 Å²	33.4	15%	0.152	17%	0.173	C	C	.	.			trans	-58.3	142.9	177.3	-76.2	-177	0	0	0	112.1	L914 L951 I952 E956 V959 V960 K993	L914-L954 HydrophobicContact CD1-CD1 4.33Å; L951-L954 HydrophobicContact CB-CD1 4.39Å; L951-L954 HydrophobicContact CD2-CD1 3.61Å; L951-L954 HydrophobicContact CD2-CG 4.28Å; L951-L954 WeakPolarHBondContact O-CB 3.41Å; L951-L954 WeakPolarHBondContact O-CG 3.44Å; L951-L954 PolarHBondContact O-N 2.99Å; I952-L954 VanDerWaalsContact C-N 3.25Å; I952-L954 PolarHBondContact O-N 3.34Å; L954-E956 VanDerWaalsContact C-N 3.26Å; L954-E956 VanDerWaalsContact CB-OE2 3.3Å; L954-E956 WeakPolarHBondContact CB-OE2 3.42Å; L954-V959 HydrophobicContact CD1-CB 4.33Å; L954-V959 HydrophobicContact CD1-CG1 3.82Å; L954-V960 HydrophobicContact CB-CG2 4.3Å; L954-V960 VanDerWaalsContact O-CG2 3.29Å; L954-V960 WeakPolarHBondContact O-CG2 3.43Å; L954-K993 PolarHBondContact O-NZ 3.49Å
955	P	89.9	Confident	93.5	Very high	106 Å²	106	33.9 Å²	33.9	69%	0.688	18%	0.176	S	C	*	.	S	Bend	trans	-69.8	-21.3	170.8	27.8	-34.1	0	0	0	113.2	D957	P955-D957 PolarHBondContact O-N 2.86Å
956	E	91.9	Very high	93.6	Very high	56 Å²	56	33.5 Å²	33.5	26%	0.262	17%	0.174	S	C	.	.			trans	-70.8	94.2	-174.5	-63.1	78.7	-171.7	0	0	112.9	I911 L954 F958 V959 V960	I911-E956 HydrophobicContact CD1-CG 3.96Å; I911-E956 HydrophobicContact CG1-CG 4.27Å; I911-E956 HydrophobicContact CG2-CB 3.96Å; I911-E956 HydrophobicContact CG2-CG 3.79Å; L954-E956 VanDerWaalsContact C-N 3.26Å; L954-E956 VanDerWaalsContact CB-OE2 3.3Å; L954-E956 WeakPolarHBondContact CB-OE2 3.42Å; E956-F958 VanDerWaalsContact C-N 3.27Å; E956-F958 HydrophobicContact CB-CE1 4.42Å; E956-F958 PolarHBondContact O-N 2.94Å; E956-F958 VanDerWaalsContact O-N 3.07Å; E956-V959 HydrophobicContact CB-CB 4.35Å; E956-V959 HydrophobicContact CB-CG2 4Å; E956-V959 PolarHBondContact O-N 3Å; E956-V960 PolarHBondContact O-N 2.8Å; E956-V960 VanDerWaalsContact O-N 3.1Å
957	D	90.4	Very high	93.7	Very high	28 Å²	28	29.5 Å²	29.5	15%	0.15	15%	0.148	C	C	.	.	H	α-helix	trans	-41.9	-46.5	-176.3	-179	68.4	0	0	0	114.5	P955 V960 C961 I1005 S1006 T1009	P955-D957 PolarHBondContact O-N 2.86Å; D957-V960 PolarHBondContact O-N 2.87Å; D957-C961 WeakPolarHBondContact O-CB 3.27Å; D957-C961 PolarHBondContact O-N 3.42Å; D957-I1005 WeakPolarHBondContact OD1-CA 3.2Å; D957-S1006 PolarHBondContact OD1-N 2.73Å; D957-S1006 PolarHBondContact OD1-OG 2.63Å; D957-S1006 VanDerWaalsContact OD2-CB 3.27Å; D957-S1006 WeakPolarHBondContact OD2-CB 3.27Å; D957-S1006 PolarHBondContact OD2-OG 2.66Å; D957-T1009 PolarHBondContact O-OG1 3.39Å; D957-T1009 WeakPolarHBondContact OD1-CB 3.47Å; D957-T1009 PolarHBondContact OD1-OG1 2.92Å; D957-T1009 PolarHBondContact OD2-OG1 3.47Å
958	F	88.9	Confident	93.7	Very high	53 Å²	53	29.2 Å²	29.2	23%	0.232	15%	0.145	C	C	.	.	H	α-helix	trans	-72.2	-33.4	-175.8	59.8	-79.2	0	0	0	113.7	I911 E915 E956 A962	I911-F958 HydrophobicContact CB-CZ 4.27Å; I911-F958 HydrophobicContact CG2-CE1 4.1Å; I911-F958 HydrophobicContact CG2-CE2 3.61Å; I911-F958 HydrophobicContact CG2-CZ 3.32Å; E915-F958 HydrophobicContact CB-CD2 4.05Å; E915-F958 HydrophobicContact CB-CE2 4.44Å; E915-F958 HydrophobicContact CG-CD2 3.99Å; E956-F958 VanDerWaalsContact C-N 3.27Å; E956-F958 HydrophobicContact CB-CE1 4.42Å; E956-F958 PolarHBondContact O-N 2.94Å; E956-F958 VanDerWaalsContact O-N 3.07Å; F958-A962 PolarHBondContact O-N 3.47Å; F958-A962 VanDerWaalsContact O-N 3.17Å
959	V	93.6	Very high	93.6	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-66	-46.9	169.7	-176.3	0	0	0	0	109.4	I911 L914 E915 L954 E956 C961 A962 V963	I911-V959 HydrophobicContact CG2-CG2 3.4Å; L914-V959 HydrophobicContact CB-CG1 4.21Å; L914-V959 HydrophobicContact CB-CG2 4.42Å; E915-V959 HydrophobicContact CB-CG2 4.14Å; L954-V959 HydrophobicContact CD1-CB 4.33Å; L954-V959 HydrophobicContact CD1-CG1 3.82Å; E956-V959 HydrophobicContact CB-CB 4.35Å; E956-V959 HydrophobicContact CB-CG2 4Å; E956-V959 PolarHBondContact O-N 3Å; V959-C961 VanDerWaalsContact C-N 3.29Å; V959-C961 PolarHBondContact O-N 3.34Å; V959-A962 PolarHBondContact O-N 3.47Å; V959-V963 HydrophobicContact CG1-CG2 3.93Å; V959-V963 VanDerWaalsContact O-CB 3.29Å; V959-V963 WeakPolarHBondContact O-CB 3.44Å; V959-V963 WeakPolarHBondContact O-CG2 3.47Å; V959-V963 PolarHBondContact O-N 3.4Å
960	V	94.9	Very high	93.7	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.006	14%	0.14	C	C	.	.	H	α-helix	trans	-59.8	-39.9	179.1	-179.9	0	0	0	0	111.2	I952 L954 E956 D957 A964 K993 T1009	I952-V960 HydrophobicContact CD1-CG1 4.26Å; L954-V960 HydrophobicContact CB-CG2 4.3Å; L954-V960 VanDerWaalsContact O-CG2 3.29Å; L954-V960 WeakPolarHBondContact O-CG2 3.43Å; E956-V960 PolarHBondContact O-N 2.8Å; E956-V960 VanDerWaalsContact O-N 3.1Å; D957-V960 PolarHBondContact O-N 2.87Å; V960-A964 WeakPolarHBondContact O-CB 3.48Å; V960-A964 PolarHBondContact O-N 3.02Å; V960-K993 HydrophobicContact CG1-CD 4.33Å; V960-K993 HydrophobicContact CG1-CG 4.32Å; V960-T1009 HydrophobicContact CB-CG2 4.1Å; V960-T1009 HydrophobicContact CG1-CG2 3.74Å
961	C	93.4	Very high	93.7	Very high	11 Å²	11	22 Å²	22	7%	0.074	11%	0.11	C	C	.	.	H	α-helix	trans	-59.8	-51	174.4	-176.1	0	0	0	0	112.8	D957 V959 T965 T1009	D957-C961 WeakPolarHBondContact O-CB 3.27Å; D957-C961 PolarHBondContact O-N 3.42Å; V959-C961 VanDerWaalsContact C-N 3.29Å; V959-C961 PolarHBondContact O-N 3.34Å; C961-T965 WeakPolarHBondContact O-CB 3.46Å; C961-T965 PolarHBondContact O-N 3.42Å; C961-T965 PolarHBondContact O-OG1 2.86Å; C961-T1009 HydrophobicContact CB-CG2 4.47Å; C961-T1009 WeakPolarHBondContact CB-OG1 3.43Å
962	A	95.3	Very high	93.4	Very high	4 Å²	4	22.9 Å²	22.9	3%	0.033	11%	0.114	C	C	.	.	H	α-helix	trans	-65	-42.7	179.7	0	0	0	0	0	111.5	E915 A918 F958 V959 T965 A966	E915-A962 HydrophobicContact CG-CB 3.9Å; A918-A962 HydrophobicContact CB-CB 4.01Å; F958-A962 PolarHBondContact O-N 3.47Å; F958-A962 VanDerWaalsContact O-N 3.17Å; V959-A962 PolarHBondContact O-N 3.47Å; A962-T965 PolarHBondContact O-N 2.91Å; A962-A966 VanDerWaalsContact O-CB 3.29Å; A962-A966 WeakPolarHBondContact O-CB 3.43Å; A962-A966 PolarHBondContact O-N 3Å
963	V	97	Very high	93.2	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-66.3	-44.1	178.4	171.1	0	0	0	0	111.9	A918 L948 L951 I952 V959 T965 A966 L967	A918-V963 HydrophobicContact CB-CG2 3.64Å; L948-V963 HydrophobicContact CB-CG1 4.21Å; L948-V963 HydrophobicContact CD2-CG1 4.12Å; L948-V963 HydrophobicContact CD2-CG2 4.24Å; L948-V963 WeakPolarHBondContact O-CG1 3.5Å; L951-V963 HydrophobicContact CB-CG1 4.17Å; L951-V963 HydrophobicContact CB-CG2 4.07Å; L951-V963 HydrophobicContact CD1-CG2 4.39Å; I952-V963 HydrophobicContact CD1-CB 4.31Å; I952-V963 HydrophobicContact CD1-CG1 3.72Å; I952-V963 HydrophobicContact CG1-CG1 3.96Å; V959-V963 HydrophobicContact CG1-CG2 3.93Å; V959-V963 VanDerWaalsContact O-CB 3.29Å; V959-V963 WeakPolarHBondContact O-CB 3.44Å; V959-V963 WeakPolarHBondContact O-CG2 3.47Å; V959-V963 PolarHBondContact O-N 3.4Å; V963-T965 VanDerWaalsContact C-N 3.35Å; V963-T965 PolarHBondContact O-N 3.2Å; V963-A966 PolarHBondContact O-N 3.25Å; V963-L967 HydrophobicContact CG1-CD1 4.11Å; V963-L967 WeakPolarHBondContact O-CB 3.43Å; V963-L967 WeakPolarHBondContact O-CG 3.26Å; V963-L967 PolarHBondContact O-N 2.74Å
964	A	96.1	Very high	93.1	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-63.2	-41.1	175.5	0	0	0	0	0	111.7	I952 V960 L967 R968 A1012 V1013	I952-A964 HydrophobicContact CD1-CB 3.93Å; V960-A964 WeakPolarHBondContact O-CB 3.48Å; V960-A964 PolarHBondContact O-N 3.02Å; A964-L967 PolarHBondContact O-N 3.12Å; A964-R968 WeakPolarHBondContact O-CB 3.36Å; A964-R968 PolarHBondContact O-N 3.14Å; A964-A1012 HydrophobicContact CB-CB 3.97Å; A964-V1013 HydrophobicContact CB-CG2 4.26Å
965	T	95.1	Very high	93	Very high	11 Å²	11	26.9 Å²	26.9	7%	0.067	14%	0.14	C	C	.	.	H	α-helix	trans	-69.7	-36.6	176.8	-48.4	0	0	0	0	111.7	Q922 C961 A962 V963 R968 N969 A1012 I1102	Q922-T965 HydrophobicContact CG-CG2 3.73Å; C961-T965 WeakPolarHBondContact O-CB 3.46Å; C961-T965 PolarHBondContact O-N 3.42Å; C961-T965 PolarHBondContact O-OG1 2.86Å; A962-T965 PolarHBondContact O-N 2.91Å; V963-T965 VanDerWaalsContact C-N 3.35Å; V963-T965 PolarHBondContact O-N 3.2Å; T965-R968 PolarHBondContact O-N 3.13Å; T965-N969 PolarHBondContact O-N 2.85Å; T965-A1012 WeakPolarHBondContact OG1-CB 3.39Å; T965-I1102 HydrophobicContact CG2-CB 4.02Å; T965-I1102 HydrophobicContact CG2-CG2 4.09Å
966	A	96.6	Very high	93.2	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-62.4	-50.3	171.8	0	0	0	0	0	111.3	Q922 A962 V963 R968 N969 L970	Q922-A966 HydrophobicContact CB-CB 3.94Å; A962-A966 VanDerWaalsContact O-CB 3.29Å; A962-A966 WeakPolarHBondContact O-CB 3.43Å; A962-A966 PolarHBondContact O-N 3Å; V963-A966 PolarHBondContact O-N 3.25Å; A966-R968 VanDerWaalsContact C-N 3.31Å; A966-R968 PolarHBondContact O-N 2.91Å; A966-N969 PolarHBondContact O-N 3.18Å; A966-L970 WeakPolarHBondContact O-CB 3.33Å; A966-L970 WeakPolarHBondContact O-CD1 3.26Å; A966-L970 WeakPolarHBondContact O-CG 3.46Å; A966-L970 PolarHBondContact O-N 3.29Å
967	L	95.7	Very high	93.1	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-59.7	-39.4	177.1	-75.1	170.3	0	0	0	112.1	L948 V949 I952 V963 A964 L970 A971 I980 F990 I1016	L948-L967 HydrophobicContact CB-CD1 4.19Å; L948-L967 HydrophobicContact CB-CD2 3.6Å; L948-L967 HydrophobicContact CB-CG 3.85Å; L948-L967 HydrophobicContact CD1-CD2 4.22Å; V949-L967 HydrophobicContact CG2-CD1 4.15Å; V949-L967 HydrophobicContact CG2-CD2 4.24Å; I952-L967 HydrophobicContact CD1-CD1 4.14Å; I952-L967 HydrophobicContact CG1-CD1 3.93Å; V963-L967 HydrophobicContact CG1-CD1 4.11Å; V963-L967 WeakPolarHBondContact O-CB 3.43Å; V963-L967 WeakPolarHBondContact O-CG 3.26Å; V963-L967 PolarHBondContact O-N 2.74Å; A964-L967 PolarHBondContact O-N 3.12Å; L967-L970 PolarHBondContact O-N 3.02Å; L967-A971 VanDerWaalsContact O-CB 3.29Å; L967-A971 WeakPolarHBondContact O-CB 3.46Å; L967-A971 PolarHBondContact O-N 3.33Å; L967-I980 HydrophobicContact CD2-CD1 4.08Å; L967-I980 HydrophobicContact CD2-CG1 4.25Å; L967-F990 HydrophobicContact CD1-CE1 4.01Å; L967-F990 HydrophobicContact CD1-CZ 4.16Å; L967-I1016 HydrophobicContact CB-CD1 3.44Å; L967-I1016 VanDerWaalsContact CB-CD1 3.44Å
968	R	93.6	Very high	93	Very high	12 Å²	12	24.1 Å²	24.1	5%	0.045	12%	0.117	C	C	.	.	H	α-helix	trans	-59.1	-50.8	173.2	-178.7	-177.8	174.5	-119.6	-7.9	111.7	A964 T965 A966 L970 A971 G1015 I1016 L1098 R1100 I1102	A964-R968 WeakPolarHBondContact O-CB 3.36Å; A964-R968 PolarHBondContact O-N 3.14Å; T965-R968 PolarHBondContact O-N 3.13Å; A966-R968 VanDerWaalsContact C-N 3.31Å; A966-R968 PolarHBondContact O-N 2.91Å; R968-L970 VanDerWaalsContact C-N 3.28Å; R968-L970 PolarHBondContact O-N 3.44Å; R968-A971 PolarHBondContact O-N 2.85Å; R968-G1015 WeakPolarHBondContact CD-O 3.2Å; R968-G1015 PolarHBondContact NE-O 2.98Å; R968-I1016 HydrophobicContact CB-CB 4.04Å; R968-L1098 PolarHBondContact NH2-O 3.22Å; R968-R1100 PolarHBondContact NH1-O 3.44Å; R968-R1100 PolarHBondContact NH2-O 3.4Å; R968-I1102 VanDerWaalsContact NH1-CD1 3.28Å; R968-I1102 VanDerWaalsContact NH1-CG1 3.33Å
969	N	94.1	Very high	92.9	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-64.5	-33	177.2	-70.8	-8.2	0	0	0	112	Q922 A925 A926 R936 T965 A966 I972 I1102	Q922-N969 PolarHBondContact O-ND2 3.1Å; A925-N969 HydrophobicContact CB-CB 3.84Å; A926-N969 WeakPolarHBondContact CA-ND2 3.46Å; R936-N969 WeakPolarHBondContact CD-O 3.22Å; T965-N969 PolarHBondContact O-N 2.85Å; A966-N969 PolarHBondContact O-N 3.18Å; N969-I972 WeakPolarHBondContact O-CB 3.46Å; N969-I972 VanDerWaalsContact O-CD1 3.32Å; N969-I972 WeakPolarHBondContact O-CD1 3.47Å; N969-I972 VanDerWaalsContact O-CG1 3.29Å; N969-I972 WeakPolarHBondContact O-CG1 3.29Å; N969-I1102 PolarHBondContact ND2-O 2.99Å; N969-I1102 PolarHBondContact OD1-N 3.47Å
970	L	94.8	Very high	92.6	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-70.4	-38.5	175.5	-70.9	164.7	0	0	0	112.4	I921 A925 R936 V939 L945 L948 A966 L967 R968 I972 D973 N976	I921-L970 HydrophobicContact CG2-CD1 4.09Å; I921-L970 HydrophobicContact CG2-CD2 4.34Å; I921-L970 HydrophobicContact CG2-CG 4.46Å; A925-L970 HydrophobicContact CB-CD2 4.25Å; A925-L970 HydrophobicContact CB-CG 4.48Å; R936-L970 HydrophobicContact CG-CD2 4.18Å; V939-L970 HydrophobicContact CB-CD2 3.88Å; V939-L970 HydrophobicContact CG1-CD1 3.92Å; V939-L970 HydrophobicContact CG1-CD2 3.98Å; V939-L970 HydrophobicContact CG2-CD2 3.97Å; L945-L970 HydrophobicContact CD2-CB 4.27Å; L945-L970 HydrophobicContact CD2-CD1 4.04Å; L948-L970 HydrophobicContact CD1-CD1 3.41Å; L948-L970 VanDerWaalsContact CD1-CD1 3.41Å; A966-L970 WeakPolarHBondContact O-CB 3.33Å; A966-L970 WeakPolarHBondContact O-CD1 3.26Å; A966-L970 WeakPolarHBondContact O-CG 3.46Å; A966-L970 PolarHBondContact O-N 3.29Å; L967-L970 PolarHBondContact O-N 3.02Å; R968-L970 VanDerWaalsContact C-N 3.28Å; R968-L970 PolarHBondContact O-N 3.44Å; L970-I972 PolarHBondContact O-N 3.47Å; L970-D973 PolarHBondContact O-N 3.45Å; L970-N976 VanDerWaalsContact O-CB 3.23Å; L970-N976 WeakPolarHBondContact O-CB 3.31Å; L970-N976 PolarHBondContact O-ND2 2.99Å
971	A	92.5	Very high	91.9	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-65.8	-13.9	179.9	0	0	0	0	0	114	L967 R968 D973 R977 I980 E1019	L967-A971 VanDerWaalsContact O-CB 3.29Å; L967-A971 WeakPolarHBondContact O-CB 3.46Å; L967-A971 PolarHBondContact O-N 3.33Å; R968-A971 PolarHBondContact O-N 2.85Å; A971-D973 CarbonylContact O-C 3.59Å; A971-D973 PolarHBondContact O-N 3.38Å; A971-R977 HydrophobicContact CB-CB 4.26Å; A971-R977 HydrophobicContact CB-CG 4.21Å; A971-R977 PolarHBondContact O-NE 3.01Å; A971-R977 PolarHBondContact O-NH2 3.12Å; A971-I980 HydrophobicContact CB-CD1 4.08Å; A971-E1019 HydrophobicContact CB-CG 3.84Å
972	I	88.6	Confident	90.8	Very high	37 Å²	37	29.7 Å²	29.7	19%	0.19	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-36.9	170.5	-59.8	172.7	0	0	0	110.9	N969 L970 P974 R977 P1101	N969-I972 WeakPolarHBondContact O-CB 3.46Å; N969-I972 VanDerWaalsContact O-CD1 3.32Å; N969-I972 WeakPolarHBondContact O-CD1 3.47Å; N969-I972 VanDerWaalsContact O-CG1 3.29Å; N969-I972 WeakPolarHBondContact O-CG1 3.29Å; L970-I972 PolarHBondContact O-N 3.47Å; I972-P974 WeakPolarHBondContact O-CD 3.39Å; I972-R977 PolarHBondContact O-NH2 2.92Å; I972-P1101 HydrophobicContact CD1-CB 3.93Å; I972-P1101 HydrophobicContact CD1-CG 3.55Å
973	D	89.7	Confident	89.2	Confident	15 Å²	15	31.4 Å²	31.4	8%	0.08	17%	0.172	C	C	.	.	S	Bend	trans	-74.4	117.8	167.4	-175.2	-25.2	0	0	0	109.6	R936 R940 L970 A971 R975 N976 R977	R936-D973 HydrophobicContact CB-CB 4.38Å; R940-D973 IonicContact CZ-OD2 2.6Å; R940-D973 VanDerWaalsContact NH1-CG 3.32Å; R940-D973 IonicContact NH1-OD1 3.93Å; R940-D973 IonicContact NH1-OD2 2.81Å; R940-D973 PolarHBondContact NH1-OD2 3.49Å; R940-D973 IonicContact NH2-OD2 2.67Å; L970-D973 PolarHBondContact O-N 3.45Å; A971-D973 CarbonylContact O-C 3.59Å; A971-D973 PolarHBondContact O-N 3.38Å; D973-R975 PolarHBondContact O-N 3.34Å; D973-R975 WeakPolarHBondContact OD1-CB 3.31Å; D973-R975 IonicContact OD1-CZ 2.92Å; D973-R975 PolarHBondContact OD1-N 3.12Å; D973-R975 IonicContact OD1-NE 2.63Å; D973-R975 PolarHBondContact OD1-NE 2.97Å; D973-R975 IonicContact OD1-NH2 3.51Å; D973-R975 IonicContact OD2-CZ 3.84Å; D973-R975 IonicContact OD2-NE 3.91Å; D973-R975 PolarHBondContact OD2-NE 3.03Å; D973-R975 IonicContact OD2-NH2 3.01Å; D973-R975 PolarHBondContact OD2-NH2 3.49Å; D973-N976 HydrophobicContact CB-CB 4.27Å; D973-N976 WeakPolarHBondContact O-CB 3.44Å; D973-N976 PolarHBondContact O-N 3.45Å; D973-R977 PolarHBondContact O-N 3.09Å
974	P	90.3	Very high	87.2	Confident	91 Å²	91	37.3 Å²	37.3	59%	0.591	20%	0.198	S	C	*	.	H	α-helix	trans	-54.8	-31.8	-178.5	-27.2	36.1	0	0	0	113.8	I972 N976 R977 E978	I972-P974 WeakPolarHBondContact O-CD 3.39Å; P974-N976 VanDerWaalsContact C-N 3.32Å; P974-N976 PolarHBondContact O-N 3.49Å; P974-R977 WeakPolarHBondContact O-CB 3.39Å; P974-R977 PolarHBondContact O-N 2.89Å; P974-E978 PolarHBondContact O-N 2.95Å
975	R	91.4	Very high	86	Confident	139 Å²	139	44.5 Å²	44.5	53%	0.525	23%	0.226	S	C	.	.	H	α-helix	trans	-71.9	-26	179.4	-56.3	166.5	-66.1	-172.4	1.9	112.5	R940 D973 L979	R940-R975 VanDerWaalsContact NH2-CZ 3.29Å; D973-R975 PolarHBondContact O-N 3.34Å; D973-R975 WeakPolarHBondContact OD1-CB 3.31Å; D973-R975 IonicContact OD1-CZ 2.92Å; D973-R975 PolarHBondContact OD1-N 3.12Å; D973-R975 IonicContact OD1-NE 2.63Å; D973-R975 PolarHBondContact OD1-NE 2.97Å; D973-R975 IonicContact OD1-NH2 3.51Å; D973-R975 IonicContact OD2-CZ 3.84Å; D973-R975 IonicContact OD2-NE 3.91Å; D973-R975 PolarHBondContact OD2-NE 3.03Å; D973-R975 IonicContact OD2-NH2 3.01Å; D973-R975 PolarHBondContact OD2-NH2 3.49Å; R975-L979 WeakPolarHBondContact O-CD1 3.35Å; R975-L979 WeakPolarHBondContact O-CG 3.34Å
976	N	93.2	Very high	85.6	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-75.9	-43.6	171.6	-72.4	-6.7	0	0	0	110.3	R936 R940 L945 L970 D973 P974 E978 L979 I980	R936-N976 PolarHBondContact O-ND2 3.43Å; R940-N976 WeakPolarHBondContact CB-OD1 3.41Å; R940-N976 WeakPolarHBondContact CD-OD1 3.47Å; R940-N976 PolarHBondContact NH1-OD1 2.6Å; L945-N976 HydrophobicContact CD1-CB 4.03Å; L945-N976 HydrophobicContact CD2-CB 4.46Å; L970-N976 VanDerWaalsContact O-CB 3.23Å; L970-N976 WeakPolarHBondContact O-CB 3.31Å; L970-N976 PolarHBondContact O-ND2 2.99Å; D973-N976 HydrophobicContact CB-CB 4.27Å; D973-N976 WeakPolarHBondContact O-CB 3.44Å; D973-N976 PolarHBondContact O-N 3.45Å; P974-N976 VanDerWaalsContact C-N 3.32Å; P974-N976 PolarHBondContact O-N 3.49Å; N976-E978 PolarHBondContact O-N 2.76Å; N976-L979 PolarHBondContact O-N 2.86Å; N976-I980 VanDerWaalsContact O-CG1 3.25Å; N976-I980 WeakPolarHBondContact O-CG1 3.4Å; N976-I980 PolarHBondContact O-N 3.19Å
977	R	90.2	Very high	85.3	Confident	16 Å²	16	44.2 Å²	44.2	6%	0.06	22%	0.224	C	C	.	.	H	α-helix	trans	-58.3	-46.3	179.8	-160.8	-176.3	-44.2	-149.7	-1.3	112.3	A971 I972 D973 P974 L979 I980 V981 E1019 I1020 S1023	A971-R977 HydrophobicContact CB-CB 4.26Å; A971-R977 HydrophobicContact CB-CG 4.21Å; A971-R977 PolarHBondContact O-NE 3.01Å; A971-R977 PolarHBondContact O-NH2 3.12Å; I972-R977 PolarHBondContact O-NH2 2.92Å; D973-R977 PolarHBondContact O-N 3.09Å; P974-R977 WeakPolarHBondContact O-CB 3.39Å; P974-R977 PolarHBondContact O-N 2.89Å; R977-L979 PolarHBondContact O-N 3.48Å; R977-I980 PolarHBondContact O-N 3.09Å; R977-V981 WeakPolarHBondContact O-CG2 3.33Å; R977-V981 PolarHBondContact O-N 3.4Å; R977-V981 VanDerWaalsContact O-N 3.13Å; R977-E1019 IonicContact CZ-OE1 3.65Å; R977-E1019 PolarHBondContact NH1-O 2.96Å; R977-E1019 IonicContact NH1-OE1 3.66Å; R977-E1019 PolarHBondContact NH1-OE1 3.15Å; R977-E1019 VanDerWaalsContact NH1-OE1 3.08Å; R977-E1019 IonicContact NH2-OE1 3.57Å; R977-E1019 PolarHBondContact NH2-OE1 3.04Å; R977-I1020 HydrophobicContact CG-CG1 4.31Å; R977-S1023 WeakPolarHBondContact CD-OG 3.22Å; R977-S1023 PolarHBondContact NH1-OG 3.37Å; R977-S1023 VanDerWaalsContact NH1-OG 3.08Å
978	E	87.4	Confident	85.1	Confident	116 Å²	116	49.7 Å²	49.7	54%	0.542	25%	0.245	S	C	.	.	H	α-helix	trans	-57.3	-48.2	174.5	-176.5	176.1	-163.5	0	0	111.4	P974 N976 V981 S982	P974-E978 PolarHBondContact O-N 2.95Å; N976-E978 PolarHBondContact O-N 2.76Å; E978-V981 PolarHBondContact O-N 2.99Å; E978-S982 VanDerWaalsContact O-CB 3.24Å; E978-S982 WeakPolarHBondContact O-CB 3.49Å; E978-S982 PolarHBondContact O-N 3.44Å; E978-S982 PolarHBondContact O-OG 2.71Å
979	L	87.3	Confident	85.1	Confident	92 Å²	92	50 Å²	50	48%	0.482	25%	0.247	S	C	.	.	H	α-helix	trans	-69	-34.7	-180	-70	172.2	0	0	0	114	R940 L945 R975 N976 R977 V981 S982	R940-L979 HydrophobicContact CG-CD1 3.66Å; L945-L979 HydrophobicContact CD1-CB 4.05Å; L945-L979 HydrophobicContact CD1-CD1 4.34Å; R975-L979 WeakPolarHBondContact O-CD1 3.35Å; R975-L979 WeakPolarHBondContact O-CG 3.34Å; N976-L979 PolarHBondContact O-N 2.86Å; R977-L979 PolarHBondContact O-N 3.48Å; L979-V981 VanDerWaalsContact C-N 3.32Å; L979-S982 PolarHBondContact O-OG 3.11Å; L979-S982 VanDerWaalsContact O-OG 3.09Å
980	I	87.4	Confident	85.1	Confident	7 Å²	7	50 Å²	50	4%	0.036	25%	0.247	C	C	.	.	H	α-helix	trans	-61.2	-44.5	173.9	-71.2	161.6	0	0	0	109.5	L945 V949 L967 A971 N976 R977 A986 F990	L945-I980 HydrophobicContact CB-CG1 4.47Å; L945-I980 HydrophobicContact CD1-CG1 4.44Å; L945-I980 HydrophobicContact CD2-CD1 4.27Å; L945-I980 HydrophobicContact CD2-CG1 4.25Å; V949-I980 HydrophobicContact CG2-CG2 4.33Å; L967-I980 HydrophobicContact CD2-CD1 4.08Å; L967-I980 HydrophobicContact CD2-CG1 4.25Å; A971-I980 HydrophobicContact CB-CD1 4.08Å; N976-I980 VanDerWaalsContact O-CG1 3.25Å; N976-I980 WeakPolarHBondContact O-CG1 3.4Å; N976-I980 PolarHBondContact O-N 3.19Å; R977-I980 PolarHBondContact O-N 3.09Å; I980-A986 HydrophobicContact CG2-CB 4.29Å; I980-A986 WeakPolarHBondContact O-CB 3.49Å; I980-F990 HydrophobicContact CG2-CE2 4.09Å; I980-F990 HydrophobicContact CG2-CZ 4.05Å
981	V	79.5	Confident	85	Confident	3 Å²	3	50.1 Å²	50.1	2%	0.018	25%	0.248	C	C	.	.	H	α-helix	trans	-87.8	-25.4	-173.4	-176.3	0	0	0	0	113.1	R977 E978 L979 G983 K984 L987 I1020 Y1027	R977-V981 WeakPolarHBondContact O-CG2 3.33Å; R977-V981 PolarHBondContact O-N 3.4Å; R977-V981 VanDerWaalsContact O-N 3.13Å; E978-V981 PolarHBondContact O-N 2.99Å; L979-V981 VanDerWaalsContact C-N 3.32Å; V981-G983 PolarHBondContact O-N 3.01Å; V981-K984 PolarHBondContact O-N 3.46Å; V981-L987 HydrophobicContact CG1-CD1 3.65Å; V981-L987 HydrophobicContact CG1-CG 3.99Å; V981-I1020 HydrophobicContact CG2-CB 4.45Å; V981-I1020 HydrophobicContact CG2-CD1 3.75Å; V981-I1020 HydrophobicContact CG2-CG1 3.86Å; V981-I1020 HydrophobicContact CG2-CG2 3.71Å; V981-Y1027 HydrophobicContact CB-CD1 4.24Å; V981-Y1027 HydrophobicContact CB-CE1 4.03Å; V981-Y1027 HydrophobicContact CB-CE2 4.33Å; V981-Y1027 HydrophobicContact CB-CG 4.48Å; V981-Y1027 HydrophobicContact CG1-CD1 3.37Å; V981-Y1027 HydrophobicContact CG1-CD2 4.29Å; V981-Y1027 HydrophobicContact CG1-CE1 3.54Å; V981-Y1027 HydrophobicContact CG1-CE2 4.43Å; V981-Y1027 HydrophobicContact CG1-CG 3.78Å; V981-Y1027 HydrophobicContact CG2-CD2 4.42Å; V981-Y1027 HydrophobicContact CG2-CE2 4.48Å
982	S	71.3	Confident	84.9	Confident	81 Å²	81	54.8 Å²	54.8	57%	0.566	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-23.4	-174	60.5	0	0	0	0	114.9	E978 L979 K984	E978-S982 VanDerWaalsContact O-CB 3.24Å; E978-S982 WeakPolarHBondContact O-CB 3.49Å; E978-S982 PolarHBondContact O-N 3.44Å; E978-S982 PolarHBondContact O-OG 2.71Å; L979-S982 PolarHBondContact O-OG 3.11Å; L979-S982 VanDerWaalsContact O-OG 3.09Å; S982-K984 VanDerWaalsContact C-N 3.31Å
983	G	61	Low	85.1	Confident	40 Å²	40	54.4 Å²	54.4	41%	0.412	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-10.5	175.9	0	0	0	0	0	115.2	V981 Y985	V981-G983 PolarHBondContact O-N 3.01Å; G983-Y985 WeakPolarHBondContact O-CD2 3.41Å; G983-Y985 WeakPolarHBondContact O-CE2 3.43Å; G983-Y985 PolarHBondContact O-N 3.22Å
984	K	56	Low	85.2	Confident	124 Å²	124	53.9 Å²	53.9	54%	0.539	27%	0.267	S	S	.	.	S	Bend	trans	57.8	-35.4	-164.7	-66.5	-161.6	174.8	-124.9	0	116.3	V981 S982 A986 L987 D1030	V981-K984 PolarHBondContact O-N 3.46Å; S982-K984 VanDerWaalsContact C-N 3.31Å; K984-A986 PolarHBondContact O-N 3.32Å; K984-L987 PolarHBondContact O-N 2.98Å; K984-D1030 IonicContact NZ-OD1 3.61Å; K984-D1030 PolarHBondContact NZ-OD1 3.36Å
985	Y	70.9	Confident	85.2	Confident	150 Å²	150	50.3 Å²	50.3	59%	0.588	24%	0.244	S	C	*	.	H	α-helix	trans	-57.6	-43.6	-178.4	-58.6	-70.7	0	0	0	112.8	G983 L987 R988 D989	G983-Y985 WeakPolarHBondContact O-CD2 3.41Å; G983-Y985 WeakPolarHBondContact O-CE2 3.43Å; G983-Y985 PolarHBondContact O-N 3.22Å; Y985-L987 VanDerWaalsContact C-N 3.28Å; Y985-L987 PolarHBondContact O-N 2.85Å; Y985-L987 VanDerWaalsContact O-N 3.17Å; Y985-R988 CarbonylContact O-C 3.56Å; Y985-R988 WeakPolarHBondContact O-CA 3.47Å; Y985-R988 WeakPolarHBondContact O-CB 3.47Å; Y985-R988 PolarHBondContact O-N 2.89Å; Y985-D989 VanDerWaalsContact O-CG 3.32Å; Y985-D989 PolarHBondContact O-N 2.96Å
986	A	86.8	Confident	85	Confident	3 Å²	3	49 Å²	49	3%	0.025	24%	0.244	C	C	.	.	H	α-helix	trans	-55.5	-38.3	-178.1	0	0	0	0	0	113.8	V949 I980 K984 R988 D989 F990	V949-A986 HydrophobicContact CG1-CB 3.7Å; V949-A986 HydrophobicContact CG2-CB 4.12Å; I980-A986 HydrophobicContact CG2-CB 4.29Å; I980-A986 WeakPolarHBondContact O-CB 3.49Å; K984-A986 PolarHBondContact O-N 3.32Å; A986-R988 VanDerWaalsContact C-N 3.32Å; A986-R988 PolarHBondContact O-N 3.03Å; A986-D989 WeakPolarHBondContact CA-OD2 3.44Å; A986-D989 PolarHBondContact N-OD2 3.02Å; A986-D989 PolarHBondContact O-N 3.24Å; A986-F990 HydrophobicContact CB-CE2 4.13Å; A986-F990 HydrophobicContact CB-CZ 4.33Å; A986-F990 WeakPolarHBondContact O-CD2 3.38Å; A986-F990 WeakPolarHBondContact O-CE2 3.44Å; A986-F990 WeakPolarHBondContact O-CG 3.46Å; A986-F990 PolarHBondContact O-N 3.04Å
987	L	90.2	Very high	84.6	Confident	2 Å²	2	52.1 Å²	52.1	1%	0.01	26%	0.264	C	S	.	.	H	α-helix	trans	-65.4	-35.9	175.8	-83.7	179.8	0	0	0	112.3	V981 K984 Y985 F990 L991 L1017 I1020 D1030 V1031 L1034	V981-L987 HydrophobicContact CG1-CD1 3.65Å; V981-L987 HydrophobicContact CG1-CG 3.99Å; K984-L987 PolarHBondContact O-N 2.98Å; Y985-L987 VanDerWaalsContact C-N 3.28Å; Y985-L987 PolarHBondContact O-N 2.85Å; Y985-L987 VanDerWaalsContact O-N 3.17Å; L987-F990 HydrophobicContact CD2-CD2 4.42Å; L987-L991 WeakPolarHBondContact O-CB 3.36Å; L987-L991 VanDerWaalsContact O-CG 3.24Å; L987-L991 WeakPolarHBondContact O-CG 3.47Å; L987-L991 PolarHBondContact O-N 2.9Å; L987-L991 VanDerWaalsContact O-N 3.1Å; L987-L1017 HydrophobicContact CD2-CD2 4.06Å; L987-I1020 HydrophobicContact CD2-CD1 4.09Å; L987-I1020 HydrophobicContact CD2-CG2 4.13Å; L987-D1030 HydrophobicContact CD1-CB 3.77Å; L987-V1031 HydrophobicContact CD1-CG2 4.19Å; L987-V1031 HydrophobicContact CD2-CG2 3.78Å; L987-L1034 HydrophobicContact CB-CD1 3.88Å
988	R	91.1	Very high	83.6	Confident	116 Å²	116	55 Å²	55	44%	0.438	30%	0.299	S	S	.	.	H	α-helix	trans	-68.6	-48	171.4	-176.7	-178.8	-61	133.9	4.1	110.4	Y985 A986 F990 L991 D992 L1034	Y985-R988 CarbonylContact O-C 3.56Å; Y985-R988 WeakPolarHBondContact O-CA 3.47Å; Y985-R988 WeakPolarHBondContact O-CB 3.47Å; Y985-R988 PolarHBondContact O-N 2.89Å; A986-R988 VanDerWaalsContact C-N 3.32Å; A986-R988 PolarHBondContact O-N 3.03Å; R988-F990 PolarHBondContact O-N 3.29Å; R988-F990 VanDerWaalsContact O-N 3.17Å; R988-L991 CarbonylContact O-C 3.49Å; R988-L991 PolarHBondContact O-N 3.45Å; R988-D992 WeakPolarHBondContact CG-OD2 3.29Å; R988-D992 WeakPolarHBondContact O-CB 3.37Å; R988-D992 PolarHBondContact O-N 3.45Å; R988-L1034 HydrophobicContact CB-CD1 4.47Å
989	D	92.6	Very high	82.7	Confident	17 Å²	17	51.7 Å²	51.7	9%	0.091	29%	0.289	C	S	.	.	H	α-helix	trans	-55.4	-36.3	178.5	-59.6	-52.9	0	0	0	112.2	I952 R953 Y985 A986	I952-D989 HydrophobicContact CG2-CB 4.11Å; R953-D989 IonicContact CZ-OD1 2.66Å; R953-D989 IonicContact CZ-OD2 2.7Å; R953-D989 IonicContact NE-OD1 2.73Å; R953-D989 PolarHBondContact NE-OD1 3.38Å; R953-D989 IonicContact NE-OD2 3.15Å; R953-D989 VanDerWaalsContact NH2-CG 3.32Å; R953-D989 IonicContact NH2-OD1 2.72Å; R953-D989 PolarHBondContact NH2-OD1 2.73Å; R953-D989 VanDerWaalsContact NH2-OD1 3.11Å; R953-D989 IonicContact NH2-OD2 2.89Å; R953-D989 PolarHBondContact NH2-OD2 3.35Å; Y985-D989 VanDerWaalsContact O-CG 3.32Å; Y985-D989 PolarHBondContact O-N 2.96Å; A986-D989 WeakPolarHBondContact CA-OD2 3.44Å; A986-D989 PolarHBondContact N-OD2 3.02Å; A986-D989 PolarHBondContact O-N 3.24Å
990	F	94	Very high	81.7	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-71.4	-44.3	171.4	-57.6	-40	0	0	0	113.1	I952 L967 I980 A986 L987 R988 D992 K993 V1013 I1016 L1017 I1020	I952-F990 HydrophobicContact CD1-CD1 4.43Å; I952-F990 HydrophobicContact CD1-CE1 4.14Å; I952-F990 HydrophobicContact CG1-CD1 4.4Å; I952-F990 HydrophobicContact CG1-CE1 3.96Å; I952-F990 HydrophobicContact CG2-CD1 4.28Å; L967-F990 HydrophobicContact CD1-CE1 4.01Å; L967-F990 HydrophobicContact CD1-CZ 4.16Å; I980-F990 HydrophobicContact CG2-CE2 4.09Å; I980-F990 HydrophobicContact CG2-CZ 4.05Å; A986-F990 HydrophobicContact CB-CE2 4.13Å; A986-F990 HydrophobicContact CB-CZ 4.33Å; A986-F990 WeakPolarHBondContact O-CD2 3.38Å; A986-F990 WeakPolarHBondContact O-CE2 3.44Å; A986-F990 WeakPolarHBondContact O-CG 3.46Å; A986-F990 PolarHBondContact O-N 3.04Å; L987-F990 HydrophobicContact CD2-CD2 4.42Å; R988-F990 PolarHBondContact O-N 3.29Å; R988-F990 VanDerWaalsContact O-N 3.17Å; F990-D992 VanDerWaalsContact C-N 3.33Å; F990-D992 PolarHBondContact O-N 3.39Å; F990-K993 PolarHBondContact O-N 2.59Å; F990-V1013 HydrophobicContact CB-CG1 4.22Å; F990-V1013 WeakPolarHBondContact O-CG1 3.24Å; F990-I1016 HydrophobicContact CD1-CG2 4.15Å; F990-I1016 HydrophobicContact CE1-CD1 3.95Å; F990-I1016 HydrophobicContact CE1-CG2 4.21Å; F990-I1016 HydrophobicContact CE2-CD1 3.78Å; F990-I1016 HydrophobicContact CE2-CG1 3.98Å; F990-I1016 HydrophobicContact CG-CG2 4.32Å; F990-I1016 HydrophobicContact CZ-CD1 3.36Å; F990-I1016 HydrophobicContact CZ-CG1 4.03Å; F990-I1016 HydrophobicContact CZ-CG2 4.46Å; F990-L1017 HydrophobicContact CB-CD2 4.05Å; F990-L1017 HydrophobicContact CB-CG 4.32Å; F990-L1017 HydrophobicContact CD2-CD2 4.4Å; F990-I1020 HydrophobicContact CD2-CD1 4.13Å; F990-I1020 HydrophobicContact CE2-CD1 3.73Å
991	L	93.3	Very high	80.8	Confident	4 Å²	4	58.5 Å²	58.5	2%	0.021	32%	0.318	C	S	.	.	H	α-helix	trans	-70.6	-27.5	-179.4	-71.4	173.7	0	0	0	113	L987 R988 K993 L994 L1017 V1031 L1034 K1039	L987-L991 WeakPolarHBondContact O-CB 3.36Å; L987-L991 VanDerWaalsContact O-CG 3.24Å; L987-L991 WeakPolarHBondContact O-CG 3.47Å; L987-L991 PolarHBondContact O-N 2.9Å; L987-L991 VanDerWaalsContact O-N 3.1Å; R988-L991 CarbonylContact O-C 3.49Å; R988-L991 PolarHBondContact O-N 3.45Å; L991-K993 PolarHBondContact O-N 3.13Å; L991-L994 HydrophobicContact CD2-CD1 4.02Å; L991-L994 PolarHBondContact O-N 2.99Å; L991-L994 VanDerWaalsContact O-N 3.12Å; L991-L1017 HydrophobicContact CD2-CD1 4.02Å; L991-L1017 HydrophobicContact CD2-CD2 4.36Å; L991-V1031 HydrophobicContact CD1-CG1 4.44Å; L991-L1034 HydrophobicContact CD1-CB 3.62Å; L991-L1034 HydrophobicContact CD1-CD1 4.14Å; L991-K1039 WeakPolarHBondContact O-CD 3.24Å; L991-K1039 WeakPolarHBondContact O-CE 3.32Å; L991-K1039 PolarHBondContact O-NZ 3.41Å
992	D	91.8	Very high	79.5	Confident	97 Å²	97	67.7 Å²	67.7	52%	0.519	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-19.1	175.2	-67.1	-4.2	0	0	0	111.6	R988 F990	R988-D992 WeakPolarHBondContact CG-OD2 3.29Å; R988-D992 WeakPolarHBondContact O-CB 3.37Å; R988-D992 PolarHBondContact O-N 3.45Å; F990-D992 VanDerWaalsContact C-N 3.33Å; F990-D992 PolarHBondContact O-N 3.39Å
993	K	91.9	Very high	79	Confident	30 Å²	30	66.2 Å²	66.2	13%	0.13	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-2.3	168.2	-66.8	-63.3	-170.1	178.4	0	114.1	I952 L954 V960 F990 L991 I1005 V1013	I952-K993 HydrophobicContact CG2-CG 4.15Å; I952-K993 WeakPolarHBondContact O-CE 3.43Å; L954-K993 PolarHBondContact O-NZ 3.49Å; V960-K993 HydrophobicContact CG1-CD 4.33Å; V960-K993 HydrophobicContact CG1-CG 4.32Å; F990-K993 PolarHBondContact O-N 2.59Å; L991-K993 PolarHBondContact O-N 3.13Å; K993-I1005 HydrophobicContact CB-CD1 4.31Å; K993-I1005 HydrophobicContact CD-CD1 3.76Å; K993-I1005 WeakPolarHBondContact O-CD1 3.45Å; K993-V1013 HydrophobicContact CB-CG2 4.05Å
994	L	92.5	Very high	79.3	Confident	4 Å²	4	69 Å²	69	2%	0.021	36%	0.361	C	S	.	.	S	Bend	trans	-92.7	139.5	168.2	-64.3	-173.4	0	0	0	110.7	L991 I1010 V1013 L1014 L1017 K1039 L1040 L1043	L991-L994 HydrophobicContact CD2-CD1 4.02Å; L991-L994 PolarHBondContact O-N 2.99Å; L991-L994 VanDerWaalsContact O-N 3.12Å; L994-I1010 HydrophobicContact CD2-CG2 4.03Å; L994-V1013 HydrophobicContact CD2-CB 4.31Å; L994-V1013 HydrophobicContact CD2-CG1 3.72Å; L994-V1013 HydrophobicContact CG-CG1 4.04Å; L994-L1014 HydrophobicContact CD1-CD2 4.09Å; L994-L1014 HydrophobicContact CD2-CD2 4.04Å; L994-L1014 HydrophobicContact CD2-CG 4.12Å; L994-L1017 HydrophobicContact CD1-CD1 3.72Å; L994-L1017 HydrophobicContact CG-CD1 4.37Å; L994-K1039 HydrophobicContact CB-CD 3.92Å; L994-K1039 PolarHBondContact O-NZ 3.43Å; L994-L1040 HydrophobicContact CD1-CD2 4.04Å; L994-L1040 HydrophobicContact CD1-CG 4.5Å; L994-L1043 HydrophobicContact CD2-CD2 4.34Å
995	P	90	Very high	80.6	Confident	15 Å²	15	64.7 Å²	64.7	10%	0.097	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-61.5	151.7	-179.5	27.1	-36	0	0	0	112.3	L1043 Y1050	P995-L1043 HydrophobicContact CG-CD1 3.93Å; P995-Y1050 VanDerWaalsContact CB-OH 3.25Å; P995-Y1050 WeakPolarHBondContact CB-OH 3.21Å; P995-Y1050 HydrophobicContact CG-CE1 4.28Å; P995-Y1050 HydrophobicContact CG-CE2 4.29Å; P995-Y1050 WeakPolarHBondContact CG-OH 3.43Å
996	E	87.3	Confident	81.5	Confident	111 Å²	111	59.3 Å²	59.3	52%	0.519	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-76.5	146.5	178.3	-67.6	-58.7	156.4	0	0	111.8	G998 S999 K1039	E996-G998 PolarHBondContact O-N 3.31Å; E996-S999 PolarHBondContact N-OG 3.07Å; E996-S999 WeakPolarHBondContact O-CB 3.25Å; E996-S999 PolarHBondContact O-N 3.2Å; E996-S999 PolarHBondContact O-OG 3.15Å; E996-K1039 WeakPolarHBondContact OE1-CE 3.16Å; E996-K1039 IonicContact OE1-NZ 3.85Å; E996-K1039 PolarHBondContact OE1-NZ 2.86Å; E996-K1039 VanDerWaalsContact OE2-CE 3.22Å; E996-K1039 WeakPolarHBondContact OE2-CE 3.43Å; E996-K1039 IonicContact OE2-NZ 3.95Å
997	P	84	Confident	81.7	Confident	66 Å²	66	60.6 Å²	60.6	43%	0.429	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	124.6	177.9	-26	36.3	0	0	0	112.3	S999 D1038 A1042	P997-S999 VanDerWaalsContact C-N 3.26Å; P997-S999 PolarHBondContact O-N 2.85Å; P997-D1038 HydrophobicContact CG-CB 4.44Å; P997-A1042 HydrophobicContact CB-CB 3.83Å; P997-A1042 HydrophobicContact CG-CB 4.21Å
998	G	69.6	Low	81.6	Confident	78 Å²	78	65.9 Å²	65.9	80%	0.804	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.5	5.9	-179.7	0	0	0	0	0	115.2	E996	E996-G998 PolarHBondContact O-N 3.31Å
999	S	67.8	Low	81.6	Confident	46 Å²	46	60.4 Å²	60.4	32%	0.322	34%	0.339	S	S	.	.			trans	-65.6	136.1	169.9	58.1	0	0	0	0	110.9	E996 P997	E996-S999 PolarHBondContact N-OG 3.07Å; E996-S999 WeakPolarHBondContact O-CB 3.25Å; E996-S999 PolarHBondContact O-N 3.2Å; E996-S999 PolarHBondContact O-OG 3.15Å; P997-S999 VanDerWaalsContact C-N 3.26Å; P997-S999 PolarHBondContact O-N 2.85Å
1000	P	66.3	Low	81.7	Confident	82 Å²	82	59.6 Å²	59.6	53%	0.532	33%	0.334	S	S	.	.			trans	-66.9	160.8	170.5	29.8	-35	0	0	0	110.1	R1002	P1000-R1002 HydrophobicContact CB-CG 4.43Å; P1000-R1002 HydrophobicContact CG-CG 4.14Å; P1000-R1002 PolarHBondContact O-N 3.24Å
1001	R	68.4	Low	81.5	Confident	160 Å²	160	60.1 Å²	60.1	60%	0.604	34%	0.339	S	S	*	.	S	Bend	trans	-71.5	68.7	179.5	-157.7	-168.4	-165.1	-160	4.3	112.2	D1007 T1049	R1001-D1007 IonicContact CZ-OD1 3.55Å; R1001-D1007 IonicContact NH2-OD1 3.45Å; R1001-D1007 PolarHBondContact NH2-OD1 3.17Å; R1001-T1049 HydrophobicContact CB-CG2 3.87Å; R1001-T1049 WeakPolarHBondContact CD-O 3.46Å; R1001-T1049 HydrophobicContact CG-CG2 4.44Å; R1001-T1049 PolarHBondContact NE-O 2.97Å; R1001-T1049 VanDerWaalsContact NE-O 3.07Å
1002	R	53.2	Low	81.5	Confident	195 Å²	195	60.3 Å²	60.3	74%	0.736	34%	0.342	S	S	*	.			trans	-116.5	8.9	174.7	-62.5	-175.9	179	-178.5	-2.5	112.3	P1000	P1000-R1002 HydrophobicContact CB-CG 4.43Å; P1000-R1002 HydrophobicContact CG-CG 4.14Å; P1000-R1002 PolarHBondContact O-N 3.24Å
1003	S	61.3	Low	81.7	Confident	51 Å²	51	55.7 Å²	55.7	36%	0.357	32%	0.317	S	S	.	.			trans	-77.3	129.4	176.9	-170.8	0	0	0	0	109.8	I1005	S1003-I1005 PolarHBondContact O-N 3.41Å; S1003-I1005 PolarHBondContact OG-N 2.63Å
1004	A	66.3	Low	81.9	Confident	97 Å²	97	54.3 Å²	54.3	80%	0.802	31%	0.311	S	S	*	.	S	Bend	trans	-71.3	-2	172.4	0	0	0	0	0	113.6
1005	I	84.3	Confident	81.9	Confident	35 Å²	35	54.1 Å²	54.1	18%	0.179	31%	0.31	C	S	.	.	S	Bend	trans	-84.9	124	179.2	-53.2	175.9	0	0	0	108.9	D957 K993 S1003 T1009 I1010	D957-I1005 WeakPolarHBondContact OD1-CA 3.2Å; K993-I1005 HydrophobicContact CB-CD1 4.31Å; K993-I1005 HydrophobicContact CD-CD1 3.76Å; K993-I1005 WeakPolarHBondContact O-CD1 3.45Å; S1003-I1005 PolarHBondContact O-N 3.41Å; S1003-I1005 PolarHBondContact OG-N 2.63Å; I1005-T1009 HydrophobicContact CG2-CG2 3.69Å; I1005-I1010 HydrophobicContact CG2-CG1 3.87Å
1006	S	89.5	Confident	82	Confident	36 Å²	36	53.4 Å²	53.4	25%	0.252	31%	0.305	S	S	.	.			trans	-74.9	154.8	-176.7	68.7	0	0	0	0	113	D957 Q1008 T1009 I1010	D957-S1006 PolarHBondContact OD1-N 2.73Å; D957-S1006 PolarHBondContact OD1-OG 2.63Å; D957-S1006 VanDerWaalsContact OD2-CB 3.27Å; D957-S1006 WeakPolarHBondContact OD2-CB 3.27Å; D957-S1006 PolarHBondContact OD2-OG 2.66Å; S1006-Q1008 PolarHBondContact O-N 3.22Å; S1006-Q1008 VanDerWaalsContact O-N 3.1Å; S1006-T1009 PolarHBondContact O-N 3.29Å; S1006-T1009 PolarHBondContact OG-N 3.01Å; S1006-T1009 PolarHBondContact OG-OG1 2.83Å; S1006-I1010 WeakPolarHBondContact O-CG1 3.47Å; S1006-I1010 PolarHBondContact O-N 3.47Å
1007	D	90.1	Very high	82.3	Confident	31 Å²	31	48.1 Å²	48.1	17%	0.166	28%	0.281	C	S	.	.	H	α-helix	trans	-52	-30.3	169.4	-81.7	70.5	0	0	0	112.6	R1001 G1011 S1051 V1054	R1001-D1007 IonicContact CZ-OD1 3.55Å; R1001-D1007 IonicContact NH2-OD1 3.45Å; R1001-D1007 PolarHBondContact NH2-OD1 3.17Å; D1007-G1011 PolarHBondContact O-N 3.09Å; D1007-S1051 WeakPolarHBondContact OD2-CB 3.35Å; D1007-S1051 PolarHBondContact OD2-N 2.95Å; D1007-S1051 PolarHBondContact OD2-OG 3.46Å; D1007-V1054 HydrophobicContact CB-CG2 3.89Å; D1007-V1054 WeakPolarHBondContact O-CG2 3.44Å; D1007-V1054 WeakPolarHBondContact OD2-CG2 3.4Å
1008	Q	88.1	Confident	82.8	Confident	113 Å²	113	45.4 Å²	45.4	53%	0.528	26%	0.262	S	S	.	.	H	α-helix	trans	-65.2	-49.3	175.1	-164.4	-174.2	10.1	0	0	111.1	S1006 G1011 A1012 R1107	S1006-Q1008 PolarHBondContact O-N 3.22Å; S1006-Q1008 VanDerWaalsContact O-N 3.1Å; Q1008-G1011 PolarHBondContact O-N 3.03Å; Q1008-A1012 PolarHBondContact O-N 3.17Å; Q1008-R1107 VanDerWaalsContact OE1-NH2 3.13Å
1009	T	92.3	Very high	83.8	Confident	1 Å²	1	42 Å²	42	1%	0.006	23%	0.225	C	C	.	.	H	α-helix	trans	-67.6	-42.5	178.5	-55.7	0	0	0	0	112	D957 V960 C961 I1005 S1006 G1011 A1012 V1013	D957-T1009 PolarHBondContact O-OG1 3.39Å; D957-T1009 WeakPolarHBondContact OD1-CB 3.47Å; D957-T1009 PolarHBondContact OD1-OG1 2.92Å; D957-T1009 PolarHBondContact OD2-OG1 3.47Å; V960-T1009 HydrophobicContact CB-CG2 4.1Å; V960-T1009 HydrophobicContact CG1-CG2 3.74Å; C961-T1009 HydrophobicContact CB-CG2 4.47Å; C961-T1009 WeakPolarHBondContact CB-OG1 3.43Å; I1005-T1009 HydrophobicContact CG2-CG2 3.69Å; S1006-T1009 PolarHBondContact O-N 3.29Å; S1006-T1009 PolarHBondContact OG-N 3.01Å; S1006-T1009 PolarHBondContact OG-OG1 2.83Å; T1009-G1011 VanDerWaalsContact C-N 3.27Å; T1009-G1011 PolarHBondContact O-N 3.24Å; T1009-A1012 WeakPolarHBondContact O-CB 3.33Å; T1009-A1012 PolarHBondContact O-N 3.45Å; T1009-A1012 VanDerWaalsContact O-N 3.13Å; T1009-V1013 WeakPolarHBondContact O-CG2 3.39Å; T1009-V1013 PolarHBondContact O-N 3.5Å
1010	I	93.3	Very high	84.9	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-57.6	-44.6	173.1	-63.5	170.8	0	0	0	109.6	L994 I1005 S1006 A1012 V1013 L1014 L1043 Y1050 V1054	L994-I1010 HydrophobicContact CD2-CG2 4.03Å; I1005-I1010 HydrophobicContact CG2-CG1 3.87Å; S1006-I1010 WeakPolarHBondContact O-CG1 3.47Å; S1006-I1010 PolarHBondContact O-N 3.47Å; I1010-A1012 PolarHBondContact O-N 2.76Å; I1010-V1013 PolarHBondContact O-N 3.32Å; I1010-L1014 HydrophobicContact CG2-CD1 3.95Å; I1010-L1014 HydrophobicContact CG2-CG 4.36Å; I1010-L1014 WeakPolarHBondContact O-CB 3.32Å; I1010-L1014 VanDerWaalsContact O-CG 3.24Å; I1010-L1014 WeakPolarHBondContact O-CG 3.43Å; I1010-L1014 PolarHBondContact O-N 3.11Å; I1010-L1043 HydrophobicContact CG2-CD2 3.79Å; I1010-Y1050 HydrophobicContact CD1-CD1 3.91Å; I1010-Y1050 HydrophobicContact CD1-CE1 3.62Å; I1010-V1054 HydrophobicContact CB-CG2 4.35Å; I1010-V1054 HydrophobicContact CG2-CG1 3.63Å; I1010-V1054 HydrophobicContact CG2-CG2 4.23Å
1011	G	91.3	Very high	86.1	Confident	10 Å²	10	35.9 Å²	35.9	10%	0.103	19%	0.185	C	C	.	.	H	α-helix	trans	-61	-39.3	175.1	0	0	0	0	0	114	D1007 Q1008 T1009 G1015	D1007-G1011 PolarHBondContact O-N 3.09Å; Q1008-G1011 PolarHBondContact O-N 3.03Å; T1009-G1011 VanDerWaalsContact C-N 3.27Å; T1009-G1011 PolarHBondContact O-N 3.24Å; G1011-G1015 PolarHBondContact O-N 3.45Å
1012	A	93.3	Very high	87.1	Confident	9 Å²	9	33.5 Å²	33.5	7%	0.074	18%	0.176	C	C	.	.	H	α-helix	trans	-66.4	-43.9	175.6	0	0	0	0	0	112.4	A964 T965 Q1008 T1009 I1010 G1015 I1016	A964-A1012 HydrophobicContact CB-CB 3.97Å; T965-A1012 WeakPolarHBondContact OG1-CB 3.39Å; Q1008-A1012 PolarHBondContact O-N 3.17Å; T1009-A1012 WeakPolarHBondContact O-CB 3.33Å; T1009-A1012 PolarHBondContact O-N 3.45Å; T1009-A1012 VanDerWaalsContact O-N 3.13Å; I1010-A1012 PolarHBondContact O-N 2.76Å; A1012-G1015 PolarHBondContact O-N 3.49Å; A1012-G1015 VanDerWaalsContact O-N 3.17Å; A1012-I1016 PolarHBondContact O-N 2.88Å; A1012-I1016 VanDerWaalsContact O-N 3.15Å
1013	V	95.8	Very high	88.6	Confident	0 Å²	0	27 Å²	27	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-63	-45.7	176.2	170.6	0	0	0	0	111.3	A964 F990 K993 L994 T1009 I1010 G1015 I1016 L1017	A964-V1013 HydrophobicContact CB-CG2 4.26Å; F990-V1013 HydrophobicContact CB-CG1 4.22Å; F990-V1013 WeakPolarHBondContact O-CG1 3.24Å; K993-V1013 HydrophobicContact CB-CG2 4.05Å; L994-V1013 HydrophobicContact CD2-CB 4.31Å; L994-V1013 HydrophobicContact CD2-CG1 3.72Å; L994-V1013 HydrophobicContact CG-CG1 4.04Å; T1009-V1013 WeakPolarHBondContact O-CG2 3.39Å; T1009-V1013 PolarHBondContact O-N 3.5Å; I1010-V1013 PolarHBondContact O-N 3.32Å; V1013-G1015 PolarHBondContact O-N 2.94Å; V1013-I1016 WeakPolarHBondContact O-CG2 3.33Å; V1013-I1016 PolarHBondContact O-N 3.35Å; V1013-L1017 HydrophobicContact CG1-CD1 4.08Å; V1013-L1017 WeakPolarHBondContact O-CG 3.5Å; V1013-L1017 PolarHBondContact O-N 3.37Å
1014	L	94.9	Very high	89.9	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-59.2	-36	173	-70.5	171.2	0	0	0	111.9	L994 I1010 L1017 F1018 L1040 L1043 V1054 A1058 V1061	L994-L1014 HydrophobicContact CD1-CD2 4.09Å; L994-L1014 HydrophobicContact CD2-CD2 4.04Å; L994-L1014 HydrophobicContact CD2-CG 4.12Å; I1010-L1014 HydrophobicContact CG2-CD1 3.95Å; I1010-L1014 HydrophobicContact CG2-CG 4.36Å; I1010-L1014 WeakPolarHBondContact O-CB 3.32Å; I1010-L1014 VanDerWaalsContact O-CG 3.24Å; I1010-L1014 WeakPolarHBondContact O-CG 3.43Å; I1010-L1014 PolarHBondContact O-N 3.11Å; L1014-L1017 PolarHBondContact O-N 3.28Å; L1014-F1018 WeakPolarHBondContact O-CB 3.31Å; L1014-F1018 PolarHBondContact O-N 3.38Å; L1014-L1040 HydrophobicContact CD2-CD2 3.35Å; L1014-L1043 HydrophobicContact CD1-CD2 4.05Å; L1014-L1043 HydrophobicContact CD2-CD2 4.34Å; L1014-V1054 HydrophobicContact CD1-CG1 4.29Å; L1014-A1058 HydrophobicContact CD1-CB 4.22Å; L1014-A1058 HydrophobicContact CD2-CB 4.3Å; L1014-V1061 HydrophobicContact CB-CG2 4.49Å; L1014-V1061 HydrophobicContact CD2-CG2 4.31Å
1015	G	92.4	Very high	91.1	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-68.1	-34.8	177.7	0	0	0	0	0	115.1	R968 G1011 A1012 V1013 E1019	R968-G1015 WeakPolarHBondContact CD-O 3.2Å; R968-G1015 PolarHBondContact NE-O 2.98Å; G1011-G1015 PolarHBondContact O-N 3.45Å; A1012-G1015 PolarHBondContact O-N 3.49Å; A1012-G1015 VanDerWaalsContact O-N 3.17Å; V1013-G1015 PolarHBondContact O-N 2.94Å; G1015-E1019 PolarHBondContact O-N 3.02Å
1016	I	92.9	Very high	91.3	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-75.1	-38.1	170.9	177.2	153.5	0	0	0	111.7	L967 R968 F990 A1012 V1013 F1018 E1019 I1020	L967-I1016 HydrophobicContact CB-CD1 3.44Å; L967-I1016 VanDerWaalsContact CB-CD1 3.44Å; R968-I1016 HydrophobicContact CB-CB 4.04Å; F990-I1016 HydrophobicContact CD1-CG2 4.15Å; F990-I1016 HydrophobicContact CE1-CD1 3.95Å; F990-I1016 HydrophobicContact CE1-CG2 4.21Å; F990-I1016 HydrophobicContact CE2-CD1 3.78Å; F990-I1016 HydrophobicContact CE2-CG1 3.98Å; F990-I1016 HydrophobicContact CG-CG2 4.32Å; F990-I1016 HydrophobicContact CZ-CD1 3.36Å; F990-I1016 HydrophobicContact CZ-CG1 4.03Å; F990-I1016 HydrophobicContact CZ-CG2 4.46Å; A1012-I1016 PolarHBondContact O-N 2.88Å; A1012-I1016 VanDerWaalsContact O-N 3.15Å; V1013-I1016 WeakPolarHBondContact O-CG2 3.33Å; V1013-I1016 PolarHBondContact O-N 3.35Å; I1016-F1018 VanDerWaalsContact C-N 3.34Å; I1016-F1018 PolarHBondContact O-N 3.19Å; I1016-E1019 PolarHBondContact O-N 3.38Å; I1016-I1020 HydrophobicContact CD1-CD1 4.35Å; I1016-I1020 HydrophobicContact CG1-CD1 3.68Å; I1016-I1020 HydrophobicContact CG1-CG1 4.27Å; I1016-I1020 WeakPolarHBondContact O-CG1 3.48Å; I1016-I1020 PolarHBondContact O-N 2.69Å
1017	L	94.3	Very high	91.4	Very high	1 Å²	1	23.6 Å²	23.6	1%	0.005	13%	0.131	C	C	.	.	H	α-helix	trans	-59.1	-45.5	174.2	-71.4	169.2	0	0	0	111.1	L987 F990 L991 L994 V1013 L1014 E1019 I1020 V1021 V1031	L987-L1017 HydrophobicContact CD2-CD2 4.06Å; F990-L1017 HydrophobicContact CB-CD2 4.05Å; F990-L1017 HydrophobicContact CB-CG 4.32Å; F990-L1017 HydrophobicContact CD2-CD2 4.4Å; L991-L1017 HydrophobicContact CD2-CD1 4.02Å; L991-L1017 HydrophobicContact CD2-CD2 4.36Å; L994-L1017 HydrophobicContact CD1-CD1 3.72Å; L994-L1017 HydrophobicContact CG-CD1 4.37Å; V1013-L1017 HydrophobicContact CG1-CD1 4.08Å; V1013-L1017 WeakPolarHBondContact O-CG 3.5Å; V1013-L1017 PolarHBondContact O-N 3.37Å; L1014-L1017 PolarHBondContact O-N 3.28Å; L1017-E1019 PolarHBondContact O-N 3.03Å; L1017-I1020 PolarHBondContact O-N 3.11Å; L1017-V1021 WeakPolarHBondContact O-CG2 3.26Å; L1017-V1021 PolarHBondContact O-N 3.09Å; L1017-V1031 HydrophobicContact CD2-CG2 4.48Å
1018	F	93.4	Very high	91.5	Very high	9 Å²	9	22.1 Å²	22.1	4%	0.039	12%	0.123	C	C	.	.	H	α-helix	trans	-54	-48.8	172.3	-178.7	-90.4	0	0	0	112.4	L1014 I1016 I1020 R1022 Q1060 V1061 V1064 S1096 L1098 A1099	L1014-F1018 WeakPolarHBondContact O-CB 3.31Å; L1014-F1018 PolarHBondContact O-N 3.38Å; I1016-F1018 VanDerWaalsContact C-N 3.34Å; I1016-F1018 PolarHBondContact O-N 3.19Å; F1018-I1020 VanDerWaalsContact C-N 3.29Å; F1018-I1020 PolarHBondContact O-N 2.95Å; F1018-R1022 WeakPolarHBondContact O-CB 3.46Å; F1018-R1022 WeakPolarHBondContact O-CG 3.27Å; F1018-R1022 PolarHBondContact O-N 2.82Å; F1018-Q1060 HydrophobicContact CD2-CB 4.38Å; F1018-Q1060 HydrophobicContact CE2-CB 4.29Å; F1018-V1061 HydrophobicContact CB-CG2 4Å; F1018-V1064 HydrophobicContact CD2-CG2 4.14Å; F1018-V1064 HydrophobicContact CE2-CG2 3.53Å; F1018-V1064 HydrophobicContact CZ-CG2 4.14Å; F1018-S1096 VanDerWaalsContact CZ-OG 3.27Å; F1018-S1096 WeakPolarHBondContact CZ-OG 3.2Å; F1018-L1098 HydrophobicContact CB-CB 4.15Å; F1018-L1098 HydrophobicContact CB-CD1 3.88Å; F1018-L1098 HydrophobicContact CD1-CB 3.79Å; F1018-L1098 VanDerWaalsContact CD1-O 3.31Å; F1018-L1098 WeakPolarHBondContact CD1-O 3.47Å; F1018-L1098 HydrophobicContact CD2-CB 3.86Å; F1018-L1098 HydrophobicContact CD2-CD1 3.97Å; F1018-L1098 HydrophobicContact CE1-CB 4.11Å; F1018-L1098 HydrophobicContact CE2-CB 4.17Å; F1018-L1098 HydrophobicContact CG-CB 3.67Å; F1018-L1098 HydrophobicContact CG-CD1 4.04Å; F1018-L1098 HydrophobicContact CZ-CB 4.3Å; F1018-A1099 HydrophobicContact CE1-CB 3.9Å; F1018-A1099 HydrophobicContact CZ-CB 4.33Å
1019	E	90.6	Very high	91.6	Very high	5 Å²	5	21.4 Å²	21.4	2%	0.023	12%	0.118	C	C	.	.	H	α-helix	trans	-63.2	-34	179.7	-170.6	61	-157.6	0	0	112.1	A971 R977 G1015 I1016 L1017 R1022 S1023	A971-E1019 HydrophobicContact CB-CG 3.84Å; R977-E1019 IonicContact CZ-OE1 3.65Å; R977-E1019 PolarHBondContact NH1-O 2.96Å; R977-E1019 IonicContact NH1-OE1 3.66Å; R977-E1019 PolarHBondContact NH1-OE1 3.15Å; R977-E1019 VanDerWaalsContact NH1-OE1 3.08Å; R977-E1019 IonicContact NH2-OE1 3.57Å; R977-E1019 PolarHBondContact NH2-OE1 3.04Å; G1015-E1019 PolarHBondContact O-N 3.02Å; I1016-E1019 PolarHBondContact O-N 3.38Å; L1017-E1019 PolarHBondContact O-N 3.03Å; E1019-R1022 VanDerWaalsContact CD-NH2 3.27Å; E1019-R1022 IonicContact OE1-CZ 3.81Å; E1019-R1022 IonicContact OE1-NE 2.75Å; E1019-R1022 IonicContact OE1-NH2 3.85Å; E1019-R1022 PolarHBondContact OE1-NH2 3.26Å; E1019-R1022 IonicContact OE2-CZ 2.74Å; E1019-R1022 VanDerWaalsContact OE2-CZ 3.28Å; E1019-R1022 IonicContact OE2-NE 3.83Å; E1019-R1022 PolarHBondContact OE2-NE 3.3Å; E1019-R1022 IonicContact OE2-NH2 2.88Å; E1019-R1022 PolarHBondContact OE2-NH2 3.22Å; E1019-S1023 PolarHBondContact O-OG 3.39Å
1020	I	91.1	Very high	91.6	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-74.9	-52.4	176.8	-68.9	163.5	0	0	0	111.6	R977 V981 L987 F990 I1016 L1017 F1018 R1022 S1023 Y1027	R977-I1020 HydrophobicContact CG-CG1 4.31Å; V981-I1020 HydrophobicContact CG2-CB 4.45Å; V981-I1020 HydrophobicContact CG2-CD1 3.75Å; V981-I1020 HydrophobicContact CG2-CG1 3.86Å; V981-I1020 HydrophobicContact CG2-CG2 3.71Å; L987-I1020 HydrophobicContact CD2-CD1 4.09Å; L987-I1020 HydrophobicContact CD2-CG2 4.13Å; F990-I1020 HydrophobicContact CD2-CD1 4.13Å; F990-I1020 HydrophobicContact CE2-CD1 3.73Å; I1016-I1020 HydrophobicContact CD1-CD1 4.35Å; I1016-I1020 HydrophobicContact CG1-CD1 3.68Å; I1016-I1020 HydrophobicContact CG1-CG1 4.27Å; I1016-I1020 WeakPolarHBondContact O-CG1 3.48Å; I1016-I1020 PolarHBondContact O-N 2.69Å; L1017-I1020 PolarHBondContact O-N 3.11Å; F1018-I1020 VanDerWaalsContact C-N 3.29Å; F1018-I1020 PolarHBondContact O-N 2.95Å; I1020-R1022 PolarHBondContact O-N 2.87Å; I1020-S1023 PolarHBondContact O-N 3.49Å; I1020-S1023 PolarHBondContact O-OG 3.48Å; I1020-Y1027 HydrophobicContact CG2-CD2 3.83Å; I1020-Y1027 HydrophobicContact CG2-CG 4.03Å
1021	V	91.6	Very high	91.5	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-67	-35.9	-174.5	-60.6	0	0	0	0	112	L1017 S1023 S1024 T1028 V1031 V1061 V1064 M1065 H1068	L1017-V1021 WeakPolarHBondContact O-CG2 3.26Å; L1017-V1021 PolarHBondContact O-N 3.09Å; V1021-S1023 PolarHBondContact O-N 3.3Å; V1021-S1024 PolarHBondContact O-N 3.4Å; V1021-T1028 WeakPolarHBondContact CB-OG1 3.43Å; V1021-T1028 PolarHBondContact O-OG1 2.98Å; V1021-V1031 HydrophobicContact CG1-CG2 4.17Å; V1021-V1061 HydrophobicContact CG2-CG1 4.11Å; V1021-V1064 HydrophobicContact CG2-CB 4.37Å; V1021-V1064 HydrophobicContact CG2-CG1 3.84Å; V1021-M1065 HydrophobicContact CB-CG 4.39Å; V1021-M1065 HydrophobicContact CG1-CG 4.36Å; V1021-M1065 HydrophobicContact CG2-CG 4.28Å; V1021-H1068 PolarHBondContact O-CE1 3.42Å; V1021-H1068 PolarHBondContact O-NE2 2.95Å
1022	R	88.8	Confident	91.6	Very high	111 Å²	111	23.9 Å²	23.9	42%	0.419	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-15.3	-177.9	78.9	-176.4	-173.1	83.5	-2.1	115.2	F1018 E1019 I1020 V1064	F1018-R1022 WeakPolarHBondContact O-CB 3.46Å; F1018-R1022 WeakPolarHBondContact O-CG 3.27Å; F1018-R1022 PolarHBondContact O-N 2.82Å; E1019-R1022 VanDerWaalsContact CD-NH2 3.27Å; E1019-R1022 IonicContact OE1-CZ 3.81Å; E1019-R1022 IonicContact OE1-NE 2.75Å; E1019-R1022 IonicContact OE1-NH2 3.85Å; E1019-R1022 PolarHBondContact OE1-NH2 3.26Å; E1019-R1022 IonicContact OE2-CZ 2.74Å; E1019-R1022 VanDerWaalsContact OE2-CZ 3.28Å; E1019-R1022 IonicContact OE2-NE 3.83Å; E1019-R1022 PolarHBondContact OE2-NE 3.3Å; E1019-R1022 IonicContact OE2-NH2 2.88Å; E1019-R1022 PolarHBondContact OE2-NH2 3.22Å; I1020-R1022 PolarHBondContact O-N 2.87Å; R1022-V1064 VanDerWaalsContact CA-CG1 3.42Å; R1022-V1064 HydrophobicContact CB-CG1 3.59Å
1023	S	85.9	Confident	91.5	Very high	59 Å²	59	28.9 Å²	28.9	41%	0.413	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.3	-15.4	-178.2	33.3	0	0	0	0	115.1	R977 E1019 I1020 V1021	R977-S1023 WeakPolarHBondContact CD-OG 3.22Å; R977-S1023 PolarHBondContact NH1-OG 3.37Å; R977-S1023 VanDerWaalsContact NH1-OG 3.08Å; E1019-S1023 PolarHBondContact O-OG 3.39Å; I1020-S1023 PolarHBondContact O-N 3.49Å; I1020-S1023 PolarHBondContact O-OG 3.48Å; V1021-S1023 PolarHBondContact O-N 3.3Å
1024	S	87.9	Confident	91.2	Very high	27 Å²	27	31.6 Å²	31.6	19%	0.189	16%	0.164	C	C	.	.			trans	-158.2	123.9	-169.4	-178.5	0	0	0	0	113.5	V1021 A1026 Y1027 T1028	V1021-S1024 PolarHBondContact O-N 3.4Å; S1024-A1026 PolarHBondContact O-N 2.94Å; S1024-A1026 WeakPolarHBondContact OG-CB 3.24Å; S1024-A1026 PolarHBondContact OG-N 3.29Å; S1024-A1026 VanDerWaalsContact OG-N 3.16Å; S1024-Y1027 VanDerWaalsContact CB-CD2 3.44Å; S1024-Y1027 PolarHBondContact O-N 3.41Å; S1024-Y1027 PolarHBondContact OG-N 3.26Å; S1024-T1028 WeakPolarHBondContact O-CB 3.4Å; S1024-T1028 PolarHBondContact O-N 3.37Å; S1024-T1028 VanDerWaalsContact O-N 3.09Å; S1024-T1028 PolarHBondContact O-OG1 2.67Å
1025	A	90.7	Very high	91	Very high	15 Å²	15	39.1 Å²	39.1	12%	0.124	20%	0.197	C	C	.	.	H	α-helix	trans	-62.5	-30	167.2	0	0	0	0	0	112.1	T1028 K1029 H1068 E1070 L1071	A1025-T1028 PolarHBondContact O-N 2.87Å; A1025-K1029 WeakPolarHBondContact O-CB 3.16Å; A1025-K1029 PolarHBondContact O-N 2.94Å; A1025-H1068 HydrophobicContact CB-CB 3.96Å; A1025-E1070 HydrophobicContact CB-CG 3.66Å; A1025-E1070 WeakPolarHBondContact CB-OE1 3.27Å; A1025-L1071 HydrophobicContact CB-CD1 4.26Å; A1025-L1071 HydrophobicContact CB-CD2 4.4Å; A1025-L1071 HydrophobicContact CB-CG 4.23Å; A1025-L1071 WeakPolarHBondContact O-CD1 3.25Å
1026	A	89.9	Confident	91	Very high	58 Å²	58	39.1 Å²	39.1	48%	0.479	20%	0.197	S	C	.	.	H	α-helix	trans	-64.6	-47.6	178	0	0	0	0	0	111.6	S1024 T1028 K1029 D1030	S1024-A1026 PolarHBondContact O-N 2.94Å; S1024-A1026 WeakPolarHBondContact OG-CB 3.24Å; S1024-A1026 PolarHBondContact OG-N 3.29Å; S1024-A1026 VanDerWaalsContact OG-N 3.16Å; A1026-T1028 VanDerWaalsContact C-N 3.33Å; A1026-T1028 PolarHBondContact O-N 3.5Å; A1026-K1029 WeakPolarHBondContact O-CB 3.38Å; A1026-K1029 PolarHBondContact O-N 2.95Å; A1026-D1030 PolarHBondContact O-N 2.91Å
1027	Y	89.9	Confident	91	Very high	46 Å²	46	39.2 Å²	39.2	18%	0.18	20%	0.197	C	C	.	.	H	α-helix	trans	-70.9	-31.5	177.4	-52.6	-32.6	0	0	0	112.2	V981 I1020 S1024 K1029 D1030 V1031	V981-Y1027 HydrophobicContact CB-CD1 4.24Å; V981-Y1027 HydrophobicContact CB-CE1 4.03Å; V981-Y1027 HydrophobicContact CB-CE2 4.33Å; V981-Y1027 HydrophobicContact CB-CG 4.48Å; V981-Y1027 HydrophobicContact CG1-CD1 3.37Å; V981-Y1027 HydrophobicContact CG1-CD2 4.29Å; V981-Y1027 HydrophobicContact CG1-CE1 3.54Å; V981-Y1027 HydrophobicContact CG1-CE2 4.43Å; V981-Y1027 HydrophobicContact CG1-CG 3.78Å; V981-Y1027 HydrophobicContact CG2-CD2 4.42Å; V981-Y1027 HydrophobicContact CG2-CE2 4.48Å; I1020-Y1027 HydrophobicContact CG2-CD2 3.83Å; I1020-Y1027 HydrophobicContact CG2-CG 4.03Å; S1024-Y1027 VanDerWaalsContact CB-CD2 3.44Å; S1024-Y1027 PolarHBondContact O-N 3.41Å; S1024-Y1027 PolarHBondContact OG-N 3.26Å; Y1027-K1029 VanDerWaalsContact C-N 3.29Å; Y1027-K1029 PolarHBondContact O-N 3.41Å; Y1027-D1030 PolarHBondContact O-N 3.26Å; Y1027-V1031 WeakPolarHBondContact O-CG2 3.34Å; Y1027-V1031 PolarHBondContact O-N 2.93Å
1028	T	92.4	Very high	90.8	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-62.5	-37.7	171.2	-57.8	0	0	0	0	111.5	V1021 S1024 A1025 A1026 H1032 M1065 H1068 L1071 F1075	V1021-T1028 WeakPolarHBondContact CB-OG1 3.43Å; V1021-T1028 PolarHBondContact O-OG1 2.98Å; S1024-T1028 WeakPolarHBondContact O-CB 3.4Å; S1024-T1028 PolarHBondContact O-N 3.37Å; S1024-T1028 VanDerWaalsContact O-N 3.09Å; S1024-T1028 PolarHBondContact O-OG1 2.67Å; A1025-T1028 PolarHBondContact O-N 2.87Å; A1026-T1028 VanDerWaalsContact C-N 3.33Å; A1026-T1028 PolarHBondContact O-N 3.5Å; T1028-H1032 PolarHBondContact O-N 3.44Å; T1028-H1032 VanDerWaalsContact O-N 3.13Å; T1028-M1065 HydrophobicContact CG2-CB 3.72Å; T1028-M1065 HydrophobicContact CG2-CE 3.69Å; T1028-M1065 HydrophobicContact CG2-CG 3.85Å; T1028-M1065 WeakPolarHBondContact O-CE 3.43Å; T1028-H1068 PolarHBondContact OG1-CD2 3.01Å; T1028-H1068 VanDerWaalsContact OG1-CD2 3.3Å; T1028-H1068 PolarHBondContact OG1-NE2 3.45Å; T1028-L1071 HydrophobicContact CG2-CD1 3.4Å; T1028-F1075 HydrophobicContact CG2-CZ 4.16Å
1029	K	91.8	Very high	90.8	Very high	99 Å²	99	42.3 Å²	42.3	43%	0.43	21%	0.214	S	C	.	.	H	α-helix	trans	-69	-42.8	172.4	-179	177.2	173.7	-67.3	0	112.2	A1025 A1026 Y1027 V1031 H1032 E1033 L1071	A1025-K1029 WeakPolarHBondContact O-CB 3.16Å; A1025-K1029 PolarHBondContact O-N 2.94Å; A1026-K1029 WeakPolarHBondContact O-CB 3.38Å; A1026-K1029 PolarHBondContact O-N 2.95Å; Y1027-K1029 VanDerWaalsContact C-N 3.29Å; Y1027-K1029 PolarHBondContact O-N 3.41Å; K1029-V1031 VanDerWaalsContact C-N 3.33Å; K1029-V1031 PolarHBondContact O-N 3.13Å; K1029-H1032 WeakPolarHBondContact O-CB 3.44Å; K1029-H1032 PolarHBondContact O-N 3.49Å; K1029-H1032 VanDerWaalsContact O-N 3.15Å; K1029-E1033 WeakPolarHBondContact CE-OE1 3.23Å; K1029-E1033 IonicContact NZ-OE1 2.8Å; K1029-E1033 PolarHBondContact NZ-OE1 3.07Å; K1029-E1033 IonicContact NZ-OE2 2.79Å; K1029-E1033 WeakPolarHBondContact O-CG 3.47Å; K1029-E1033 PolarHBondContact O-N 2.66Å; K1029-L1071 HydrophobicContact CB-CD1 4.45Å; K1029-L1071 HydrophobicContact CB-CD2 3.98Å; K1029-L1071 HydrophobicContact CD-CD2 4.4Å
1030	D	90.9	Very high	90.9	Very high	28 Å²	28	42.1 Å²	42.1	15%	0.15	21%	0.213	C	C	.	.	H	α-helix	trans	-58.6	-42.9	173.6	-72.9	-56.8	0	0	0	111.5	K984 L987 A1026 Y1027 H1032 E1033 L1034	K984-D1030 IonicContact NZ-OD1 3.61Å; K984-D1030 PolarHBondContact NZ-OD1 3.36Å; L987-D1030 HydrophobicContact CD1-CB 3.77Å; A1026-D1030 PolarHBondContact O-N 2.91Å; Y1027-D1030 PolarHBondContact O-N 3.26Å; D1030-H1032 VanDerWaalsContact C-N 3.32Å; D1030-H1032 PolarHBondContact O-N 3.44Å; D1030-E1033 PolarHBondContact O-N 2.98Å; D1030-L1034 WeakPolarHBondContact O-CB 3.32Å; D1030-L1034 WeakPolarHBondContact O-CG 3.43Å; D1030-L1034 PolarHBondContact O-N 3.5Å
1031	V	92.1	Very high	90.9	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.006	22%	0.224	C	C	.	.	H	α-helix	trans	-62.2	-37.4	175	168.7	0	0	0	0	112	L987 L991 L1017 V1021 Y1027 K1029 G1036 M1065	L987-V1031 HydrophobicContact CD1-CG2 4.19Å; L987-V1031 HydrophobicContact CD2-CG2 3.78Å; L991-V1031 HydrophobicContact CD1-CG1 4.44Å; L1017-V1031 HydrophobicContact CD2-CG2 4.48Å; V1021-V1031 HydrophobicContact CG1-CG2 4.17Å; Y1027-V1031 WeakPolarHBondContact O-CG2 3.34Å; Y1027-V1031 PolarHBondContact O-N 2.93Å; K1029-V1031 VanDerWaalsContact C-N 3.33Å; K1029-V1031 PolarHBondContact O-N 3.13Å; V1031-G1036 WeakPolarHBondContact O-CA 3.45Å; V1031-G1036 PolarHBondContact O-N 2.9Å; V1031-M1065 HydrophobicContact CB-CE 4.18Å; V1031-M1065 HydrophobicContact CG1-CE 3.78Å; V1031-M1065 HydrophobicContact CG1-SD 4.27Å
1032	H	92.4	Very high	90.9	Very high	34 Å²	34	46.4 Å²	46.4	16%	0.157	24%	0.235	C	C	.	.	H	α-helix	trans	-69	-43.4	175.7	-174.8	58	0	0	0	112.3	T1028 K1029 D1030 L1034 K1035 T1037 F1075 S1078	T1028-H1032 PolarHBondContact O-N 3.44Å; T1028-H1032 VanDerWaalsContact O-N 3.13Å; K1029-H1032 WeakPolarHBondContact O-CB 3.44Å; K1029-H1032 PolarHBondContact O-N 3.49Å; K1029-H1032 VanDerWaalsContact O-N 3.15Å; D1030-H1032 VanDerWaalsContact C-N 3.32Å; D1030-H1032 PolarHBondContact O-N 3.44Å; H1032-L1034 VanDerWaalsContact C-N 3.26Å; H1032-L1034 PolarHBondContact O-N 2.85Å; H1032-K1035 WeakPolarHBondContact O-CA 3.49Å; H1032-K1035 PolarHBondContact O-N 3.35Å; H1032-T1037 PolarHBondContact ND1-OG1 3.22Å; H1032-F1075 HydrophobicContact CB-CE1 4.07Å; H1032-F1075 AromaticContact CG-CD1 3.98Å; H1032-F1075 AromaticContact CG-CE1 3.84Å; H1032-F1075 AromaticContact ND1-CD1 3.97Å; H1032-S1078 WeakPolarHBondContact NE2-CB 3.38Å; H1032-S1078 PolarHBondContact NE2-OG 3.16Å
1033	E	91.3	Very high	90.9	Very high	114 Å²	114	41.3 Å²	41.3	53%	0.533	22%	0.216	S	C	.	.	H	α-helix	trans	-65	-29	176.7	-73.5	176.6	-177.3	0	0	112.8	K1029 D1030 K1035	K1029-E1033 WeakPolarHBondContact CE-OE1 3.23Å; K1029-E1033 IonicContact NZ-OE1 2.8Å; K1029-E1033 PolarHBondContact NZ-OE1 3.07Å; K1029-E1033 IonicContact NZ-OE2 2.79Å; K1029-E1033 WeakPolarHBondContact O-CG 3.47Å; K1029-E1033 PolarHBondContact O-N 2.66Å; D1030-E1033 PolarHBondContact O-N 2.98Å; E1033-K1035 PolarHBondContact O-N 3.38Å
1034	L	90.9	Very high	91.2	Very high	56 Å²	56	39.2 Å²	39.2	29%	0.293	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	13.8	170.7	-67.8	171.4	0	0	0	113.8	L987 R988 L991 D1030 H1032 G1036	L987-L1034 HydrophobicContact CB-CD1 3.88Å; R988-L1034 HydrophobicContact CB-CD1 4.47Å; L991-L1034 HydrophobicContact CD1-CB 3.62Å; L991-L1034 HydrophobicContact CD1-CD1 4.14Å; D1030-L1034 WeakPolarHBondContact O-CB 3.32Å; D1030-L1034 WeakPolarHBondContact O-CG 3.43Å; D1030-L1034 PolarHBondContact O-N 3.5Å; H1032-L1034 VanDerWaalsContact C-N 3.26Å; H1032-L1034 PolarHBondContact O-N 2.85Å; L1034-G1036 PolarHBondContact O-N 3.49Å; L1034-G1036 VanDerWaalsContact O-N 3.1Å
1035	K	90.2	Very high	91.1	Very high	158 Å²	158	44.6 Å²	44.6	69%	0.687	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.7	13.4	-175.9	-56.3	-177.2	178	-178.9	0	115.3	H1032 E1033 T1037 D1038	H1032-K1035 WeakPolarHBondContact O-CA 3.49Å; H1032-K1035 PolarHBondContact O-N 3.35Å; E1033-K1035 PolarHBondContact O-N 3.38Å; K1035-T1037 PolarHBondContact O-N 3.28Å; K1035-T1037 VanDerWaalsContact O-N 3.14Å; K1035-D1038 PolarHBondContact O-N 3.04Å
1036	G	91.6	Very high	90.9	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-60	-28.4	-178.4	0	0	0	0	0	113.5	V1031 L1034 D1038 K1039 L1040	V1031-G1036 WeakPolarHBondContact O-CA 3.45Å; V1031-G1036 PolarHBondContact O-N 2.9Å; L1034-G1036 PolarHBondContact O-N 3.49Å; L1034-G1036 VanDerWaalsContact O-N 3.1Å; G1036-D1038 VanDerWaalsContact C-N 3.29Å; G1036-D1038 PolarHBondContact O-N 3.28Å; G1036-K1039 PolarHBondContact O-N 3.05Å; G1036-L1040 WeakPolarHBondContact O-CB 3.49Å; G1036-L1040 WeakPolarHBondContact O-CD1 3.28Å; G1036-L1040 VanDerWaalsContact O-CG 3.23Å; G1036-L1040 WeakPolarHBondContact O-CG 3.48Å; G1036-L1040 PolarHBondContact O-N 3.34Å
1037	T	92.5	Very high	90.4	Very high	2 Å²	2	50.3 Å²	50.3	1%	0.012	23%	0.229	C	C	.	.	H	α-helix	trans	-60.6	-35.2	175	-43.5	0	0	0	0	112.8	H1032 K1035 R1041 L1062 L1080 F1085	H1032-T1037 PolarHBondContact ND1-OG1 3.22Å; K1035-T1037 PolarHBondContact O-N 3.28Å; K1035-T1037 VanDerWaalsContact O-N 3.14Å; T1037-R1041 WeakPolarHBondContact O-CB 3.45Å; T1037-R1041 PolarHBondContact O-N 2.7Å; T1037-L1062 HydrophobicContact CG2-CD2 4.03Å; T1037-L1080 HydrophobicContact CG2-CD1 3.64Å; T1037-F1085 HydrophobicContact CG2-CE1 3.84Å; T1037-F1085 HydrophobicContact CG2-CZ 4Å
1038	D	90.8	Very high	89.7	Confident	60 Å²	60	53 Å²	53	32%	0.321	25%	0.253	S	S	.	.	H	α-helix	trans	-74.5	-40.5	178.3	-73.3	-54.7	0	0	0	112.1	P997 K1035 G1036 R1041 A1042	P997-D1038 HydrophobicContact CG-CB 4.44Å; K1035-D1038 PolarHBondContact O-N 3.04Å; G1036-D1038 VanDerWaalsContact C-N 3.29Å; G1036-D1038 PolarHBondContact O-N 3.28Å; D1038-R1041 PolarHBondContact O-N 3.41Å; D1038-R1041 IonicContact OD1-CZ 3.35Å; D1038-R1041 IonicContact OD1-NE 2.81Å; D1038-R1041 IonicContact OD1-NH2 3.7Å; D1038-R1041 PolarHBondContact OD1-NH2 2.86Å; D1038-A1042 WeakPolarHBondContact O-CB 3.35Å; D1038-A1042 PolarHBondContact O-N 3.24Å
1039	K	92.6	Very high	89.2	Confident	16 Å²	16	55.9 Å²	55.9	7%	0.07	27%	0.27	C	S	.	.	H	α-helix	trans	-56.3	-50.9	170.7	-66.1	-159.7	173.4	-159.4	0	111.2	L991 L994 E996 G1036 R1041 A1042 L1043	L991-K1039 WeakPolarHBondContact O-CD 3.24Å; L991-K1039 WeakPolarHBondContact O-CE 3.32Å; L991-K1039 PolarHBondContact O-NZ 3.41Å; L994-K1039 HydrophobicContact CB-CD 3.92Å; L994-K1039 PolarHBondContact O-NZ 3.43Å; E996-K1039 WeakPolarHBondContact OE1-CE 3.16Å; E996-K1039 IonicContact OE1-NZ 3.85Å; E996-K1039 PolarHBondContact OE1-NZ 2.86Å; E996-K1039 VanDerWaalsContact OE2-CE 3.22Å; E996-K1039 WeakPolarHBondContact OE2-CE 3.43Å; E996-K1039 IonicContact OE2-NZ 3.95Å; G1036-K1039 PolarHBondContact O-N 3.05Å; K1039-R1041 PolarHBondContact O-N 3.15Å; K1039-A1042 PolarHBondContact O-N 3.23Å; K1039-L1043 VanDerWaalsContact O-CB 3.27Å; K1039-L1043 WeakPolarHBondContact O-CB 3.49Å; K1039-L1043 PolarHBondContact O-N 3.32Å
1040	L	94.1	Very high	88.8	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-62.4	-39.8	179.6	-69.4	167.4	0	0	0	112.5	L994 L1014 G1036 S1044 A1058 V1061 L1062 M1065	L994-L1040 HydrophobicContact CD1-CD2 4.04Å; L994-L1040 HydrophobicContact CD1-CG 4.5Å; L1014-L1040 HydrophobicContact CD2-CD2 3.35Å; G1036-L1040 WeakPolarHBondContact O-CB 3.49Å; G1036-L1040 WeakPolarHBondContact O-CD1 3.28Å; G1036-L1040 VanDerWaalsContact O-CG 3.23Å; G1036-L1040 WeakPolarHBondContact O-CG 3.48Å; G1036-L1040 PolarHBondContact O-N 3.34Å; L1040-S1044 WeakPolarHBondContact O-CB 3.28Å; L1040-S1044 PolarHBondContact O-N 3.31Å; L1040-S1044 PolarHBondContact O-OG 3.1Å; L1040-S1044 VanDerWaalsContact O-OG 3.11Å; L1040-A1058 HydrophobicContact CD2-CB 4.45Å; L1040-V1061 HydrophobicContact CD1-CB 4.38Å; L1040-V1061 HydrophobicContact CD1-CG1 3.62Å; L1040-V1061 HydrophobicContact CD2-CB 4.13Å; L1040-V1061 HydrophobicContact CD2-CG1 4.09Å; L1040-V1061 HydrophobicContact CD2-CG2 4.49Å; L1040-L1062 HydrophobicContact CB-CD1 4.29Å; L1040-L1062 HydrophobicContact CB-CD2 3.77Å; L1040-L1062 HydrophobicContact CB-CG 3.91Å; L1040-L1062 HydrophobicContact CD1-CD2 4.42Å; L1040-M1065 HydrophobicContact CD1-SD 3.83Å
1041	R	90.9	Very high	88.4	Confident	64 Å²	64	52.3 Å²	52.3	24%	0.242	26%	0.259	C	S	.	.	H	α-helix	trans	-71.6	-33	179	179.4	172.3	66.1	148.4	-5.5	113.5	T1037 D1038 K1039 S1044 L1062 D1084	T1037-R1041 WeakPolarHBondContact O-CB 3.45Å; T1037-R1041 PolarHBondContact O-N 2.7Å; D1038-R1041 PolarHBondContact O-N 3.41Å; D1038-R1041 IonicContact OD1-CZ 3.35Å; D1038-R1041 IonicContact OD1-NE 2.81Å; D1038-R1041 IonicContact OD1-NH2 3.7Å; D1038-R1041 PolarHBondContact OD1-NH2 2.86Å; K1039-R1041 PolarHBondContact O-N 3.15Å; R1041-S1044 PolarHBondContact O-OG 3.18Å; R1041-L1062 HydrophobicContact CB-CD1 4.49Å; R1041-D1084 WeakPolarHBondContact CD-OD1 3.45Å; R1041-D1084 IonicContact NH1-OD1 2.78Å; R1041-D1084 PolarHBondContact NH1-OD1 3.19Å; R1041-D1084 IonicContact NH1-OD2 2.68Å
1042	A	90.6	Very high	87.7	Confident	27 Å²	27	56.6 Å²	56.6	22%	0.223	28%	0.278	C	S	.	.	H	α-helix	trans	-67.4	-55	169.7	0	0	0	0	0	109.7	P997 D1038 K1039 S1044 R1045 S1046	P997-A1042 HydrophobicContact CB-CB 3.83Å; P997-A1042 HydrophobicContact CG-CB 4.21Å; D1038-A1042 WeakPolarHBondContact O-CB 3.35Å; D1038-A1042 PolarHBondContact O-N 3.24Å; K1039-A1042 PolarHBondContact O-N 3.23Å; A1042-S1044 VanDerWaalsContact C-N 3.33Å; A1042-S1044 PolarHBondContact O-N 3.42Å; A1042-R1045 CarbonylContact O-C 3.59Å; A1042-R1045 WeakPolarHBondContact O-CA 3.42Å; A1042-R1045 PolarHBondContact O-N 3.14Å; A1042-S1046 PolarHBondContact O-N 2.73Å; A1042-S1046 VanDerWaalsContact O-N 3.15Å; A1042-S1046 PolarHBondContact O-OG 3.28Å
1043	L	90.4	Very high	87.2	Confident	4 Å²	4	61 Å²	61	2%	0.021	29%	0.294	C	S	.	.	H	α-helix	trans	-59.7	-37	-174.8	-171.8	59.1	0	0	0	113.7	L994 P995 I1010 L1014 K1039 R1045 S1046 Y1050 V1054 C1055 A1058	L994-L1043 HydrophobicContact CD2-CD2 4.34Å; P995-L1043 HydrophobicContact CG-CD1 3.93Å; I1010-L1043 HydrophobicContact CG2-CD2 3.79Å; L1014-L1043 HydrophobicContact CD1-CD2 4.05Å; L1014-L1043 HydrophobicContact CD2-CD2 4.34Å; K1039-L1043 VanDerWaalsContact O-CB 3.27Å; K1039-L1043 WeakPolarHBondContact O-CB 3.49Å; K1039-L1043 PolarHBondContact O-N 3.32Å; L1043-R1045 PolarHBondContact O-N 3.49Å; L1043-S1046 PolarHBondContact O-N 2.98Å; L1043-Y1050 HydrophobicContact CD1-CD1 4.24Å; L1043-Y1050 HydrophobicContact CD1-CD2 3.6Å; L1043-Y1050 HydrophobicContact CD1-CE2 3.92Å; L1043-Y1050 HydrophobicContact CD1-CG 3.78Å; L1043-V1054 HydrophobicContact CD1-CG1 3.63Å; L1043-V1054 HydrophobicContact CD2-CG1 3.99Å; L1043-V1054 HydrophobicContact CG-CG1 3.83Å; L1043-C1055 PolarHBondContact O-SG 3.07Å; L1043-A1058 HydrophobicContact CB-CB 4.16Å; L1043-A1058 HydrophobicContact CD2-CB 4.22Å; L1043-A1058 HydrophobicContact CG-CB 4.08Å
1044	S	90.4	Very high	87	Confident	15 Å²	15	55.7 Å²	55.7	11%	0.105	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-14.9	174.8	61.8	0	0	0	0	114.5	L1040 R1041 A1042 S1059	L1040-S1044 WeakPolarHBondContact O-CB 3.28Å; L1040-S1044 PolarHBondContact O-N 3.31Å; L1040-S1044 PolarHBondContact O-OG 3.1Å; L1040-S1044 VanDerWaalsContact O-OG 3.11Å; R1041-S1044 PolarHBondContact O-OG 3.18Å; A1042-S1044 VanDerWaalsContact C-N 3.33Å; A1042-S1044 PolarHBondContact O-N 3.42Å; S1044-S1059 WeakPolarHBondContact CB-OG 3.45Å
1045	R	87.8	Confident	86.8	Confident	140 Å²	140	53.3 Å²	53.3	53%	0.528	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.7	2.1	179.2	-61.1	177.1	-179.8	162.2	2.3	112.9	A1042 L1043 Y1047 D1084	A1042-R1045 CarbonylContact O-C 3.59Å; A1042-R1045 WeakPolarHBondContact O-CA 3.42Å; A1042-R1045 PolarHBondContact O-N 3.14Å; L1043-R1045 PolarHBondContact O-N 3.49Å; R1045-Y1047 PolarHBondContact O-N 2.91Å; R1045-D1084 IonicContact CZ-OD1 3.25Å; R1045-D1084 IonicContact NH1-OD1 2.69Å; R1045-D1084 PolarHBondContact NH1-OD1 3.43Å; R1045-D1084 IonicContact NH2-OD1 3.13Å; R1045-D1084 PolarHBondContact NH2-OD1 3.36Å
1046	S	85.1	Confident	86.5	Confident	34 Å²	34	48.6 Å²	48.6	24%	0.238	24%	0.237	C	C	.	.			trans	-93.5	39.5	-175.3	-60.7	0	0	0	0	114.4	A1042 L1043 T1049 Y1050	A1042-S1046 PolarHBondContact O-N 2.73Å; A1042-S1046 VanDerWaalsContact O-N 3.15Å; A1042-S1046 PolarHBondContact O-OG 3.28Å; L1043-S1046 PolarHBondContact O-N 2.98Å; S1046-T1049 CarbonylContact O-C 3.59Å; S1046-T1049 WeakPolarHBondContact O-CA 3.36Å; S1046-T1049 VanDerWaalsContact O-CB 3.26Å; S1046-T1049 WeakPolarHBondContact O-CB 3.38Å; S1046-T1049 PolarHBondContact O-N 3.39Å; S1046-Y1050 PolarHBondContact O-N 3.47Å
1047	Y	79.4	Confident	86.4	Confident	158 Å²	158	49.2 Å²	49.2	62%	0.62	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.1	138.6	167.2	178.1	-92.2	0	0	0	109.3	R1045 H1052	R1045-Y1047 PolarHBondContact O-N 2.91Å; Y1047-H1052 HydrophobicContact CD2-CB 4.29Å; Y1047-H1052 HydrophobicContact CE2-CB 4.27Å
1048	P	75.2	Confident	86.4	Confident	103 Å²	103	49.1 Å²	49.1	67%	0.669	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	cis	-88.5	6.3	4.5	36.3	-36.9	0	0	0	115.3	Y1050	P1048-Y1050 PolarHBondContact O-N 3.41Å
1049	T	81.8	Confident	86.3	Confident	60 Å²	60	46.4 Å²	46.4	37%	0.368	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-31.7	-179.3	-43.8	0	0	0	0	113.4	R1001 S1046	R1001-T1049 HydrophobicContact CB-CG2 3.87Å; R1001-T1049 WeakPolarHBondContact CD-O 3.46Å; R1001-T1049 HydrophobicContact CG-CG2 4.44Å; R1001-T1049 PolarHBondContact NE-O 2.97Å; R1001-T1049 VanDerWaalsContact NE-O 3.07Å; S1046-T1049 CarbonylContact O-C 3.59Å; S1046-T1049 WeakPolarHBondContact O-CA 3.36Å; S1046-T1049 VanDerWaalsContact O-CB 3.26Å; S1046-T1049 WeakPolarHBondContact O-CB 3.38Å; S1046-T1049 PolarHBondContact O-N 3.39Å
1050	Y	83.7	Confident	86.1	Confident	8 Å²	8	47.1 Å²	47.1	3%	0.031	23%	0.228	C	C	.	.	S	Bend	trans	-124.4	157.8	167.2	-62	-86.1	0	0	0	109.9	P995 I1010 L1043 S1046 P1048 V1054	P995-Y1050 VanDerWaalsContact CB-OH 3.25Å; P995-Y1050 WeakPolarHBondContact CB-OH 3.21Å; P995-Y1050 HydrophobicContact CG-CE1 4.28Å; P995-Y1050 HydrophobicContact CG-CE2 4.29Å; P995-Y1050 WeakPolarHBondContact CG-OH 3.43Å; I1010-Y1050 HydrophobicContact CD1-CD1 3.91Å; I1010-Y1050 HydrophobicContact CD1-CE1 3.62Å; L1043-Y1050 HydrophobicContact CD1-CD1 4.24Å; L1043-Y1050 HydrophobicContact CD1-CD2 3.6Å; L1043-Y1050 HydrophobicContact CD1-CE2 3.92Å; L1043-Y1050 HydrophobicContact CD1-CG 3.78Å; S1046-Y1050 PolarHBondContact O-N 3.47Å; P1048-Y1050 PolarHBondContact O-N 3.41Å; Y1050-V1054 HydrophobicContact CG-CG1 4.37Å
1051	S	82.3	Confident	86.1	Confident	44 Å²	44	47.2 Å²	47.2	31%	0.308	23%	0.228	S	C	.	.			trans	-58.7	148.6	178.9	61.9	0	0	0	0	112.3	D1007 R1053 V1054 C1055	D1007-S1051 WeakPolarHBondContact OD2-CB 3.35Å; D1007-S1051 PolarHBondContact OD2-N 2.95Å; D1007-S1051 PolarHBondContact OD2-OG 3.46Å; S1051-R1053 PolarHBondContact O-N 3.09Å; S1051-R1053 VanDerWaalsContact O-N 3.08Å; S1051-V1054 PolarHBondContact O-N 2.67Å; S1051-V1054 WeakPolarHBondContact OG-CG2 3.49Å; S1051-V1054 PolarHBondContact OG-N 2.83Å; S1051-C1055 PolarHBondContact O-N 3.18Å; S1051-C1055 VanDerWaalsContact O-N 3.12Å
1052	H	78	Confident	86.1	Confident	91 Å²	91	44.2 Å²	44.2	42%	0.421	22%	0.217	S	C	.	.	H	α-helix	trans	-54.3	-31.9	175.9	-177.8	-132.4	0	0	0	112.2	Y1047 C1055 K1056	Y1047-H1052 HydrophobicContact CD2-CB 4.29Å; Y1047-H1052 HydrophobicContact CE2-CB 4.27Å; H1052-C1055 PolarHBondContact O-N 3.06Å; H1052-K1056 VanDerWaalsContact O-CB 3.24Å; H1052-K1056 WeakPolarHBondContact O-CB 3.47Å; H1052-K1056 PolarHBondContact O-N 3.33Å
1053	R	81	Confident	86.1	Confident	128 Å²	128	46.6 Å²	46.6	48%	0.483	22%	0.221	S	C	.	.	H	α-helix	trans	-58.5	-50.5	172.2	-172.5	-179.7	-164.5	155	16	112.5	D517 S1051 K1056 Y1057	D517-R1053 IonicContact OD2-NH2 3.63Å; S1051-R1053 PolarHBondContact O-N 3.09Å; S1051-R1053 VanDerWaalsContact O-N 3.08Å; R1053-K1056 PolarHBondContact O-N 3.42Å; R1053-Y1057 HydrophobicContact CG-CD1 4.32Å; R1053-Y1057 HydrophobicContact CG-CD2 4.44Å; R1053-Y1057 HydrophobicContact CG-CE1 3.9Å; R1053-Y1057 HydrophobicContact CG-CE2 4.07Å; R1053-Y1057 PolarHBondContact NE-OH 3.14Å; R1053-Y1057 PolarHBondContact NH2-OH 3.07Å; R1053-Y1057 VanDerWaalsContact NH2-OH 3.07Å; R1053-Y1057 WeakPolarHBondContact O-CB 3.46Å; R1053-Y1057 VanDerWaalsContact O-CD1 3.26Å; R1053-Y1057 WeakPolarHBondContact O-CD1 3.16Å; R1053-Y1057 VanDerWaalsContact O-CG 3.23Å; R1053-Y1057 PolarHBondContact O-N 2.97Å
1054	V	87.8	Confident	86.2	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.006	23%	0.225	C	C	.	.	H	α-helix	trans	-63.2	-43.8	178.7	165.2	0	0	0	0	111	D1007 I1010 L1014 L1043 Y1050 S1051 Y1057 A1058	D1007-V1054 HydrophobicContact CB-CG2 3.89Å; D1007-V1054 WeakPolarHBondContact O-CG2 3.44Å; D1007-V1054 WeakPolarHBondContact OD2-CG2 3.4Å; I1010-V1054 HydrophobicContact CB-CG2 4.35Å; I1010-V1054 HydrophobicContact CG2-CG1 3.63Å; I1010-V1054 HydrophobicContact CG2-CG2 4.23Å; L1014-V1054 HydrophobicContact CD1-CG1 4.29Å; L1043-V1054 HydrophobicContact CD1-CG1 3.63Å; L1043-V1054 HydrophobicContact CD2-CG1 3.99Å; L1043-V1054 HydrophobicContact CG-CG1 3.83Å; Y1050-V1054 HydrophobicContact CG-CG1 4.37Å; S1051-V1054 PolarHBondContact O-N 2.67Å; S1051-V1054 WeakPolarHBondContact OG-CG2 3.49Å; S1051-V1054 PolarHBondContact OG-N 2.83Å; V1054-Y1057 PolarHBondContact O-N 2.9Å; V1054-A1058 PolarHBondContact O-N 3.14Å
1055	C	86.3	Confident	86.3	Confident	6 Å²	6	46.6 Å²	46.6	4%	0.041	22%	0.22	C	C	.	.	H	α-helix	trans	-63.6	-45.6	176.8	-60.3	0	0	0	0	112.1	L1043 S1051 H1052 Y1057 A1058 S1059	L1043-C1055 PolarHBondContact O-SG 3.07Å; S1051-C1055 PolarHBondContact O-N 3.18Å; S1051-C1055 VanDerWaalsContact O-N 3.12Å; H1052-C1055 PolarHBondContact O-N 3.06Å; C1055-Y1057 VanDerWaalsContact C-N 3.32Å; C1055-Y1057 PolarHBondContact O-N 3.44Å; C1055-A1058 PolarHBondContact O-N 2.82Å; C1055-S1059 PolarHBondContact O-N 2.84Å; C1055-S1059 PolarHBondContact O-OG 3.49Å
1056	K	83.4	Confident	86.5	Confident	60 Å²	60	40.6 Å²	40.6	26%	0.261	20%	0.197	S	C	.	.	H	α-helix	trans	-58.4	-42.1	174.3	-176.6	175.2	-177.8	176.3	0	111.6	H1052 R1053 S1059 Q1060	H1052-K1056 VanDerWaalsContact O-CB 3.24Å; H1052-K1056 WeakPolarHBondContact O-CB 3.47Å; H1052-K1056 PolarHBondContact O-N 3.33Å; R1053-K1056 PolarHBondContact O-N 3.42Å; K1056-S1059 PolarHBondContact O-N 3.28Å; K1056-Q1060 WeakPolarHBondContact O-CG 3.36Å; K1056-Q1060 PolarHBondContact O-N 2.9Å
1057	Y	89.8	Confident	86.8	Confident	13 Å²	13	43 Å²	43	5%	0.051	21%	0.205	C	C	.	.	H	α-helix	trans	-66.6	-42.1	178	-77.4	14.7	0	0	0	111.9	R1053 V1054 C1055 S1059 Q1060 V1061 T1097 L1098	R1053-Y1057 HydrophobicContact CG-CD1 4.32Å; R1053-Y1057 HydrophobicContact CG-CD2 4.44Å; R1053-Y1057 HydrophobicContact CG-CE1 3.9Å; R1053-Y1057 HydrophobicContact CG-CE2 4.07Å; R1053-Y1057 PolarHBondContact NE-OH 3.14Å; R1053-Y1057 PolarHBondContact NH2-OH 3.07Å; R1053-Y1057 VanDerWaalsContact NH2-OH 3.07Å; R1053-Y1057 WeakPolarHBondContact O-CB 3.46Å; R1053-Y1057 VanDerWaalsContact O-CD1 3.26Å; R1053-Y1057 WeakPolarHBondContact O-CD1 3.16Å; R1053-Y1057 VanDerWaalsContact O-CG 3.23Å; R1053-Y1057 PolarHBondContact O-N 2.97Å; V1054-Y1057 PolarHBondContact O-N 2.9Å; C1055-Y1057 VanDerWaalsContact C-N 3.32Å; C1055-Y1057 PolarHBondContact O-N 3.44Å; Y1057-S1059 PolarHBondContact O-N 3.26Å; Y1057-Q1060 PolarHBondContact O-N 3.49Å; Y1057-V1061 WeakPolarHBondContact O-CG2 3.41Å; Y1057-V1061 PolarHBondContact O-N 3.35Å; Y1057-V1061 VanDerWaalsContact O-N 3.09Å; Y1057-T1097 WeakPolarHBondContact CE1-OG1 2.97Å; Y1057-L1098 HydrophobicContact CD1-CD1 4.43Å; Y1057-L1098 HydrophobicContact CD1-CD2 4.07Å; Y1057-L1098 HydrophobicContact CD1-CG 3.92Å; Y1057-L1098 HydrophobicContact CD2-CD1 4.44Å; Y1057-L1098 HydrophobicContact CD2-CD2 3.4Å; Y1057-L1098 HydrophobicContact CD2-CG 4.08Å; Y1057-L1098 HydrophobicContact CE1-CD2 4.2Å; Y1057-L1098 HydrophobicContact CE1-CG 4.29Å; Y1057-L1098 HydrophobicContact CE2-CD2 3.52Å; Y1057-L1098 HydrophobicContact CE2-CG 4.41Å; Y1057-L1098 HydrophobicContact CG-CD1 4Å; Y1057-L1098 HydrophobicContact CG-CD2 3.68Å; Y1057-L1098 HydrophobicContact CG-CG 3.81Å; Y1057-L1098 WeakPolarHBondContact O-CD1 3.15Å
1058	A	92.3	Very high	87.4	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-63.1	-41.1	174.8	0	0	0	0	0	111.9	L1014 L1040 L1043 V1054 C1055 V1061 L1062	L1014-A1058 HydrophobicContact CD1-CB 4.22Å; L1014-A1058 HydrophobicContact CD2-CB 4.3Å; L1040-A1058 HydrophobicContact CD2-CB 4.45Å; L1043-A1058 HydrophobicContact CB-CB 4.16Å; L1043-A1058 HydrophobicContact CD2-CB 4.22Å; L1043-A1058 HydrophobicContact CG-CB 4.08Å; V1054-A1058 PolarHBondContact O-N 3.14Å; C1055-A1058 PolarHBondContact O-N 2.82Å; A1058-V1061 PolarHBondContact O-N 3.1Å; A1058-L1062 WeakPolarHBondContact O-CG 3.42Å; A1058-L1062 PolarHBondContact O-N 3.38Å; A1058-L1062 VanDerWaalsContact O-N 3.09Å
1059	S	88.8	Confident	88.2	Confident	3 Å²	3	39.4 Å²	39.4	2%	0.021	18%	0.182	C	C	.	.	H	α-helix	trans	-62.1	-40.6	172.1	-65.3	0	0	0	0	113.3	S1044 C1055 K1056 Y1057 V1061 L1062 Y1063 S1087	S1044-S1059 WeakPolarHBondContact CB-OG 3.45Å; C1055-S1059 PolarHBondContact O-N 2.84Å; C1055-S1059 PolarHBondContact O-OG 3.49Å; K1056-S1059 PolarHBondContact O-N 3.28Å; Y1057-S1059 PolarHBondContact O-N 3.26Å; S1059-V1061 VanDerWaalsContact C-N 3.32Å; S1059-V1061 PolarHBondContact O-N 3Å; S1059-L1062 PolarHBondContact O-N 2.91Å; S1059-Y1063 WeakPolarHBondContact O-CB 3.43Å; S1059-Y1063 PolarHBondContact O-N 2.9Å; S1059-S1087 VanDerWaalsContact CB-OG 3.25Å; S1059-S1087 WeakPolarHBondContact CB-OG 3.16Å; S1059-S1087 WeakPolarHBondContact OG-CB 3.26Å; S1059-S1087 PolarHBondContact OG-OG 3.33Å
1060	Q	89.1	Confident	88.8	Confident	31 Å²	31	43.1 Å²	43.1	15%	0.145	20%	0.195	C	C	.	.	H	α-helix	trans	-63.5	-36	176.5	-78.3	174.4	-10.1	0	0	112.1	F1018 K1056 Y1057 V1064 T1097 L1098	F1018-Q1060 HydrophobicContact CD2-CB 4.38Å; F1018-Q1060 HydrophobicContact CE2-CB 4.29Å; K1056-Q1060 WeakPolarHBondContact O-CG 3.36Å; K1056-Q1060 PolarHBondContact O-N 2.9Å; Y1057-Q1060 PolarHBondContact O-N 3.49Å; Q1060-V1064 WeakPolarHBondContact O-CG2 3.49Å; Q1060-V1064 PolarHBondContact O-N 3.3Å; Q1060-T1097 PolarHBondContact NE2-OG1 2.94Å; Q1060-T1097 PolarHBondContact OE1-OG1 3Å; Q1060-L1098 HydrophobicContact CB-CD1 4.11Å
1061	V	93	Very high	89.3	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.006	20%	0.199	C	C	.	.	H	α-helix	trans	-64.3	-51.4	171.8	179.9	0	0	0	0	110.3	L1014 F1018 V1021 L1040 Y1057 A1058 S1059 Y1063 V1064 M1065 L1098	L1014-V1061 HydrophobicContact CB-CG2 4.49Å; L1014-V1061 HydrophobicContact CD2-CG2 4.31Å; F1018-V1061 HydrophobicContact CB-CG2 4Å; V1021-V1061 HydrophobicContact CG2-CG1 4.11Å; L1040-V1061 HydrophobicContact CD1-CB 4.38Å; L1040-V1061 HydrophobicContact CD1-CG1 3.62Å; L1040-V1061 HydrophobicContact CD2-CB 4.13Å; L1040-V1061 HydrophobicContact CD2-CG1 4.09Å; L1040-V1061 HydrophobicContact CD2-CG2 4.49Å; Y1057-V1061 WeakPolarHBondContact O-CG2 3.41Å; Y1057-V1061 PolarHBondContact O-N 3.35Å; Y1057-V1061 VanDerWaalsContact O-N 3.09Å; A1058-V1061 PolarHBondContact O-N 3.1Å; S1059-V1061 VanDerWaalsContact C-N 3.32Å; S1059-V1061 PolarHBondContact O-N 3Å; V1061-Y1063 PolarHBondContact O-N 3.17Å; V1061-V1064 PolarHBondContact O-N 2.82Å; V1061-M1065 HydrophobicContact CG1-CG 4.4Å; V1061-M1065 HydrophobicContact CG1-SD 4.45Å; V1061-M1065 WeakPolarHBondContact O-CG 3.38Å; V1061-M1065 PolarHBondContact O-N 3.23Å; V1061-L1098 HydrophobicContact CG2-CD1 4.2Å
1062	L	92.6	Very high	89.8	Confident	2 Å²	2	43.1 Å²	43.1	1%	0.01	19%	0.191	C	C	.	.	H	α-helix	trans	-57.8	-47.4	179.9	-72.1	168.6	0	0	0	112.8	T1037 L1040 R1041 A1058 S1059 V1064 M1065 W1066 F1085	T1037-L1062 HydrophobicContact CG2-CD2 4.03Å; L1040-L1062 HydrophobicContact CB-CD1 4.29Å; L1040-L1062 HydrophobicContact CB-CD2 3.77Å; L1040-L1062 HydrophobicContact CB-CG 3.91Å; L1040-L1062 HydrophobicContact CD1-CD2 4.42Å; R1041-L1062 HydrophobicContact CB-CD1 4.49Å; A1058-L1062 WeakPolarHBondContact O-CG 3.42Å; A1058-L1062 PolarHBondContact O-N 3.38Å; A1058-L1062 VanDerWaalsContact O-N 3.09Å; S1059-L1062 PolarHBondContact O-N 2.91Å; L1062-V1064 PolarHBondContact O-N 3.44Å; L1062-M1065 HydrophobicContact CD2-SD 4.49Å; L1062-M1065 WeakPolarHBondContact O-CB 3.23Å; L1062-M1065 PolarHBondContact O-N 2.71Å; L1062-W1066 PolarHBondContact O-N 2.94Å; L1062-W1066 VanDerWaalsContact O-N 3.07Å; L1062-F1085 HydrophobicContact CB-CB 4.48Å; L1062-F1085 HydrophobicContact CB-CD1 4.18Å; L1062-F1085 HydrophobicContact CD2-CD1 4Å; L1062-F1085 HydrophobicContact CD2-CE1 4.28Å; L1062-F1085 WeakPolarHBondContact O-CD1 3.46Å
1063	Y	90.6	Very high	90.3	Very high	77 Å²	77	43.5 Å²	43.5	30%	0.302	20%	0.196	S	C	.	.	H	α-helix	trans	-54.9	-41.4	177.2	170	-101.2	0	0	0	112	S1059 V1061 W1066 Q1067 Y1086	S1059-Y1063 WeakPolarHBondContact O-CB 3.43Å; S1059-Y1063 PolarHBondContact O-N 2.9Å; V1061-Y1063 PolarHBondContact O-N 3.17Å; Y1063-W1066 PolarHBondContact O-N 2.94Å; Y1063-Q1067 HydrophobicContact CE1-CG 4.44Å; Y1063-Q1067 VanDerWaalsContact CE2-NE2 3.35Å; Y1063-Q1067 WeakPolarHBondContact O-CG 3.5Å; Y1063-Q1067 PolarHBondContact O-N 3.19Å; Y1063-Q1067 PolarHBondContact O-NE2 2.72Å; Y1063-Y1086 HydrophobicContact CD2-CD1 4.06Å; Y1063-Y1086 AromaticContact CD2-CE1 3.55Å; Y1063-Y1086 HydrophobicContact CD2-CE1 3.55Å; Y1063-Y1086 AromaticContact CD2-CZ 3.96Å; Y1063-Y1086 HydrophobicContact CE2-CD1 4.43Å; Y1063-Y1086 AromaticContact CE2-CE1 3.57Å; Y1063-Y1086 HydrophobicContact CE2-CE1 3.57Å; Y1063-Y1086 AromaticContact CE2-CZ 3.98Å
1064	V	91.1	Very high	90.7	Very high	18 Å²	18	38.5 Å²	38.5	11%	0.109	19%	0.185	C	C	.	.	H	α-helix	trans	-70	-39.7	175.8	170.7	0	0	0	0	112.1	F1018 V1021 R1022 Q1060 V1061 L1062 W1066 Q1067	F1018-V1064 HydrophobicContact CD2-CG2 4.14Å; F1018-V1064 HydrophobicContact CE2-CG2 3.53Å; F1018-V1064 HydrophobicContact CZ-CG2 4.14Å; V1021-V1064 HydrophobicContact CG2-CB 4.37Å; V1021-V1064 HydrophobicContact CG2-CG1 3.84Å; R1022-V1064 VanDerWaalsContact CA-CG1 3.42Å; R1022-V1064 HydrophobicContact CB-CG1 3.59Å; Q1060-V1064 WeakPolarHBondContact O-CG2 3.49Å; Q1060-V1064 PolarHBondContact O-N 3.3Å; V1061-V1064 PolarHBondContact O-N 2.82Å; L1062-V1064 PolarHBondContact O-N 3.44Å; V1064-W1066 PolarHBondContact O-N 2.78Å; V1064-Q1067 PolarHBondContact O-N 3.04Å
1065	M	93.4	Very high	90.9	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-56.8	-36	174.2	-63.3	-173.3	73.8	0	0	111.6	V1021 T1028 V1031 L1040 V1061 L1062 F1085	V1021-M1065 HydrophobicContact CB-CG 4.39Å; V1021-M1065 HydrophobicContact CG1-CG 4.36Å; V1021-M1065 HydrophobicContact CG2-CG 4.28Å; T1028-M1065 HydrophobicContact CG2-CB 3.72Å; T1028-M1065 HydrophobicContact CG2-CE 3.69Å; T1028-M1065 HydrophobicContact CG2-CG 3.85Å; T1028-M1065 WeakPolarHBondContact O-CE 3.43Å; V1031-M1065 HydrophobicContact CB-CE 4.18Å; V1031-M1065 HydrophobicContact CG1-CE 3.78Å; V1031-M1065 HydrophobicContact CG1-SD 4.27Å; L1040-M1065 HydrophobicContact CD1-SD 3.83Å; V1061-M1065 HydrophobicContact CG1-CG 4.4Å; V1061-M1065 HydrophobicContact CG1-SD 4.45Å; V1061-M1065 WeakPolarHBondContact O-CG 3.38Å; V1061-M1065 PolarHBondContact O-N 3.23Å; L1062-M1065 HydrophobicContact CD2-SD 4.49Å; L1062-M1065 WeakPolarHBondContact O-CB 3.23Å; L1062-M1065 PolarHBondContact O-N 2.71Å; M1065-F1085 HydrophobicContact CB-CD1 4.4Å; M1065-F1085 HydrophobicContact CB-CE1 4.25Å
1066	W	92	Very high	91.1	Very high	14 Å²	14	43.6 Å²	43.6	5%	0.053	21%	0.206	C	C	.	.	H	α-helix	trans	-75.7	-15.3	177.8	-167.1	-104.3	0	0	0	114.6	L1062 Y1063 V1064 H1068 H1072 F1075 E1082 F1085 Y1086	L1062-W1066 PolarHBondContact O-N 2.94Å; L1062-W1066 VanDerWaalsContact O-N 3.07Å; Y1063-W1066 PolarHBondContact O-N 2.94Å; V1064-W1066 PolarHBondContact O-N 2.78Å; W1066-H1068 PolarHBondContact O-N 3.09Å; W1066-H1072 AromaticContact CD1-NE2 3.92Å; W1066-H1072 AromaticContact CD2-NE2 3.57Å; W1066-H1072 AromaticContact CE2-CE1 3.54Å; W1066-H1072 AromaticContact CE2-NE2 3.53Å; W1066-H1072 AromaticContact CG-NE2 3.86Å; W1066-H1072 AromaticContact CZ2-CE1 3.76Å; W1066-H1072 AromaticContact CZ2-ND1 3.98Å; W1066-H1072 AromaticContact NE1-CE1 3.65Å; W1066-H1072 AromaticContact NE1-NE2 3.76Å; W1066-H1072 PolarHBondContact O-NE2 3.15Å; W1066-F1075 AromaticContact CE3-CD2 3.76Å; W1066-F1075 HydrophobicContact CE3-CD2 3.76Å; W1066-F1075 HydrophobicContact CE3-CE2 4.31Å; W1066-F1075 HydrophobicContact CZ3-CB 4.17Å; W1066-F1075 AromaticContact CZ3-CD2 3.84Å; W1066-F1075 HydrophobicContact CZ3-CD2 3.84Å; W1066-F1075 HydrophobicContact CZ3-CG 4.47Å; W1066-E1082 HydrophobicContact CH2-CB 4.16Å; W1066-E1082 HydrophobicContact CZ2-CB 3.55Å; W1066-E1082 HydrophobicContact CZ2-CG 3.84Å; W1066-E1082 PolarHBondContact NE1-OE1 2.79Å; W1066-F1085 HydrophobicContact CB-CB 3.82Å; W1066-F1085 HydrophobicContact CB-CD1 4.16Å; W1066-F1085 HydrophobicContact CB-CG 3.98Å; W1066-F1085 HydrophobicContact CD2-CB 4.37Å; W1066-F1085 AromaticContact CD2-CD2 3.98Å; W1066-F1085 HydrophobicContact CD2-CD2 3.98Å; W1066-F1085 HydrophobicContact CD2-CE2 4.49Å; W1066-F1085 HydrophobicContact CD2-CG 4.19Å; W1066-F1085 HydrophobicContact CE3-CB 4.42Å; W1066-F1085 HydrophobicContact CE3-CD1 4.34Å; W1066-F1085 AromaticContact CE3-CD2 3.25Å; W1066-F1085 HydrophobicContact CE3-CD2 3.25Å; W1066-F1085 HydrophobicContact CE3-CE1 4.43Å; W1066-F1085 AromaticContact CE3-CE2 3.38Å; W1066-F1085 HydrophobicContact CE3-CE2 3.38Å; W1066-F1085 AromaticContact CE3-CG 3.77Å; W1066-F1085 HydrophobicContact CE3-CG 3.77Å; W1066-F1085 AromaticContact CE3-CZ 3.99Å; W1066-F1085 HydrophobicContact CE3-CZ 3.99Å; W1066-F1085 HydrophobicContact CG-CB 4.15Å; W1066-F1085 HydrophobicContact CG-CG 4.32Å; W1066-F1085 AromaticContact CZ3-CD2 3.66Å; W1066-F1085 HydrophobicContact CZ3-CD2 3.66Å; W1066-F1085 AromaticContact CZ3-CE2 3.51Å; W1066-F1085 HydrophobicContact CZ3-CE2 3.51Å; W1066-F1085 HydrophobicContact CZ3-CZ 4.33Å; W1066-Y1086 AromaticContact CD1-CE2 3.48Å; W1066-Y1086 VanDerWaalsContact CD1-CE2 3.48Å; W1066-Y1086 HydrophobicContact CG-CE2 4.19Å; W1066-Y1086 AromaticContact NE1-CE2 3.84Å
1067	Q	91.5	Very high	91.4	Very high	84 Å²	84	50.7 Å²	50.7	39%	0.393	23%	0.231	S	C	.	.	H	α-helix	trans	-70.6	-21	176.2	-58.1	-45.4	-62	0	0	112.9	Y1063 V1064 K1069	Y1063-Q1067 HydrophobicContact CE1-CG 4.44Å; Y1063-Q1067 VanDerWaalsContact CE2-NE2 3.35Å; Y1063-Q1067 WeakPolarHBondContact O-CG 3.5Å; Y1063-Q1067 PolarHBondContact O-N 3.19Å; Y1063-Q1067 PolarHBondContact O-NE2 2.72Å; V1064-Q1067 PolarHBondContact O-N 3.04Å; Q1067-K1069 PolarHBondContact O-N 3.1Å
1068	H	92.4	Very high	91.3	Very high	26 Å²	26	53.3 Å²	53.3	12%	0.12	25%	0.252	C	S	.	.			trans	-77.6	84.1	174.1	-60.4	-69.8	0	0	0	110.6	V1021 A1025 T1028 W1066 E1070 L1071	V1021-H1068 PolarHBondContact O-CE1 3.42Å; V1021-H1068 PolarHBondContact O-NE2 2.95Å; A1025-H1068 HydrophobicContact CB-CB 3.96Å; T1028-H1068 PolarHBondContact OG1-CD2 3.01Å; T1028-H1068 VanDerWaalsContact OG1-CD2 3.3Å; T1028-H1068 PolarHBondContact OG1-NE2 3.45Å; W1066-H1068 PolarHBondContact O-N 3.09Å; H1068-E1070 WeakPolarHBondContact CA-OE2 3.48Å; H1068-E1070 PolarHBondContact O-N 3.38Å; H1068-L1071 HydrophobicContact CB-CD1 3.93Å; H1068-L1071 HydrophobicContact CB-CG 4.05Å; H1068-L1071 WeakPolarHBondContact O-CB 3.44Å; H1068-L1071 PolarHBondContact O-N 3.39Å
1069	K	91.8	Very high	91.1	Very high	160 Å²	160	56.4 Å²	56.4	70%	0.696	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-57.5	-30.3	-175.8	-64.1	-177.1	-178.8	-178.4	0	113.2	Q1067 L1071 H1072	Q1067-K1069 PolarHBondContact O-N 3.1Å; K1069-L1071 PolarHBondContact O-N 3.4Å; K1069-H1072 WeakPolarHBondContact O-CB 3.27Å; K1069-H1072 PolarHBondContact O-N 2.84Å; K1069-H1072 VanDerWaalsContact O-N 3.16Å
1070	E	93.9	Very high	91.1	Very high	138 Å²	138	56.7 Å²	56.7	65%	0.645	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-61.9	-17.7	174.5	60.3	-94.7	-117.7	0	0	114.1	A1025 H1068	A1025-E1070 HydrophobicContact CB-CG 3.66Å; A1025-E1070 WeakPolarHBondContact CB-OE1 3.27Å; H1068-E1070 WeakPolarHBondContact CA-OE2 3.48Å; H1068-E1070 PolarHBondContact O-N 3.38Å
1071	L	93.2	Very high	91	Very high	19 Å²	19	61.7 Å²	61.7	10%	0.099	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-96.5	-9.2	177.6	-56.3	-177	0	0	0	113.7	A1025 T1028 K1029 H1068 K1069 D1073 G1074 F1075	A1025-L1071 HydrophobicContact CB-CD1 4.26Å; A1025-L1071 HydrophobicContact CB-CD2 4.4Å; A1025-L1071 HydrophobicContact CB-CG 4.23Å; A1025-L1071 WeakPolarHBondContact O-CD1 3.25Å; T1028-L1071 HydrophobicContact CG2-CD1 3.4Å; K1029-L1071 HydrophobicContact CB-CD1 4.45Å; K1029-L1071 HydrophobicContact CB-CD2 3.98Å; K1029-L1071 HydrophobicContact CD-CD2 4.4Å; H1068-L1071 HydrophobicContact CB-CD1 3.93Å; H1068-L1071 HydrophobicContact CB-CG 4.05Å; H1068-L1071 WeakPolarHBondContact O-CB 3.44Å; H1068-L1071 PolarHBondContact O-N 3.39Å; K1069-L1071 PolarHBondContact O-N 3.4Å; L1071-D1073 VanDerWaalsContact C-N 3.29Å; L1071-D1073 PolarHBondContact O-N 3.25Å; L1071-G1074 CarbonylContact O-C 3.6Å; L1071-G1074 VanDerWaalsContact O-CA 3.3Å; L1071-G1074 WeakPolarHBondContact O-CA 3.49Å; L1071-G1074 PolarHBondContact O-N 3Å; L1071-F1075 HydrophobicContact CB-CD2 4.16Å; L1071-F1075 HydrophobicContact CB-CE1 4.27Å; L1071-F1075 HydrophobicContact CB-CE2 3.58Å; L1071-F1075 HydrophobicContact CB-CZ 3.64Å; L1071-F1075 HydrophobicContact CD1-CE2 4.42Å; L1071-F1075 HydrophobicContact CD1-CZ 3.83Å; L1071-F1075 HydrophobicContact CG-CZ 4.42Å; L1071-F1075 WeakPolarHBondContact O-CD2 3.38Å; L1071-F1075 WeakPolarHBondContact O-CG 3.32Å; L1071-F1075 PolarHBondContact O-N 3.15Å
1072	H	93.1	Very high	90.6	Very high	33 Å²	33	66.8 Å²	66.8	15%	0.153	33%	0.329	C	S	.	.	H	α-helix	trans	-55.3	-43.1	-175.2	-77.8	-159.1	0	0	0	112.4	W1066 K1069 G1074 F1075 K1076	W1066-H1072 AromaticContact CD1-NE2 3.92Å; W1066-H1072 AromaticContact CD2-NE2 3.57Å; W1066-H1072 AromaticContact CE2-CE1 3.54Å; W1066-H1072 AromaticContact CE2-NE2 3.53Å; W1066-H1072 AromaticContact CG-NE2 3.86Å; W1066-H1072 AromaticContact CZ2-CE1 3.76Å; W1066-H1072 AromaticContact CZ2-ND1 3.98Å; W1066-H1072 AromaticContact NE1-CE1 3.65Å; W1066-H1072 AromaticContact NE1-NE2 3.76Å; W1066-H1072 PolarHBondContact O-NE2 3.15Å; K1069-H1072 WeakPolarHBondContact O-CB 3.27Å; K1069-H1072 PolarHBondContact O-N 2.84Å; K1069-H1072 VanDerWaalsContact O-N 3.16Å; H1072-G1074 VanDerWaalsContact C-N 3.27Å; H1072-G1074 PolarHBondContact O-N 2.71Å; H1072-F1075 PolarHBondContact O-N 2.87Å; H1072-K1076 WeakPolarHBondContact O-CG 3.4Å; H1072-K1076 PolarHBondContact O-N 3.08Å
1073	D	89.7	Confident	90.2	Very high	99 Å²	99	69.7 Å²	69.7	53%	0.529	35%	0.354	S	S	.	.	H	α-helix	trans	-79.2	-11.2	178.9	-61	-23.2	0	0	0	112.8	L1071 K1076 R1077	L1071-D1073 VanDerWaalsContact C-N 3.29Å; L1071-D1073 PolarHBondContact O-N 3.25Å; D1073-K1076 IonicContact OD1-NZ 2.98Å; D1073-K1076 PolarHBondContact OD1-NZ 2.96Å; D1073-R1077 WeakPolarHBondContact O-CG 3.36Å; D1073-R1077 PolarHBondContact O-NE 3.49Å; D1073-R1077 PolarHBondContact O-NH2 3.38Å
1074	G	89.3	Confident	89.9	Confident	23 Å²	23	66.8 Å²	66.8	24%	0.237	34%	0.344	C	S	.	.	H	α-helix	trans	-72.2	-57.5	161.1	0	0	0	0	0	110.7	L1071 H1072 K1076 R1077 S1078	L1071-G1074 CarbonylContact O-C 3.6Å; L1071-G1074 VanDerWaalsContact O-CA 3.3Å; L1071-G1074 WeakPolarHBondContact O-CA 3.49Å; L1071-G1074 PolarHBondContact O-N 3Å; H1072-G1074 VanDerWaalsContact C-N 3.27Å; H1072-G1074 PolarHBondContact O-N 2.71Å; G1074-K1076 VanDerWaalsContact C-N 3.33Å; G1074-K1076 PolarHBondContact O-N 2.7Å; G1074-R1077 WeakPolarHBondContact O-CB 3.21Å; G1074-R1077 PolarHBondContact O-N 3.08Å; G1074-S1078 PolarHBondContact O-N 3.31Å; G1074-S1078 VanDerWaalsContact O-N 3.12Å; G1074-S1078 PolarHBondContact O-OG 3.1Å
1075	F	91.9	Very high	89.6	Confident	2 Å²	2	66 Å²	66	1%	0.009	34%	0.339	C	S	.	.	H	α-helix	trans	-56.3	-43.2	-178.8	-57.9	-38.3	0	0	0	112.8	T1028 H1032 W1066 L1071 H1072 R1077 S1078 G1079 L1080 F1085	T1028-F1075 HydrophobicContact CG2-CZ 4.16Å; H1032-F1075 HydrophobicContact CB-CE1 4.07Å; H1032-F1075 AromaticContact CG-CD1 3.98Å; H1032-F1075 AromaticContact CG-CE1 3.84Å; H1032-F1075 AromaticContact ND1-CD1 3.97Å; W1066-F1075 AromaticContact CE3-CD2 3.76Å; W1066-F1075 HydrophobicContact CE3-CD2 3.76Å; W1066-F1075 HydrophobicContact CE3-CE2 4.31Å; W1066-F1075 HydrophobicContact CZ3-CB 4.17Å; W1066-F1075 AromaticContact CZ3-CD2 3.84Å; W1066-F1075 HydrophobicContact CZ3-CD2 3.84Å; W1066-F1075 HydrophobicContact CZ3-CG 4.47Å; L1071-F1075 HydrophobicContact CB-CD2 4.16Å; L1071-F1075 HydrophobicContact CB-CE1 4.27Å; L1071-F1075 HydrophobicContact CB-CE2 3.58Å; L1071-F1075 HydrophobicContact CB-CZ 3.64Å; L1071-F1075 HydrophobicContact CD1-CE2 4.42Å; L1071-F1075 HydrophobicContact CD1-CZ 3.83Å; L1071-F1075 HydrophobicContact CG-CZ 4.42Å; L1071-F1075 WeakPolarHBondContact O-CD2 3.38Å; L1071-F1075 WeakPolarHBondContact O-CG 3.32Å; L1071-F1075 PolarHBondContact O-N 3.15Å; H1072-F1075 PolarHBondContact O-N 2.87Å; F1075-R1077 PolarHBondContact O-N 2.91Å; F1075-S1078 CarbonylContact O-C 3.44Å; F1075-S1078 WeakPolarHBondContact O-CA 3.28Å; F1075-S1078 WeakPolarHBondContact O-CB 3.35Å; F1075-S1078 PolarHBondContact O-N 3.41Å; F1075-S1078 VanDerWaalsContact O-N 3.12Å; F1075-G1079 PolarHBondContact O-N 3.39Å; F1075-L1080 HydrophobicContact CB-CB 4.21Å; F1075-L1080 HydrophobicContact CB-CD1 4.5Å; F1075-L1080 WeakPolarHBondContact O-CB 3.34Å; F1075-L1080 PolarHBondContact O-N 2.93Å; F1075-F1085 HydrophobicContact CB-CE2 4.29Å; F1075-F1085 HydrophobicContact CB-CZ 4.15Å; F1075-F1085 HydrophobicContact CD1-CZ 4.06Å; F1075-F1085 HydrophobicContact CD2-CE1 4.42Å; F1075-F1085 HydrophobicContact CD2-CE2 4.28Å; F1075-F1085 AromaticContact CD2-CZ 3.79Å; F1075-F1085 HydrophobicContact CD2-CZ 3.79Å; F1075-F1085 HydrophobicContact CE1-CZ 4.39Å; F1075-F1085 HydrophobicContact CE2-CE1 4.33Å; F1075-F1085 HydrophobicContact CE2-CZ 4.14Å; F1075-F1085 HydrophobicContact CG-CE2 4.3Å; F1075-F1085 AromaticContact CG-CZ 3.75Å; F1075-F1085 HydrophobicContact CG-CZ 3.75Å; F1075-F1085 HydrophobicContact CZ-CE1 4.45Å; F1075-F1085 HydrophobicContact CZ-CZ 4.43Å
1076	K	90.4	Very high	88.8	Confident	113 Å²	113	69.5 Å²	69.5	49%	0.491	35%	0.352	S	S	.	.	H	α-helix	trans	-61.1	-38.5	175.6	-68.2	165.8	-157.5	162.3	0	113	H1072 D1073 G1074 S1078 G1079 L1080	H1072-K1076 WeakPolarHBondContact O-CG 3.4Å; H1072-K1076 PolarHBondContact O-N 3.08Å; D1073-K1076 IonicContact OD1-NZ 2.98Å; D1073-K1076 PolarHBondContact OD1-NZ 2.96Å; G1074-K1076 VanDerWaalsContact C-N 3.33Å; G1074-K1076 PolarHBondContact O-N 2.7Å; K1076-S1078 VanDerWaalsContact C-N 3.29Å; K1076-S1078 PolarHBondContact O-N 3.44Å; K1076-G1079 PolarHBondContact O-N 2.87Å; K1076-L1080 WeakPolarHBondContact CA-O 3.41Å
1077	R	90.1	Very high	87.4	Confident	209 Å²	209	70.2 Å²	70.2	79%	0.789	36%	0.359	S	S	*	.	H	α-helix	trans	-68.1	-29.5	175.3	-81.6	-179.5	-70.4	158	-0.6	112.2	D1073 G1074 F1075 G1079	D1073-R1077 WeakPolarHBondContact O-CG 3.36Å; D1073-R1077 PolarHBondContact O-NE 3.49Å; D1073-R1077 PolarHBondContact O-NH2 3.38Å; G1074-R1077 WeakPolarHBondContact O-CB 3.21Å; G1074-R1077 PolarHBondContact O-N 3.08Å; F1075-R1077 PolarHBondContact O-N 2.91Å; R1077-G1079 PolarHBondContact O-N 3.06Å
1078	S	87.3	Confident	85.5	Confident	68 Å²	68	69.5 Å²	69.5	48%	0.476	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	10.1	169.5	-52.1	0	0	0	0	113.7	H1032 G1074 F1075 K1076 L1080	H1032-S1078 WeakPolarHBondContact NE2-CB 3.38Å; H1032-S1078 PolarHBondContact NE2-OG 3.16Å; G1074-S1078 PolarHBondContact O-N 3.31Å; G1074-S1078 VanDerWaalsContact O-N 3.12Å; G1074-S1078 PolarHBondContact O-OG 3.1Å; F1075-S1078 CarbonylContact O-C 3.44Å; F1075-S1078 WeakPolarHBondContact O-CA 3.28Å; F1075-S1078 WeakPolarHBondContact O-CB 3.35Å; F1075-S1078 PolarHBondContact O-N 3.41Å; F1075-S1078 VanDerWaalsContact O-N 3.12Å; K1076-S1078 VanDerWaalsContact C-N 3.29Å; K1076-S1078 PolarHBondContact O-N 3.44Å; S1078-L1080 VanDerWaalsContact C-N 3.3Å; S1078-L1080 PolarHBondContact O-N 2.99Å
1079	G	87.8	Confident	83.4	Confident	64 Å²	64	71.7 Å²	71.7	66%	0.66	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.6	7.4	178.4	0	0	0	0	0	115.5	F1075 K1076 R1077	F1075-G1079 PolarHBondContact O-N 3.39Å; K1076-G1079 PolarHBondContact O-N 2.87Å; R1077-G1079 PolarHBondContact O-N 3.06Å
1080	L	88.5	Confident	81.1	Confident	10 Å²	10	64.8 Å²	64.8	5%	0.052	36%	0.363	C	S	.	.			trans	-87.3	139.7	179.4	-58	175.7	0	0	0	111.5	T1037 F1075 K1076 S1078 F1085	T1037-L1080 HydrophobicContact CG2-CD1 3.64Å; F1075-L1080 HydrophobicContact CB-CB 4.21Å; F1075-L1080 HydrophobicContact CB-CD1 4.5Å; F1075-L1080 WeakPolarHBondContact O-CB 3.34Å; F1075-L1080 PolarHBondContact O-N 2.93Å; K1076-L1080 WeakPolarHBondContact CA-O 3.41Å; S1078-L1080 VanDerWaalsContact C-N 3.3Å; S1078-L1080 PolarHBondContact O-N 2.99Å; L1080-F1085 HydrophobicContact CB-CE2 3.94Å; L1080-F1085 HydrophobicContact CB-CZ 4.38Å; L1080-F1085 HydrophobicContact CD1-CE2 4.23Å; L1080-F1085 HydrophobicContact CD1-CZ 3.85Å
1081	K	88.1	Confident	78.6	Confident	136 Å²	136	67.7 Å²	67.7	59%	0.591	37%	0.368	S	S	*	.			trans	-116.4	163.9	178.4	52.4	-179.5	172.9	-172	0	110.5	A1083 D1084	K1081-A1083 VanDerWaalsContact C-N 3.26Å; K1081-A1083 PolarHBondContact O-N 3.37Å; K1081-D1084 WeakPolarHBondContact CG-OD2 3.21Å; K1081-D1084 WeakPolarHBondContact O-CB 3.38Å; K1081-D1084 PolarHBondContact O-N 2.73Å
1082	E	84.9	Confident	76.1	Confident	107 Å²	107	76.8 Å²	76.8	50%	0.5	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-51.7	-43.3	-179.1	-174.9	155.5	-124.4	0	0	112.9	W1066 D1084 F1085 Y1086	W1066-E1082 HydrophobicContact CH2-CB 4.16Å; W1066-E1082 HydrophobicContact CZ2-CB 3.55Å; W1066-E1082 HydrophobicContact CZ2-CG 3.84Å; W1066-E1082 PolarHBondContact NE1-OE1 2.79Å; E1082-D1084 PolarHBondContact O-N 3.34Å; E1082-F1085 PolarHBondContact O-N 2.68Å; E1082-Y1086 HydrophobicContact CG-CD2 3.82Å; E1082-Y1086 HydrophobicContact CG-CE2 3.69Å; E1082-Y1086 WeakPolarHBondContact O-CD2 3.41Å; E1082-Y1086 PolarHBondContact O-N 3.16Å
1083	A	83.4	Confident	73.7	Confident	64 Å²	64	78.9 Å²	78.9	53%	0.529	43%	0.432	S	S	.	.	G	3₁₀ helix	trans	-63.1	-7.6	177.4	0	0	0	0	0	115.4	K1081	K1081-A1083 VanDerWaalsContact C-N 3.26Å; K1081-A1083 PolarHBondContact O-N 3.37Å
1084	D	84.1	Confident	71.3	Confident	16 Å²	16	78.7 Å²	78.7	9%	0.086	43%	0.431	C	S	.	.	G	3₁₀ helix	trans	-85.7	-14.5	170.1	-74	-61.4	0	0	0	113.6	R1041 R1045 K1081 E1082	R1041-D1084 WeakPolarHBondContact CD-OD1 3.45Å; R1041-D1084 IonicContact NH1-OD1 2.78Å; R1041-D1084 PolarHBondContact NH1-OD1 3.19Å; R1041-D1084 IonicContact NH1-OD2 2.68Å; R1045-D1084 IonicContact CZ-OD1 3.25Å; R1045-D1084 IonicContact NH1-OD1 2.69Å; R1045-D1084 PolarHBondContact NH1-OD1 3.43Å; R1045-D1084 IonicContact NH2-OD1 3.13Å; R1045-D1084 PolarHBondContact NH2-OD1 3.36Å; K1081-D1084 WeakPolarHBondContact CG-OD2 3.21Å; K1081-D1084 WeakPolarHBondContact O-CB 3.38Å; K1081-D1084 PolarHBondContact O-N 2.73Å; E1082-D1084 PolarHBondContact O-N 3.34Å
1085	F	84.4	Confident	69.4	Low	2 Å²	2	81 Å²	81	1%	0.009	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-10.4	178.6	-62.5	-93.7	0	0	0	114	T1037 L1062 M1065 W1066 F1075 L1080 E1082	T1037-F1085 HydrophobicContact CG2-CE1 3.84Å; T1037-F1085 HydrophobicContact CG2-CZ 4Å; L1062-F1085 HydrophobicContact CB-CB 4.48Å; L1062-F1085 HydrophobicContact CB-CD1 4.18Å; L1062-F1085 HydrophobicContact CD2-CD1 4Å; L1062-F1085 HydrophobicContact CD2-CE1 4.28Å; L1062-F1085 WeakPolarHBondContact O-CD1 3.46Å; M1065-F1085 HydrophobicContact CB-CD1 4.4Å; M1065-F1085 HydrophobicContact CB-CE1 4.25Å; W1066-F1085 HydrophobicContact CB-CB 3.82Å; W1066-F1085 HydrophobicContact CB-CD1 4.16Å; W1066-F1085 HydrophobicContact CB-CG 3.98Å; W1066-F1085 HydrophobicContact CD2-CB 4.37Å; W1066-F1085 AromaticContact CD2-CD2 3.98Å; W1066-F1085 HydrophobicContact CD2-CD2 3.98Å; W1066-F1085 HydrophobicContact CD2-CE2 4.49Å; W1066-F1085 HydrophobicContact CD2-CG 4.19Å; W1066-F1085 HydrophobicContact CE3-CB 4.42Å; W1066-F1085 HydrophobicContact CE3-CD1 4.34Å; W1066-F1085 AromaticContact CE3-CD2 3.25Å; W1066-F1085 HydrophobicContact CE3-CD2 3.25Å; W1066-F1085 HydrophobicContact CE3-CE1 4.43Å; W1066-F1085 AromaticContact CE3-CE2 3.38Å; W1066-F1085 HydrophobicContact CE3-CE2 3.38Å; W1066-F1085 AromaticContact CE3-CG 3.77Å; W1066-F1085 HydrophobicContact CE3-CG 3.77Å; W1066-F1085 AromaticContact CE3-CZ 3.99Å; W1066-F1085 HydrophobicContact CE3-CZ 3.99Å; W1066-F1085 HydrophobicContact CG-CB 4.15Å; W1066-F1085 HydrophobicContact CG-CG 4.32Å; W1066-F1085 AromaticContact CZ3-CD2 3.66Å; W1066-F1085 HydrophobicContact CZ3-CD2 3.66Å; W1066-F1085 AromaticContact CZ3-CE2 3.51Å; W1066-F1085 HydrophobicContact CZ3-CE2 3.51Å; W1066-F1085 HydrophobicContact CZ3-CZ 4.33Å; F1075-F1085 HydrophobicContact CB-CE2 4.29Å; F1075-F1085 HydrophobicContact CB-CZ 4.15Å; F1075-F1085 HydrophobicContact CD1-CZ 4.06Å; F1075-F1085 HydrophobicContact CD2-CE1 4.42Å; F1075-F1085 HydrophobicContact CD2-CE2 4.28Å; F1075-F1085 AromaticContact CD2-CZ 3.79Å; F1075-F1085 HydrophobicContact CD2-CZ 3.79Å; F1075-F1085 HydrophobicContact CE1-CZ 4.39Å; F1075-F1085 HydrophobicContact CE2-CE1 4.33Å; F1075-F1085 HydrophobicContact CE2-CZ 4.14Å; F1075-F1085 HydrophobicContact CG-CE2 4.3Å; F1075-F1085 AromaticContact CG-CZ 3.75Å; F1075-F1085 HydrophobicContact CG-CZ 3.75Å; F1075-F1085 HydrophobicContact CZ-CE1 4.45Å; F1075-F1085 HydrophobicContact CZ-CZ 4.43Å; L1080-F1085 HydrophobicContact CB-CE2 3.94Å; L1080-F1085 HydrophobicContact CB-CZ 4.38Å; L1080-F1085 HydrophobicContact CD1-CE2 4.23Å; L1080-F1085 HydrophobicContact CD1-CZ 3.85Å; E1082-F1085 PolarHBondContact O-N 2.68Å
1086	Y	76.9	Confident	67.9	Low	73 Å²	73	82 Å²	82	29%	0.286	45%	0.451	S	S	.	.			trans	-116.6	105.1	177.1	-69.4	-99	0	0	0	111.2	Y1063 W1066 E1082	Y1063-Y1086 HydrophobicContact CD2-CD1 4.06Å; Y1063-Y1086 AromaticContact CD2-CE1 3.55Å; Y1063-Y1086 HydrophobicContact CD2-CE1 3.55Å; Y1063-Y1086 AromaticContact CD2-CZ 3.96Å; Y1063-Y1086 HydrophobicContact CE2-CD1 4.43Å; Y1063-Y1086 AromaticContact CE2-CE1 3.57Å; Y1063-Y1086 HydrophobicContact CE2-CE1 3.57Å; Y1063-Y1086 AromaticContact CE2-CZ 3.98Å; W1066-Y1086 AromaticContact CD1-CE2 3.48Å; W1066-Y1086 VanDerWaalsContact CD1-CE2 3.48Å; W1066-Y1086 HydrophobicContact CG-CE2 4.19Å; W1066-Y1086 AromaticContact NE1-CE2 3.84Å; E1082-Y1086 HydrophobicContact CG-CD2 3.82Å; E1082-Y1086 HydrophobicContact CG-CE2 3.69Å; E1082-Y1086 WeakPolarHBondContact O-CD2 3.41Å; E1082-Y1086 PolarHBondContact O-N 3.16Å
1087	S	63	Low	66.7	Low	28 Å²	28	77.5 Å²	77.5	20%	0.196	43%	0.433	C	S	.	.			trans	-78.8	162.1	161.7	64.4	0	0	0	0	110.8	S1059 T1089 A1090	S1059-S1087 VanDerWaalsContact CB-OG 3.25Å; S1059-S1087 WeakPolarHBondContact CB-OG 3.16Å; S1059-S1087 WeakPolarHBondContact OG-CB 3.26Å; S1059-S1087 PolarHBondContact OG-OG 3.33Å; S1087-T1089 PolarHBondContact O-N 3.25Å; S1087-T1089 PolarHBondContact OG-OG1 3.2Å; S1087-A1090 PolarHBondContact O-N 2.98Å; S1087-A1090 VanDerWaalsContact O-N 3.12Å
1088	G	51	Low	65.8	Low	69 Å²	69	67.7 Å²	67.7	71%	0.711	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-56.4	-33	178	0	0	0	0	0	113.6	A1090	G1088-A1090 VanDerWaalsContact C-N 3.25Å; G1088-A1090 PolarHBondContact O-N 3.03Å
1089	T	49.2	Very low	64.7	Low	72 Å²	72	66.3 Å²	66.3	44%	0.442	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-74.6	2.3	178.8	49.2	0	0	0	0	115.7	S1087	S1087-T1089 PolarHBondContact O-N 3.25Å; S1087-T1089 PolarHBondContact OG-OG1 3.2Å
1090	A	43.7	Very low	64	Low	16 Å²	16	66.8 Å²	66.8	13%	0.132	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-119.4	23.1	-176	0	0	0	0	0	113.5	S1087 G1088 R1092	S1087-A1090 PolarHBondContact O-N 2.98Å; S1087-A1090 VanDerWaalsContact O-N 3.12Å; G1088-A1090 VanDerWaalsContact C-N 3.25Å; G1088-A1090 PolarHBondContact O-N 3.03Å; A1090-R1092 PolarHBondContact O-N 3.28Å
1091	R	41.3	Very low	63	Low	199 Å²	199	68 Å²	68	75%	0.751	38%	0.378	S	S	*	.			trans	-99.9	46.6	-167.9	-90.5	-167.2	167.2	-164.5	-1.9	115.9
1092	R	39.5	Very low	62.3	Low	209 Å²	209	64.3 Å²	64.3	79%	0.789	37%	0.365	S	S	*	.	S	Bend	trans	-173.8	-176.5	150	-103.2	150.1	-168.4	-154.7	3.3	111.2	A1090 D1094	A1090-R1092 PolarHBondContact O-N 3.28Å; R1092-D1094 WeakPolarHBondContact CB-OD1 3.41Å; R1092-D1094 PolarHBondContact O-N 2.96Å
1093	G	42.4	Very low	61.8	Low	78 Å²	78	60.7 Å²	60.7	80%	0.804	35%	0.351	S	S	*	.			trans	-79.7	34.4	-167.9	0	0	0	0	0	115.2
1094	D	39.8	Very low	61.3	Low	95 Å²	95	59.2 Å²	59.2	51%	0.508	34%	0.337	S	S	.	.			trans	-65.9	153.6	-166.1	-41.9	-17	0	0	0	111.9	R1092 S1096	R1092-D1094 WeakPolarHBondContact CB-OD1 3.41Å; R1092-D1094 PolarHBondContact O-N 2.96Å; D1094-S1096 PolarHBondContact O-N 2.68Å
1095	S	50.7	Low	60	Low	71 Å²	71	62.6 Å²	62.6	50%	0.497	35%	0.352	S	S	.	.			trans	-62.4	100	-179	-167	0	0	0	0	110.6	T1097 R1100	S1095-T1097 PolarHBondContact O-N 3.26Å; S1095-R1100 PolarHBondContact OG-NH2 3.39Å; S1095-R1100 VanDerWaalsContact OG-NH2 3.12Å
1096	S	59.1	Low	58.4	Low	24 Å²	24	63 Å²	63	17%	0.168	36%	0.358	C	S	.	.			trans	-59.3	113.2	-175.2	177.7	0	0	0	0	111.4	F1018 D1094 L1098 A1099	F1018-S1096 VanDerWaalsContact CZ-OG 3.27Å; F1018-S1096 WeakPolarHBondContact CZ-OG 3.2Å; D1094-S1096 PolarHBondContact O-N 2.68Å; S1096-L1098 PolarHBondContact O-N 3.39Å; S1096-L1098 PolarHBondContact OG-N 3.04Å; S1096-A1099 WeakPolarHBondContact O-CA 3.15Å; S1096-A1099 VanDerWaalsContact O-CB 3.31Å; S1096-A1099 WeakPolarHBondContact O-CB 3.44Å; S1096-A1099 PolarHBondContact O-N 2.84Å
1097	T	64.9	Low	57.3	Low	18 Å²	18	65.5 Å²	65.5	11%	0.11	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-52.5	-33.2	169.6	42.8	0	0	0	0	112.1	Y1057 Q1060 S1095 A1099 R1100	Y1057-T1097 WeakPolarHBondContact CE1-OG1 2.97Å; Q1060-T1097 PolarHBondContact NE2-OG1 2.94Å; Q1060-T1097 PolarHBondContact OE1-OG1 3Å; S1095-T1097 PolarHBondContact O-N 3.26Å; T1097-A1099 VanDerWaalsContact C-N 3.3Å; T1097-A1099 PolarHBondContact O-N 3.28Å; T1097-R1100 PolarHBondContact O-N 3.06Å
1098	L	72.6	Confident	56.4	Low	2 Å²	2	68.3 Å²	68.3	1%	0.01	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-75.2	-9.9	173.7	-75.5	-170.9	0	0	0	114.9	R968 F1018 Y1057 Q1060 V1061 S1096	R968-L1098 PolarHBondContact NH2-O 3.22Å; F1018-L1098 HydrophobicContact CB-CB 4.15Å; F1018-L1098 HydrophobicContact CB-CD1 3.88Å; F1018-L1098 HydrophobicContact CD1-CB 3.79Å; F1018-L1098 VanDerWaalsContact CD1-O 3.31Å; F1018-L1098 WeakPolarHBondContact CD1-O 3.47Å; F1018-L1098 HydrophobicContact CD2-CB 3.86Å; F1018-L1098 HydrophobicContact CD2-CD1 3.97Å; F1018-L1098 HydrophobicContact CE1-CB 4.11Å; F1018-L1098 HydrophobicContact CE2-CB 4.17Å; F1018-L1098 HydrophobicContact CG-CB 3.67Å; F1018-L1098 HydrophobicContact CG-CD1 4.04Å; F1018-L1098 HydrophobicContact CZ-CB 4.3Å; Y1057-L1098 HydrophobicContact CD1-CD1 4.43Å; Y1057-L1098 HydrophobicContact CD1-CD2 4.07Å; Y1057-L1098 HydrophobicContact CD1-CG 3.92Å; Y1057-L1098 HydrophobicContact CD2-CD1 4.44Å; Y1057-L1098 HydrophobicContact CD2-CD2 3.4Å; Y1057-L1098 HydrophobicContact CD2-CG 4.08Å; Y1057-L1098 HydrophobicContact CE1-CD2 4.2Å; Y1057-L1098 HydrophobicContact CE1-CG 4.29Å; Y1057-L1098 HydrophobicContact CE2-CD2 3.52Å; Y1057-L1098 HydrophobicContact CE2-CG 4.41Å; Y1057-L1098 HydrophobicContact CG-CD1 4Å; Y1057-L1098 HydrophobicContact CG-CD2 3.68Å; Y1057-L1098 HydrophobicContact CG-CG 3.81Å; Y1057-L1098 WeakPolarHBondContact O-CD1 3.15Å; Q1060-L1098 HydrophobicContact CB-CD1 4.11Å; V1061-L1098 HydrophobicContact CG2-CD1 4.2Å; S1096-L1098 PolarHBondContact O-N 3.39Å; S1096-L1098 PolarHBondContact OG-N 3.04Å
1099	A	64.4	Low	55.7	Low	39 Å²	39	68.4 Å²	68.4	32%	0.322	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-87.9	-18.2	170.9	0	0	0	0	0	113.5	F1018 S1096 T1097 P1101	F1018-A1099 HydrophobicContact CE1-CB 3.9Å; F1018-A1099 HydrophobicContact CZ-CB 4.33Å; S1096-A1099 WeakPolarHBondContact O-CA 3.15Å; S1096-A1099 VanDerWaalsContact O-CB 3.31Å; S1096-A1099 WeakPolarHBondContact O-CB 3.44Å; S1096-A1099 PolarHBondContact O-N 2.84Å; T1097-A1099 VanDerWaalsContact C-N 3.3Å; T1097-A1099 PolarHBondContact O-N 3.28Å; A1099-P1101 WeakPolarHBondContact O-CD 3.46Å
1100	R	71.3	Confident	54.8	Low	75 Å²	75	70 Å²	70	28%	0.283	37%	0.367	S	S	.	.	S	Bend	trans	-81.4	121.2	179.3	-63	-171.3	-170.3	165.3	8.5	111.1	D469 R968 S1095 T1097	D469-R1100 IonicContact OD1-NH1 3.35Å; D469-R1100 PolarHBondContact OD1-NH1 2.96Å; D469-R1100 IonicContact OD2-CZ 2.74Å; D469-R1100 IonicContact OD2-NH1 2.85Å; D469-R1100 PolarHBondContact OD2-NH1 3.21Å; D469-R1100 IonicContact OD2-NH2 3.16Å; D469-R1100 PolarHBondContact OD2-NH2 3.13Å; R968-R1100 PolarHBondContact NH1-O 3.44Å; R968-R1100 PolarHBondContact NH2-O 3.4Å; S1095-R1100 PolarHBondContact OG-NH2 3.39Å; S1095-R1100 VanDerWaalsContact OG-NH2 3.12Å; T1097-R1100 PolarHBondContact O-N 3.06Å
1101	P	67.5	Low	54.1	Low	34 Å²	34	71.4 Å²	71.4	22%	0.221	38%	0.375	C	S	.	.			trans	-58.2	149.6	174.8	-26.3	37.6	0	0	0	112.3	A926 I972 A1099	A926-P1101 WeakPolarHBondContact O-CB 3.3Å; I972-P1101 HydrophobicContact CD1-CB 3.93Å; I972-P1101 HydrophobicContact CD1-CG 3.55Å; A1099-P1101 WeakPolarHBondContact O-CD 3.46Å
1102	I	73.7	Confident	53.7	Low	59 Å²	59	63.9 Å²	63.9	30%	0.303	35%	0.349	S	S	.	.			trans	-120	125.1	-174.8	-70.5	175.7	0	0	0	111.6	Q922 T965 R968 N969	Q922-I1102 PolarHBondContact NE2-O 2.99Å; T965-I1102 HydrophobicContact CG2-CB 4.02Å; T965-I1102 HydrophobicContact CG2-CG2 4.09Å; R968-I1102 VanDerWaalsContact NH1-CD1 3.28Å; R968-I1102 VanDerWaalsContact NH1-CG1 3.33Å; N969-I1102 PolarHBondContact ND2-O 2.99Å; N969-I1102 PolarHBondContact OD1-N 3.47Å
1103	S	75.4	Confident	53.3	Low	31 Å²	31	59.7 Å²	59.7	22%	0.217	34%	0.338	C	S	.	.			trans	-100.1	148.5	159.1	55.2	0	0	0	0	109.3	Y836 N923	Y836-S1103 WeakPolarHBondContact CE2-OG 3.26Å; N923-S1103 VanDerWaalsContact OD1-CA 3.23Å; N923-S1103 WeakPolarHBondContact OD1-CA 3.35Å; N923-S1103 WeakPolarHBondContact OD1-CB 3.25Å
1104	S	72.6	Confident	52.6	Low	33 Å²	33	64.7 Å²	64.7	23%	0.231	34%	0.341	C	S	.	.			trans	-132.1	144.2	175	51.8	0	0	0	0	111.5	Y836 Q922 N923	Y836-S1104 VanDerWaalsContact CD2-O 3.26Å; Y836-S1104 WeakPolarHBondContact CD2-O 3.26Å; Q922-S1104 PolarHBondContact NE2-OG 2.98Å; Q922-S1104 PolarHBondContact OE1-OG 2.86Å; N923-S1104 PolarHBondContact ND2-O 2.7Å; N923-S1104 PolarHBondContact OD1-N 2.96Å; N923-S1104 PolarHBondContact OD1-O 3.06Å
1105	Q	57.5	Low	52	Low	87 Å²	87	64 Å²	64	41%	0.407	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-71.3	151.1	163.8	-60.5	-177.1	73.7	0	0	108	A787 R793 Y836	A787-Q1105 PolarHBondContact O-OE1 3Å; R793-Q1105 VanDerWaalsContact NH2-CD 3.28Å; Y836-Q1105 HydrophobicContact CD1-CG 3.58Å; Y836-Q1105 HydrophobicContact CD2-CG 4.01Å; Y836-Q1105 HydrophobicContact CE1-CG 3.47Å; Y836-Q1105 VanDerWaalsContact CE1-CG 3.47Å; Y836-Q1105 HydrophobicContact CE2-CG 3.92Å; Y836-Q1105 HydrophobicContact CG-CG 3.83Å
1106	G	50.7	Low	50.8	Low	12 Å²	12	66.3 Å²	66.3	12%	0.124	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-65.4	157.9	176.4	0	0	0	0	0	112.3	N833	N833-G1106 PolarHBondContact OD1-N 3.49Å
1107	R	53.2	Low	49.3	Very low	125 Å²	125	74.4 Å²	74.4	47%	0.472	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-64.7	144.5	163.4	-66.9	-175.8	178.2	-173.6	0.7	109	Q1008	Q1008-R1107 VanDerWaalsContact OE1-NH2 3.13Å
1108	E	42.9	Very low	47.5	Very low	86 Å²	86	79.7 Å²	79.7	40%	0.402	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-81.7	148.7	169.1	-59.1	-150.1	154.3	0	0	110.3	K739 A787	K739-E1108 IonicContact NZ-OE1 2.99Å; K739-E1108 PolarHBondContact NZ-OE1 2.81Å; K739-E1108 IonicContact NZ-OE2 3.63Å; K739-E1108 PolarHBondContact NZ-OE2 3.47Å; A787-E1108 HydrophobicContact CB-CG 4.23Å; A787-E1108 WeakPolarHBondContact CB-OE1 3.37Å
1109	R	38.1	Very low	45.3	Very low	72 Å²	72	88.2 Å²	88.2	27%	0.272	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-77.8	132.8	-177.4	-160.1	-159.1	-172.4	114.2	15.5	109.6	E825	E825-R1109 IonicContact OE1-CZ 3.8Å; E825-R1109 IonicContact OE1-NH1 3.21Å; E825-R1109 PolarHBondContact OE1-NH1 3.26Å; E825-R1109 IonicContact OE1-NH2 3.4Å
1110	P	28.9	Very low	43.3	Very low	106 Å²	106	92.4 Å²	92.4	69%	0.688	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-52.7	158.8	158.9	-24.7	35.3	0	0	0	111.7
1111	S	29.6	Very low	41	Very low	44 Å²	44	94.6 Å²	94.6	31%	0.308	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-57.5	152.1	-179.9	46.7	0	0	0	0	112.2	H1113	S1111-H1113 PolarHBondContact O-N 2.85Å
1112	M	32.1	Very low	39	Very low	41 Å²	41	96.6 Å²	96.6	20%	0.202	54%	0.537	C	S	.	.	S	Bend	trans	-76.8	42.9	-162.3	-158.5	-178.2	82.2	0	0	114.9	F689 W730 Q1114	F689-M1112 HydrophobicContact CE2-CB 4.02Å; F689-M1112 HydrophobicContact CE2-CE 4.35Å; F689-M1112 HydrophobicContact CZ-CB 4.48Å; F689-M1112 WeakPolarHBondContact CZ-O 3.41Å; W730-M1112 HydrophobicContact CH2-SD 4.35Å; W730-M1112 HydrophobicContact CZ3-SD 4.4Å; M1112-Q1114 PolarHBondContact O-N 3.25Å
1113	H	31.9	Very low	36.5	Very low	121 Å²	121	98 Å²	98	56%	0.56	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	-0.3	-176.6	-87.6	-74.3	0	0	0	116.2	S1111	S1111-H1113 PolarHBondContact O-N 2.85Å
1114	Q	26.7	Very low	34	Very low	184 Å²	184	99.4 Å²	99.4	86%	0.86	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.3	11.5	-166.5	-70.4	-175.2	-29.7	0	0	115.5	M1112	M1112-Q1114 PolarHBondContact O-N 3.25Å
1115	L	27.8	Very low	31.6	Very low	80 Å²	80	109.6 Å²	109.6	42%	0.419	62%	0.62	S	S	.	*			trans	-143.2	70.4	-177.1	-71.8	177.6	0	0	0	113.8
1116	D	26.1	Very low	29.9	Very low	119 Å²	119	108.2 Å²	108.2	64%	0.636	63%	0.629	S	S	*	*			trans	-150.9	16.1	158	-110.8	-22.2	0	0	0	115.5	T1118	D1116-T1118 VanDerWaalsContact C-N 3.26Å; D1116-T1118 PolarHBondContact O-N 3.28Å; D1116-T1118 VanDerWaalsContact O-N 3.15Å
1117	E	26.7	Very low	28.6	Very low	194 Å²	194	114.2 Å²	114.2	91%	0.907	66%	0.664	S	S	*	*	S	Bend	trans	-85.9	55.5	167.7	-72.1	-155.6	150.3	0	0	112.7
1118	T	28.3	Very low	27.1	Very low	129 Å²	129	116.3 Å²	116.3	79%	0.791	68%	0.68	S	S	*	*	S	Bend	trans	-170.4	95.9	155.6	5.9	0	0	0	0	111.4	D1116	D1116-T1118 VanDerWaalsContact C-N 3.26Å; D1116-T1118 PolarHBondContact O-N 3.28Å; D1116-T1118 VanDerWaalsContact O-N 3.15Å
1119	L	25.4	Very low	26.1	Very low	181 Å²	181	119.5 Å²	119.5	95%	0.948	70%	0.695	S	S	*	*			trans	168.3	88.6	144.3	-94.3	161.1	0	0	0	112.4
1120	S	22.3	Very low	25.4	Very low	128 Å²	128	120 Å²	120	90%	0.895	71%	0.71	S	S	*	*			trans	-161.1	102	151.5	-161	0	0	0	0	114
1121	S	24.3	Very low	25.2	Very low	121 Å²	121	121.1 Å²	121.1	85%	0.846	71%	0.71	S	S	*	*			trans	-155.4	152.9	152.8	56.3	0	0	0	0	108.9
1122	G	24.1	Very low	24.9	Very low	76 Å²	76	124.6 Å²	124.6	78%	0.784	73%	0.726	S	S	*	*			trans	-63.5	168.8	-164.2	0	0	0	0	0	116
1123	G	22.1	Very low	24.5	Very low	87 Å²	87	133.7 Å²	133.7	90%	0.897	76%	0.757	S	S	*	*			cis	87.6	120.3	18.8	0	0	0	0	0	111.7
1124	G	22.3	Very low	24.1	Very low	62 Å²	62	132.5 Å²	132.5	64%	0.639	77%	0.769	S	S	*	*			cis	176.6	-179	-4.4	0	0	0	0	0	113
1125	Y	22.3	Very low	24.1	Very low	247 Å²	247	126.8 Å²	126.8	97%	0.969	76%	0.759	S	S	*	*			trans	66.7	146.8	171.8	-53.3	-83.1	0	0	0	118.2
1126	G	22.6	Very low	23.9	Very low	57 Å²	57	129.3 Å²	129.3	59%	0.588	78%	0.778	S	S	*	*			cis	171	175.4	-7.7	0	0	0	0	0	113.6
1127	T	22.6	Very low	23.8	Very low	139 Å²	139	131.8 Å²	131.8	85%	0.853	79%	0.791	S	S	*	*			trans	66	156.7	170.4	64.1	0	0	0	0	117.1
1128	M	22	Very low	23.6	Very low	168 Å²	168	133.3 Å²	133.3	83%	0.828	79%	0.788	S	S	*	*			cis	-170	165.5	-8.2	-111.8	176.8	151.3	0	0	107.8
1129	E	22.5	Very low	24.6	Very low	153 Å²	153	132.2 Å²	132.2	72%	0.715	78%	0.783	S	S	*	*			cis	-165.4	166.6	-17.4	-148.1	-98.5	-74.2	0	0	110.1
1130	S	22.8	Very low	24.6	Very low	83 Å²	83	128 Å²	128	58%	0.58	77%	0.774	S	S	*	*			trans	70.7	163	161.8	89.5	0	0	0	0	118.1
1131	N	23.6	Very low	24.7	Very low	130 Å²	130	126.9 Å²	126.9	70%	0.695	77%	0.766	S	S	*	*			cis	-160.4	164	2.8	-144.2	-36.1	0	0	0	114.2
1132	N	24.3	Very low	24.8	Very low	117 Å²	117	125.4 Å²	125.4	63%	0.626	76%	0.762	S	S	*	*			trans	77.2	128.2	145.1	-90.3	-54.4	0	0	0	125.5
1133	R	24.3	Very low	24.9	Very low	231 Å²	231	127.6 Å²	127.6	87%	0.872	76%	0.76	S	S	*	*			trans	73.8	155.2	141.5	-67.9	175.1	179.2	-169.9	-2.2	121.3
1134	A	23.9	Very low	25	Very low	96 Å²	96	127.8 Å²	127.8	79%	0.793	75%	0.747	S	S	*	*			cis	-174.7	157.9	-28.9	0	0	0	0	0	111.1
1135	G	25	Very low	25.2	Very low	64 Å²	64	133 Å²	133	66%	0.66	76%	0.755	S	S	*	*			trans	97.8	105.3	164.5	0	0	0	0	0	114.5
1136	T	24.3	Very low	25.4	Very low	133 Å²	133	126.6 Å²	126.6	82%	0.816	74%	0.742	S	S	*	*				59.3	111.3	69.1	71.5	0	0	0	0	115.7
1137	L	24.5	Very low	25.5	Very low	172 Å²	172	132.5 Å²	132.5	90%	0.901	76%	0.758	S	S	*	*				-169.2	162.1	107.8	-98.7	164.7	0	0	0	113.1
1138	R	21.7	Very low	25.6	Very low	226 Å²	226	133.4 Å²	133.4	85%	0.853	75%	0.753	S	S	*	*			trans	-136.7	179.8	-177.8	-110.4	-167.8	175.8	-169	1.2	106.3
1139	P	49.3	Very low	25.8	Very low	106 Å²	106	137.3 Å²	137.3	69%	0.688	76%	0.758	S	S	*	*			cis	-136.5	-158.8	-39.1	38.4	-19.3	0	0	0	111.3
1140	A	25.3	Very low	26	Very low	91 Å²	91	139.4 Å²	139.4	75%	0.752	76%	0.759	S	S	*	*			trans	71.1	158.7	145.5	0	0	0	0	0	119.6
1141	S	25	Very low	26.2	Very low	106 Å²	106	144.6 Å²	144.6	74%	0.741	77%	0.768	S	S	*	*			cis	-172.3	146.3	-21	51.8	0	0	0	0	113.1
1142	A	26.7	Very low	26.4	Very low	90 Å²	90	143.7 Å²	143.7	74%	0.744	76%	0.763	S	S	*	*			trans	62.7	173.3	148.7	0	0	0	0	0	118.2
1143	T	25.5	Very low	26.6	Very low	121 Å²	121	145.1 Å²	145.1	74%	0.742	77%	0.766	S	S	*	*			cis	-156.6	157	2.4	-22.7	0	0	0	0	111.1
1144	S	24.5	Very low	26.7	Very low	92 Å²	92	139.1 Å²	139.1	64%	0.643	75%	0.754	S	S	*	*			trans	64.8	166	149.2	-70.5	0	0	0	0	119.3
1145	Q	27.3	Very low	27.7	Very low	172 Å²	172	140.2 Å²	140.2	80%	0.804	75%	0.754	S	S	*	*			cis	-171.4	177.8	-20.3	-100.1	165.6	4.9	0	0	106.5
1146	T	26.6	Very low	28.2	Very low	112 Å²	112	146.9 Å²	146.9	69%	0.687	76%	0.759	S	S	*	*			cis	-178.7	133.7	-43	-83.3	0	0	0	0	107.3
1147	I	24	Very low	28.4	Very low	180 Å²	180	146.4 Å²	146.4	92%	0.923	75%	0.751	S	S	*	*			trans	-154.9	161.9	167.5	-107.6	153.4	0	0	0	112.2
1148	Q	25.4	Very low	28.6	Very low	159 Å²	159	141 Å²	141	74%	0.743	74%	0.737	S	S	*	*			trans	-149.2	150.4	-152.3	-159.6	168.7	7.3	0	0	112.3
1149	R	25.8	Very low	29.7	Very low	250 Å²	250	135.8 Å²	135.8	94%	0.943	73%	0.732	S	S	*	*			trans	170.8	169.9	149.5	-96.7	159	-165.1	-140.9	5.2	112.1
1150	R	27.4	Very low	28.9	Very low	196 Å²	196	135.8 Å²	135.8	74%	0.74	73%	0.73	S	S	*	*				-166.4	176.5	-85.7	-137.9	-164.3	-166.9	-162.9	6.7	109.3
1151	Y	26.3	Very low	29.1	Very low	192 Å²	192	141.7 Å²	141.7	75%	0.753	74%	0.735	S	S	*	*			trans	79.7	138.3	176.9	-62.8	-84.5	0	0	0	115.9
1152	D	27.9	Very low	29.2	Very low	111 Å²	111	140.7 Å²	140.7	59%	0.594	73%	0.728	S	S	*	*			cis	179.5	172.1	-23.8	-104.5	13.8	0	0	0	106.7
1153	Q	27.9	Very low	29.3	Very low	148 Å²	148	141.7 Å²	141.7	69%	0.692	73%	0.729	S	S	*	*			cis	-156.7	155.9	-1.7	-115.3	175.5	67.7	0	0	107.3
1154	V	26.9	Very low	29.5	Very low	104 Å²	104	141.9 Å²	141.9	63%	0.63	73%	0.73	S	S	*	*				62.4	140.1	78.2	-175.8	0	0	0	0	113.9	R1156	V1154-R1156 HydrophobicContact CG1-CG 4.46Å
1155	P	44.6	Very low	29.7	Very low	120 Å²	120	145.8 Å²	145.8	78%	0.779	74%	0.738	S	S	*	*			cis	-112.7	174.9	15.4	10.1	16.3	0	0	0	115
1156	R	35.7	Very low	30.2	Very low	203 Å²	203	147.3 Å²	147.3	77%	0.766	74%	0.742	S	S	*	*			cis	119.9	151.8	12.6	-86.6	178.4	166	-115.3	7.6	111.5	V1154	V1154-R1156 HydrophobicContact CG1-CG 4.46Å
1157	D	29.3	Very low	30.6	Very low	124 Å²	124	147.7 Å²	147.7	66%	0.663	75%	0.746	S	S	*	*			cis	-129.2	-152.9	4.4	-123.2	-51.5	0	0	0	110.3
1158	G	27.1	Very low	30.8	Very low	58 Å²	58	144.6 Å²	144.6	60%	0.598	74%	0.741	S	S	*	*			cis	107.1	143.8	11.4	0	0	0	0	0	112.2
1159	P	45.9	Very low	32.1	Very low	116 Å²	116	142.6 Å²	142.6	75%	0.753	74%	0.741	S	S	*	*			cis	-118.1	147.9	12.3	39.6	-26.2	0	0	0	116.3
1160	V	32.4	Very low	32.3	Very low	107 Å²	107	142.3 Å²	142.3	65%	0.648	74%	0.74	S	S	*	*				64.7	128.6	83.2	-149.4	0	0	0	0	112.9
1161	Y	28.6	Very low	32.3	Very low	215 Å²	215	137 Å²	137	84%	0.843	75%	0.747	S	S	*	*			cis	-151.3	-179.4	42.7	-71.5	-99.6	0	0	0	113
1162	S	27.9	Very low	32.4	Very low	85 Å²	85	131.8 Å²	131.8	59%	0.594	75%	0.751	S	S	*	*				-175.4	142.2	-53.8	65.2	0	0	0	0	113.3
1163	S	28.6	Very low	32.4	Very low	111 Å²	111	130.5 Å²	130.5	78%	0.776	76%	0.764	S	S	*	*			trans	63.6	164.2	149.2	72.7	0	0	0	0	120.4
1164	V	29	Very low	32.4	Very low	124 Å²	124	127.6 Å²	127.6	75%	0.752	77%	0.774	S	S	*	*			cis	-138	171.8	12.6	177.4	0	0	0	0	112.5
1165	Q	29.8	Very low	32.5	Very low	174 Å²	174	126.8 Å²	126.8	81%	0.813	79%	0.787	S	S	*	*			trans	-68.9	172.1	-173	-54.8	155.7	-61.4	0	0	119.2
1166	K	36.9	Very low	31.8	Very low	204 Å²	204	124.7 Å²	124.7	89%	0.887	79%	0.787	S	S	*	*			trans	-55.8	157	157	-61.1	179.1	176.4	-177.7	0	113
1167	P	34.7	Very low	31.7	Very low	120 Å²	120	122.1 Å²	122.1	78%	0.779	79%	0.788	S	S	*	*			trans	-142.5	172.4	134.8	39.3	-26.1	0	0	0	116.1
1168	S	28.4	Very low	31.9	Very low	116 Å²	116	124.1 Å²	124.1	81%	0.811	80%	0.797	S	S	*	*			trans	-164.5	165.2	164.1	-58.4	0	0	0	0	107.6
1169	P	53.3	Low	32.2	Very low	116 Å²	116	127.6 Å²	127.6	75%	0.753	80%	0.802	S	S	*	*			cis	-126.3	175.7	-33.3	39.4	-26.5	0	0	0	111.9
1170	R	28.9	Very low	31.5	Very low	245 Å²	245	129.3 Å²	129.3	93%	0.925	81%	0.805	S	S	*	*			trans	159.7	133.3	137.2	-92	170.2	-179.1	-158.7	0.7	114.2
1171	G	28.6	Very low	31.4	Very low	85 Å²	85	128.8 Å²	128.8	88%	0.876	81%	0.806	S	S	*	*			trans	97.8	128.9	132.2	0	0	0	0	0	119.4
1172	G	27.9	Very low	31.6	Very low	81 Å²	81	129.4 Å²	129.4	84%	0.835	81%	0.807	S	S	*	*			trans	112.8	88.4	143.5	0	0	0	0	0	118.7
1173	G	27.3	Very low	32	Very low	85 Å²	85	134.9 Å²	134.9	88%	0.876	84%	0.836	S	S	*	*				49.5	128.8	126.9	0	0	0	0	0	122.4
1174	G	28.8	Very low	32.2	Very low	86 Å²	86	136.1 Å²	136.1	89%	0.887	84%	0.839	S	S	*	*			trans	103.1	135.9	170.9	0	0	0	0	0	112.3
1175	G	28.9	Very low	32.4	Very low	88 Å²	88	136.7 Å²	136.7	91%	0.907	84%	0.844	S	S	*	*			cis	118	91	-2.3	0	0	0	0	0	112.3
1176	G	30	Very low	32.5	Very low	75 Å²	75	134.6 Å²	134.6	77%	0.773	85%	0.846	S	S	*	*			trans	159.4	129.7	177.9	0	0	0	0	0	110.9
1177	N	32.9	Very low	32.3	Very low	150 Å²	150	130.5 Å²	130.5	80%	0.802	84%	0.843	S	S	*	*			trans	-75.3	161.7	173.1	-59.5	-1.1	0	0	0	110.5
1178	I	34.8	Very low	32.1	Very low	165 Å²	165	131.2 Å²	131.2	85%	0.846	85%	0.847	S	S	*	*				-162.2	157.9	118.6	-99.3	154.4	0	0	0	108.5
1179	D	32.2	Very low	32.4	Very low	131 Å²	131	132.2 Å²	132.2	70%	0.701	85%	0.849	S	S	*	*			trans	-80.9	171.9	-160.6	-59.5	-80.3	0	0	0	116.6
1180	D	31.7	Very low	30.9	Very low	152 Å²	152	133.4 Å²	133.4	81%	0.813	86%	0.856	S	S	*	*			trans	92.1	143.1	138	-94.5	-33	0	0	0	123.4
1181	S	30.3	Very low	31	Very low	97 Å²	97	124.8 Å²	124.8	68%	0.678	85%	0.851	S	S	*	*			trans	84	114.4	154.8	67.4	0	0	0	0	121.9
1182	W	33.2	Very low	31.2	Very low	228 Å²	228	128.1 Å²	128.1	86%	0.864	85%	0.849	S	S	*	*			trans	42	118.8	136.4	-59.5	82.9	0	0	0	119.3
1183	V	36.5	Very low	31.5	Very low	199 Å²	199	132.4 Å²	132.4	100%	1.206	85%	0.85	S	S	*	*				69.4	0	66	176.3	0	0	0	0	111.5

Retrieved 1,183 of 1,183 residues in 368.4 ms (Link to these results)

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