A0A077Z8Q9_TRITR Loading...

Hexosyltransferase

AlphaFold DB , UniProt , Accession A0A077Z8Q9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 817 aa.

						>A0A077Z8Q9_TRITR|A0A077Z8Q9
MVFRKYMNDAATERKVVVIGDETLSSCPSAGREGTQLWTIESDRTVVVLRVLARVYRLGVIQVCQDHAMRTQQFDSSWDRTLRLYSRASIRHWALFTVGVLFGYFFTICMHLSPQLLLCTPEANYHTSSVKLWGHHVEPLDRSKSRRLLFVGVMTAQKYLDSRAEAIMKTWGSKLGDSLVFFVGENATCASATLPLVRLKGVDDTYPPQKKSMHMIRYMYMHHGSQFEWFLRADDDVFVRVERLEQLLRSLDASRPLMLGQAGFGKPEEHGKLGLSDGEPYCMGGTGIVLSRETLRLTAPYVHLCLPLVSSNHEDVELNRCVQRFAGVKCTWSYEMQSLFYNNYSGSQAFTGDFNVPEVQHAIVLHPLKEPAVMHAMYRHFKRQEMADLYDRIQLLLHNGEWNLLASHFTGQTFPKSSSLLEPRCSSATAMNVWQFFQSPFAYCSGASECPRHRMKSRQMYAVRNIAYEIIDMMNKYGRQRGRMVEYQSTLYGYWRVEPTVGTDYILDLLLMYKRLKGKRTSMLVRRHVYLRQLFLPLQATDAIDTSHPADADNVNLVTVHVIVPLHKRLTSLQRFVAHFEKHCLRNGEKVSLIVVLFPSDDSESDFQIAQTLHNLEVVYQKQSNISLVVLKKQPFNRAFALSRGAELCPAGSLMFFADVDMLFTRQLLHRIRLNTIKNRQVFFPVVFSEYKPASDGQNHFNHFYMNGHFRYFGFGLVSLYREDFDAVGGMNTKIRGWGLEDVDLFEKCLNNPMISIFRAPEPDLIHVYHDVTCDSNLPPLQLRMCKGRKADGYLSKQRLAEIVGPMLRNGTKDAAL
					

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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	30	Very low	28.4	Very low	222 Å²	222	151.8 Å²	151.8	100%	1.094	76%	0.756	S	S	*	*				0	-43.1	0	-83.1	179.3	-148.2	0	0	113.7	F3 R4	M1-F3 PolarHBondContact O-N 3.37Å; M1-R4 PolarHBondContact O-N 3.4Å; M1-R4 VanDerWaalsContact O-N 3.12Å
2	V	31.4	Very low	28.1	Very low	122 Å²	122	149.9 Å²	149.9	74%	0.739	76%	0.759	S	S	*	*	H	α-helix	trans	-60.1	-30.2	179	-178	0	0	0	0	113.4	R4	V2-R4 VanDerWaalsContact C-N 3.3Å; V2-R4 PolarHBondContact O-N 2.93Å
3	F	30.6	Very low	27.8	Very low	199 Å²	199	147.8 Å²	147.8	87%	0.873	74%	0.744	S	S	*	*	H	α-helix	trans	-71.3	-17.8	178.2	-134	-96.3	0	0	0	114.7	M1	M1-F3 PolarHBondContact O-N 3.37Å
4	R	30.3	Very low	27.9	Very low	213 Å²	213	144.8 Å²	144.8	80%	0.804	72%	0.72	S	S	*	*	H	α-helix	trans	-89.5	-18.7	-179.3	-144.1	177.3	-166.8	177.1	3.8	112.9	M1 V2	M1-R4 PolarHBondContact O-N 3.4Å; M1-R4 VanDerWaalsContact O-N 3.12Å; V2-R4 VanDerWaalsContact C-N 3.3Å; V2-R4 PolarHBondContact O-N 2.93Å
5	K	31.1	Very low	27.7	Very low	158 Å²	158	146.8 Å²	146.8	69%	0.687	72%	0.723	S	S	*	*	H	α-helix	trans	-80.5	-31.2	-178.2	-161	172.8	-180	-179.2	0	112.8	M7 N8	K5-M7 VanDerWaalsContact C-N 3.3Å; K5-M7 PolarHBondContact O-N 2.9Å; K5-N8 PolarHBondContact O-N 3.39Å
6	Y	28	Very low	27.6	Very low	195 Å²	195	141.9 Å²	141.9	77%	0.765	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	-12.9	-179.4	-94.4	-79.1	0	0	0	115.3
7	M	27.7	Very low	27.5	Very low	149 Å²	149	138.6 Å²	138.6	73%	0.734	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	-17.5	176.8	-74.3	-73.5	-83.3	0	0	113.4	K5	K5-M7 VanDerWaalsContact C-N 3.3Å; K5-M7 PolarHBondContact O-N 2.9Å
8	N	28.7	Very low	27.4	Very low	127 Å²	127	135.9 Å²	135.9	68%	0.679	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	-25.5	-178.9	-77	-2.1	0	0	0	113.2	K5 A10	K5-N8 PolarHBondContact O-N 3.39Å; N8-A10 VanDerWaalsContact C-N 3.33Å; N8-A10 PolarHBondContact O-N 3.35Å
9	D	25.5	Very low	27.3	Very low	142 Å²	142	133.6 Å²	133.6	76%	0.759	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	2	-178.4	-69	-15.4	0	0	0	113.9
10	A	24.8	Very low	27.1	Very low	64 Å²	64	129.6 Å²	129.6	53%	0.529	67%	0.667	S	S	.	*	T	Hydrogen-bonded Turn	trans	-113.5	6.1	176.9	0	0	0	0	0	114.1	N8 T12	N8-A10 VanDerWaalsContact C-N 3.33Å; N8-A10 PolarHBondContact O-N 3.35Å; A10-T12 VanDerWaalsContact C-N 3.28Å; A10-T12 PolarHBondContact O-N 3.41Å
11	A	24.2	Very low	27.1	Very low	79 Å²	79	130 Å²	130	65%	0.653	67%	0.67	S	S	*	*			trans	-84.6	59.9	-177.6	0	0	0	0	0	112.8
12	T	24.6	Very low	26.8	Very low	129 Å²	129	128.1 Å²	128.1	79%	0.791	66%	0.659	S	S	*	*			trans	-138.9	49.5	162.6	45.2	0	0	0	0	109.8	A10	A10-T12 VanDerWaalsContact C-N 3.28Å; A10-T12 PolarHBondContact O-N 3.41Å
13	E	25.2	Very low	26.4	Very low	122 Å²	122	127.9 Å²	127.9	57%	0.57	66%	0.658	S	S	*	*			trans	-100.9	130.9	176.3	-78.6	-168.2	152.7	0	0	112.1	K15	E13-K15 PolarHBondContact O-N 3.44Å; E13-K15 VanDerWaalsContact O-N 3.14Å
14	R	28.3	Very low	26.2	Very low	106 Å²	106	126.3 Å²	126.3	40%	0.4	66%	0.658	S	S	.	*			trans	-48.8	111	167.8	-58.9	-178.8	176	-173.8	-8.8	109.5	V16 L395	R14-V16 PolarHBondContact O-N 3.01Å; R14-L395 HydrophobicContact CB-CD1 3.79Å; R14-L395 HydrophobicContact CG-CD1 3.63Å
15	K	24.9	Very low	26	Very low	175 Å²	175	121.4 Å²	121.4	76%	0.761	66%	0.656	S	S	*	*			trans	-93.3	95.3	170.4	-78.6	-174.8	177.4	178	0	110	E13	E13-K15 PolarHBondContact O-N 3.44Å; E13-K15 VanDerWaalsContact O-N 3.14Å
16	V	26.9	Very low	25.6	Very low	68 Å²	68	119.3 Å²	119.3	41%	0.412	66%	0.662	S	S	.	*			trans	-74.6	123.4	137.5	175.2	0	0	0	0	104.9	R14 V18 M473	R14-V16 PolarHBondContact O-N 3.01Å; V16-V18 VanDerWaalsContact C-N 3.33Å; V16-V18 PolarHBondContact O-N 2.83Å; V16-M473 HydrophobicContact CG2-CE 4.33Å; V16-M473 HydrophobicContact CG2-SD 4.13Å
17	V	24.9	Very low	25.4	Very low	86 Å²	86	116.1 Å²	116.1	52%	0.521	67%	0.666	S	S	.	*			trans	-73.9	90.6	-179.6	-173.4	0	0	0	0	108.3	I19	V17-I19 HydrophobicContact CG1-CD1 4.33Å; V17-I19 HydrophobicContact CG1-CG1 3.6Å; V17-I19 PolarHBondContact O-N 3.06Å
18	V	26.7	Very low	25.3	Very low	90 Å²	90	114.6 Å²	114.6	55%	0.545	67%	0.667	S	S	.	*			trans	-80.4	97.8	163.4	-177.7	0	0	0	0	106.2	V16 G20	V16-V18 VanDerWaalsContact C-N 3.33Å; V16-V18 PolarHBondContact O-N 2.83Å; V18-G20 PolarHBondContact O-N 3.42Å
19	I	25.2	Very low	25.1	Very low	92 Å²	92	114.3 Å²	114.3	47%	0.472	68%	0.676	S	S	.	*			trans	-72.1	108.4	173.6	-54.5	179.1	0	0	0	106.7	V17	V17-I19 HydrophobicContact CG1-CD1 4.33Å; V17-I19 HydrophobicContact CG1-CG1 3.6Å; V17-I19 PolarHBondContact O-N 3.06Å
20	G	22.9	Very low	25.1	Very low	54 Å²	54	112.3 Å²	112.3	56%	0.557	68%	0.678	S	S	*	*			trans	-75	151.4	168.5	0	0	0	0	0	110.7	V18 E22	V18-G20 PolarHBondContact O-N 3.42Å; G20-E22 PolarHBondContact O-N 3.28Å
21	D	26.4	Very low	25.2	Very low	137 Å²	137	113 Å²	113	73%	0.733	69%	0.693	S	S	*	*	S	Bend	trans	-56.1	90.8	176.4	-76.6	-37.7	0	0	0	111.5
22	E	24.4	Very low	25.1	Very low	184 Å²	184	121.3 Å²	121.3	86%	0.86	71%	0.707	S	S	*	*	S	Bend	trans	-154	3.5	160.6	-116.7	169.8	-147.6	0	0	115.4	G20	G20-E22 PolarHBondContact O-N 3.28Å
23	T	24.3	Very low	25.1	Very low	117 Å²	117	124.3 Å²	124.3	72%	0.718	71%	0.712	S	S	*	*			trans	-134.1	64.4	175.3	57.2	0	0	0	0	112.5
24	L	25.8	Very low	25	Very low	165 Å²	165	122.2 Å²	122.2	86%	0.864	72%	0.723	S	S	*	*			trans	-121.3	61.7	161	-84.5	165.7	0	0	0	108.8
25	S	25.4	Very low	24.8	Very low	110 Å²	110	123.7 Å²	123.7	77%	0.769	74%	0.744	S	S	*	*			trans	-139.4	58.1	172.7	69.5	0	0	0	0	111.2
26	S	23.5	Very low	24.5	Very low	115 Å²	115	123.2 Å²	123.2	80%	0.804	74%	0.744	S	S	*	*			trans	-166	76.5	161.5	61.1	0	0	0	0	111.8
27	C	24.1	Very low	24.3	Very low	127 Å²	127	127.4 Å²	127.4	86%	0.858	76%	0.764	S	S	*	*			trans	-138.3	120.4	152.8	-96.3	0	0	0	0	107.8	S29	C27-S29 PolarHBondContact O-N 3.39Å
28	P	25.2	Very low	24	Very low	117 Å²	117	134.2 Å²	134.2	76%	0.76	78%	0.78	S	S	*	*			trans	-75.1	126.9	-176.5	27.9	-28	0	0	0	110.6	A30	P28-A30 PolarHBondContact O-N 2.95Å
29	S	23.5	Very low	23.7	Very low	122 Å²	122	135.4 Å²	135.4	85%	0.853	79%	0.788	S	S	*	*			trans	6.4	103.5	152.3	53.2	0	0	0	0	117.3	C27	C27-S29 PolarHBondContact O-N 3.39Å
30	A	26.8	Very low	23.5	Very low	99 Å²	99	138.5 Å²	138.5	82%	0.818	80%	0.804	S	S	*	*			trans	-135.6	117.9	153.4	0	0	0	0	0	109	P28	P28-A30 PolarHBondContact O-N 2.95Å
31	G	25.3	Very low	23.4	Very low	80 Å²	80	144.1 Å²	144.1	83%	0.825	82%	0.816	S	S	*	*			trans	75.4	92.1	158.3	0	0	0	0	0	117.1	E33	G31-E33 PolarHBondContact O-N 3.5Å
32	R	22.5	Very low	23.5	Very low	253 Å²	253	142.5 Å²	142.5	96%	0.955	82%	0.815	S	S	*	*			trans	-60.4	117.1	160.9	-69.3	175.2	178.8	177.7	-1.2	109.7
33	E	25.8	Very low	23.7	Very low	191 Å²	191	139.7 Å²	139.7	89%	0.893	81%	0.806	S	S	*	*			trans	-157.1	104.3	145.3	-111.1	172.1	-155.3	0	0	107.7	G31 T35	G31-E33 PolarHBondContact O-N 3.5Å; E33-T35 PolarHBondContact O-N 3.1Å
34	G	23	Very low	23.8	Very low	78 Å²	78	144.6 Å²	144.6	80%	0.804	81%	0.811	S	S	*	*			trans	-70.1	116.6	-167.3	0	0	0	0	0	112.4	Q36	G34-Q36 PolarHBondContact O-N 3.48Å; G34-Q36 VanDerWaalsContact O-N 3.15Å
35	T	23	Very low	24.1	Very low	137 Å²	137	141.7 Å²	141.7	84%	0.84	80%	0.8	S	S	*	*			trans	-75.7	94.4	155.4	-0.2	0	0	0	0	106.9	E33 L37	E33-T35 PolarHBondContact O-N 3.1Å; T35-L37 PolarHBondContact O-N 3.34Å
36	Q	20.2	Very low	24.4	Very low	165 Å²	165	140.8 Å²	140.8	77%	0.771	79%	0.79	S	S	*	*			trans	-58.4	110.6	169.4	-80.4	-179.7	-24.8	0	0	108.5	G34 W38	G34-Q36 PolarHBondContact O-N 3.48Å; G34-Q36 VanDerWaalsContact O-N 3.15Å; Q36-W38 PolarHBondContact O-N 3Å
37	L	21.5	Very low	24.6	Very low	156 Å²	156	139.7 Å²	139.7	82%	0.817	78%	0.778	S	S	*	*			trans	-62.2	113.4	165.8	-96.3	109.1	0	0	0	107.9	T35 T39	T35-L37 PolarHBondContact O-N 3.34Å; L37-T39 PolarHBondContact O-N 3.47Å
38	W	19.2	Very low	24.8	Very low	230 Å²	230	138.1 Å²	138.1	87%	0.871	76%	0.764	S	S	*	*			trans	-70.2	94.6	167.6	-68.8	82.1	0	0	0	108.8	Q36 I40	Q36-W38 PolarHBondContact O-N 3Å; W38-I40 PolarHBondContact O-N 2.91Å
39	T	19.6	Very low	24.9	Very low	114 Å²	114	138.2 Å²	138.2	70%	0.699	76%	0.758	S	S	*	*			trans	-73.7	106.9	159.2	40.8	0	0	0	0	107.9	L37 E41	L37-T39 PolarHBondContact O-N 3.47Å; T39-E41 PolarHBondContact O-N 3.11Å
40	I	21.6	Very low	25	Very low	158 Å²	158	141.8 Å²	141.8	81%	0.81	75%	0.753	S	S	*	*			trans	-71.3	98.5	168.9	-62.6	172.6	0	0	0	106.9	W38 S42	W38-I40 PolarHBondContact O-N 2.91Å; I40-S42 PolarHBondContact O-N 3.42Å
41	E	21.1	Very low	25.3	Very low	172 Å²	172	141.4 Å²	141.4	80%	0.804	74%	0.74	S	S	*	*			trans	-71.7	102.8	167.1	-75.3	-179.5	157.8	0	0	109.1	T39 D43	T39-E41 PolarHBondContact O-N 3.11Å; E41-D43 PolarHBondContact O-N 3.43Å
42	S	28.1	Very low	25.3	Very low	103 Å²	103	142.5 Å²	142.5	72%	0.72	73%	0.726	S	S	*	*			trans	-96.3	66.6	164.8	79.7	0	0	0	0	110.1	I40 R44	I40-S42 PolarHBondContact O-N 3.42Å; S42-R44 PolarHBondContact O-N 3.31Å
43	D	28.5	Very low	25.9	Very low	124 Å²	124	134.1 Å²	134.1	66%	0.663	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.4	70.6	179.6	-160	12.5	0	0	0	111	E41	E41-D43 PolarHBondContact O-N 3.43Å
44	R	26.9	Very low	26	Very low	221 Å²	221	135.9 Å²	135.9	83%	0.834	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-145.5	-14.6	165.7	-74.6	-159.8	174.8	177	-1.4	116.7	S42	S42-R44 PolarHBondContact O-N 3.31Å
45	T	30.9	Very low	26.6	Very low	104 Å²	104	136.9 Å²	136.9	64%	0.638	70%	0.7	S	S	*	*	H	α-helix	trans	-86.1	-23.5	-175.2	-36.5	0	0	0	0	113.5
46	V	31.4	Very low	26.9	Very low	91 Å²	91	138 Å²	138	55%	0.552	69%	0.69	S	S	*	*	H	α-helix	trans	-83.6	-26	-173.3	-178.7	0	0	0	0	113	R50	V46-R50 PolarHBondContact O-N 3.41Å
47	V	28.3	Very low	27.4	Very low	92 Å²	92	142 Å²	142	56%	0.558	70%	0.698	S	S	*	*	H	α-helix	trans	-72.7	-37.2	-177.7	-177.3	0	0	0	0	111.7	L49 R50 V51	V47-L49 PolarHBondContact O-N 2.96Å; V47-R50 PolarHBondContact O-N 2.92Å; V47-V51 PolarHBondContact O-N 3.49Å
48	V	27.7	Very low	27.8	Very low	93 Å²	93	141.7 Å²	141.7	56%	0.564	70%	0.696	S	S	*	*	H	α-helix	trans	-67.4	-36.9	-179.1	-178.6	0	0	0	0	111.6	V51 L52	V48-V51 PolarHBondContact O-N 2.76Å; V48-L52 HydrophobicContact CG1-CD1 4.21Å; V48-L52 PolarHBondContact O-N 3.25Å
49	L	27.4	Very low	28.3	Very low	120 Å²	120	134 Å²	134	63%	0.628	69%	0.689	S	S	*	*	H	α-helix	trans	-71.3	-30.7	179.5	-82.4	160.6	0	0	0	113.3	V47 A53	V47-L49 PolarHBondContact O-N 2.96Å; L49-A53 WeakPolarHBondContact O-CB 3.36Å; L49-A53 PolarHBondContact O-N 3.4Å
50	R	27.2	Very low	28.6	Very low	196 Å²	196	135.2 Å²	135.2	74%	0.74	70%	0.696	S	S	*	*	H	α-helix	trans	-73.5	-30.4	176.1	-80.7	-173.4	179.8	176	2.1	113.3	V46 V47	V46-R50 PolarHBondContact O-N 3.41Å; V47-R50 PolarHBondContact O-N 2.92Å
51	V	31.5	Very low	28.8	Very low	92 Å²	92	135.4 Å²	135.4	56%	0.558	70%	0.697	S	S	*	*	H	α-helix	trans	-73	-42.6	176.9	177.9	0	0	0	0	110.4	V47 V48 A53 R54	V47-V51 PolarHBondContact O-N 3.49Å; V48-V51 PolarHBondContact O-N 2.76Å; V51-A53 PolarHBondContact O-N 2.96Å; V51-R54 PolarHBondContact O-N 2.95Å
52	L	27.2	Very low	29	Very low	102 Å²	102	134.5 Å²	134.5	53%	0.534	69%	0.693	S	S	.	*	H	α-helix	trans	-67.7	-35.8	179.3	-71	170.7	0	0	0	112.9	V48 R54 V55 Y56	V48-L52 HydrophobicContact CG1-CD1 4.21Å; V48-L52 PolarHBondContact O-N 3.25Å; L52-R54 VanDerWaalsContact C-N 3.26Å; L52-R54 PolarHBondContact O-N 2.94Å; L52-V55 PolarHBondContact O-N 2.93Å; L52-Y56 PolarHBondContact O-N 3.48Å
53	A	33.6	Very low	28.9	Very low	77 Å²	77	136.6 Å²	136.6	64%	0.636	70%	0.7	S	S	*	*	H	α-helix	trans	-68.7	-20.8	177.7	0	0	0	0	0	114	L49 V51	L49-A53 WeakPolarHBondContact O-CB 3.36Å; L49-A53 PolarHBondContact O-N 3.4Å; V51-A53 PolarHBondContact O-N 2.96Å
54	R	29.4	Very low	28.8	Very low	228 Å²	228	136.3 Å²	136.3	86%	0.86	71%	0.707	S	S	*	*	H	α-helix	trans	-86.2	-22.5	178.9	-136.6	174	-172.3	176.3	0.8	113	V51 L52	V51-R54 PolarHBondContact O-N 2.95Å; L52-R54 VanDerWaalsContact C-N 3.26Å; L52-R54 PolarHBondContact O-N 2.94Å
55	V	35	Very low	28.9	Very low	99 Å²	99	131.6 Å²	131.6	60%	0.6	69%	0.694	S	S	*	*	H	α-helix	trans	-82.9	-32.9	-180	178	0	0	0	0	111.7	L52	L52-V55 PolarHBondContact O-N 2.93Å
56	Y	29.8	Very low	28.8	Very low	161 Å²	161	133.8 Å²	133.8	63%	0.631	70%	0.702	S	S	*	*			trans	-110.5	89.2	-176.7	-70.1	-81	0	0	0	112	L52 L58	L52-Y56 PolarHBondContact O-N 3.48Å; Y56-L58 PolarHBondContact O-N 2.94Å
57	R	28.9	Very low	28.8	Very low	249 Å²	249	138.1 Å²	138.1	94%	0.94	72%	0.716	S	S	*	*			trans	-66.3	68.3	162.8	-79.4	-174.8	175.7	-178.5	-0.2	110.6
58	L	31.6	Very low	28.8	Very low	149 Å²	149	136.8 Å²	136.8	78%	0.78	72%	0.715	S	S	*	*			trans	-119.5	110.4	171.1	-72.7	170.6	0	0	0	109.1	Y56	Y56-L58 PolarHBondContact O-N 2.94Å
59	G	28.2	Very low	28.9	Very low	70 Å²	70	140 Å²	140	72%	0.722	73%	0.725	S	S	*	*			trans	-65.9	140.4	178.5	0	0	0	0	0	111.8
60	V	25.7	Very low	29.2	Very low	138 Å²	138	145.6 Å²	145.6	84%	0.836	74%	0.738	S	S	*	*	S	Bend	trans	44.6	85.9	143.8	-167	0	0	0	0	114.9
61	I	26.2	Very low	29.3	Very low	163 Å²	163	141.5 Å²	141.5	84%	0.836	74%	0.735	S	S	*	*			trans	176.8	85.6	136.2	-80.3	144.4	0	0	0	106.2
62	Q	24.9	Very low	29.2	Very low	153 Å²	153	146.9 Å²	146.9	72%	0.715	75%	0.754	S	S	*	*			trans	-167.7	68.7	160.8	-129.5	161.8	-14.8	0	0	112.9
63	V	26.5	Very low	29.5	Very low	146 Å²	146	150.6 Å²	150.6	89%	0.885	77%	0.769	S	S	*	*	S	Bend	trans	-118.4	12.5	165.5	-179	0	0	0	0	111.8
64	C	26.2	Very low	29.4	Very low	118 Å²	118	156 Å²	156	80%	0.797	78%	0.778	S	S	*	*	S	Bend	trans	-125.5	33.8	-178.2	-66.6	0	0	0	0	114.9
65	Q	29.5	Very low	29.5	Very low	122 Å²	122	152.4 Å²	152.4	57%	0.57	78%	0.776	S	S	*	*	S	Bend	trans	-114	-8.8	174	-90.4	-178.2	-24.3	0	0	116.7	H67	Q65-H67 VanDerWaalsContact C-N 3.33Å; Q65-H67 PolarHBondContact O-N 2.86Å
66	D	29.2	Very low	29.7	Very low	150 Å²	150	151.8 Å²	151.8	80%	0.802	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	-7.9	173.7	-98.9	-0.6	0	0	0	114.6
67	H	30.1	Very low	30.1	Very low	182 Å²	182	147.8 Å²	147.8	84%	0.843	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96	-7.2	174.4	-136.6	42	0	0	0	114.2	Q65	Q65-H67 VanDerWaalsContact C-N 3.33Å; Q65-H67 PolarHBondContact O-N 2.86Å
68	A	29.3	Very low	30.4	Very low	64 Å²	64	144.8 Å²	144.8	53%	0.529	76%	0.76	S	S	.	*	G	3₁₀ helix	trans	-90.4	-11.9	-176.8	0	0	0	0	0	114.2	R70	A68-R70 PolarHBondContact O-N 3.37Å
69	M	29.6	Very low	30.9	Very low	160 Å²	160	141.9 Å²	141.9	79%	0.788	75%	0.746	S	S	*	*	G	3₁₀ helix	trans	-79.1	8.4	179.7	-74.9	-155.8	-77.7	0	0	115.1
70	R	32.6	Very low	31.4	Very low	238 Å²	238	146.8 Å²	146.8	90%	0.898	74%	0.742	S	S	*	*	G	3₁₀ helix	trans	-120.4	7.7	178	-78.7	-169.5	-175.7	-171	2.3	116.8	A68	A68-R70 PolarHBondContact O-N 3.37Å
71	T	30	Very low	32.4	Very low	110 Å²	110	143 Å²	143	68%	0.675	72%	0.72	S	S	*	*			trans	-128.3	81.5	176.8	51.3	0	0	0	0	111	Q73	T71-Q73 PolarHBondContact O-N 3.49Å
72	Q	29.4	Very low	33.2	Very low	206 Å²	206	141.1 Å²	141.1	96%	0.963	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	36.9	-176.6	-125.2	-177.9	5.1	0	0	114.3
73	Q	33.7	Very low	33.9	Very low	180 Å²	180	141.1 Å²	141.1	84%	0.841	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-143.5	18.5	-172.5	-125.5	168.8	-0.3	0	0	118.4	T71	T71-Q73 PolarHBondContact O-N 3.49Å
74	F	30.6	Very low	34.7	Very low	190 Å²	190	140.5 Å²	140.5	83%	0.833	70%	0.695	S	S	*	*			trans	-135	30.8	-178.8	-94.5	-78.2	0	0	0	116.7
75	D	32.5	Very low	35.4	Very low	153 Å²	153	143.6 Å²	143.6	82%	0.818	69%	0.692	S	S	*	*			trans	-105.2	38.3	-169.1	-131.9	2.1	0	0	0	116.3
76	S	38.8	Very low	36.2	Very low	85 Å²	85	142.4 Å²	142.4	59%	0.594	70%	0.696	S	S	*	*	S	Bend	trans	-127.3	2.8	179	72.1	0	0	0	0	116.6	R80	S76-R80 PolarHBondContact O-NH2 3.38Å
77	S	39.3	Very low	37	Very low	77 Å²	77	146 Å²	146	54%	0.538	70%	0.699	S	S	.	*	S	Bend	trans	-101	-49.9	-179.9	-179.2	0	0	0	0	112.9	D79 R80	S77-D79 VanDerWaalsContact C-N 3.33Å; S77-D79 PolarHBondContact O-N 3.39Å; S77-R80 WeakPolarHBondContact O-CB 3.31Å; S77-R80 PolarHBondContact O-N 2.84Å; S77-R80 VanDerWaalsContact O-N 3.15Å
78	W	34.8	Very low	38	Very low	186 Å²	186	139.2 Å²	139.2	71%	0.705	67%	0.674	S	S	*	*	H	α-helix	trans	-65.5	-33.9	-173.7	-75.5	101	0	0	0	114	R80 T81 L82	W78-R80 PolarHBondContact O-N 2.91Å; W78-T81 PolarHBondContact O-N 2.98Å; W78-L82 PolarHBondContact O-N 2.99Å
79	D	42.3	Very low	39.2	Very low	88 Å²	88	139.4 Å²	139.4	47%	0.471	67%	0.672	S	S	.	*	H	α-helix	trans	-72.1	-11.4	-179.5	-142.4	24.4	0	0	0	113	S77 R83	S77-D79 VanDerWaalsContact C-N 3.33Å; S77-D79 PolarHBondContact O-N 3.39Å; D79-R83 PolarHBondContact O-NE 2.99Å; D79-R83 PolarHBondContact O-NH2 2.83Å; D79-R83 VanDerWaalsContact O-NH2 3.14Å; D79-R83 IonicContact OD1-NH2 3.77Å; D79-R83 IonicContact OD2-CZ 3.62Å; D79-R83 IonicContact OD2-NH1 4Å; D79-R83 IonicContact OD2-NH2 2.68Å; D79-R83 PolarHBondContact OD2-NH2 3.45Å
80	R	38.5	Very low	41.2	Very low	173 Å²	173	138.9 Å²	138.9	65%	0.653	67%	0.671	S	S	*	*	H	α-helix	trans	-86.8	-39.6	171.8	-125.5	179.7	-65.5	-146	0.2	111.4	S76 S77 W78 L84	S76-R80 PolarHBondContact O-NH2 3.38Å; S77-R80 WeakPolarHBondContact O-CB 3.31Å; S77-R80 PolarHBondContact O-N 2.84Å; S77-R80 VanDerWaalsContact O-N 3.15Å; W78-R80 PolarHBondContact O-N 2.91Å; R80-L84 PolarHBondContact O-N 2.97Å
81	T	45.2	Very low	43	Very low	59 Å²	59	136.9 Å²	136.9	36%	0.362	66%	0.663	S	S	.	*	H	α-helix	trans	-68.8	-41.2	-178.5	-49.1	0	0	0	0	112.2	W78 R83 L84 Y85	W78-T81 PolarHBondContact O-N 2.98Å; T81-R83 PolarHBondContact O-N 2.8Å; T81-L84 PolarHBondContact O-N 3.19Å; T81-Y85 HydrophobicContact CG2-CE2 4.29Å; T81-Y85 WeakPolarHBondContact O-CD2 3.45Å
82	L	43.5	Very low	45.2	Very low	123 Å²	123	137.5 Å²	137.5	64%	0.644	66%	0.658	S	S	*	*	H	α-helix	trans	-68.6	-33.4	179	-83.7	159	0	0	0	112.9	W78 L84 Y85	W78-L82 PolarHBondContact O-N 2.99Å; L82-L84 VanDerWaalsContact C-N 3.31Å; L82-L84 PolarHBondContact O-N 3.5Å; L82-Y85 PolarHBondContact O-N 3.44Å
83	R	39.7	Very low	47.6	Very low	153 Å²	153	135.6 Å²	135.6	58%	0.577	64%	0.642	S	S	*	*	H	α-helix	trans	-67.5	-30.1	175	-85.2	-176.3	-88.1	-124.5	-3.8	113	D79 T81 S86	D79-R83 PolarHBondContact O-NE 2.99Å; D79-R83 PolarHBondContact O-NH2 2.83Å; D79-R83 VanDerWaalsContact O-NH2 3.14Å; D79-R83 IonicContact OD1-NH2 3.77Å; D79-R83 IonicContact OD2-CZ 3.62Å; D79-R83 IonicContact OD2-NH1 4Å; D79-R83 IonicContact OD2-NH2 2.68Å; D79-R83 PolarHBondContact OD2-NH2 3.45Å; T81-R83 PolarHBondContact O-N 2.8Å; R83-S86 PolarHBondContact O-OG 2.85Å
84	L	43	Very low	49.7	Very low	134 Å²	134	129.1 Å²	129.1	70%	0.702	62%	0.62	S	S	*	*	H	α-helix	trans	-67	-34.9	176.3	-81	157.3	0	0	0	112.9	R80 T81 L82	R80-L84 PolarHBondContact O-N 2.97Å; T81-L84 PolarHBondContact O-N 3.19Å; L82-L84 VanDerWaalsContact C-N 3.31Å; L82-L84 PolarHBondContact O-N 3.5Å
85	Y	42.6	Very low	52.2	Low	183 Å²	183	126 Å²	126	72%	0.718	61%	0.611	S	S	*	*	H	α-helix	trans	-71.4	-29.8	-180	-84.8	-81.5	0	0	0	113.7	T81 L82 R87 A88	T81-Y85 HydrophobicContact CG2-CE2 4.29Å; T81-Y85 WeakPolarHBondContact O-CD2 3.45Å; L82-Y85 PolarHBondContact O-N 3.44Å; Y85-R87 PolarHBondContact O-N 3.28Å; Y85-A88 PolarHBondContact O-N 3.3Å
86	S	46	Very low	54.6	Low	96 Å²	96	124.8 Å²	124.8	67%	0.671	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	-9.8	-178.9	71.2	0	0	0	0	115	R83	R83-S86 PolarHBondContact O-OG 2.85Å
87	R	44.9	Very low	56.6	Low	225 Å²	225	124.1 Å²	124.1	85%	0.849	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.9	14.1	-178.3	-72.8	-175.5	173.6	174.7	-2.2	114	Y85 S89	Y85-R87 PolarHBondContact O-N 3.28Å; R87-S89 PolarHBondContact O-N 3.47Å
88	A	50.9	Low	58.9	Low	40 Å²	40	125 Å²	125	33%	0.331	59%	0.593	S	S	.	*			trans	-62.7	95.2	175.2	0	0	0	0	0	110.6	Y85 H92	Y85-A88 PolarHBondContact O-N 3.3Å; A88-H92 HydrophobicContact CB-CB 4.31Å
89	S	55.9	Low	61.2	Low	69 Å²	69	118.2 Å²	118.2	48%	0.483	58%	0.58	S	S	.	*			trans	-49.6	148.9	173.4	155.1	0	0	0	0	111.2	R87 R91 H92	R87-S89 PolarHBondContact O-N 3.47Å; S89-R91 PolarHBondContact O-N 3.45Å; S89-R91 PolarHBondContact OG-N 3.37Å; S89-H92 PolarHBondContact O-N 3.34Å
90	I	71.3	Confident	63.3	Low	149 Å²	149	117.9 Å²	117.9	76%	0.764	58%	0.581	S	S	*	*	H	α-helix	trans	-40.4	-31.3	175.8	-68.3	165	0	0	0	112.7	H92 W93 A94	I90-H92 PolarHBondContact O-N 3.32Å; I90-W93 PolarHBondContact O-N 3.18Å; I90-A94 WeakPolarHBondContact O-CB 3.44Å; I90-A94 PolarHBondContact O-N 2.94Å
91	R	70.4	Confident	65.7	Low	196 Å²	196	115.1 Å²	115.1	74%	0.74	58%	0.579	S	S	*	*	H	α-helix	trans	-58.7	-39.2	175.3	-127.5	177.7	174.7	166.8	-1.8	114.2	S89 A94 L95	S89-R91 PolarHBondContact O-N 3.45Å; S89-R91 PolarHBondContact OG-N 3.37Å; R91-A94 PolarHBondContact O-N 3.45Å; R91-L95 PolarHBondContact O-N 3.39Å
92	H	75.5	Confident	67.6	Low	122 Å²	122	119.3 Å²	119.3	57%	0.565	59%	0.593	S	S	*	*	H	α-helix	trans	-71.5	-37.6	178.6	-65.8	91	0	0	0	111.7	A88 S89 I90 L95 F96	A88-H92 HydrophobicContact CB-CB 4.31Å; S89-H92 PolarHBondContact O-N 3.34Å; I90-H92 PolarHBondContact O-N 3.32Å; H92-L95 PolarHBondContact O-N 3.44Å; H92-F96 WeakPolarHBondContact O-CB 3.44Å; H92-F96 PolarHBondContact O-N 3.12Å
93	W	79.8	Confident	69.3	Low	167 Å²	167	115 Å²	115	63%	0.633	58%	0.577	S	S	*	*	H	α-helix	trans	-67.9	-36.7	173.1	-78.3	109.3	0	0	0	112.1	I90 F96 T97	I90-W93 PolarHBondContact O-N 3.18Å; W93-F96 HydrophobicContact CE3-CD1 4.37Å; W93-F96 HydrophobicContact CZ3-CD1 4.29Å; W93-F96 PolarHBondContact O-N 3.23Å; W93-T97 WeakPolarHBondContact O-CB 3.4Å; W93-T97 WeakPolarHBondContact O-CG2 3.41Å; W93-T97 PolarHBondContact O-N 2.81Å; W93-T97 PolarHBondContact O-OG1 3.18Å
94	A	79.2	Confident	71.5	Confident	44 Å²	44	115.2 Å²	115.2	36%	0.364	58%	0.579	S	S	.	*	H	α-helix	trans	-64.4	-44.5	173	0	0	0	0	0	112.1	I90 R91 T97 V98	I90-A94 WeakPolarHBondContact O-CB 3.44Å; I90-A94 PolarHBondContact O-N 2.94Å; R91-A94 PolarHBondContact O-N 3.45Å; A94-T97 WeakPolarHBondContact CA-OG1 3.28Å; A94-T97 PolarHBondContact O-N 2.93Å; A94-T97 PolarHBondContact O-OG1 2.8Å; A94-V98 WeakPolarHBondContact O-CB 3.48Å; A94-V98 VanDerWaalsContact O-CG2 3.23Å; A94-V98 WeakPolarHBondContact O-CG2 3.23Å; A94-V98 PolarHBondContact O-N 2.79Å
95	L	81.9	Confident	73.3	Confident	123 Å²	123	115.6 Å²	115.6	64%	0.644	58%	0.575	S	S	*	*	H	α-helix	trans	-63.6	-41	175.8	-92.9	144.2	0	0	0	112.6	R91 H92 G99	R91-L95 PolarHBondContact O-N 3.39Å; H92-L95 PolarHBondContact O-N 3.44Å; L95-G99 PolarHBondContact O-N 2.9Å
96	F	82.4	Confident	75	Confident	129 Å²	129	112.2 Å²	112.2	57%	0.566	57%	0.565	S	S	*	*	H	α-helix	trans	-63.8	-45.8	176.2	-178.7	-100	0	0	0	111.8	H92 W93 G99 V100	H92-F96 WeakPolarHBondContact O-CB 3.44Å; H92-F96 PolarHBondContact O-N 3.12Å; W93-F96 HydrophobicContact CE3-CD1 4.37Å; W93-F96 HydrophobicContact CZ3-CD1 4.29Å; W93-F96 PolarHBondContact O-N 3.23Å; F96-G99 PolarHBondContact O-N 3.38Å; F96-V100 HydrophobicContact CD1-CG2 4.32Å; F96-V100 HydrophobicContact CE1-CG2 3.93Å; F96-V100 HydrophobicContact CE2-CG2 4.41Å; F96-V100 HydrophobicContact CZ-CG2 3.98Å; F96-V100 WeakPolarHBondContact O-CG2 3.42Å; F96-V100 PolarHBondContact O-N 3.45Å
97	T	81.8	Confident	76.6	Confident	71 Å²	71	111.1 Å²	111.1	44%	0.436	55%	0.554	S	S	.	*	H	α-helix	trans	-66.8	-39.8	178.8	45.4	0	0	0	0	112.4	W93 A94 G99 V100 L101	W93-T97 WeakPolarHBondContact O-CB 3.4Å; W93-T97 WeakPolarHBondContact O-CG2 3.41Å; W93-T97 PolarHBondContact O-N 2.81Å; W93-T97 PolarHBondContact O-OG1 3.18Å; A94-T97 WeakPolarHBondContact CA-OG1 3.28Å; A94-T97 PolarHBondContact O-N 2.93Å; A94-T97 PolarHBondContact O-OG1 2.8Å; T97-G99 VanDerWaalsContact C-N 3.33Å; T97-G99 PolarHBondContact O-N 3.15Å; T97-V100 PolarHBondContact O-N 3.22Å; T97-L101 WeakPolarHBondContact O-CB 3.4Å; T97-L101 VanDerWaalsContact O-CG 3.31Å; T97-L101 WeakPolarHBondContact O-CG 3.46Å; T97-L101 PolarHBondContact O-N 3.39Å
98	V	87	Confident	78.2	Confident	95 Å²	95	103.2 Å²	103.2	58%	0.576	53%	0.528	S	S	*	.	H	α-helix	trans	-61.2	-42	171.6	170.9	0	0	0	0	111.2	A94 L101 F102	A94-V98 WeakPolarHBondContact O-CB 3.48Å; A94-V98 VanDerWaalsContact O-CG2 3.23Å; A94-V98 WeakPolarHBondContact O-CG2 3.23Å; A94-V98 PolarHBondContact O-N 2.79Å; V98-L101 PolarHBondContact O-N 3.29Å; V98-F102 VanDerWaalsContact O-CB 3.3Å; V98-F102 WeakPolarHBondContact O-CB 3.36Å; V98-F102 PolarHBondContact O-N 3.15Å
99	G	82.8	Confident	79.3	Confident	43 Å²	43	104.5 Å²	104.5	44%	0.443	53%	0.534	S	S	.	.	H	α-helix	trans	-63.3	-41.1	176.9	0	0	0	0	0	113.4	L95 F96 T97 G103	L95-G99 PolarHBondContact O-N 2.9Å; F96-G99 PolarHBondContact O-N 3.38Å; T97-G99 VanDerWaalsContact C-N 3.33Å; T97-G99 PolarHBondContact O-N 3.15Å; G99-G103 PolarHBondContact O-N 2.99Å
100	V	86.6	Confident	80.2	Confident	81 Å²	81	106.3 Å²	106.3	49%	0.491	54%	0.536	S	S	.	.	H	α-helix	trans	-67.5	-43	175.9	172.7	0	0	0	0	111.3	F96 T97 G103 Y104	F96-V100 HydrophobicContact CD1-CG2 4.32Å; F96-V100 HydrophobicContact CE1-CG2 3.93Å; F96-V100 HydrophobicContact CE2-CG2 4.41Å; F96-V100 HydrophobicContact CZ-CG2 3.98Å; F96-V100 WeakPolarHBondContact O-CG2 3.42Å; F96-V100 PolarHBondContact O-N 3.45Å; T97-V100 PolarHBondContact O-N 3.22Å; V100-G103 PolarHBondContact O-N 3.35Å; V100-Y104 WeakPolarHBondContact O-CB 3.3Å; V100-Y104 PolarHBondContact O-N 3.47Å
101	L	89	Confident	80	Confident	116 Å²	116	106.6 Å²	106.6	61%	0.607	53%	0.534	S	S	*	.	H	α-helix	trans	-64.8	-41.4	176.8	-71.9	172.1	0	0	0	111.7	T97 V98 Y104 F105	T97-L101 WeakPolarHBondContact O-CB 3.4Å; T97-L101 VanDerWaalsContact O-CG 3.31Å; T97-L101 WeakPolarHBondContact O-CG 3.46Å; T97-L101 PolarHBondContact O-N 3.39Å; V98-L101 PolarHBondContact O-N 3.29Å; L101-Y104 PolarHBondContact O-N 3.44Å; L101-F105 WeakPolarHBondContact O-CB 3.23Å; L101-F105 PolarHBondContact O-N 3.48Å
102	F	85.9	Confident	79.4	Confident	147 Å²	147	103.9 Å²	103.9	65%	0.645	53%	0.533	S	S	*	.	H	α-helix	trans	-63.5	-44.2	175.1	-173.2	-94.8	0	0	0	111.6	V98 Y104 F105 F106	V98-F102 VanDerWaalsContact O-CB 3.3Å; V98-F102 WeakPolarHBondContact O-CB 3.36Å; V98-F102 PolarHBondContact O-N 3.15Å; F102-Y104 PolarHBondContact O-N 3.39Å; F102-F105 PolarHBondContact O-N 3.22Å; F102-F106 VanDerWaalsContact O-CB 3.23Å; F102-F106 WeakPolarHBondContact O-CB 3.38Å; F102-F106 PolarHBondContact O-N 2.82Å
103	G	79.6	Confident	78.5	Confident	31 Å²	31	101.6 Å²	101.6	32%	0.32	53%	0.531	S	S	.	.	H	α-helix	trans	-60.2	-44.9	175.1	0	0	0	0	0	112.4	G99 V100 F106 T107	G99-G103 PolarHBondContact O-N 2.99Å; V100-G103 PolarHBondContact O-N 3.35Å; G103-F106 PolarHBondContact O-N 2.84Å; G103-T107 PolarHBondContact O-N 2.87Å; G103-T107 PolarHBondContact O-OG1 3.35Å
104	Y	84.2	Confident	77.1	Confident	158 Å²	158	99 Å²	99	62%	0.62	54%	0.536	S	S	*	.	H	α-helix	trans	-64.1	-44.3	177.5	-169.3	-104.5	0	0	0	112.1	V100 L101 F102 T107 I108	V100-Y104 WeakPolarHBondContact O-CB 3.3Å; V100-Y104 PolarHBondContact O-N 3.47Å; L101-Y104 PolarHBondContact O-N 3.44Å; F102-Y104 PolarHBondContact O-N 3.39Å; Y104-T107 PolarHBondContact O-N 2.91Å; Y104-I108 HydrophobicContact CD1-CD1 3.62Å; Y104-I108 HydrophobicContact CE1-CD1 3.21Å; Y104-I108 HydrophobicContact CE1-CG1 4.33Å; Y104-I108 HydrophobicContact CE2-CD1 4.48Å; Y104-I108 HydrophobicContact CG-CD1 4.42Å; Y104-I108 WeakPolarHBondContact O-CG1 3.47Å; Y104-I108 PolarHBondContact O-N 2.87Å
105	F	81.4	Confident	75.5	Confident	142 Å²	142	105.4 Å²	105.4	62%	0.623	56%	0.558	S	S	*	*	H	α-helix	trans	-65	-40.8	176.3	-124	-87.2	0	0	0	112	L101 F102 T107 I108 C109	L101-F105 WeakPolarHBondContact O-CB 3.23Å; L101-F105 PolarHBondContact O-N 3.48Å; F102-F105 PolarHBondContact O-N 3.22Å; F105-T107 PolarHBondContact O-N 2.84Å; F105-I108 PolarHBondContact O-N 3.01Å; F105-C109 WeakPolarHBondContact O-CB 3.48Å; F105-C109 PolarHBondContact O-N 2.86Å; F105-C109 PolarHBondContact O-SG 3.38Å; F105-C109 VanDerWaalsContact O-SG 3.35Å
106	F	79.6	Confident	73.6	Confident	112 Å²	112	106.9 Å²	106.9	49%	0.491	57%	0.566	S	S	.	*	H	α-helix	trans	-61.7	-44	176.8	-175.4	-96	0	0	0	111.5	F102 G103 C109 M110	F102-F106 VanDerWaalsContact O-CB 3.23Å; F102-F106 WeakPolarHBondContact O-CB 3.38Å; F102-F106 PolarHBondContact O-N 2.82Å; G103-F106 PolarHBondContact O-N 2.84Å; F106-C109 PolarHBondContact O-N 3.18Å; F106-M110 HydrophobicContact CD1-CG 4.31Å; F106-M110 HydrophobicContact CE1-CE 3.91Å; F106-M110 HydrophobicContact CE1-CG 4.05Å; F106-M110 HydrophobicContact CE2-CE 3.77Å; F106-M110 HydrophobicContact CZ-CE 3.31Å; F106-M110 HydrophobicContact CZ-CG 4.33Å; F106-M110 WeakPolarHBondContact O-CB 3.42Å; F106-M110 VanDerWaalsContact O-CG 3.28Å; F106-M110 WeakPolarHBondContact O-CG 3.39Å; F106-M110 PolarHBondContact O-N 3.49Å
107	T	77.9	Confident	71.4	Confident	74 Å²	74	108.5 Å²	108.5	45%	0.454	58%	0.579	S	S	.	*	H	α-helix	trans	-65.3	-38.5	175.9	-53.1	0	0	0	0	112.2	G103 Y104 F105 M110 H111	G103-T107 PolarHBondContact O-N 2.87Å; G103-T107 PolarHBondContact O-OG1 3.35Å; Y104-T107 PolarHBondContact O-N 2.91Å; F105-T107 PolarHBondContact O-N 2.84Å; T107-M110 PolarHBondContact O-N 3.45Å; T107-H111 PolarHBondContact O-CD2 2.68Å; T107-H111 PolarHBondContact O-N 2.95Å; T107-H111 VanDerWaalsContact O-N 3.11Å
108	I	79	Confident	69.1	Low	58 Å²	58	113.3 Å²	113.3	30%	0.297	60%	0.602	S	S	.	*	H	α-helix	trans	-66.6	-45.6	175.3	-73.7	178.2	0	0	0	111.2	Y104 F105 M110 H111 L112	Y104-I108 HydrophobicContact CD1-CD1 3.62Å; Y104-I108 HydrophobicContact CE1-CD1 3.21Å; Y104-I108 HydrophobicContact CE1-CG1 4.33Å; Y104-I108 HydrophobicContact CE2-CD1 4.48Å; Y104-I108 HydrophobicContact CG-CD1 4.42Å; Y104-I108 WeakPolarHBondContact O-CG1 3.47Å; Y104-I108 PolarHBondContact O-N 2.87Å; F105-I108 PolarHBondContact O-N 3.01Å; I108-M110 VanDerWaalsContact C-N 3.31Å; I108-M110 PolarHBondContact O-N 3.36Å; I108-H111 PolarHBondContact O-N 3.35Å; I108-L112 HydrophobicContact CG2-CD1 3.42Å; I108-L112 VanDerWaalsContact CG2-CD1 3.42Å; I108-L112 PolarHBondContact O-N 3.14Å
109	C	75.1	Confident	66.4	Low	67 Å²	67	114.6 Å²	114.6	45%	0.453	61%	0.614	S	S	.	*	H	α-helix	trans	-59.9	-41.9	176	-74.6	0	0	0	0	111.5	F105 F106 H111 L112 S113	F105-C109 WeakPolarHBondContact O-CB 3.48Å; F105-C109 PolarHBondContact O-N 2.86Å; F105-C109 PolarHBondContact O-SG 3.38Å; F105-C109 VanDerWaalsContact O-SG 3.35Å; F106-C109 PolarHBondContact O-N 3.18Å; C109-H111 PolarHBondContact O-N 3.1Å; C109-L112 PolarHBondContact O-N 2.93Å; C109-S113 PolarHBondContact O-N 3.22Å; C109-S113 PolarHBondContact O-OG 3.15Å; C109-S113 VanDerWaalsContact O-OG 3.1Å
110	M	73.3	Confident	64.2	Low	107 Å²	107	118.9 Å²	118.9	53%	0.527	63%	0.631	S	S	.	*	H	α-helix	trans	-64.5	-27.6	175.1	-73.6	-66.3	-177.9	0	0	113.2	F106 T107 I108	F106-M110 HydrophobicContact CD1-CG 4.31Å; F106-M110 HydrophobicContact CE1-CE 3.91Å; F106-M110 HydrophobicContact CE1-CG 4.05Å; F106-M110 HydrophobicContact CE2-CE 3.77Å; F106-M110 HydrophobicContact CZ-CE 3.31Å; F106-M110 HydrophobicContact CZ-CG 4.33Å; F106-M110 WeakPolarHBondContact O-CB 3.42Å; F106-M110 VanDerWaalsContact O-CG 3.28Å; F106-M110 WeakPolarHBondContact O-CG 3.39Å; F106-M110 PolarHBondContact O-N 3.49Å; T107-M110 PolarHBondContact O-N 3.45Å; I108-M110 VanDerWaalsContact C-N 3.31Å; I108-M110 PolarHBondContact O-N 3.36Å
111	H	68.8	Low	61.5	Low	155 Å²	155	120.8 Å²	120.8	72%	0.718	65%	0.645	S	S	*	*	H	α-helix	trans	-87.1	-26.2	177.1	-89.3	-55.1	0	0	0	114.7	T107 I108 C109	T107-H111 PolarHBondContact O-CD2 2.68Å; T107-H111 PolarHBondContact O-N 2.95Å; T107-H111 VanDerWaalsContact O-N 3.11Å; I108-H111 PolarHBondContact O-N 3.35Å; C109-H111 PolarHBondContact O-N 3.1Å
112	L	56.2	Low	58.6	Low	139 Å²	139	123.5 Å²	123.5	73%	0.728	66%	0.655	S	S	*	*	H	α-helix	trans	-94.5	-5.6	-176.3	-88.5	135.5	0	0	0	115.1	I108 C109	I108-L112 HydrophobicContact CG2-CD1 3.42Å; I108-L112 VanDerWaalsContact CG2-CD1 3.42Å; I108-L112 PolarHBondContact O-N 3.14Å; C109-L112 PolarHBondContact O-N 2.93Å
113	S	57.6	Low	56	Low	75 Å²	75	120 Å²	120	52%	0.524	65%	0.654	S	S	.	*			trans	-123.7	79.8	172.7	61.6	0	0	0	0	112.1	C109 Q115	C109-S113 PolarHBondContact O-N 3.22Å; C109-S113 PolarHBondContact O-OG 3.15Å; C109-S113 VanDerWaalsContact O-OG 3.1Å; S113-Q115 PolarHBondContact O-N 3.2Å
114	P	50	Low	53.4	Low	111 Å²	111	124.9 Å²	124.9	72%	0.721	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	26.7	-174.4	32.4	-34.7	0	0	0	114.5
115	Q	45.7	Very low	50.7	Low	180 Å²	180	127.1 Å²	127.1	84%	0.841	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.5	11.5	-173.5	-69.6	-171.5	-4.6	0	0	116.4	S113	S113-Q115 PolarHBondContact O-N 3.2Å
116	L	41.9	Very low	48.2	Very low	154 Å²	154	128.3 Å²	128.3	81%	0.806	69%	0.688	S	S	*	*	S	Bend	trans	-127.3	11.7	-177.2	-133.6	83.8	0	0	0	118.8
117	L	37.2	Very low	45.8	Very low	162 Å²	162	129.2 Å²	129.2	85%	0.848	70%	0.703	S	S	*	*			trans	-144.5	50.1	171.6	-92.3	116.1	0	0	0	113.7
118	L	33.2	Very low	43.4	Very low	172 Å²	172	130.2 Å²	130.2	90%	0.901	71%	0.713	S	S	*	*			trans	-110.3	76.6	156.7	-85.9	161.2	0	0	0	108.1
119	C	29.5	Very low	41	Very low	123 Å²	123	133 Å²	133	83%	0.831	74%	0.738	S	S	*	*			trans	-158.7	72.2	166.2	-92.1	0	0	0	0	108.2
120	T	35.8	Very low	38.9	Very low	132 Å²	132	136 Å²	136	81%	0.81	75%	0.754	S	S	*	*			trans	-86	118.2	150.7	49.8	0	0	0	0	106.2	E122	T120-E122 PolarHBondContact O-N 2.73Å
121	P	30.7	Very low	36.7	Very low	121 Å²	121	140 Å²	140	79%	0.786	77%	0.768	S	S	*	*			trans	-65.4	121.8	179.8	21.4	-22.2	0	0	0	108.4	A123	P121-A123 VanDerWaalsContact C-N 3.34Å; P121-A123 PolarHBondContact O-N 3.33Å
122	E	27.9	Very low	34.9	Very low	173 Å²	173	140.1 Å²	140.1	81%	0.808	77%	0.773	S	S	*	*			trans	-53.2	105.2	157.7	-74.5	178	155.7	0	0	106.7	T120 N124	T120-E122 PolarHBondContact O-N 2.73Å; E122-N124 PolarHBondContact O-N 3.15Å
123	A	30.8	Very low	33.5	Very low	75 Å²	75	144.7 Å²	144.7	62%	0.62	78%	0.781	S	S	*	*			trans	-66.1	90.1	169.3	0	0	0	0	0	106.8	P121 Y125	P121-A123 VanDerWaalsContact C-N 3.34Å; P121-A123 PolarHBondContact O-N 3.33Å; A123-Y125 HydrophobicContact CB-CD2 4.31Å; A123-Y125 HydrophobicContact CB-CE2 4.2Å; A123-Y125 PolarHBondContact O-N 2.76Å
124	N	25.4	Very low	32	Very low	133 Å²	133	144 Å²	144	71%	0.711	79%	0.786	S	S	*	*			trans	-57	88.4	159.7	-84	-31.6	0	0	0	107.1	E122 H126	E122-N124 PolarHBondContact O-N 3.15Å; N124-H126 PolarHBondContact O-N 2.68Å
125	Y	28.4	Very low	31	Very low	204 Å²	204	146.7 Å²	146.7	80%	0.8	79%	0.788	S	S	*	*			trans	-65.2	87.8	158.4	-82.4	-82.9	0	0	0	106.4	A123 T127	A123-Y125 HydrophobicContact CB-CD2 4.31Å; A123-Y125 HydrophobicContact CB-CE2 4.2Å; A123-Y125 PolarHBondContact O-N 2.76Å; Y125-T127 PolarHBondContact O-N 2.96Å
126	H	27.5	Very low	30.2	Very low	167 Å²	167	147.1 Å²	147.1	77%	0.773	79%	0.79	S	S	*	*			trans	-52.6	99.8	146.5	-82.3	-75.2	0	0	0	105.8	N124 S128	N124-H126 PolarHBondContact O-N 2.68Å; H126-S128 PolarHBondContact O-N 2.66Å
127	T	29.5	Very low	30	Very low	131 Å²	131	146.2 Å²	146.2	80%	0.804	79%	0.79	S	S	*	*			trans	-60.1	85.3	160.3	40.7	0	0	0	0	106.6	Y125 S129	Y125-T127 PolarHBondContact O-N 2.96Å; T127-S129 PolarHBondContact O-N 3.28Å; T127-S129 VanDerWaalsContact O-N 3.15Å
128	S	29	Very low	29.8	Very low	96 Å²	96	146.7 Å²	146.7	67%	0.671	79%	0.788	S	S	*	*			trans	-52.5	120.4	153.6	-48	0	0	0	0	105	H126 V130	H126-S128 PolarHBondContact O-N 2.66Å; S128-V130 PolarHBondContact O-N 3.46Å
129	S	27.9	Very low	30.1	Very low	116 Å²	116	144.5 Å²	144.5	81%	0.811	78%	0.784	S	S	*	*			trans	-57.4	78.9	176.3	42.7	0	0	0	0	110	T127 K131	T127-S129 PolarHBondContact O-N 3.28Å; T127-S129 VanDerWaalsContact O-N 3.15Å; S129-K131 VanDerWaalsContact C-N 3.33Å; S129-K131 PolarHBondContact O-N 2.68Å
130	V	31.2	Very low	30.7	Very low	131 Å²	131	144.1 Å²	144.1	79%	0.794	77%	0.773	S	S	*	*			trans	-63.4	105.7	159.9	177.8	0	0	0	0	104	S128 L132	S128-V130 PolarHBondContact O-N 3.46Å; V130-L132 VanDerWaalsContact C-N 3.26Å; V130-L132 PolarHBondContact O-N 3.35Å
131	K	27.1	Very low	31	Very low	189 Å²	189	142.8 Å²	142.8	82%	0.822	76%	0.761	S	S	*	*			trans	-48.4	96.6	172	-83.7	175.7	172.5	175.8	0	107.8	S129 W133	S129-K131 VanDerWaalsContact C-N 3.33Å; S129-K131 PolarHBondContact O-N 2.68Å; K131-W133 PolarHBondContact O-N 2.66Å
132	L	30	Very low	31.7	Very low	158 Å²	158	148 Å²	148	83%	0.827	77%	0.766	S	S	*	*			trans	-60.2	110.5	173.1	-163.9	76.8	0	0	0	104.9	V130 G134	V130-L132 VanDerWaalsContact C-N 3.26Å; V130-L132 PolarHBondContact O-N 3.35Å; L132-G134 PolarHBondContact O-N 3.28Å
133	W	27.7	Very low	32.6	Very low	236 Å²	236	144.4 Å²	144.4	89%	0.894	76%	0.759	S	S	*	*			trans	-61.2	95.7	165.2	-76.2	77.9	0	0	0	105.8	K131 H135	K131-W133 PolarHBondContact O-N 2.66Å; W133-H135 VanDerWaalsContact C-N 3.25Å; W133-H135 PolarHBondContact O-N 3.45Å
134	G	25.6	Very low	33.9	Very low	60 Å²	60	148.7 Å²	148.7	62%	0.619	76%	0.764	S	S	*	*			trans	-66.4	86.2	179.7	0	0	0	0	0	109.2	L132 H136	L132-G134 PolarHBondContact O-N 3.28Å; G134-H136 PolarHBondContact O-N 3.25Å
135	H	29.6	Very low	36.5	Very low	167 Å²	167	148 Å²	148	77%	0.773	77%	0.77	S	S	*	*			trans	-72.7	110.9	147.5	-82.8	-71.9	0	0	0	106.3	W133 V137	W133-H135 VanDerWaalsContact C-N 3.25Å; W133-H135 PolarHBondContact O-N 3.45Å; H135-V137 PolarHBondContact O-N 3.5Å
136	H	28.9	Very low	39.3	Very low	190 Å²	190	141.8 Å²	141.8	88%	0.88	75%	0.745	S	S	*	*			trans	-45.1	104.5	169.3	-80.9	-86.9	0	0	0	109.6	G134 E138	G134-H136 PolarHBondContact O-N 3.25Å; H136-E138 PolarHBondContact O-N 2.87Å
137	V	37.2	Very low	42.5	Very low	135 Å²	135	138.2 Å²	138.2	82%	0.818	72%	0.724	S	S	*	*			trans	-83.4	108.1	161.2	179.9	0	0	0	0	104.9	H135	H135-V137 PolarHBondContact O-N 3.5Å
138	E	33.6	Very low	45.6	Very low	172 Å²	172	132.7 Å²	132.7	80%	0.804	69%	0.69	S	S	*	*			trans	-55.6	142.8	176.1	-80.9	-178.5	152.6	0	0	111.2	H136	H136-E138 PolarHBondContact O-N 2.87Å
139	P	37.8	Very low	48.9	Very low	126 Å²	126	128.2 Å²	128.2	82%	0.818	66%	0.658	S	S	*	*			trans	-63.8	138.8	176.4	-16.9	29.4	0	0	0	112.3	D141	P139-D141 PolarHBondContact O-N 3.02Å
140	L	42.4	Very low	52.3	Low	114 Å²	114	122.7 Å²	122.7	60%	0.597	62%	0.62	S	S	*	*			trans	-61.6	110.1	-179.7	-79.5	133.8	0	0	0	113	R142	L140-R142 PolarHBondContact O-N 3.26Å
141	D	43.4	Very low	55.5	Low	104 Å²	104	116.6 Å²	116.6	56%	0.556	58%	0.583	S	S	*	*			trans	-64.1	112.9	162.3	-178.6	6	0	0	0	109.7	P139 S143	P139-D141 PolarHBondContact O-N 3.02Å; D141-S143 VanDerWaalsContact C-N 3.31Å; D141-S143 WeakPolarHBondContact OD1-CB 3.44Å; D141-S143 PolarHBondContact OD1-N 3.47Å; D141-S143 PolarHBondContact OD1-OG 2.64Å; D141-S143 PolarHBondContact OD2-OG 2.9Å
142	R	43.8	Very low	58.9	Low	232 Å²	232	107.6 Å²	107.6	88%	0.875	54%	0.543	S	S	*	.			trans	-83	-1.2	-179.4	-76.3	-174	176.8	-172.1	-0.3	113.5	L140	L140-R142 PolarHBondContact O-N 3.26Å
143	S	48.8	Very low	62.1	Low	96 Å²	96	100 Å²	100	67%	0.671	50%	0.504	S	S	*	.	S	Bend	trans	-85.6	-15.9	-170.6	74.7	0	0	0	0	115.5	D141	D141-S143 VanDerWaalsContact C-N 3.31Å; D141-S143 WeakPolarHBondContact OD1-CB 3.44Å; D141-S143 PolarHBondContact OD1-N 3.47Å; D141-S143 PolarHBondContact OD1-OG 2.64Å; D141-S143 PolarHBondContact OD2-OG 2.9Å
144	K	56.9	Low	65.3	Low	166 Å²	166	89.6 Å²	89.6	72%	0.722	47%	0.465	S	S	*	.	S	Bend	trans	-97.5	121.3	176.7	-74.4	179.1	179.9	173	0	111.4	R146	K144-R146 PolarHBondContact O-N 3.26Å
145	S	80.8	Confident	68.6	Low	119 Å²	119	87 Å²	87	83%	0.832	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-54.5	126.4	166.4	-173.8	0	0	0	0	109
146	R	85.8	Confident	71.5	Confident	73 Å²	73	79.7 Å²	79.7	28%	0.275	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-71.6	150.9	-179.4	-71.1	-178.5	-177.2	82.4	4	110.2	K144 S225 Q226 E228	K144-R146 PolarHBondContact O-N 3.26Å; R146-S225 WeakPolarHBondContact CD-O 3.42Å; R146-S225 PolarHBondContact NE-O 2.78Å; R146-Q226 WeakPolarHBondContact CA-O 3.49Å; R146-Q226 WeakPolarHBondContact CB-O 3.49Å; R146-E228 HydrophobicContact CB-CG 3.98Å
147	R	94.7	Very high	74.5	Confident	91 Å²	91	74.3 Å²	74.3	34%	0.343	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	154	171.6	-69.6	172.2	64.6	173.4	5.9	109.8	D177 S178 Q226 F227 E228	R147-D177 IonicContact CZ-OD1 3.39Å; R147-D177 IonicContact CZ-OD2 2.83Å; R147-D177 IonicContact NH1-OD1 3.02Å; R147-D177 PolarHBondContact NH1-OD1 3.04Å; R147-D177 IonicContact NH1-OD2 3.73Å; R147-D177 PolarHBondContact NH1-OD2 3.4Å; R147-D177 IonicContact NH2-OD1 3.44Å; R147-D177 PolarHBondContact NH2-OD1 2.78Å; R147-S178 PolarHBondContact NH2-OG 3.15Å; R147-Q226 PolarHBondContact N-O 3.34Å; R147-F227 HydrophobicContact CB-CD1 3.42Å; R147-F227 VanDerWaalsContact CB-CD1 3.42Å; R147-F227 HydrophobicContact CB-CE1 3.34Å; R147-F227 HydrophobicContact CB-CG 4.25Å; R147-F227 HydrophobicContact CB-CZ 4.14Å; R147-F227 HydrophobicContact CG-CE1 4.19Å; R147-F227 CarbonylContact O-C 3.48Å; R147-F227 VanDerWaalsContact O-CA 3.22Å; R147-F227 WeakPolarHBondContact O-CA 3.29Å; R147-E228 PolarHBondContact O-N 2.97Å
148	L	96.4	Very high	77.1	Confident	16 Å²	16	75.1 Å²	75.1	8%	0.084	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	-54.9	-171.5	-174.7	68.7	0	0	0	112.7	E228 W229 E245 L248 R249	L148-E228 PolarHBondContact O-N 2.97Å; L148-W229 WeakPolarHBondContact O-CB 3.06Å; L148-W229 PolarHBondContact O-N 3.46Å; L148-E245 HydrophobicContact CD2-CB 3.52Å; L148-E245 HydrophobicContact CD2-CG 3.63Å; L148-L248 HydrophobicContact CD1-CB 4.48Å; L148-R249 HydrophobicContact CD1-CG 4.14Å; L148-R249 HydrophobicContact CD2-CG 3.71Å
149	L	98.1	Very high	80	Confident	2 Å²	2	70 Å²	70	1%	0.01	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	129.8	-167.6	-179.4	64.4	0	0	0	112.4	V151 S178 F227 W229 L231 L244 L248	L149-V151 HydrophobicContact CD1-CG2 4.45Å; L149-V151 HydrophobicContact CD2-CG2 3.86Å; L149-V151 HydrophobicContact CG-CG2 3.84Å; L149-S178 WeakPolarHBondContact O-CB 3.3Å; L149-S178 PolarHBondContact O-OG 2.79Å; L149-F227 WeakPolarHBondContact O-CD1 3.47Å; L149-F227 VanDerWaalsContact O-CE1 3.27Å; L149-F227 WeakPolarHBondContact O-CE1 3.38Å; L149-W229 WeakPolarHBondContact CA-O 3Å; L149-W229 HydrophobicContact CD1-CB 3.95Å; L149-L231 HydrophobicContact CD1-CB 4.03Å; L149-L244 HydrophobicContact CD2-CD2 3.74Å; L149-L244 HydrophobicContact CD2-CG 4.3Å; L149-L248 HydrophobicContact CD1-CD1 3.95Å; L149-L248 HydrophobicContact CD2-CD1 4.46Å
150	F	98.4	Very high	82.6	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	134.6	164	-173.9	-87.4	0	0	0	109.5	V180 M219 H223 F227 W229 F230 L231	F150-V180 HydrophobicContact CE2-CG2 4.14Å; F150-V180 HydrophobicContact CZ-CB 4Å; F150-V180 HydrophobicContact CZ-CG2 3.67Å; F150-M219 HydrophobicContact CD1-CB 4.47Å; F150-M219 HydrophobicContact CD1-CE 3.61Å; F150-M219 HydrophobicContact CD1-CG 4.09Å; F150-M219 HydrophobicContact CE1-CB 4.41Å; F150-M219 HydrophobicContact CE1-CE 4.03Å; F150-M219 HydrophobicContact CE1-CG 3.75Å; F150-H223 HydrophobicContact CD2-CB 4.05Å; F150-H223 AromaticContact CD2-CG 3.85Å; F150-H223 HydrophobicContact CE2-CB 4.21Å; F150-H223 AromaticContact CE2-CD2 3.38Å; F150-H223 WeakPolarHBondContact CE2-CD2 3.41Å; F150-H223 AromaticContact CE2-CE1 3.76Å; F150-H223 AromaticContact CE2-CG 3.54Å; F150-H223 AromaticContact CE2-ND1 3.78Å; F150-H223 AromaticContact CE2-NE2 3.55Å; F150-H223 HydrophobicContact CG-CB 4.39Å; F150-H223 AromaticContact CZ-CD2 3.41Å; F150-H223 VanDerWaalsContact CZ-CD2 3.41Å; F150-H223 WeakPolarHBondContact CZ-CD2 3.34Å; F150-H223 AromaticContact CZ-NE2 3.66Å; F150-F227 HydrophobicContact CB-CB 4.04Å; F150-F227 HydrophobicContact CB-CD1 3.87Å; F150-F227 HydrophobicContact CB-CD2 3.87Å; F150-F227 HydrophobicContact CB-CE1 4.25Å; F150-F227 HydrophobicContact CB-CE2 4.25Å; F150-F227 HydrophobicContact CB-CG 3.66Å; F150-F227 HydrophobicContact CB-CZ 4.42Å; F150-F227 AromaticContact CD2-CD2 3.98Å; F150-F227 HydrophobicContact CD2-CD2 3.98Å; F150-F227 AromaticContact CD2-CE2 3.63Å; F150-F227 HydrophobicContact CD2-CE2 3.63Å; F150-F227 AromaticContact CD2-CZ 3.92Å; F150-F227 HydrophobicContact CD2-CZ 3.92Å; F150-F227 HydrophobicContact CG-CD2 4.31Å; F150-F227 HydrophobicContact CG-CE2 4.38Å; F150-W229 PolarHBondContact N-O 3.23Å; F150-F230 HydrophobicContact CB-CD1 3.78Å; F150-F230 HydrophobicContact CB-CE1 3.93Å; F150-F230 HydrophobicContact CD1-CD1 4.08Å; F150-F230 HydrophobicContact CD1-CE1 4.48Å; F150-F230 HydrophobicContact CG-CD1 4.22Å; F150-F230 HydrophobicContact CG-CE1 4.32Å; F150-F230 CarbonylContact O-C 3.56Å; F150-F230 WeakPolarHBondContact O-CA 3.35Å; F150-L231 PolarHBondContact O-N 3.34Å
151	V	98.4	Very high	84.9	Confident	2 Å²	2	62.8 Å²	62.8	1%	0.012	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	119.4	-178	-176.1	0	0	0	0	109.5	L149 V153 W171 L175 S178 L179 V180 L231 A233	L149-V151 HydrophobicContact CD1-CG2 4.45Å; L149-V151 HydrophobicContact CD2-CG2 3.86Å; L149-V151 HydrophobicContact CG-CG2 3.84Å; V151-V153 HydrophobicContact CG1-CG2 4.27Å; V151-W171 HydrophobicContact CG1-CH2 4.18Å; V151-W171 HydrophobicContact CG1-CZ3 4.18Å; V151-L175 HydrophobicContact CB-CD1 3.9Å; V151-L175 HydrophobicContact CG1-CD1 4.36Å; V151-L175 HydrophobicContact CG2-CD1 3.57Å; V151-L175 HydrophobicContact CG2-CD2 3.94Å; V151-L175 HydrophobicContact CG2-CG 4.42Å; V151-S178 PolarHBondContact N-O 3.18Å; V151-L179 HydrophobicContact CB-CD1 4.06Å; V151-L179 HydrophobicContact CG1-CD1 3.87Å; V151-L179 WeakPolarHBondContact O-CA 3.47Å; V151-V180 PolarHBondContact O-N 2.85Å; V151-L231 HydrophobicContact CG1-CB 4.38Å; V151-L231 HydrophobicContact CG1-CD2 3.91Å; V151-L231 HydrophobicContact CG1-CG 4.22Å; V151-L231 HydrophobicContact CG2-CB 4.2Å; V151-L231 HydrophobicContact CG2-CD2 4.12Å; V151-A233 HydrophobicContact CG1-CB 4.37Å
152	G	98	Very high	87.3	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	126.9	167.4	0	0	0	0	0	109.6	V180 M215 L231 A233	G152-V180 CarbonylContact C-O 3.56Å; G152-V180 WeakPolarHBondContact CA-O 3.49Å; G152-M215 WeakPolarHBondContact O-CE 3.44Å; G152-L231 PolarHBondContact N-O 3.45Å; G152-A233 PolarHBondContact O-N 3.26Å
153	V	97.5	Very high	89.7	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	117.7	173.9	177.2	0	0	0	0	108.8	V151 I167 W171 L179 V180 F181 F182 A233 D235	V151-V153 HydrophobicContact CG1-CG2 4.27Å; V153-I167 HydrophobicContact CG1-CD1 3.91Å; V153-I167 HydrophobicContact CG2-CD1 4.41Å; V153-W171 HydrophobicContact CG2-CH2 4.01Å; V153-W171 HydrophobicContact CG2-CZ2 4.49Å; V153-L179 HydrophobicContact CG2-CD1 3.64Å; V153-V180 PolarHBondContact N-O 2.87Å; V153-F181 HydrophobicContact CB-CD1 3.6Å; V153-F181 HydrophobicContact CB-CE1 3.79Å; V153-F181 HydrophobicContact CB-CG 4.43Å; V153-F181 HydrophobicContact CG1-CD1 3.67Å; V153-F181 HydrophobicContact CG1-CE1 3.75Å; V153-F181 HydrophobicContact CG2-CD1 4.37Å; V153-F181 HydrophobicContact CG2-CE1 4.1Å; V153-F181 CarbonylContact O-C 3.54Å; V153-F181 WeakPolarHBondContact O-CA 3.49Å; V153-F182 PolarHBondContact O-N 2.73Å; V153-A233 CarbonylContact C-O 3.51Å; V153-A233 WeakPolarHBondContact CA-O 3.2Å; V153-A233 HydrophobicContact CG2-CB 4.1Å; V153-D235 HydrophobicContact CG1-CB 4.24Å
154	M	95.1	Very high	91.9	Very high	16 Å²	16	45.4 Å²	45.4	8%	0.079	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	122.9	173.5	-165.4	-178.6	72.6	0	0	109.2	P208 K211 M215 A233 D235	M154-P208 HydrophobicContact CE-CB 3.81Å; M154-P208 HydrophobicContact CE-CG 3.5Å; M154-P208 VanDerWaalsContact CE-CG 3.5Å; M154-P208 HydrophobicContact SD-CB 3.92Å; M154-P208 HydrophobicContact SD-CG 4.17Å; M154-K211 HydrophobicContact CG-CD 3.42Å; M154-K211 VanDerWaalsContact CG-CD 3.42Å; M154-K211 HydrophobicContact CG-CG 3.95Å; M154-K211 HydrophobicContact SD-CB 4.21Å; M154-K211 HydrophobicContact SD-CD 3.84Å; M154-K211 HydrophobicContact SD-CG 4.05Å; M154-M215 HydrophobicContact CB-SD 3.87Å; M154-M215 HydrophobicContact CG-SD 4.33Å; M154-A233 PolarHBondContact N-O 2.87Å; M154-D235 PolarHBondContact O-N 3.06Å
155	T	94.1	Very high	93.7	Very high	6 Å²	6	40.9 Å²	40.9	4%	0.037	20%	0.202	C	C	.	.			trans	-143	-175.8	-179.7	-167.1	0	0	0	0	110.9	Y159 L160 F181 F182 V183 K211 D235	T155-Y159 WeakPolarHBondContact OG1-CB 3.4Å; T155-L160 HydrophobicContact CG2-CD2 3.72Å; T155-F181 HydrophobicContact CG2-CB 4.34Å; T155-F181 HydrophobicContact CG2-CD1 4.3Å; T155-F182 PolarHBondContact N-O 2.66Å; T155-V183 HydrophobicContact CG2-CG1 3.56Å; T155-K211 PolarHBondContact O-NZ 2.86Å; T155-D235 WeakPolarHBondContact CB-OD2 3.48Å; T155-D235 WeakPolarHBondContact OG1-CB 3.41Å; T155-D235 PolarHBondContact OG1-OD2 2.79Å
156	A	92.2	Very high	94.3	Very high	14 Å²	14	35.3 Å²	35.3	12%	0.116	16%	0.163	C	C	.	.			trans	-130.4	158.5	174.5	0	0	0	0	0	109.6	K158 Y159 D204	A156-K158 HydrophobicContact CB-CG 4.43Å; A156-K158 PolarHBondContact O-N 2.8Å; A156-K158 VanDerWaalsContact O-N 3.07Å; A156-Y159 HydrophobicContact CB-CD2 4.27Å; A156-Y159 PolarHBondContact O-N 3.01Å; A156-D204 WeakPolarHBondContact CA-OD2 3.38Å; A156-D204 HydrophobicContact CB-CB 4.14Å
157	Q	91.7	Very high	94.9	Very high	77 Å²	77	31.8 Å²	31.8	36%	0.36	15%	0.15	S	C	.	.	G	3₁₀ helix	trans	-46.6	-44.9	-177.7	-177.9	173.4	-14.5	0	0	113.5	Y159 L160 A187 T188 D204	Q157-Y159 PolarHBondContact O-N 2.85Å; Q157-Y159 VanDerWaalsContact O-N 3.11Å; Q157-L160 WeakPolarHBondContact O-CB 3.43Å; Q157-L160 PolarHBondContact O-N 3.07Å; Q157-A187 HydrophobicContact CB-CB 3.97Å; Q157-A187 HydrophobicContact CG-CB 4.38Å; Q157-T188 WeakPolarHBondContact CG-O 3.18Å; Q157-T188 PolarHBondContact NE2-O 3.15Å; Q157-T188 PolarHBondContact NE2-OG1 3.4Å; Q157-D204 PolarHBondContact N-OD2 3.37Å
158	K	91.7	Very high	94.9	Very high	152 Å²	152	30.3 Å²	30.3	66%	0.661	15%	0.147	S	C	*	.	G	3₁₀ helix	trans	-62.9	-16.3	-179.1	65.8	-179.1	175.3	174.5	0	115.2	A156	A156-K158 HydrophobicContact CB-CG 4.43Å; A156-K158 PolarHBondContact O-N 2.8Å; A156-K158 VanDerWaalsContact O-N 3.07Å
159	Y	93.5	Very high	94.8	Very high	65 Å²	65	35.3 Å²	35.3	26%	0.255	17%	0.168	S	C	.	.	G	3₁₀ helix	trans	-106.8	-0.4	-178.1	-61.8	-50.3	0	0	0	113.4	T155 A156 Q157 S162 R163 A164 D235	T155-Y159 WeakPolarHBondContact OG1-CB 3.4Å; A156-Y159 HydrophobicContact CB-CD2 4.27Å; A156-Y159 PolarHBondContact O-N 3.01Å; Q157-Y159 PolarHBondContact O-N 2.85Å; Q157-Y159 VanDerWaalsContact O-N 3.11Å; Y159-S162 PolarHBondContact O-N 3.24Å; Y159-S162 PolarHBondContact O-OG 3.16Å; Y159-R163 HydrophobicContact CD1-CG 4.38Å; Y159-R163 PolarHBondContact O-N 2.97Å; Y159-A164 PolarHBondContact O-N 3.38Å; Y159-D235 WeakPolarHBondContact CB-OD2 3.36Å; Y159-D235 WeakPolarHBondContact CD2-OD2 3.37Å
160	L	92.8	Very high	94.7	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	17%	0.168	C	C	.	.	I	π-helix	trans	-63.4	-50	179.7	-68.4	176.5	0	0	0	112	T155 Q157 S162 A164 E165 V183 C189 L194 L196	T155-L160 HydrophobicContact CG2-CD2 3.72Å; Q157-L160 WeakPolarHBondContact O-CB 3.43Å; Q157-L160 PolarHBondContact O-N 3.07Å; L160-S162 PolarHBondContact O-N 3Å; L160-S162 VanDerWaalsContact O-N 3.16Å; L160-A164 HydrophobicContact CD2-CB 4.2Å; L160-A164 WeakPolarHBondContact O-CB 3.34Å; L160-E165 PolarHBondContact O-N 3.01Å; L160-V183 HydrophobicContact CD1-CG1 4.36Å; L160-V183 HydrophobicContact CD2-CG1 3.92Å; L160-V183 HydrophobicContact CG-CG1 4.44Å; L160-C189 HydrophobicContact CD1-CB 3.87Å; L160-L194 HydrophobicContact CB-CD1 4.23Å; L160-L194 HydrophobicContact CD2-CD1 4.21Å; L160-L196 HydrophobicContact CD2-CD1 3.95Å
161	D	91.3	Very high	94.6	Very high	87 Å²	87	35.4 Å²	35.4	47%	0.465	17%	0.169	S	C	.	.	I	π-helix	trans	-81.7	13.5	-178.1	-54.1	-39.6	0	0	0	113.5
162	S	92.6	Very high	94.6	Very high	40 Å²	40	35.3 Å²	35.3	28%	0.28	17%	0.169	S	C	.	.	I	π-helix	trans	-136.6	-76.5	179.8	54.9	0	0	0	0	111.8	Y159 L160 A166	Y159-S162 PolarHBondContact O-N 3.24Å; Y159-S162 PolarHBondContact O-OG 3.16Å; L160-S162 PolarHBondContact O-N 3Å; L160-S162 VanDerWaalsContact O-N 3.16Å; S162-A166 WeakPolarHBondContact O-CB 3.45Å; S162-A166 PolarHBondContact O-N 3.02Å
163	R	95.1	Very high	94.4	Very high	27 Å²	27	38.3 Å²	38.3	10%	0.102	19%	0.189	C	C	.	.	I	π-helix	trans	-73.8	-44.3	-175.5	-63.9	-175.5	-176.5	178.3	1.6	112.5	Y159 E165 A166 I167 D235 D236 K369	Y159-R163 HydrophobicContact CD1-CG 4.38Å; Y159-R163 PolarHBondContact O-N 2.97Å; R163-E165 PolarHBondContact O-N 3.21Å; R163-A166 WeakPolarHBondContact O-CB 3.43Å; R163-A166 PolarHBondContact O-N 2.88Å; R163-I167 WeakPolarHBondContact O-CG1 3.34Å; R163-I167 PolarHBondContact O-N 3.4Å; R163-D235 HydrophobicContact CB-CB 4.15Å; R163-D235 WeakPolarHBondContact CB-O 3.39Å; R163-D235 VanDerWaalsContact CD-OD1 3.24Å; R163-D235 WeakPolarHBondContact CD-OD1 3.39Å; R163-D235 IonicContact CZ-OD1 2.88Å; R163-D235 IonicContact NE-OD1 3.28Å; R163-D235 IonicContact NH1-OD1 2.8Å; R163-D235 PolarHBondContact NH1-OD1 3.13Å; R163-D236 IonicContact NH1-OD2 2.6Å; R163-K369 PolarHBondContact NE-O 3.34Å; R163-K369 VanDerWaalsContact NE-O 3.1Å
164	A	95	Very high	94.1	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.204	C	C	.	.	I	π-helix	trans	-65.1	-41.7	178.8	0	0	0	0	0	111.4	Y159 L160 A166 I167 M168 F181 L194	Y159-A164 PolarHBondContact O-N 3.38Å; L160-A164 HydrophobicContact CD2-CB 4.2Å; L160-A164 WeakPolarHBondContact O-CB 3.34Å; A164-A166 VanDerWaalsContact C-N 3.34Å; A164-A166 PolarHBondContact O-N 2.73Å; A164-I167 PolarHBondContact O-N 3.05Å; A164-M168 PolarHBondContact O-N 3.46Å; A164-F181 HydrophobicContact CB-CD1 3.69Å; A164-F181 HydrophobicContact CB-CE1 3.52Å; A164-F181 HydrophobicContact CB-CG 4.37Å; A164-F181 HydrophobicContact CB-CZ 4.06Å; A164-F181 WeakPolarHBondContact O-CZ 3.41Å; A164-L194 HydrophobicContact CB-CD1 4.03Å
165	E	93.6	Very high	94.1	Very high	71 Å²	71	41.3 Å²	41.3	33%	0.332	20%	0.203	S	C	.	.	H	α-helix	trans	-61.4	-41.3	172.8	-165.5	-175.1	177.3	0	0	112.1	L160 R163 I167 M168 K169	L160-E165 PolarHBondContact O-N 3.01Å; R163-E165 PolarHBondContact O-N 3.21Å; E165-I167 VanDerWaalsContact C-N 3.34Å; E165-I167 PolarHBondContact O-N 3.32Å; E165-M168 PolarHBondContact O-N 3.07Å; E165-K169 HydrophobicContact CG-CD 4.15Å; E165-K169 WeakPolarHBondContact O-CB 3.07Å; E165-K169 WeakPolarHBondContact O-CG 3.3Å; E165-K169 PolarHBondContact O-N 3.1Å; E165-K169 WeakPolarHBondContact OE1-CE 3.24Å; E165-K169 IonicContact OE1-NZ 3.86Å; E165-K169 PolarHBondContact OE1-NZ 3.42Å
166	A	95.3	Very high	94	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.008	23%	0.225	C	C	.	.	H	α-helix	trans	-62.4	-40	175.1	0	0	0	0	0	112.3	S162 R163 A164 K169 T170 P371 M374	S162-A166 WeakPolarHBondContact O-CB 3.45Å; S162-A166 PolarHBondContact O-N 3.02Å; R163-A166 WeakPolarHBondContact O-CB 3.43Å; R163-A166 PolarHBondContact O-N 2.88Å; A164-A166 VanDerWaalsContact C-N 3.34Å; A164-A166 PolarHBondContact O-N 2.73Å; A166-K169 PolarHBondContact O-N 2.84Å; A166-T170 VanDerWaalsContact O-CB 3.31Å; A166-T170 WeakPolarHBondContact O-CB 3.37Å; A166-T170 VanDerWaalsContact O-CG2 3.27Å; A166-T170 WeakPolarHBondContact O-CG2 3.37Å; A166-T170 PolarHBondContact O-N 2.79Å; A166-T170 PolarHBondContact O-OG1 3.26Å; A166-P371 HydrophobicContact CB-CB 4Å; A166-M374 HydrophobicContact CB-SD 3.67Å
167	I	97.2	Very high	94	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-59.9	-49.6	174.1	-71	170.9	0	0	0	110.1	V153 R163 A164 E165 K169 T170 W171 G172 L179 F181 D235 M374	V153-I167 HydrophobicContact CG1-CD1 3.91Å; V153-I167 HydrophobicContact CG2-CD1 4.41Å; R163-I167 WeakPolarHBondContact O-CG1 3.34Å; R163-I167 PolarHBondContact O-N 3.4Å; A164-I167 PolarHBondContact O-N 3.05Å; E165-I167 VanDerWaalsContact C-N 3.34Å; E165-I167 PolarHBondContact O-N 3.32Å; I167-K169 VanDerWaalsContact C-N 3.3Å; I167-K169 PolarHBondContact O-N 3.07Å; I167-T170 CarbonylContact O-C 3.57Å; I167-T170 PolarHBondContact O-N 2.85Å; I167-T170 VanDerWaalsContact O-N 3.12Å; I167-T170 PolarHBondContact O-OG1 2.76Å; I167-W171 HydrophobicContact CB-CZ2 4.26Å; I167-W171 HydrophobicContact CD1-CZ2 3.88Å; I167-W171 HydrophobicContact CG1-CZ2 3.83Å; I167-W171 HydrophobicContact CG2-CD2 4.19Å; I167-W171 HydrophobicContact CG2-CH2 3.88Å; I167-W171 HydrophobicContact CG2-CZ2 3.47Å; I167-W171 VanDerWaalsContact CG2-CZ2 3.47Å; I167-W171 HydrophobicContact CG2-CZ3 4.39Å; I167-G172 VanDerWaalsContact O-CA 3.27Å; I167-G172 WeakPolarHBondContact O-CA 3.36Å; I167-G172 PolarHBondContact O-N 3.19Å; I167-L179 HydrophobicContact CG2-CD2 4.09Å; I167-F181 HydrophobicContact CB-CE1 4.22Å; I167-F181 HydrophobicContact CB-CZ 4.04Å; I167-F181 HydrophobicContact CD1-CE1 4.13Å; I167-F181 HydrophobicContact CG2-CE1 4.17Å; I167-F181 HydrophobicContact CG2-CZ 3.81Å; I167-D235 WeakPolarHBondContact CD1-O 3.37Å; I167-M374 HydrophobicContact CG1-CE 3.85Å; I167-M374 HydrophobicContact CG1-SD 3.76Å
168	M	94.9	Very high	94.2	Very high	59 Å²	59	44.8 Å²	44.8	29%	0.291	23%	0.234	S	C	.	.	H	α-helix	trans	-59.7	-39.1	179.4	-77.2	-60.6	-70.3	0	0	113.1	A164 E165 T170 S173 L179 F181 L194 P195	A164-M168 PolarHBondContact O-N 3.46Å; E165-M168 PolarHBondContact O-N 3.07Å; M168-T170 VanDerWaalsContact C-N 3.32Å; M168-S173 WeakPolarHBondContact O-CA 3.39Å; M168-S173 WeakPolarHBondContact O-CB 3.09Å; M168-S173 PolarHBondContact O-N 3.06Å; M168-L179 HydrophobicContact SD-CD2 3.64Å; M168-F181 HydrophobicContact CG-CE2 3.66Å; M168-F181 HydrophobicContact CG-CZ 3.89Å; M168-F181 HydrophobicContact SD-CE2 3.7Å; M168-F181 HydrophobicContact SD-CZ 4.24Å; M168-L194 HydrophobicContact CB-CD2 4.3Å; M168-L194 HydrophobicContact CG-CD2 3.48Å; M168-L194 VanDerWaalsContact CG-CD2 3.48Å; M168-P195 HydrophobicContact SD-CG 4.35Å
169	K	94.3	Very high	94.5	Very high	121 Å²	121	37.6 Å²	37.6	53%	0.526	20%	0.203	S	C	.	.	H	α-helix	trans	-77.8	-14.6	178.6	-72.6	175.2	171.3	173.4	0	113.9	E165 A166 I167	E165-K169 HydrophobicContact CG-CD 4.15Å; E165-K169 WeakPolarHBondContact O-CB 3.07Å; E165-K169 WeakPolarHBondContact O-CG 3.3Å; E165-K169 PolarHBondContact O-N 3.1Å; E165-K169 WeakPolarHBondContact OE1-CE 3.24Å; E165-K169 IonicContact OE1-NZ 3.86Å; E165-K169 PolarHBondContact OE1-NZ 3.42Å; A166-K169 PolarHBondContact O-N 2.84Å; I167-K169 VanDerWaalsContact C-N 3.3Å; I167-K169 PolarHBondContact O-N 3.07Å
170	T	96.4	Very high	94.6	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.6	-111.9	-174.9	62.2	0	0	0	0	111.7	A166 I167 M168 G172 S173 M374 Y378	A166-T170 VanDerWaalsContact O-CB 3.31Å; A166-T170 WeakPolarHBondContact O-CB 3.37Å; A166-T170 VanDerWaalsContact O-CG2 3.27Å; A166-T170 WeakPolarHBondContact O-CG2 3.37Å; A166-T170 PolarHBondContact O-N 2.79Å; A166-T170 PolarHBondContact O-OG1 3.26Å; I167-T170 CarbonylContact O-C 3.57Å; I167-T170 PolarHBondContact O-N 2.85Å; I167-T170 VanDerWaalsContact O-N 3.12Å; I167-T170 PolarHBondContact O-OG1 2.76Å; M168-T170 VanDerWaalsContact C-N 3.32Å; T170-G172 VanDerWaalsContact C-N 3.33Å; T170-G172 PolarHBondContact O-N 3.43Å; T170-S173 WeakPolarHBondContact O-CB 3.39Å; T170-S173 PolarHBondContact O-N 2.79Å; T170-S173 PolarHBondContact O-OG 2.97Å; T170-M374 HydrophobicContact CG2-CG 4.43Å; T170-Y378 HydrophobicContact CG2-CD1 4.09Å; T170-Y378 HydrophobicContact CG2-CG 3.89Å; T170-Y378 WeakPolarHBondContact O-CE2 3.23Å
171	W	97	Very high	94.8	Very high	4 Å²	4	35.2 Å²	35.2	2%	0.015	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-71.1	-28.5	-173.9	62.8	-92.7	0	0	0	113.3	V151 V153 I167 S173 L175 V237 F238 V239 V241	V151-W171 HydrophobicContact CG1-CH2 4.18Å; V151-W171 HydrophobicContact CG1-CZ3 4.18Å; V153-W171 HydrophobicContact CG2-CH2 4.01Å; V153-W171 HydrophobicContact CG2-CZ2 4.49Å; I167-W171 HydrophobicContact CB-CZ2 4.26Å; I167-W171 HydrophobicContact CD1-CZ2 3.88Å; I167-W171 HydrophobicContact CG1-CZ2 3.83Å; I167-W171 HydrophobicContact CG2-CD2 4.19Å; I167-W171 HydrophobicContact CG2-CH2 3.88Å; I167-W171 HydrophobicContact CG2-CZ2 3.47Å; I167-W171 VanDerWaalsContact CG2-CZ2 3.47Å; I167-W171 HydrophobicContact CG2-CZ3 4.39Å; W171-S173 PolarHBondContact O-N 3.15Å; W171-L175 HydrophobicContact CE3-CD1 4.14Å; W171-L175 HydrophobicContact CZ3-CD1 3.76Å; W171-V237 HydrophobicContact CH2-CG1 4.32Å; W171-V237 HydrophobicContact CZ2-CG1 3.76Å; W171-V237 PolarHBondContact NE1-O 3.31Å; W171-F238 HydrophobicContact CB-CD2 4.44Å; W171-F238 HydrophobicContact CB-CE2 4.09Å; W171-F238 HydrophobicContact CB-CZ 4.31Å; W171-F238 AromaticContact CD1-CD2 3.48Å; W171-F238 VanDerWaalsContact CD1-CD2 3.48Å; W171-F238 AromaticContact CD1-CE2 3.9Å; W171-F238 HydrophobicContact CG-CD2 4.26Å; W171-F238 HydrophobicContact CG-CE2 4.38Å; W171-V239 WeakPolarHBondContact CB-O 3.38Å; W171-V239 HydrophobicContact CD2-CB 4.07Å; W171-V239 HydrophobicContact CE3-CB 3.82Å; W171-V239 HydrophobicContact CE3-CG2 4.32Å; W171-V239 HydrophobicContact CH2-CG2 4.17Å; W171-V239 HydrophobicContact CZ2-CG2 4.34Å; W171-V239 HydrophobicContact CZ3-CB 4.09Å; W171-V239 HydrophobicContact CZ3-CG2 4.16Å; W171-V241 HydrophobicContact CE3-CG2 4.15Å
172	G	96.7	Very high	95	Very high	1 Å²	1	31 Å²	31	1%	0.01	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-66.8	-24.5	177.2	0	0	0	0	0	113.5	I167 T170 K174 L175	I167-G172 VanDerWaalsContact O-CA 3.27Å; I167-G172 WeakPolarHBondContact O-CA 3.36Å; I167-G172 PolarHBondContact O-N 3.19Å; T170-G172 VanDerWaalsContact C-N 3.33Å; T170-G172 PolarHBondContact O-N 3.43Å; G172-K174 PolarHBondContact O-N 3.23Å; G172-L175 PolarHBondContact O-N 3.42Å
173	S	94.6	Very high	95.1	Very high	62 Å²	62	29.1 Å²	29.1	43%	0.434	16%	0.159	S	C	.	.	G	3₁₀ helix	trans	-55.8	-23.3	179	66.2	0	0	0	0	114.2	M168 T170 W171	M168-S173 WeakPolarHBondContact O-CA 3.39Å; M168-S173 WeakPolarHBondContact O-CB 3.09Å; M168-S173 PolarHBondContact O-N 3.06Å; T170-S173 WeakPolarHBondContact O-CB 3.39Å; T170-S173 PolarHBondContact O-N 2.79Å; T170-S173 PolarHBondContact O-OG 2.97Å; W171-S173 PolarHBondContact O-N 3.15Å
174	K	91.9	Very high	94.9	Very high	69 Å²	69	28 Å²	28	30%	0.3	16%	0.155	S	C	.	.	G	3₁₀ helix	trans	-84.7	-16.6	-178.1	-58.4	-170.4	177.4	-172.4	0	114.2	G172 E242 E385	G172-K174 PolarHBondContact O-N 3.23Å; K174-E242 WeakPolarHBondContact CD-OE1 3.5Å; K174-E242 VanDerWaalsContact CE-OE1 3.27Å; K174-E242 WeakPolarHBondContact CE-OE1 3.1Å; K174-E242 IonicContact NZ-OE1 3.9Å; K174-E242 PolarHBondContact NZ-OE1 3.08Å; K174-E242 IonicContact NZ-OE2 2.86Å; K174-E242 PolarHBondContact NZ-OE2 2.72Å; K174-E385 IonicContact NZ-OE2 3.73Å
175	L	94.8	Very high	94.7	Very high	11 Å²	11	32 Å²	32	6%	0.058	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-23.9	-172.8	-70.5	166.3	0	0	0	112.5	V151 W171 G172 D177 S178 L179 V241	V151-L175 HydrophobicContact CB-CD1 3.9Å; V151-L175 HydrophobicContact CG1-CD1 4.36Å; V151-L175 HydrophobicContact CG2-CD1 3.57Å; V151-L175 HydrophobicContact CG2-CD2 3.94Å; V151-L175 HydrophobicContact CG2-CG 4.42Å; W171-L175 HydrophobicContact CE3-CD1 4.14Å; W171-L175 HydrophobicContact CZ3-CD1 3.76Å; G172-L175 PolarHBondContact O-N 3.42Å; L175-D177 PolarHBondContact O-N 3.33Å; L175-S178 VanDerWaalsContact O-CB 3.24Å; L175-S178 WeakPolarHBondContact O-CB 3.29Å; L175-S178 PolarHBondContact O-N 2.78Å; L175-L179 HydrophobicContact CB-CB 3.79Å; L175-L179 HydrophobicContact CD1-CB 4.09Å; L175-L179 HydrophobicContact CD1-CD1 4.3Å; L175-L179 HydrophobicContact CD1-CD2 4.44Å; L175-V241 HydrophobicContact CD1-CG2 4.31Å; L175-V241 HydrophobicContact CD2-CG1 3.73Å; L175-V241 HydrophobicContact CD2-CG2 4.38Å; L175-V241 HydrophobicContact CG-CG1 4.31Å; L175-V241 HydrophobicContact CG-CG2 4.19Å
176	G	91.4	Very high	94.5	Very high	50 Å²	50	35.6 Å²	35.6	52%	0.515	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	55.1	-127	-174.8	0	0	0	0	0	111.3	S178 L179	G176-S178 PolarHBondContact O-N 3Å; G176-L179 PolarHBondContact O-N 3.47Å
177	D	92.5	Very high	94.2	Very high	112 Å²	112	35.6 Å²	35.6	60%	0.599	20%	0.196	S	C	*	.	G	3₁₀ helix	trans	-73.2	-4.5	178.3	68.2	-29.9	0	0	0	114.6	R147 L175 L179	R147-D177 IonicContact CZ-OD1 3.39Å; R147-D177 IonicContact CZ-OD2 2.83Å; R147-D177 IonicContact NH1-OD1 3.02Å; R147-D177 PolarHBondContact NH1-OD1 3.04Å; R147-D177 IonicContact NH1-OD2 3.73Å; R147-D177 PolarHBondContact NH1-OD2 3.4Å; R147-D177 IonicContact NH2-OD1 3.44Å; R147-D177 PolarHBondContact NH2-OD1 2.78Å; L175-D177 PolarHBondContact O-N 3.33Å; D177-L179 PolarHBondContact O-N 3.03Å
178	S	96.1	Very high	93.6	Very high	8 Å²	8	40.2 Å²	40.2	6%	0.056	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-71.3	-12.3	168.7	-79.1	0	0	0	0	113.2	R147 L149 V151 L175 G176 F227	R147-S178 PolarHBondContact NH2-OG 3.15Å; L149-S178 WeakPolarHBondContact O-CB 3.3Å; L149-S178 PolarHBondContact O-OG 2.79Å; V151-S178 PolarHBondContact N-O 3.18Å; L175-S178 VanDerWaalsContact O-CB 3.24Å; L175-S178 WeakPolarHBondContact O-CB 3.29Å; L175-S178 PolarHBondContact O-N 2.78Å; G176-S178 PolarHBondContact O-N 3Å; S178-F227 WeakPolarHBondContact OG-CE1 3.48Å
179	L	97.3	Very high	92.6	Very high	1 Å²	1	39 Å²	39	1%	0.005	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	127.6	-174.4	175.6	63.1	0	0	0	111.3	V151 V153 I167 M168 L175 G176 D177 F181 P195	V151-L179 HydrophobicContact CB-CD1 4.06Å; V151-L179 HydrophobicContact CG1-CD1 3.87Å; V151-L179 WeakPolarHBondContact O-CA 3.47Å; V153-L179 HydrophobicContact CG2-CD1 3.64Å; I167-L179 HydrophobicContact CG2-CD2 4.09Å; M168-L179 HydrophobicContact SD-CD2 3.64Å; L175-L179 HydrophobicContact CB-CB 3.79Å; L175-L179 HydrophobicContact CD1-CB 4.09Å; L175-L179 HydrophobicContact CD1-CD1 4.3Å; L175-L179 HydrophobicContact CD1-CD2 4.44Å; G176-L179 PolarHBondContact O-N 3.47Å; D177-L179 PolarHBondContact O-N 3.03Å; L179-F181 HydrophobicContact CD2-CE2 4.17Å; L179-F181 HydrophobicContact CD2-CZ 4.2Å; L179-F181 HydrophobicContact CG-CE2 4.22Å; L179-F181 HydrophobicContact CG-CZ 4.49Å; L179-P195 WeakPolarHBondContact O-CG 3.41Å
180	V	96.8	Very high	91.3	Very high	15 Å²	15	37.6 Å²	37.6	9%	0.091	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	138.5	176.7	175.2	0	0	0	0	110.7	F150 V151 G152 V153 F182 V197	F150-V180 HydrophobicContact CE2-CG2 4.14Å; F150-V180 HydrophobicContact CZ-CB 4Å; F150-V180 HydrophobicContact CZ-CG2 3.67Å; V151-V180 PolarHBondContact O-N 2.85Å; G152-V180 CarbonylContact C-O 3.56Å; G152-V180 WeakPolarHBondContact CA-O 3.49Å; V153-V180 PolarHBondContact N-O 2.87Å; V180-F182 HydrophobicContact CB-CE2 4.11Å; V180-F182 HydrophobicContact CG1-CD2 4.31Å; V180-F182 HydrophobicContact CG1-CE2 3.88Å; V180-F182 HydrophobicContact CG1-CZ 4.11Å; V180-V197 HydrophobicContact CG1-CB 3.86Å; V180-V197 HydrophobicContact CG1-CG2 3.38Å
181	F	96.2	Very high	90	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	130.5	173.7	-63.8	-89.3	0	0	0	110.8	V153 T155 A164 I167 M168 L179 L194 P195 L196 V197	V153-F181 HydrophobicContact CB-CD1 3.6Å; V153-F181 HydrophobicContact CB-CE1 3.79Å; V153-F181 HydrophobicContact CB-CG 4.43Å; V153-F181 HydrophobicContact CG1-CD1 3.67Å; V153-F181 HydrophobicContact CG1-CE1 3.75Å; V153-F181 HydrophobicContact CG2-CD1 4.37Å; V153-F181 HydrophobicContact CG2-CE1 4.1Å; V153-F181 CarbonylContact O-C 3.54Å; V153-F181 WeakPolarHBondContact O-CA 3.49Å; T155-F181 HydrophobicContact CG2-CB 4.34Å; T155-F181 HydrophobicContact CG2-CD1 4.3Å; A164-F181 HydrophobicContact CB-CD1 3.69Å; A164-F181 HydrophobicContact CB-CE1 3.52Å; A164-F181 HydrophobicContact CB-CG 4.37Å; A164-F181 HydrophobicContact CB-CZ 4.06Å; A164-F181 WeakPolarHBondContact O-CZ 3.41Å; I167-F181 HydrophobicContact CB-CE1 4.22Å; I167-F181 HydrophobicContact CB-CZ 4.04Å; I167-F181 HydrophobicContact CD1-CE1 4.13Å; I167-F181 HydrophobicContact CG2-CE1 4.17Å; I167-F181 HydrophobicContact CG2-CZ 3.81Å; M168-F181 HydrophobicContact CG-CE2 3.66Å; M168-F181 HydrophobicContact CG-CZ 3.89Å; M168-F181 HydrophobicContact SD-CE2 3.7Å; M168-F181 HydrophobicContact SD-CZ 4.24Å; L179-F181 HydrophobicContact CD2-CE2 4.17Å; L179-F181 HydrophobicContact CD2-CZ 4.2Å; L179-F181 HydrophobicContact CG-CE2 4.22Å; L179-F181 HydrophobicContact CG-CZ 4.49Å; F181-L194 HydrophobicContact CE2-CD2 4.4Å; F181-P195 HydrophobicContact CD2-CG 4.09Å; F181-P195 HydrophobicContact CE2-CG 4.28Å; F181-P195 PolarHBondContact N-O 3.19Å; F181-L196 HydrophobicContact CB-CD1 4.05Å; F181-V197 PolarHBondContact O-N 2.84Å
182	F	95.8	Very high	88.5	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	123.4	179.9	-70.2	-93.4	0	0	0	110.5	V153 T155 V180 V197 L199 M215 Y218 M219	V153-F182 PolarHBondContact O-N 2.73Å; T155-F182 PolarHBondContact N-O 2.66Å; V180-F182 HydrophobicContact CB-CE2 4.11Å; V180-F182 HydrophobicContact CG1-CD2 4.31Å; V180-F182 HydrophobicContact CG1-CE2 3.88Å; V180-F182 HydrophobicContact CG1-CZ 4.11Å; F182-V197 HydrophobicContact CD1-CB 3.98Å; F182-V197 HydrophobicContact CD1-CG1 3.8Å; F182-V197 HydrophobicContact CE1-CB 3.97Å; F182-V197 HydrophobicContact CE1-CG1 3.7Å; F182-L199 HydrophobicContact CB-CD1 4.37Å; F182-L199 HydrophobicContact CD1-CD1 4.09Å; F182-L199 HydrophobicContact CD1-CD2 3.87Å; F182-L199 HydrophobicContact CD1-CG 4.03Å; F182-L199 HydrophobicContact CE1-CD2 4.24Å; F182-M215 HydrophobicContact CB-CB 4.45Å; F182-M215 HydrophobicContact CB-CG 4.28Å; F182-M215 HydrophobicContact CB-SD 4.18Å; F182-M215 HydrophobicContact CD1-CB 3.96Å; F182-M215 HydrophobicContact CD1-CG 3.9Å; F182-M215 HydrophobicContact CD2-CE 3.96Å; F182-M215 HydrophobicContact CD2-CG 3.66Å; F182-M215 HydrophobicContact CD2-SD 3.96Å; F182-M215 HydrophobicContact CE1-CB 4.33Å; F182-M215 HydrophobicContact CE1-CG 4.11Å; F182-M215 HydrophobicContact CE2-CE 4.3Å; F182-M215 HydrophobicContact CE2-CG 3.89Å; F182-M215 HydrophobicContact CG-CB 4.06Å; F182-M215 HydrophobicContact CG-CG 3.66Å; F182-M215 HydrophobicContact CG-SD 4.08Å; F182-M215 HydrophobicContact CZ-CG 4.1Å; F182-Y218 AromaticContact CE1-CD1 3.55Å; F182-Y218 HydrophobicContact CE1-CD1 3.55Å; F182-Y218 HydrophobicContact CE1-CE1 4.29Å; F182-Y218 AromaticContact CE1-CG 3.79Å; F182-Y218 HydrophobicContact CE1-CG 3.79Å; F182-Y218 AromaticContact CZ-CD1 3.72Å; F182-Y218 HydrophobicContact CZ-CD1 3.72Å; F182-Y218 HydrophobicContact CZ-CE1 4.36Å; F182-Y218 HydrophobicContact CZ-CG 4.38Å; F182-M219 HydrophobicContact CE2-CG 4.22Å; F182-M219 HydrophobicContact CZ-CG 3.86Å
183	V	94.1	Very high	87.7	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	166.8	179.7	-66.2	0	0	0	0	111.3	T155 L160 A187 L196 V197 R198 L199	T155-V183 HydrophobicContact CG2-CG1 3.56Å; L160-V183 HydrophobicContact CD1-CG1 4.36Å; L160-V183 HydrophobicContact CD2-CG1 3.92Å; L160-V183 HydrophobicContact CG-CG1 4.44Å; V183-A187 HydrophobicContact CB-CB 3.75Å; V183-A187 HydrophobicContact CG1-CB 4.48Å; V183-A187 HydrophobicContact CG2-CB 3.61Å; V183-L196 HydrophobicContact CB-CD1 4.21Å; V183-L196 HydrophobicContact CG1-CD1 3.72Å; V183-L196 HydrophobicContact CG2-CD1 3.43Å; V183-L196 VanDerWaalsContact CG2-CD1 3.43Å; V183-L196 HydrophobicContact CG2-CD2 3.94Å; V183-L196 HydrophobicContact CG2-CG 3.72Å; V183-V197 PolarHBondContact N-O 3.42Å; V183-V197 VanDerWaalsContact N-O 3.09Å; V183-R198 HydrophobicContact CG2-CG 3.98Å; V183-L199 PolarHBondContact O-N 3.08Å
184	G	91.5	Very high	87.4	Confident	2 Å²	2	47.5 Å²	47.5	2%	0.021	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	160.4	172	0	0	0	0	0	113.3	N186 A187 V202 D204	G184-N186 VanDerWaalsContact C-N 3.26Å; G184-N186 PolarHBondContact O-N 2.8Å; G184-A187 WeakPolarHBondContact O-CB 3Å; G184-A187 PolarHBondContact O-N 3.18Å; G184-V202 CarbonylContact C-O 3.58Å; G184-V202 WeakPolarHBondContact CA-O 3.37Å; G184-D204 WeakPolarHBondContact CA-OD1 3.47Å; G184-D204 PolarHBondContact N-OD1 2.64Å
185	E	91.3	Very high	87.4	Confident	85 Å²	85	46.4 Å²	46.4	40%	0.397	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-37.7	-173.3	-173.5	161.9	-150.3	0	0	113.5	R198 G201 V202	E185-R198 WeakPolarHBondContact O-CD 3.46Å; E185-G201 WeakPolarHBondContact OE2-CA 2.98Å; E185-G201 PolarHBondContact OE2-N 3.06Å; E185-V202 PolarHBondContact N-O 3Å
186	N	89.6	Confident	87.4	Confident	146 Å²	146	47.6 Å²	47.6	78%	0.781	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	6.2	-174.5	-64.6	-27.7	0	0	0	114.2	G184 T188	G184-N186 VanDerWaalsContact C-N 3.26Å; G184-N186 PolarHBondContact O-N 2.8Å; N186-T188 PolarHBondContact O-N 2.92Å
187	A	87.5	Confident	87.5	Confident	2 Å²	2	46 Å²	46	2%	0.017	29%	0.289	C	S	.	.			trans	-69.9	124.1	-176.4	0	0	0	0	0	112.2	Q157 V183 G184 R198	Q157-A187 HydrophobicContact CB-CB 3.97Å; Q157-A187 HydrophobicContact CG-CB 4.38Å; V183-A187 HydrophobicContact CB-CB 3.75Å; V183-A187 HydrophobicContact CG1-CB 4.48Å; V183-A187 HydrophobicContact CG2-CB 3.61Å; G184-A187 WeakPolarHBondContact O-CB 3Å; G184-A187 PolarHBondContact O-N 3.18Å; A187-R198 PolarHBondContact O-NE 3.24Å; A187-R198 PolarHBondContact O-NH2 2.78Å
188	T	84.3	Confident	87.5	Confident	96 Å²	96	46.5 Å²	46.5	59%	0.589	28%	0.282	S	S	*	.			trans	-101.4	143.8	171.5	59.4	0	0	0	0	110.5	Q157 N186	Q157-T188 WeakPolarHBondContact CG-O 3.18Å; Q157-T188 PolarHBondContact NE2-O 3.15Å; Q157-T188 PolarHBondContact NE2-OG1 3.4Å; N186-T188 PolarHBondContact O-N 2.92Å
189	C	75.2	Confident	87.3	Confident	33 Å²	33	46.5 Å²	46.5	22%	0.223	28%	0.282	C	S	.	.			trans	-125.5	131.5	-178.1	-173.2	0	0	0	0	108.2	L160 S191 L196	L160-C189 HydrophobicContact CD1-CB 3.87Å; C189-S191 VanDerWaalsContact C-N 3.32Å; C189-S191 PolarHBondContact SG-O 2.82Å; C189-L196 HydrophobicContact CB-CD2 4.35Å
190	A	66.8	Low	86.9	Confident	92 Å²	92	54.6 Å²	54.6	76%	0.76	32%	0.317	S	S	*	.	S	Bend	trans	-70.7	-32.8	176.9	0	0	0	0	0	111.5
191	S	68.5	Low	86.4	Confident	39 Å²	39	56 Å²	56	27%	0.273	33%	0.334	S	S	.	.			trans	-88.1	121.2	179.3	-175.5	0	0	0	0	112.4	C189 T193	C189-S191 VanDerWaalsContact C-N 3.32Å; C189-S191 PolarHBondContact SG-O 2.82Å; S191-T193 PolarHBondContact O-N 2.76Å; S191-T193 PolarHBondContact OG-N 3.27Å; S191-T193 PolarHBondContact OG-OG1 2.99Å
192	A	65.4	Low	86	Confident	109 Å²	109	56.2 Å²	56.2	90%	0.901	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-3.7	175.7	0	0	0	0	0	114.1
193	T	80	Confident	85.4	Confident	111 Å²	111	60.7 Å²	60.7	68%	0.681	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98	-11.8	-170.6	57.4	0	0	0	0	115.2	S191	S191-T193 PolarHBondContact O-N 2.76Å; S191-T193 PolarHBondContact OG-N 3.27Å; S191-T193 PolarHBondContact OG-OG1 2.99Å
194	L	88.5	Confident	84.8	Confident	17 Å²	17	63.2 Å²	63.2	9%	0.089	37%	0.373	C	S	.	.	S	Bend	trans	-76.8	128.1	-179.6	-64.8	-177.3	0	0	0	111.2	L160 A164 M168 F181 L196	L160-L194 HydrophobicContact CB-CD1 4.23Å; L160-L194 HydrophobicContact CD2-CD1 4.21Å; A164-L194 HydrophobicContact CB-CD1 4.03Å; M168-L194 HydrophobicContact CB-CD2 4.3Å; M168-L194 HydrophobicContact CG-CD2 3.48Å; M168-L194 VanDerWaalsContact CG-CD2 3.48Å; F181-L194 HydrophobicContact CE2-CD2 4.4Å; L194-L196 PolarHBondContact O-N 3.48Å
195	P	92.8	Very high	84.2	Confident	45 Å²	45	67.1 Å²	67.1	29%	0.292	40%	0.396	S	S	.	.			trans	-70.6	93.3	174.9	28.4	-33.1	0	0	0	110	M168 L179 F181	M168-P195 HydrophobicContact SD-CG 4.35Å; L179-P195 WeakPolarHBondContact O-CG 3.41Å; F181-P195 HydrophobicContact CD2-CG 4.09Å; F181-P195 HydrophobicContact CE2-CG 4.28Å; F181-P195 PolarHBondContact N-O 3.19Å
196	L	93.1	Very high	83.3	Confident	37 Å²	37	71.1 Å²	71.1	19%	0.194	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	127.9	-168	-167.3	70	0	0	0	112.3	L160 F181 V183 C189 L194 R198	L160-L196 HydrophobicContact CD2-CD1 3.95Å; F181-L196 HydrophobicContact CB-CD1 4.05Å; V183-L196 HydrophobicContact CB-CD1 4.21Å; V183-L196 HydrophobicContact CG1-CD1 3.72Å; V183-L196 HydrophobicContact CG2-CD1 3.43Å; V183-L196 VanDerWaalsContact CG2-CD1 3.43Å; V183-L196 HydrophobicContact CG2-CD2 3.94Å; V183-L196 HydrophobicContact CG2-CG 3.72Å; C189-L196 HydrophobicContact CB-CD2 4.35Å; L194-L196 PolarHBondContact O-N 3.48Å; L196-R198 HydrophobicContact CD2-CG 4.4Å
197	V	94.3	Very high	82.4	Confident	17 Å²	17	66.1 Å²	66.1	10%	0.103	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	118.2	167.9	169.7	0	0	0	0	109.5	V180 F181 F182 V183 L199 Y218	V180-V197 HydrophobicContact CG1-CB 3.86Å; V180-V197 HydrophobicContact CG1-CG2 3.38Å; F181-V197 PolarHBondContact O-N 2.84Å; F182-V197 HydrophobicContact CD1-CB 3.98Å; F182-V197 HydrophobicContact CD1-CG1 3.8Å; F182-V197 HydrophobicContact CE1-CB 3.97Å; F182-V197 HydrophobicContact CE1-CG1 3.7Å; V183-V197 PolarHBondContact N-O 3.42Å; V183-V197 VanDerWaalsContact N-O 3.09Å; V197-L199 HydrophobicContact CG1-CD2 4.16Å; V197-Y218 HydrophobicContact CG1-CD1 4.29Å; V197-Y218 HydrophobicContact CG1-CD2 3.89Å; V197-Y218 HydrophobicContact CG1-CE1 4.09Å; V197-Y218 HydrophobicContact CG1-CE2 3.64Å; V197-Y218 HydrophobicContact CG1-CG 4.2Å; V197-Y218 HydrophobicContact CG2-CE1 3.77Å; V197-Y218 HydrophobicContact CG2-CE2 4.36Å
198	R	93.5	Very high	82.1	Confident	122 Å²	122	66.8 Å²	66.8	46%	0.46	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	114.4	173.1	-66.3	-179.7	-177.2	88	0.2	109.1	V183 E185 A187 L196 K200	V183-R198 HydrophobicContact CG2-CG 3.98Å; E185-R198 WeakPolarHBondContact O-CD 3.46Å; A187-R198 PolarHBondContact O-NE 3.24Å; A187-R198 PolarHBondContact O-NH2 2.78Å; L196-R198 HydrophobicContact CD2-CG 4.4Å; R198-K200 PolarHBondContact O-N 2.63Å
199	L	91.9	Very high	82.2	Confident	8 Å²	8	63.3 Å²	63.3	4%	0.042	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	114	-178.4	-68.3	173.5	0	0	0	110.4	F182 V183 V197 G201 V202 K211 H214 M215	F182-L199 HydrophobicContact CB-CD1 4.37Å; F182-L199 HydrophobicContact CD1-CD1 4.09Å; F182-L199 HydrophobicContact CD1-CD2 3.87Å; F182-L199 HydrophobicContact CD1-CG 4.03Å; F182-L199 HydrophobicContact CE1-CD2 4.24Å; V183-L199 PolarHBondContact O-N 3.08Å; V197-L199 HydrophobicContact CG1-CD2 4.16Å; L199-G201 PolarHBondContact O-N 3.22Å; L199-V202 HydrophobicContact CB-CB 3.85Å; L199-V202 HydrophobicContact CB-CG1 4.48Å; L199-V202 HydrophobicContact CB-CG2 3.86Å; L199-V202 WeakPolarHBondContact O-CB 3.33Å; L199-V202 PolarHBondContact O-N 3.42Å; L199-K211 HydrophobicContact CD1-CG 3.84Å; L199-K211 WeakPolarHBondContact CD1-O 3.3Å; L199-H214 HydrophobicContact CD1-CB 3.99Å; L199-H214 HydrophobicContact CD2-CB 4.17Å; L199-H214 HydrophobicContact CG-CB 4.5Å; L199-M215 HydrophobicContact CD1-CB 4.24Å
200	K	88.5	Confident	82.8	Confident	171 Å²	171	66.2 Å²	66.2	74%	0.743	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	133.1	179.4	-64.6	-173.9	177.9	-176.2	0	112	R198 V202	R198-K200 PolarHBondContact O-N 2.63Å; K200-V202 PolarHBondContact O-N 2.86Å
201	G	86.5	Confident	84	Confident	44 Å²	44	62.2 Å²	62.2	45%	0.454	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.9	14.5	-179.6	0	0	0	0	0	114.5	E185 L199 K210	E185-G201 WeakPolarHBondContact OE2-CA 2.98Å; E185-G201 PolarHBondContact OE2-N 3.06Å; L199-G201 PolarHBondContact O-N 3.22Å; G201-K210 VanDerWaalsContact O-CE 3.28Å; G201-K210 WeakPolarHBondContact O-CE 3.48Å; G201-K210 PolarHBondContact O-NZ 3.28Å
202	V	86.7	Confident	85.1	Confident	5 Å²	5	60.4 Å²	60.4	3%	0.03	33%	0.327	C	S	.	.			trans	-118.7	133.4	-179.6	-176.9	0	0	0	0	109.1	G184 E185 L199 K200 K210 K211 H214	G184-V202 CarbonylContact C-O 3.58Å; G184-V202 WeakPolarHBondContact CA-O 3.37Å; E185-V202 PolarHBondContact N-O 3Å; L199-V202 HydrophobicContact CB-CB 3.85Å; L199-V202 HydrophobicContact CB-CG1 4.48Å; L199-V202 HydrophobicContact CB-CG2 3.86Å; L199-V202 WeakPolarHBondContact O-CB 3.33Å; L199-V202 PolarHBondContact O-N 3.42Å; K200-V202 PolarHBondContact O-N 2.86Å; V202-K210 HydrophobicContact CG2-CD 4.17Å; V202-K210 HydrophobicContact CG2-CG 4.05Å; V202-K211 HydrophobicContact CG1-CB 3.72Å; V202-K211 HydrophobicContact CG1-CG 4.14Å; V202-H214 HydrophobicContact CG2-CB 4.11Å
203	D	84.6	Confident	86.5	Confident	94 Å²	94	55.3 Å²	55.3	50%	0.503	29%	0.285	S	S	.	.			trans	-99.6	173.8	174.7	65.3	-6.4	0	0	0	112	T205 K211	D203-T205 PolarHBondContact O-N 3.33Å; D203-T205 VanDerWaalsContact OD2-CB 3.28Å; D203-T205 WeakPolarHBondContact OD2-CB 3.24Å; D203-T205 PolarHBondContact OD2-OG1 3.33Å; D203-K211 WeakPolarHBondContact O-CE 3.49Å
204	D	81	Confident	87.1	Confident	52 Å²	52	52.2 Å²	52.2	28%	0.278	26%	0.263	S	S	.	.	S	Bend	trans	-87.2	10.9	177.3	-84.3	-15.6	0	0	0	113.2	A156 Q157 G184 K211	A156-D204 WeakPolarHBondContact CA-OD2 3.38Å; A156-D204 HydrophobicContact CB-CB 4.14Å; Q157-D204 PolarHBondContact N-OD2 3.37Å; G184-D204 WeakPolarHBondContact CA-OD1 3.47Å; G184-D204 PolarHBondContact N-OD1 2.64Å; D204-K211 WeakPolarHBondContact OD1-CE 3.47Å; D204-K211 IonicContact OD1-NZ 2.78Å; D204-K211 PolarHBondContact OD1-NZ 3.36Å
205	T	78.9	Confident	87.4	Confident	84 Å²	84	51.4 Å²	51.4	52%	0.515	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-70.7	135.8	-176	-53.6	0	0	0	0	110.8	D203 P207	D203-T205 PolarHBondContact O-N 3.33Å; D203-T205 VanDerWaalsContact OD2-CB 3.28Å; D203-T205 WeakPolarHBondContact OD2-CB 3.24Å; D203-T205 PolarHBondContact OD2-OG1 3.33Å; T205-P207 CarbonylContact O-C 3.57Å
206	Y	71.5	Confident	87.5	Confident	169 Å²	169	49.3 Å²	49.3	66%	0.663	25%	0.245	S	C	*	.	S	Bend	trans	-85.7	138.3	169.4	-177.6	-86.5	0	0	0	109.2	P208	Y206-P208 HydrophobicContact CD2-CG 4.45Å
207	P	70.3	Confident	87.7	Confident	41 Å²	41	51.9 Å²	51.9	27%	0.266	25%	0.252	S	S	.	.	S	Bend	cis	-79.9	147.6	5.1	28.8	-32.6	0	0	0	114.8	T205 Q209 N312	T205-P207 CarbonylContact O-C 3.57Å; P207-Q209 VanDerWaalsContact CG-OE1 3.32Å; P207-Q209 PolarHBondContact O-N 3.31Å; P207-Q209 PolarHBondContact O-OE1 2.92Å; P207-N312 WeakPolarHBondContact CB-O 3.46Å; P207-N312 HydrophobicContact CG-CB 4.24Å
208	P	81.6	Confident	87.8	Confident	17 Å²	17	54.2 Å²	54.2	11%	0.11	26%	0.26	C	S	.	.			trans	-93.6	33.5	-167.5	37.6	-37	0	0	0	114.1	M154 Y206 K210 K211 S212 E314	M154-P208 HydrophobicContact CE-CB 3.81Å; M154-P208 HydrophobicContact CE-CG 3.5Å; M154-P208 VanDerWaalsContact CE-CG 3.5Å; M154-P208 HydrophobicContact SD-CB 3.92Å; M154-P208 HydrophobicContact SD-CG 4.17Å; Y206-P208 HydrophobicContact CD2-CG 4.45Å; P208-K210 VanDerWaalsContact C-N 3.3Å; P208-K210 PolarHBondContact O-N 3.33Å; P208-K211 HydrophobicContact CB-CB 4.12Å; P208-K211 WeakPolarHBondContact O-CB 3.4Å; P208-K211 PolarHBondContact O-N 2.88Å; P208-K211 VanDerWaalsContact O-N 3.08Å; P208-S212 PolarHBondContact O-N 2.87Å; P208-E314 HydrophobicContact CG-CB 3.99Å; P208-E314 HydrophobicContact CG-CG 4.17Å
209	Q	86.6	Confident	87.9	Confident	23 Å²	23	48.5 Å²	48.5	11%	0.107	24%	0.238	C	C	.	.	H	α-helix	trans	-57.7	-45.5	-175.3	-57.4	91.7	-26.5	0	0	111.5	P207 K211 S212 M213 V309 S311 E314 E317	P207-Q209 VanDerWaalsContact CG-OE1 3.32Å; P207-Q209 PolarHBondContact O-N 3.31Å; P207-Q209 PolarHBondContact O-OE1 2.92Å; Q209-K211 VanDerWaalsContact C-N 3.32Å; Q209-K211 PolarHBondContact O-N 3.3Å; Q209-S212 PolarHBondContact O-N 3.46Å; Q209-M213 WeakPolarHBondContact O-CB 3.49Å; Q209-M213 VanDerWaalsContact O-CG 3.24Å; Q209-M213 WeakPolarHBondContact O-CG 3.33Å; Q209-M213 PolarHBondContact O-N 3.18Å; Q209-M213 VanDerWaalsContact O-N 3.1Å; Q209-V309 HydrophobicContact CB-CG2 4.36Å; Q209-V309 HydrophobicContact CG-CG1 4.15Å; Q209-S311 PolarHBondContact NE2-O 3.15Å; Q209-E314 HydrophobicContact CG-CB 4.12Å; Q209-E317 HydrophobicContact CG-CG 4.1Å
210	K	88.7	Confident	88.2	Confident	94 Å²	94	50.9 Å²	50.9	41%	0.409	25%	0.247	S	C	.	.	H	α-helix	trans	-61.6	-42.5	178.1	-163.8	-179.3	-173.9	179.3	0	111.2	G201 V202 P208 H214 L306	G201-K210 VanDerWaalsContact O-CE 3.28Å; G201-K210 WeakPolarHBondContact O-CE 3.48Å; G201-K210 PolarHBondContact O-NZ 3.28Å; V202-K210 HydrophobicContact CG2-CD 4.17Å; V202-K210 HydrophobicContact CG2-CG 4.05Å; P208-K210 VanDerWaalsContact C-N 3.3Å; P208-K210 PolarHBondContact O-N 3.33Å; K210-H214 VanDerWaalsContact O-CB 3.31Å; K210-H214 WeakPolarHBondContact O-CB 3.34Å; K210-H214 PolarHBondContact O-CD2 3.18Å; K210-H214 PolarHBondContact O-N 3.01Å; K210-L306 HydrophobicContact CB-CD2 4.37Å; K210-L306 HydrophobicContact CG-CD2 4.32Å
211	K	91.2	Very high	88.5	Confident	8 Å²	8	47.5 Å²	47.5	4%	0.035	24%	0.235	C	C	.	.	H	α-helix	trans	-62.2	-49.6	179.9	-169.9	-175.8	-72.9	-178.7	0	111.8	M154 T155 L199 V202 D203 D204 P208 Q209 H214 M215	M154-K211 HydrophobicContact CG-CD 3.42Å; M154-K211 VanDerWaalsContact CG-CD 3.42Å; M154-K211 HydrophobicContact CG-CG 3.95Å; M154-K211 HydrophobicContact SD-CB 4.21Å; M154-K211 HydrophobicContact SD-CD 3.84Å; M154-K211 HydrophobicContact SD-CG 4.05Å; T155-K211 PolarHBondContact O-NZ 2.86Å; L199-K211 HydrophobicContact CD1-CG 3.84Å; L199-K211 WeakPolarHBondContact CD1-O 3.3Å; V202-K211 HydrophobicContact CG1-CB 3.72Å; V202-K211 HydrophobicContact CG1-CG 4.14Å; D203-K211 WeakPolarHBondContact O-CE 3.49Å; D204-K211 WeakPolarHBondContact OD1-CE 3.47Å; D204-K211 IonicContact OD1-NZ 2.78Å; D204-K211 PolarHBondContact OD1-NZ 3.36Å; P208-K211 HydrophobicContact CB-CB 4.12Å; P208-K211 WeakPolarHBondContact O-CB 3.4Å; P208-K211 PolarHBondContact O-N 2.88Å; P208-K211 VanDerWaalsContact O-N 3.08Å; Q209-K211 VanDerWaalsContact C-N 3.32Å; Q209-K211 PolarHBondContact O-N 3.3Å; K211-H214 PolarHBondContact O-N 3.47Å; K211-M215 WeakPolarHBondContact O-CB 3.29Å; K211-M215 PolarHBondContact O-N 3.14Å
212	S	92.5	Very high	88.9	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-63.5	-44.3	179.8	-176.4	0	0	0	0	113	P208 Q209 H214 M215 I216 E314	P208-S212 PolarHBondContact O-N 2.87Å; Q209-S212 PolarHBondContact O-N 3.46Å; S212-H214 PolarHBondContact O-N 3.18Å; S212-M215 WeakPolarHBondContact O-CB 3.27Å; S212-M215 PolarHBondContact O-N 3.46Å; S212-I216 WeakPolarHBondContact O-CG1 3.26Å; S212-I216 PolarHBondContact O-N 3.15Å; S212-E314 WeakPolarHBondContact CB-OE1 2.99Å; S212-E314 PolarHBondContact OG-OE1 2.87Å
213	M	93	Very high	89.4	Confident	2 Å²	2	51.5 Å²	51.5	1%	0.01	24%	0.241	C	C	.	.	H	α-helix	trans	-62.8	-42.7	176.9	-68.1	-66.2	-179.9	0	0	112.4	Q209 M215 I216 R217 V302 C305 L306 E317 L318 C321	Q209-M213 WeakPolarHBondContact O-CB 3.49Å; Q209-M213 VanDerWaalsContact O-CG 3.24Å; Q209-M213 WeakPolarHBondContact O-CG 3.33Å; Q209-M213 PolarHBondContact O-N 3.18Å; Q209-M213 VanDerWaalsContact O-N 3.1Å; M213-M215 VanDerWaalsContact C-N 3.35Å; M213-I216 VanDerWaalsContact O-CG1 3.29Å; M213-I216 WeakPolarHBondContact O-CG1 3.47Å; M213-I216 HydrophobicContact SD-CD1 4.49Å; M213-R217 WeakPolarHBondContact O-CB 3.47Å; M213-R217 PolarHBondContact O-N 3.06Å; M213-R217 VanDerWaalsContact O-N 3.13Å; M213-V302 HydrophobicContact CB-CB 4.34Å; M213-V302 HydrophobicContact SD-CB 4.27Å; M213-V302 HydrophobicContact SD-CG1 4.18Å; M213-C305 HydrophobicContact CE-CB 4.33Å; M213-L306 HydrophobicContact CB-CD2 3.86Å; M213-L306 HydrophobicContact CB-CG 4.48Å; M213-L306 HydrophobicContact CG-CD2 3.87Å; M213-E317 VanDerWaalsContact CE-C 3.45Å; M213-E317 HydrophobicContact CE-CB 4.09Å; M213-E317 VanDerWaalsContact CE-O 3.29Å; M213-E317 WeakPolarHBondContact CE-O 3.48Å; M213-L318 VanDerWaalsContact CE-CA 3.49Å; M213-L318 HydrophobicContact CE-CB 4.28Å; M213-L318 HydrophobicContact SD-CD1 4.21Å; M213-C321 HydrophobicContact CE-CB 3.74Å; M213-C321 HydrophobicContact SD-CB 4.15Å
214	H	92.9	Very high	89.8	Confident	46 Å²	46	47.3 Å²	47.3	21%	0.213	22%	0.22	C	C	.	.	H	α-helix	trans	-69	-34.4	176.1	-83.8	-106.2	0	0	0	112.2	L199 V202 K210 K211 S212 R217 Y218	L199-H214 HydrophobicContact CD1-CB 3.99Å; L199-H214 HydrophobicContact CD2-CB 4.17Å; L199-H214 HydrophobicContact CG-CB 4.5Å; V202-H214 HydrophobicContact CG2-CB 4.11Å; K210-H214 VanDerWaalsContact O-CB 3.31Å; K210-H214 WeakPolarHBondContact O-CB 3.34Å; K210-H214 PolarHBondContact O-CD2 3.18Å; K210-H214 PolarHBondContact O-N 3.01Å; K211-H214 PolarHBondContact O-N 3.47Å; S212-H214 PolarHBondContact O-N 3.18Å; H214-R217 WeakPolarHBondContact O-CB 3.34Å; H214-R217 PolarHBondContact O-N 3.3Å; H214-Y218 WeakPolarHBondContact O-CB 3.28Å; H214-Y218 PolarHBondContact O-N 2.92Å
215	M	95.3	Very high	90.3	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-63.1	-53.7	175	167	-176.9	171.7	0	0	111.6	G152 M154 F182 L199 K211 S212 M213 R217 Y218 M219 R232	G152-M215 WeakPolarHBondContact O-CE 3.44Å; M154-M215 HydrophobicContact CB-SD 3.87Å; M154-M215 HydrophobicContact CG-SD 4.33Å; F182-M215 HydrophobicContact CB-CB 4.45Å; F182-M215 HydrophobicContact CB-CG 4.28Å; F182-M215 HydrophobicContact CB-SD 4.18Å; F182-M215 HydrophobicContact CD1-CB 3.96Å; F182-M215 HydrophobicContact CD1-CG 3.9Å; F182-M215 HydrophobicContact CD2-CE 3.96Å; F182-M215 HydrophobicContact CD2-CG 3.66Å; F182-M215 HydrophobicContact CD2-SD 3.96Å; F182-M215 HydrophobicContact CE1-CB 4.33Å; F182-M215 HydrophobicContact CE1-CG 4.11Å; F182-M215 HydrophobicContact CE2-CE 4.3Å; F182-M215 HydrophobicContact CE2-CG 3.89Å; F182-M215 HydrophobicContact CG-CB 4.06Å; F182-M215 HydrophobicContact CG-CG 3.66Å; F182-M215 HydrophobicContact CG-SD 4.08Å; F182-M215 HydrophobicContact CZ-CG 4.1Å; L199-M215 HydrophobicContact CD1-CB 4.24Å; K211-M215 WeakPolarHBondContact O-CB 3.29Å; K211-M215 PolarHBondContact O-N 3.14Å; S212-M215 WeakPolarHBondContact O-CB 3.27Å; S212-M215 PolarHBondContact O-N 3.46Å; M213-M215 VanDerWaalsContact C-N 3.35Å; M215-R217 PolarHBondContact O-N 3Å; M215-Y218 WeakPolarHBondContact O-CB 3.26Å; M215-Y218 PolarHBondContact O-N 3.41Å; M215-Y218 VanDerWaalsContact O-N 3.1Å; M215-M219 HydrophobicContact CE-SD 3.98Å; M215-M219 HydrophobicContact CG-SD 3.86Å; M215-M219 VanDerWaalsContact O-CG 3.22Å; M215-M219 WeakPolarHBondContact O-CG 3.38Å; M215-M219 PolarHBondContact O-N 3.25Å; M215-R232 HydrophobicContact CE-CB 4.05Å; M215-R232 HydrophobicContact CE-CG 3.78Å; M215-R232 HydrophobicContact SD-CG 4.18Å
216	I	95.7	Very high	91.1	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-62.6	-34.4	178.2	60.2	150.6	0	0	0	111.8	S212 M213 M219 Y220 L290 L295 T298 V302 L318	S212-I216 WeakPolarHBondContact O-CG1 3.26Å; S212-I216 PolarHBondContact O-N 3.15Å; M213-I216 VanDerWaalsContact O-CG1 3.29Å; M213-I216 WeakPolarHBondContact O-CG1 3.47Å; M213-I216 HydrophobicContact SD-CD1 4.49Å; I216-M219 HydrophobicContact CG2-SD 4.5Å; I216-M219 PolarHBondContact O-N 2.89Å; I216-Y220 PolarHBondContact O-N 3.28Å; I216-Y220 VanDerWaalsContact O-N 3.12Å; I216-L290 HydrophobicContact CG2-CD1 4.26Å; I216-L295 HydrophobicContact CB-CD1 3.85Å; I216-T298 HydrophobicContact CD1-CG2 4.49Å; I216-V302 HydrophobicContact CD1-CG1 3.53Å; I216-V302 HydrophobicContact CG1-CG1 4.11Å; I216-L318 HydrophobicContact CD1-CD1 3.45Å; I216-L318 VanDerWaalsContact CD1-CD1 3.45Å; I216-L318 HydrophobicContact CG1-CD1 4.23Å; I216-L318 HydrophobicContact CG2-CD1 4.42Å
217	R	95.6	Very high	92.4	Very high	92 Å²	92	40.6 Å²	40.6	35%	0.347	20%	0.195	S	C	.	.	H	α-helix	trans	-61.1	-48.8	172.5	-172.2	178.4	174.9	164.7	0.7	111.3	M213 H214 M215 Y220 M221 V302	M213-R217 WeakPolarHBondContact O-CB 3.47Å; M213-R217 PolarHBondContact O-N 3.06Å; M213-R217 VanDerWaalsContact O-N 3.13Å; H214-R217 WeakPolarHBondContact O-CB 3.34Å; H214-R217 PolarHBondContact O-N 3.3Å; M215-R217 PolarHBondContact O-N 3Å; R217-Y220 PolarHBondContact O-N 3.35Å; R217-M221 HydrophobicContact CG-CG 4.26Å; R217-M221 WeakPolarHBondContact O-CB 3.03Å; R217-M221 WeakPolarHBondContact O-CG 3.29Å; R217-M221 PolarHBondContact O-N 3.27Å; R217-V302 HydrophobicContact CB-CG2 3.73Å; R217-V302 HydrophobicContact CG-CG2 4.01Å
218	Y	96.5	Very high	93.6	Very high	66 Å²	66	41.7 Å²	41.7	26%	0.259	20%	0.196	S	C	.	.	H	α-helix	trans	-60.5	-48.6	178.6	-176.7	-78.5	0	0	0	111.1	F182 V197 H214 M215 Y220 M221 H222	F182-Y218 AromaticContact CE1-CD1 3.55Å; F182-Y218 HydrophobicContact CE1-CD1 3.55Å; F182-Y218 HydrophobicContact CE1-CE1 4.29Å; F182-Y218 AromaticContact CE1-CG 3.79Å; F182-Y218 HydrophobicContact CE1-CG 3.79Å; F182-Y218 AromaticContact CZ-CD1 3.72Å; F182-Y218 HydrophobicContact CZ-CD1 3.72Å; F182-Y218 HydrophobicContact CZ-CE1 4.36Å; F182-Y218 HydrophobicContact CZ-CG 4.38Å; V197-Y218 HydrophobicContact CG1-CD1 4.29Å; V197-Y218 HydrophobicContact CG1-CD2 3.89Å; V197-Y218 HydrophobicContact CG1-CE1 4.09Å; V197-Y218 HydrophobicContact CG1-CE2 3.64Å; V197-Y218 HydrophobicContact CG1-CG 4.2Å; V197-Y218 HydrophobicContact CG2-CE1 3.77Å; V197-Y218 HydrophobicContact CG2-CE2 4.36Å; H214-Y218 WeakPolarHBondContact O-CB 3.28Å; H214-Y218 PolarHBondContact O-N 2.92Å; M215-Y218 WeakPolarHBondContact O-CB 3.26Å; M215-Y218 PolarHBondContact O-N 3.41Å; M215-Y218 VanDerWaalsContact O-N 3.1Å; Y218-Y220 PolarHBondContact O-N 3.28Å; Y218-M221 PolarHBondContact O-N 3.3Å; Y218-H222 HydrophobicContact CD1-CB 4.39Å; Y218-H222 AromaticContact CD1-CD2 3.79Å; Y218-H222 AromaticContact CD2-CD2 3.41Å; Y218-H222 VanDerWaalsContact CD2-CD2 3.41Å; Y218-H222 WeakPolarHBondContact CD2-CD2 3.32Å; Y218-H222 AromaticContact CD2-NE2 3.61Å; Y218-H222 HydrophobicContact CE1-CB 4.02Å; Y218-H222 AromaticContact CE1-CD2 3.72Å; Y218-H222 AromaticContact CE1-CG 3.91Å; Y218-H222 AromaticContact CE2-CD2 3.33Å; Y218-H222 WeakPolarHBondContact CE2-CD2 3.49Å; Y218-H222 AromaticContact CE2-NE2 3.35Å; Y218-H222 WeakPolarHBondContact CE2-NE2 3.49Å; Y218-H222 AromaticContact CG-CD2 3.64Å; Y218-H222 AromaticContact CZ-CD2 3.49Å; Y218-H222 VanDerWaalsContact CZ-CD2 3.49Å; Y218-H222 AromaticContact CZ-CG 3.79Å; Y218-H222 AromaticContact CZ-NE2 3.85Å; Y218-H222 WeakPolarHBondContact O-CB 3.46Å; Y218-H222 PolarHBondContact O-CD2 2.88Å; Y218-H222 PolarHBondContact O-N 3Å
219	M	97.3	Very high	94.4	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.01	19%	0.191	C	C	.	.	H	α-helix	trans	-53	-43.6	178.1	-67.3	166.4	82	0	0	111.3	F150 F182 M215 I216 H223 G224 F230 L231 L295	F150-M219 HydrophobicContact CD1-CB 4.47Å; F150-M219 HydrophobicContact CD1-CE 3.61Å; F150-M219 HydrophobicContact CD1-CG 4.09Å; F150-M219 HydrophobicContact CE1-CB 4.41Å; F150-M219 HydrophobicContact CE1-CE 4.03Å; F150-M219 HydrophobicContact CE1-CG 3.75Å; F182-M219 HydrophobicContact CE2-CG 4.22Å; F182-M219 HydrophobicContact CZ-CG 3.86Å; M215-M219 HydrophobicContact CE-SD 3.98Å; M215-M219 HydrophobicContact CG-SD 3.86Å; M215-M219 VanDerWaalsContact O-CG 3.22Å; M215-M219 WeakPolarHBondContact O-CG 3.38Å; M215-M219 PolarHBondContact O-N 3.25Å; I216-M219 HydrophobicContact CG2-SD 4.5Å; I216-M219 PolarHBondContact O-N 2.89Å; M219-H223 CarbonylContact O-C 3.55Å; M219-H223 VanDerWaalsContact O-CA 3.3Å; M219-H223 WeakPolarHBondContact O-CA 3.43Å; M219-H223 VanDerWaalsContact O-CB 3.27Å; M219-H223 WeakPolarHBondContact O-CB 3.28Å; M219-H223 PolarHBondContact O-N 2.77Å; M219-G224 PolarHBondContact O-N 2.69Å; M219-F230 HydrophobicContact CB-CD1 4.01Å; M219-F230 HydrophobicContact CB-CE1 4.44Å; M219-F230 HydrophobicContact CE-CB 3.85Å; M219-F230 HydrophobicContact CE-CD1 4.08Å; M219-F230 HydrophobicContact CE-CG 4.47Å; M219-L231 WeakPolarHBondContact CE-O 3.24Å; M219-L295 HydrophobicContact CB-CD2 4.33Å
220	Y	96.5	Very high	95	Very high	58 Å²	58	39.9 Å²	39.9	23%	0.227	19%	0.186	C	C	.	.	H	α-helix	trans	-69.7	-49.2	176.7	-175.4	-110.7	0	0	0	113.3	I216 R217 Y218 H222 G224 L295 R296 A299 P300	I216-Y220 PolarHBondContact O-N 3.28Å; I216-Y220 VanDerWaalsContact O-N 3.12Å; R217-Y220 PolarHBondContact O-N 3.35Å; Y218-Y220 PolarHBondContact O-N 3.28Å; Y220-H222 VanDerWaalsContact C-N 3.27Å; Y220-H222 PolarHBondContact O-N 3.3Å; Y220-G224 WeakPolarHBondContact O-CA 3.31Å; Y220-G224 PolarHBondContact O-N 2.98Å; Y220-L295 HydrophobicContact CD2-CB 4.43Å; Y220-L295 HydrophobicContact CD2-CD2 4.22Å; Y220-L295 HydrophobicContact CD2-CG 4.05Å; Y220-L295 HydrophobicContact CG-CD2 4.45Å; Y220-L295 HydrophobicContact CG-CG 4.23Å; Y220-R296 HydrophobicContact CE2-CB 3.77Å; Y220-R296 HydrophobicContact CE2-CG 3.99Å; Y220-R296 VanDerWaalsContact OH-CG 3.3Å; Y220-R296 WeakPolarHBondContact OH-CG 3.49Å; Y220-A299 HydrophobicContact CD1-CB 3.68Å; Y220-A299 HydrophobicContact CG-CB 3.59Å; Y220-P300 HydrophobicContact CD1-CG 4.49Å; Y220-P300 HydrophobicContact CE1-CG 4.1Å
221	M	95.8	Very high	95.5	Very high	100 Å²	100	35.5 Å²	35.5	49%	0.493	17%	0.167	S	C	.	.	H	α-helix	trans	-65	-32.1	-174.5	-67.7	-66.3	172.5	0	0	112.4	R217 Y218	R217-M221 HydrophobicContact CG-CG 4.26Å; R217-M221 WeakPolarHBondContact O-CB 3.03Å; R217-M221 WeakPolarHBondContact O-CG 3.29Å; R217-M221 PolarHBondContact O-N 3.27Å; Y218-M221 PolarHBondContact O-N 3.3Å
222	H	95.6	Very high	95.8	Very high	99 Å²	99	35.3 Å²	35.3	46%	0.458	17%	0.166	S	C	.	.	H	α-helix	trans	-100.5	-29.1	-177.9	-67.8	-83	0	0	0	113.9	Y218 Y220 Q226	Y218-H222 HydrophobicContact CD1-CB 4.39Å; Y218-H222 AromaticContact CD1-CD2 3.79Å; Y218-H222 AromaticContact CD2-CD2 3.41Å; Y218-H222 VanDerWaalsContact CD2-CD2 3.41Å; Y218-H222 WeakPolarHBondContact CD2-CD2 3.32Å; Y218-H222 AromaticContact CD2-NE2 3.61Å; Y218-H222 HydrophobicContact CE1-CB 4.02Å; Y218-H222 AromaticContact CE1-CD2 3.72Å; Y218-H222 AromaticContact CE1-CG 3.91Å; Y218-H222 AromaticContact CE2-CD2 3.33Å; Y218-H222 WeakPolarHBondContact CE2-CD2 3.49Å; Y218-H222 AromaticContact CE2-NE2 3.35Å; Y218-H222 WeakPolarHBondContact CE2-NE2 3.49Å; Y218-H222 AromaticContact CG-CD2 3.64Å; Y218-H222 AromaticContact CZ-CD2 3.49Å; Y218-H222 VanDerWaalsContact CZ-CD2 3.49Å; Y218-H222 AromaticContact CZ-CG 3.79Å; Y218-H222 AromaticContact CZ-NE2 3.85Å; Y218-H222 WeakPolarHBondContact O-CB 3.46Å; Y218-H222 PolarHBondContact O-CD2 2.88Å; Y218-H222 PolarHBondContact O-N 3Å; Y220-H222 VanDerWaalsContact C-N 3.27Å; Y220-H222 PolarHBondContact O-N 3.3Å; H222-Q226 PolarHBondContact O-NE2 2.59Å
223	H	96.1	Very high	96	Very high	34 Å²	34	35.3 Å²	35.3	16%	0.157	17%	0.166	C	C	.	.	H	α-helix	trans	-130	-1.8	-171.5	-55.8	-73.5	0	0	0	114.3	F150 M219 S225 Q226 F227 F230	F150-H223 HydrophobicContact CD2-CB 4.05Å; F150-H223 AromaticContact CD2-CG 3.85Å; F150-H223 HydrophobicContact CE2-CB 4.21Å; F150-H223 AromaticContact CE2-CD2 3.38Å; F150-H223 WeakPolarHBondContact CE2-CD2 3.41Å; F150-H223 AromaticContact CE2-CE1 3.76Å; F150-H223 AromaticContact CE2-CG 3.54Å; F150-H223 AromaticContact CE2-ND1 3.78Å; F150-H223 AromaticContact CE2-NE2 3.55Å; F150-H223 HydrophobicContact CG-CB 4.39Å; F150-H223 AromaticContact CZ-CD2 3.41Å; F150-H223 VanDerWaalsContact CZ-CD2 3.41Å; F150-H223 WeakPolarHBondContact CZ-CD2 3.34Å; F150-H223 AromaticContact CZ-NE2 3.66Å; M219-H223 CarbonylContact O-C 3.55Å; M219-H223 VanDerWaalsContact O-CA 3.3Å; M219-H223 WeakPolarHBondContact O-CA 3.43Å; M219-H223 VanDerWaalsContact O-CB 3.27Å; M219-H223 WeakPolarHBondContact O-CB 3.28Å; M219-H223 PolarHBondContact O-N 2.77Å; H223-S225 VanDerWaalsContact C-N 3.25Å; H223-S225 PolarHBondContact O-N 3Å; H223-S225 VanDerWaalsContact O-N 3.16Å; H223-Q226 PolarHBondContact O-N 3.46Å; H223-F227 HydrophobicContact CB-CD2 3.91Å; H223-F227 HydrophobicContact CB-CE2 4.22Å; H223-F227 PolarHBondContact O-N 3.35Å; H223-F230 HydrophobicContact CB-CE1 4.11Å
224	G	93.2	Very high	96.1	Very high	5 Å²	5	36.5 Å²	36.5	5%	0.052	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-32.1	-176.3	0	0	0	0	0	115	M219 Y220 R292	M219-G224 PolarHBondContact O-N 2.69Å; Y220-G224 WeakPolarHBondContact O-CA 3.31Å; Y220-G224 PolarHBondContact O-N 2.98Å; G224-R292 WeakPolarHBondContact O-CD 3.25Å; G224-R292 WeakPolarHBondContact O-CG 3.25Å
225	S	92.7	Very high	96.2	Very high	70 Å²	70	35 Å²	35	49%	0.49	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-22.2	177.5	57.5	0	0	0	0	113.5	R146 H223	R146-S225 WeakPolarHBondContact CD-O 3.42Å; R146-S225 PolarHBondContact NE-O 2.78Å; H223-S225 VanDerWaalsContact C-N 3.25Å; H223-S225 PolarHBondContact O-N 3Å; H223-S225 VanDerWaalsContact O-N 3.16Å
226	Q	95	Very high	96.3	Very high	93 Å²	93	35.7 Å²	35.7	44%	0.435	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-27	-170.3	-61	173.5	24.7	0	0	113.2	R146 R147 H222 H223	R146-Q226 WeakPolarHBondContact CA-O 3.49Å; R146-Q226 WeakPolarHBondContact CB-O 3.49Å; R147-Q226 PolarHBondContact N-O 3.34Å; H222-Q226 PolarHBondContact O-NE2 2.59Å; H223-Q226 PolarHBondContact O-N 3.46Å
227	F	97.7	Very high	96.3	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.009	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	154.2	-173.9	-66.1	-92.7	0	0	0	113.8	R147 L149 F150 S178 H223 F230	R147-F227 HydrophobicContact CB-CD1 3.42Å; R147-F227 VanDerWaalsContact CB-CD1 3.42Å; R147-F227 HydrophobicContact CB-CE1 3.34Å; R147-F227 HydrophobicContact CB-CG 4.25Å; R147-F227 HydrophobicContact CB-CZ 4.14Å; R147-F227 HydrophobicContact CG-CE1 4.19Å; R147-F227 CarbonylContact O-C 3.48Å; R147-F227 VanDerWaalsContact O-CA 3.22Å; R147-F227 WeakPolarHBondContact O-CA 3.29Å; L149-F227 WeakPolarHBondContact O-CD1 3.47Å; L149-F227 VanDerWaalsContact O-CE1 3.27Å; L149-F227 WeakPolarHBondContact O-CE1 3.38Å; F150-F227 HydrophobicContact CB-CB 4.04Å; F150-F227 HydrophobicContact CB-CD1 3.87Å; F150-F227 HydrophobicContact CB-CD2 3.87Å; F150-F227 HydrophobicContact CB-CE1 4.25Å; F150-F227 HydrophobicContact CB-CE2 4.25Å; F150-F227 HydrophobicContact CB-CG 3.66Å; F150-F227 HydrophobicContact CB-CZ 4.42Å; F150-F227 AromaticContact CD2-CD2 3.98Å; F150-F227 HydrophobicContact CD2-CD2 3.98Å; F150-F227 AromaticContact CD2-CE2 3.63Å; F150-F227 HydrophobicContact CD2-CE2 3.63Å; F150-F227 AromaticContact CD2-CZ 3.92Å; F150-F227 HydrophobicContact CD2-CZ 3.92Å; F150-F227 HydrophobicContact CG-CD2 4.31Å; F150-F227 HydrophobicContact CG-CE2 4.38Å; S178-F227 WeakPolarHBondContact OG-CE1 3.48Å; H223-F227 HydrophobicContact CB-CD2 3.91Å; H223-F227 HydrophobicContact CB-CE2 4.22Å; H223-F227 PolarHBondContact O-N 3.35Å; F227-F230 HydrophobicContact CB-CE1 4.12Å; F227-F230 HydrophobicContact CB-CE2 4.31Å; F227-F230 HydrophobicContact CB-CZ 3.77Å
228	E	97.3	Very high	96.4	Very high	63 Å²	63	31.6 Å²	31.6	29%	0.294	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	-34.1	177	-65.2	-176.2	176.8	0	0	113.3	R146 R147 L148 A253 R292	R146-E228 HydrophobicContact CB-CG 3.98Å; R147-E228 PolarHBondContact O-N 2.97Å; L148-E228 PolarHBondContact O-N 2.97Å; E228-A253 HydrophobicContact CB-CB 3.84Å; E228-A253 WeakPolarHBondContact O-CB 3.34Å; E228-R292 VanDerWaalsContact O-CB 3.27Å; E228-R292 WeakPolarHBondContact O-CB 3.23Å; E228-R292 PolarHBondContact O-N 3.23Å
229	W	98.5	Very high	96.5	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	148.8	-176.5	-62.6	93.8	0	0	0	111.5	L148 L149 F150 L248 L251 A253 L257 L259 V289	L148-W229 WeakPolarHBondContact O-CB 3.06Å; L148-W229 PolarHBondContact O-N 3.46Å; L149-W229 WeakPolarHBondContact CA-O 3Å; L149-W229 HydrophobicContact CD1-CB 3.95Å; F150-W229 PolarHBondContact N-O 3.23Å; W229-L248 HydrophobicContact CB-CD1 3.87Å; W229-L248 HydrophobicContact CD2-CB 4.36Å; W229-L248 HydrophobicContact CD2-CD1 4.36Å; W229-L248 HydrophobicContact CD2-CD2 3.77Å; W229-L248 HydrophobicContact CD2-CG 4.36Å; W229-L248 HydrophobicContact CE3-CD2 3.87Å; W229-L248 HydrophobicContact CG-CB 4.22Å; W229-L248 HydrophobicContact CG-CD1 3.87Å; W229-L248 HydrophobicContact CG-CD2 4.17Å; W229-L248 HydrophobicContact CG-CG 4.29Å; W229-L248 HydrophobicContact CH2-CD2 4.46Å; W229-L248 HydrophobicContact CZ2-CD2 4.4Å; W229-L248 HydrophobicContact CZ3-CD2 4.21Å; W229-L251 HydrophobicContact CH2-CB 3.91Å; W229-L251 HydrophobicContact CH2-CD1 4.32Å; W229-L251 HydrophobicContact CZ2-CB 3.67Å; W229-A253 HydrophobicContact CD2-CB 4.36Å; W229-A253 HydrophobicContact CZ2-CB 3.93Å; W229-L257 HydrophobicContact CH2-CB 4.25Å; W229-L257 HydrophobicContact CH2-CD1 3.79Å; W229-L257 HydrophobicContact CZ3-CB 4.21Å; W229-L259 HydrophobicContact CZ3-CD1 4.18Å; W229-V289 HydrophobicContact CB-CG1 4.46Å; W229-V289 HydrophobicContact CE3-CG1 3.78Å; W229-V289 HydrophobicContact CZ3-CG1 4.44Å
230	F	98.5	Very high	96.5	Very high	2 Å²	2	30 Å²	30	1%	0.009	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	120.9	-177.6	-64.1	-91.2	0	0	0	109.4	F150 M219 H223 F227 V289 L290 R292 L295	F150-F230 HydrophobicContact CB-CD1 3.78Å; F150-F230 HydrophobicContact CB-CE1 3.93Å; F150-F230 HydrophobicContact CD1-CD1 4.08Å; F150-F230 HydrophobicContact CD1-CE1 4.48Å; F150-F230 HydrophobicContact CG-CD1 4.22Å; F150-F230 HydrophobicContact CG-CE1 4.32Å; F150-F230 CarbonylContact O-C 3.56Å; F150-F230 WeakPolarHBondContact O-CA 3.35Å; M219-F230 HydrophobicContact CB-CD1 4.01Å; M219-F230 HydrophobicContact CB-CE1 4.44Å; M219-F230 HydrophobicContact CE-CB 3.85Å; M219-F230 HydrophobicContact CE-CD1 4.08Å; M219-F230 HydrophobicContact CE-CG 4.47Å; H223-F230 HydrophobicContact CB-CE1 4.11Å; F227-F230 HydrophobicContact CB-CE1 4.12Å; F227-F230 HydrophobicContact CB-CE2 4.31Å; F227-F230 HydrophobicContact CB-CZ 3.77Å; F230-V289 CarbonylContact O-C 3.6Å; F230-V289 WeakPolarHBondContact O-CA 3.49Å; F230-L290 PolarHBondContact N-O 3.34Å; F230-L290 PolarHBondContact O-N 2.9Å; F230-R292 HydrophobicContact CE2-CB 4.21Å; F230-R292 HydrophobicContact CE2-CG 4.39Å; F230-L295 HydrophobicContact CB-CD2 4.05Å; F230-L295 HydrophobicContact CD1-CD2 3.73Å; F230-L295 HydrophobicContact CD2-CB 4.4Å; F230-L295 HydrophobicContact CD2-CD2 3.54Å; F230-L295 HydrophobicContact CE1-CD2 4.05Å; F230-L295 HydrophobicContact CE2-CD2 3.9Å; F230-L295 HydrophobicContact CG-CD2 3.47Å; F230-L295 VanDerWaalsContact CG-CD2 3.47Å; F230-L295 HydrophobicContact CZ-CD2 4.15Å
231	L	98.4	Very high	96.5	Very high	2 Å²	2	27.6 Å²	27.6	1%	0.01	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	120.8	174.9	171.2	64.3	0	0	0	109.6	L149 F150 V151 G152 M219 A233 V239 L244 V289	L149-L231 HydrophobicContact CD1-CB 4.03Å; F150-L231 PolarHBondContact O-N 3.34Å; V151-L231 HydrophobicContact CG1-CB 4.38Å; V151-L231 HydrophobicContact CG1-CD2 3.91Å; V151-L231 HydrophobicContact CG1-CG 4.22Å; V151-L231 HydrophobicContact CG2-CB 4.2Å; V151-L231 HydrophobicContact CG2-CD2 4.12Å; G152-L231 PolarHBondContact N-O 3.45Å; M219-L231 WeakPolarHBondContact CE-O 3.24Å; L231-A233 HydrophobicContact CD2-CB 4.38Å; L231-A233 HydrophobicContact CG-CB 4.2Å; L231-V239 HydrophobicContact CD2-CG1 4.5Å; L231-V239 HydrophobicContact CD2-CG2 4.16Å; L231-L244 HydrophobicContact CD2-CD2 4Å; L231-V289 HydrophobicContact CB-CG2 4.48Å; L231-V289 HydrophobicContact CD1-CG2 3.73Å
232	R	97.5	Very high	96.4	Very high	4 Å²	4	27.1 Å²	27.1	2%	0.015	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	117.9	161.2	177	-92	-178.7	-138.6	-8.5	107.8	M215 D234 G284 G287 I288 E314	M215-R232 HydrophobicContact CE-CB 4.05Å; M215-R232 HydrophobicContact CE-CG 3.78Å; M215-R232 HydrophobicContact SD-CG 4.18Å; R232-D234 IonicContact CZ-OD1 2.62Å; R232-D234 IonicContact NH1-OD1 3.83Å; R232-D234 PolarHBondContact NH1-OD1 3.04Å; R232-D234 IonicContact NH1-OD2 3.28Å; R232-D234 PolarHBondContact NH1-OD2 3.13Å; R232-D234 IonicContact NH2-OD1 3.97Å; R232-D234 PolarHBondContact NH2-OD1 2.03Å; R232-G284 PolarHBondContact NH1-O 3.04Å; R232-G287 CarbonylContact O-C 3.59Å; R232-G287 WeakPolarHBondContact O-CA 3.41Å; R232-I288 PolarHBondContact N-O 3.48Å; R232-I288 PolarHBondContact O-N 2.99Å; R232-E314 IonicContact CZ-OE2 3.56Å; R232-E314 IonicContact NE-OE1 3.26Å; R232-E314 IonicContact NE-OE2 3.53Å; R232-E314 IonicContact NH2-OE1 3.97Å; R232-E314 IonicContact NH2-OE2 2.73Å; R232-E314 PolarHBondContact NH2-OE2 2.96Å
233	A	97.2	Very high	96.3	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	149	-176.9	0	0	0	0	0	111.4	V151 G152 V153 M154 L231 V237	V151-A233 HydrophobicContact CG1-CB 4.37Å; G152-A233 PolarHBondContact O-N 3.26Å; V153-A233 CarbonylContact C-O 3.51Å; V153-A233 WeakPolarHBondContact CA-O 3.2Å; V153-A233 HydrophobicContact CG2-CB 4.1Å; M154-A233 PolarHBondContact N-O 2.87Å; L231-A233 HydrophobicContact CD2-CB 4.38Å; L231-A233 HydrophobicContact CG-CB 4.2Å; A233-V237 HydrophobicContact CB-CG1 3.83Å
234	D	95.5	Very high	96.4	Very high	28 Å²	28	25.5 Å²	25.5	15%	0.15	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	164.4	167.7	-76.7	-23.9	0	0	0	111.2	R232 D236 V237 G285	R232-D234 IonicContact CZ-OD1 2.62Å; R232-D234 IonicContact NH1-OD1 3.83Å; R232-D234 PolarHBondContact NH1-OD1 3.04Å; R232-D234 IonicContact NH1-OD2 3.28Å; R232-D234 PolarHBondContact NH1-OD2 3.13Å; R232-D234 IonicContact NH2-OD1 3.97Å; R232-D234 PolarHBondContact NH2-OD1 2.03Å; D234-D236 VanDerWaalsContact C-N 3.26Å; D234-D236 PolarHBondContact O-N 3.45Å; D234-V237 VanDerWaalsContact O-CG1 3.23Å; D234-V237 WeakPolarHBondContact O-CG1 3.29Å; D234-V237 PolarHBondContact O-N 2.85Å; D234-G285 VanDerWaalsContact OD2-CA 3.28Å; D234-G285 WeakPolarHBondContact OD2-CA 3.32Å
235	D	95.5	Very high	96.5	Very high	13 Å²	13	27.7 Å²	27.7	7%	0.07	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-9.4	-179.3	63.1	26.4	0	0	0	115.1	V153 M154 T155 Y159 R163 I167	V153-D235 HydrophobicContact CG1-CB 4.24Å; M154-D235 PolarHBondContact O-N 3.06Å; T155-D235 WeakPolarHBondContact CB-OD2 3.48Å; T155-D235 WeakPolarHBondContact OG1-CB 3.41Å; T155-D235 PolarHBondContact OG1-OD2 2.79Å; Y159-D235 WeakPolarHBondContact CB-OD2 3.36Å; Y159-D235 WeakPolarHBondContact CD2-OD2 3.37Å; R163-D235 HydrophobicContact CB-CB 4.15Å; R163-D235 WeakPolarHBondContact CB-O 3.39Å; R163-D235 VanDerWaalsContact CD-OD1 3.24Å; R163-D235 WeakPolarHBondContact CD-OD1 3.39Å; R163-D235 IonicContact CZ-OD1 2.88Å; R163-D235 IonicContact NE-OD1 3.28Å; R163-D235 IonicContact NH1-OD1 2.8Å; R163-D235 PolarHBondContact NH1-OD1 3.13Å; I167-D235 WeakPolarHBondContact CD1-O 3.37Å
236	D	95.7	Very high	96.6	Very high	16 Å²	16	31 Å²	31	9%	0.086	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.9	26.5	174.8	58.4	2.4	0	0	0	112.7	R163 D234 H366 P367 L368 K369	R163-D236 IonicContact NH1-OD2 2.6Å; D234-D236 VanDerWaalsContact C-N 3.26Å; D234-D236 PolarHBondContact O-N 3.45Å; D236-H366 IonicContact OD1-CD2 2.98Å; D236-H366 PolarHBondContact OD1-CD2 3.44Å; D236-H366 VanDerWaalsContact OD1-CD2 3.28Å; D236-H366 IonicContact OD1-NE2 2.69Å; D236-P367 CarbonylContact O-C 3.53Å; D236-L368 PolarHBondContact O-N 2.97Å; D236-K369 HydrophobicContact CB-CG 4.4Å
237	V	97	Very high	96.6	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.006	13%	0.129	C	C	.	.			trans	-97	148.6	173.5	84.2	0	0	0	0	112.1	W171 A233 D234 V239 V364 H366	W171-V237 HydrophobicContact CH2-CG1 4.32Å; W171-V237 HydrophobicContact CZ2-CG1 3.76Å; W171-V237 PolarHBondContact NE1-O 3.31Å; A233-V237 HydrophobicContact CB-CG1 3.83Å; D234-V237 VanDerWaalsContact O-CG1 3.23Å; D234-V237 WeakPolarHBondContact O-CG1 3.29Å; D234-V237 PolarHBondContact O-N 2.85Å; V237-V239 HydrophobicContact CG1-CG2 4.02Å; V237-V239 HydrophobicContact CG2-CG2 4.27Å; V237-V364 HydrophobicContact CG2-CG1 3.18Å; V237-H366 HydrophobicContact CG2-CB 4.41Å
238	F	97.5	Very high	96.6	Very high	5 Å²	5	28.1 Å²	28.1	2%	0.022	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	123.6	166.6	-175	-84.6	0	0	0	110.6	W171 R240 V364 L365 L368 M374 M377 Y378 F381	W171-F238 HydrophobicContact CB-CD2 4.44Å; W171-F238 HydrophobicContact CB-CE2 4.09Å; W171-F238 HydrophobicContact CB-CZ 4.31Å; W171-F238 AromaticContact CD1-CD2 3.48Å; W171-F238 VanDerWaalsContact CD1-CD2 3.48Å; W171-F238 AromaticContact CD1-CE2 3.9Å; W171-F238 HydrophobicContact CG-CD2 4.26Å; W171-F238 HydrophobicContact CG-CE2 4.38Å; F238-R240 HydrophobicContact CE1-CG 4.02Å; F238-V364 CarbonylContact O-C 3.58Å; F238-V364 WeakPolarHBondContact O-CA 3.44Å; F238-L365 HydrophobicContact CB-CB 4.4Å; F238-L365 HydrophobicContact CD1-CD1 3.77Å; F238-L365 PolarHBondContact N-O 3.1Å; F238-L365 PolarHBondContact O-N 3.47Å; F238-L368 HydrophobicContact CB-CD1 3.83Å; F238-L368 HydrophobicContact CB-CD2 4.01Å; F238-M374 HydrophobicContact CD2-CG 3.99Å; F238-M377 HydrophobicContact CD1-CG 4.02Å; F238-M377 HydrophobicContact CD2-CB 4.4Å; F238-M377 HydrophobicContact CD2-CG 4.21Å; F238-M377 HydrophobicContact CE1-CG 4.16Å; F238-M377 HydrophobicContact CE2-CB 4.47Å; F238-M377 HydrophobicContact CE2-CG 4.36Å; F238-M377 HydrophobicContact CG-CG 4.04Å; F238-M377 HydrophobicContact CZ-CG 4.33Å; F238-Y378 HydrophobicContact CE2-CD2 4.06Å; F238-Y378 HydrophobicContact CE2-CG 4.45Å; F238-Y378 HydrophobicContact CZ-CD2 4.01Å; F238-F381 HydrophobicContact CD1-CD2 4.33Å; F238-F381 HydrophobicContact CD1-CE2 4.15Å; F238-F381 AromaticContact CE1-CD2 3.45Å; F238-F381 HydrophobicContact CE1-CD2 3.45Å; F238-F381 VanDerWaalsContact CE1-CD2 3.45Å; F238-F381 AromaticContact CE1-CE2 3.7Å; F238-F381 HydrophobicContact CE1-CE2 3.7Å; F238-F381 AromaticContact CZ-CD2 3.9Å; F238-F381 HydrophobicContact CZ-CD2 3.9Å
239	V	98.2	Very high	96.5	Very high	3 Å²	3	33 Å²	33	2%	0.018	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	126.2	-175.6	-178.1	0	0	0	0	111	W171 L231 V237 V241 L244 V364	W171-V239 WeakPolarHBondContact CB-O 3.38Å; W171-V239 HydrophobicContact CD2-CB 4.07Å; W171-V239 HydrophobicContact CE3-CB 3.82Å; W171-V239 HydrophobicContact CE3-CG2 4.32Å; W171-V239 HydrophobicContact CH2-CG2 4.17Å; W171-V239 HydrophobicContact CZ2-CG2 4.34Å; W171-V239 HydrophobicContact CZ3-CB 4.09Å; W171-V239 HydrophobicContact CZ3-CG2 4.16Å; L231-V239 HydrophobicContact CD2-CG1 4.5Å; L231-V239 HydrophobicContact CD2-CG2 4.16Å; V237-V239 HydrophobicContact CG1-CG2 4.02Å; V237-V239 HydrophobicContact CG2-CG2 4.27Å; V239-V241 VanDerWaalsContact C-N 3.34Å; V239-V241 HydrophobicContact CG1-CG2 4.4Å; V239-V241 PolarHBondContact O-N 2.84Å; V239-V241 VanDerWaalsContact O-N 3.08Å; V239-L244 HydrophobicContact CG1-CB 4.35Å; V239-L244 HydrophobicContact CG1-CD2 3.79Å; V239-V364 HydrophobicContact CG1-CG2 4.32Å; V239-V364 HydrophobicContact CG2-CG1 4.11Å; V239-V364 HydrophobicContact CG2-CG2 4.26Å
240	R	96.8	Very high	96.2	Very high	32 Å²	32	37.2 Å²	37.2	12%	0.121	17%	0.174	C	C	.	.			trans	-82.9	82.7	168.8	-63.7	171.7	71.2	-179.5	15.5	109.1	F238 E242 R243 L244 Q360 A362 I363 F381	F238-R240 HydrophobicContact CE1-CG 4.02Å; R240-E242 VanDerWaalsContact C-N 3.31Å; R240-E242 PolarHBondContact O-N 3.38Å; R240-R243 HydrophobicContact CB-CB 4.25Å; R240-R243 VanDerWaalsContact CZ-CZ 3.46Å; R240-R243 VanDerWaalsContact NH1-NH1 3.11Å; R240-R243 VanDerWaalsContact NH2-NE 3.11Å; R240-R243 PolarHBondContact O-N 3.14Å; R240-L244 PolarHBondContact O-N 3.4Å; R240-Q360 PolarHBondContact NH1-O 3.39Å; R240-A362 WeakPolarHBondContact CD-O 3.36Å; R240-A362 PolarHBondContact NH1-O 3.38Å; R240-I363 WeakPolarHBondContact CB-O 3.43Å; R240-I363 PolarHBondContact N-O 3.29Å; R240-F381 HydrophobicContact CG-CD2 4.44Å; R240-F381 HydrophobicContact CG-CE2 4.38Å
241	V	96.8	Very high	96.1	Very high	8 Å²	8	40.2 Å²	40.2	5%	0.048	19%	0.19	C	C	.	.	H	α-helix	trans	-47.3	-48.6	-170.6	-179.1	0	0	0	0	112.5	W171 L175 V239 R243 L244 E245	W171-V241 HydrophobicContact CE3-CG2 4.15Å; L175-V241 HydrophobicContact CD1-CG2 4.31Å; L175-V241 HydrophobicContact CD2-CG1 3.73Å; L175-V241 HydrophobicContact CD2-CG2 4.38Å; L175-V241 HydrophobicContact CG-CG1 4.31Å; L175-V241 HydrophobicContact CG-CG2 4.19Å; V239-V241 VanDerWaalsContact C-N 3.34Å; V239-V241 HydrophobicContact CG1-CG2 4.4Å; V239-V241 PolarHBondContact O-N 2.84Å; V239-V241 VanDerWaalsContact O-N 3.08Å; V241-R243 PolarHBondContact O-N 3.37Å; V241-L244 WeakPolarHBondContact O-CB 3.49Å; V241-L244 PolarHBondContact O-N 2.97Å; V241-E245 HydrophobicContact CG1-CG 4.33Å; V241-E245 WeakPolarHBondContact O-CG 3.11Å; V241-E245 PolarHBondContact O-N 3.26Å
242	E	93.6	Very high	95.9	Very high	90 Å²	90	44 Å²	44	42%	0.421	21%	0.21	S	C	.	.	H	α-helix	trans	-63.3	-38.5	-179.2	-67.8	84	172.7	0	0	113.8	K174 R240 L244 E245 Q246	K174-E242 WeakPolarHBondContact CD-OE1 3.5Å; K174-E242 VanDerWaalsContact CE-OE1 3.27Å; K174-E242 WeakPolarHBondContact CE-OE1 3.1Å; K174-E242 IonicContact NZ-OE1 3.9Å; K174-E242 PolarHBondContact NZ-OE1 3.08Å; K174-E242 IonicContact NZ-OE2 2.86Å; K174-E242 PolarHBondContact NZ-OE2 2.72Å; R240-E242 VanDerWaalsContact C-N 3.31Å; R240-E242 PolarHBondContact O-N 3.38Å; E242-L244 VanDerWaalsContact C-N 3.34Å; E242-E245 PolarHBondContact O-N 2.83Å; E242-Q246 WeakPolarHBondContact O-CB 3.36Å; E242-Q246 PolarHBondContact O-N 2.84Å
243	R	93.7	Very high	95.7	Very high	99 Å²	99	44 Å²	44	37%	0.374	21%	0.212	S	C	.	.	H	α-helix	trans	-71.2	-36	177.6	-71.7	-152.5	175.4	-179.2	2.5	111	R240 V241 Q246 L247 Q360 I363	R240-R243 HydrophobicContact CB-CB 4.25Å; R240-R243 VanDerWaalsContact CZ-CZ 3.46Å; R240-R243 VanDerWaalsContact NH1-NH1 3.11Å; R240-R243 VanDerWaalsContact NH2-NE 3.11Å; R240-R243 PolarHBondContact O-N 3.14Å; V241-R243 PolarHBondContact O-N 3.37Å; R243-Q246 PolarHBondContact O-N 2.96Å; R243-L247 PolarHBondContact O-N 2.96Å; R243-L247 VanDerWaalsContact O-N 3.08Å; R243-Q360 PolarHBondContact NH1-O 2.81Å; R243-I363 HydrophobicContact CB-CD1 4.42Å; R243-I363 HydrophobicContact CB-CG1 4Å; R243-I363 HydrophobicContact CB-CG2 4.34Å
244	L	97.3	Very high	95.6	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-62.8	-50.1	172.4	-177.5	57.3	0	0	0	110.1	L149 L231 V239 R240 V241 E242 Q246 L247 L248 V289 F340 I363	L149-L244 HydrophobicContact CD2-CD2 3.74Å; L149-L244 HydrophobicContact CD2-CG 4.3Å; L231-L244 HydrophobicContact CD2-CD2 4Å; V239-L244 HydrophobicContact CG1-CB 4.35Å; V239-L244 HydrophobicContact CG1-CD2 3.79Å; R240-L244 PolarHBondContact O-N 3.4Å; V241-L244 WeakPolarHBondContact O-CB 3.49Å; V241-L244 PolarHBondContact O-N 2.97Å; E242-L244 VanDerWaalsContact C-N 3.34Å; L244-Q246 VanDerWaalsContact C-N 3.3Å; L244-Q246 PolarHBondContact O-N 2.04Å; L244-L247 WeakPolarHBondContact O-CB 3.38Å; L244-L247 PolarHBondContact O-N 3.29Å; L244-L247 VanDerWaalsContact O-N 3.13Å; L244-L248 HydrophobicContact CD1-CD1 4.17Å; L244-L248 HydrophobicContact CD1-CD2 4.48Å; L244-L248 HydrophobicContact CD1-CG 4.17Å; L244-L248 HydrophobicContact CG-CD1 3.95Å; L244-L248 HydrophobicContact CG-CG 4.35Å; L244-L248 VanDerWaalsContact O-CG 3.28Å; L244-L248 WeakPolarHBondContact O-CG 3.38Å; L244-L248 PolarHBondContact O-N 2.81Å; L244-V289 HydrophobicContact CD1-CG2 4.33Å; L244-F340 HydrophobicContact CD1-CZ 4.23Å; L244-I363 HydrophobicContact CB-CG2 3.58Å; L244-I363 HydrophobicContact CD1-CG2 4.19Å; L244-I363 HydrophobicContact CG-CG2 4.43Å
245	E	97.1	Very high	95.7	Very high	50 Å²	50	53.5 Å²	53.5	23%	0.234	26%	0.255	C	S	.	.	H	α-helix	trans	-57.6	-42	176.5	-71.7	-154.8	171.4	0	0	112.6	L148 V241 E242 L247 L248 R249	L148-E245 HydrophobicContact CD2-CB 3.52Å; L148-E245 HydrophobicContact CD2-CG 3.63Å; V241-E245 HydrophobicContact CG1-CG 4.33Å; V241-E245 WeakPolarHBondContact O-CG 3.11Å; V241-E245 PolarHBondContact O-N 3.26Å; E242-E245 PolarHBondContact O-N 2.83Å; E245-L247 VanDerWaalsContact C-N 3.32Å; E245-L247 PolarHBondContact O-N 3.01Å; E245-L248 PolarHBondContact O-N 2.92Å; E245-R249 WeakPolarHBondContact O-CB 3.48Å; E245-R249 VanDerWaalsContact O-CG 3.26Å; E245-R249 WeakPolarHBondContact O-CG 3.38Å; E245-R249 PolarHBondContact O-N 2.83Å; E245-R249 IonicContact OE2-CZ 3.61Å; E245-R249 IonicContact OE2-NE 3.33Å; E245-R249 IonicContact OE2-NH2 4Å; E245-R249 PolarHBondContact OE2-NH2 3.4Å
246	Q	94.3	Very high	95.8	Very high	139 Å²	139	55 Å²	55	65%	0.65	27%	0.265	S	S	*	.	H	α-helix	trans	-60.3	-42.1	176.8	-174.9	-179.1	4.4	0	0	111.9	E242 R243 L244	E242-Q246 WeakPolarHBondContact O-CB 3.36Å; E242-Q246 PolarHBondContact O-N 2.84Å; R243-Q246 PolarHBondContact O-N 2.96Å; L244-Q246 VanDerWaalsContact C-N 3.3Å; L244-Q246 PolarHBondContact O-N 2.04Å
247	L	94.7	Very high	95.8	Very high	35 Å²	35	56.4 Å²	56.4	18%	0.183	27%	0.272	C	S	.	.	H	α-helix	trans	-62.6	-48.3	173.5	174.3	63.8	0	0	0	110.7	R243 L244 E245 R249 S250 L251 L339 I363	R243-L247 PolarHBondContact O-N 2.96Å; R243-L247 VanDerWaalsContact O-N 3.08Å; L244-L247 WeakPolarHBondContact O-CB 3.38Å; L244-L247 PolarHBondContact O-N 3.29Å; L244-L247 VanDerWaalsContact O-N 3.13Å; E245-L247 VanDerWaalsContact C-N 3.32Å; E245-L247 PolarHBondContact O-N 3.01Å; L247-R249 PolarHBondContact O-N 3.32Å; L247-S250 WeakPolarHBondContact O-CB 3.19Å; L247-S250 PolarHBondContact O-N 2.99Å; L247-S250 PolarHBondContact O-OG 3.39Å; L247-L251 HydrophobicContact CG-CD1 4.49Å; L247-L339 HydrophobicContact CD2-CD1 4.28Å; L247-I363 HydrophobicContact CB-CD1 4.2Å; L247-I363 HydrophobicContact CD2-CD1 3.96Å
248	L	97	Very high	95.8	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-66	-34.7	-176.4	-63.6	178.1	0	0	0	113.2	L148 L149 W229 L244 E245 S250 L251 L259 V289	L148-L248 HydrophobicContact CD1-CB 4.48Å; L149-L248 HydrophobicContact CD1-CD1 3.95Å; L149-L248 HydrophobicContact CD2-CD1 4.46Å; W229-L248 HydrophobicContact CB-CD1 3.87Å; W229-L248 HydrophobicContact CD2-CB 4.36Å; W229-L248 HydrophobicContact CD2-CD1 4.36Å; W229-L248 HydrophobicContact CD2-CD2 3.77Å; W229-L248 HydrophobicContact CD2-CG 4.36Å; W229-L248 HydrophobicContact CE3-CD2 3.87Å; W229-L248 HydrophobicContact CG-CB 4.22Å; W229-L248 HydrophobicContact CG-CD1 3.87Å; W229-L248 HydrophobicContact CG-CD2 4.17Å; W229-L248 HydrophobicContact CG-CG 4.29Å; W229-L248 HydrophobicContact CH2-CD2 4.46Å; W229-L248 HydrophobicContact CZ2-CD2 4.4Å; W229-L248 HydrophobicContact CZ3-CD2 4.21Å; L244-L248 HydrophobicContact CD1-CD1 4.17Å; L244-L248 HydrophobicContact CD1-CD2 4.48Å; L244-L248 HydrophobicContact CD1-CG 4.17Å; L244-L248 HydrophobicContact CG-CD1 3.95Å; L244-L248 HydrophobicContact CG-CG 4.35Å; L244-L248 VanDerWaalsContact O-CG 3.28Å; L244-L248 WeakPolarHBondContact O-CG 3.38Å; L244-L248 PolarHBondContact O-N 2.81Å; E245-L248 PolarHBondContact O-N 2.92Å; L248-S250 PolarHBondContact O-N 3.27Å; L248-L251 PolarHBondContact O-N 2.92Å; L248-L251 VanDerWaalsContact O-N 3.08Å; L248-L259 HydrophobicContact CD2-CD1 3.78Å; L248-V289 HydrophobicContact CD1-CG1 4.38Å; L248-V289 HydrophobicContact CD2-CG1 3.87Å
249	R	95.8	Very high	95.7	Very high	166 Å²	166	56.5 Å²	56.5	63%	0.626	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-19.5	173.1	-72.1	174.5	-163.7	-75.3	-2.4	113.5	L148 E245 L247 L251	L148-R249 HydrophobicContact CD1-CG 4.14Å; L148-R249 HydrophobicContact CD2-CG 3.71Å; E245-R249 WeakPolarHBondContact O-CB 3.48Å; E245-R249 VanDerWaalsContact O-CG 3.26Å; E245-R249 WeakPolarHBondContact O-CG 3.38Å; E245-R249 PolarHBondContact O-N 2.83Å; E245-R249 IonicContact OE2-CZ 3.61Å; E245-R249 IonicContact OE2-NE 3.33Å; E245-R249 IonicContact OE2-NH2 4Å; E245-R249 PolarHBondContact OE2-NH2 3.4Å; L247-R249 PolarHBondContact O-N 3.32Å; R249-L251 VanDerWaalsContact C-N 3.32Å
250	S	93.1	Very high	95.5	Very high	88 Å²	88	56.3 Å²	56.3	62%	0.615	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-2.5	176.1	76.8	0	0	0	0	113.7	L247 L248	L247-S250 WeakPolarHBondContact O-CB 3.19Å; L247-S250 PolarHBondContact O-N 2.99Å; L247-S250 PolarHBondContact O-OG 3.39Å; L248-S250 PolarHBondContact O-N 3.27Å
251	L	94.8	Very high	95.3	Very high	65 Å²	65	55.3 Å²	55.3	34%	0.34	27%	0.268	S	S	.	.	S	Bend	trans	-119.4	154.1	-175.3	-58.8	175.5	0	0	0	110.8	W229 L247 L248 R249 L259	W229-L251 HydrophobicContact CH2-CB 3.91Å; W229-L251 HydrophobicContact CH2-CD1 4.32Å; W229-L251 HydrophobicContact CZ2-CB 3.67Å; L247-L251 HydrophobicContact CG-CD1 4.49Å; L248-L251 PolarHBondContact O-N 2.92Å; L248-L251 VanDerWaalsContact O-N 3.08Å; R249-L251 VanDerWaalsContact C-N 3.32Å; L251-L259 HydrophobicContact CD1-CD1 3.61Å; L251-L259 HydrophobicContact CD1-CD2 4.39Å
252	D	93.8	Very high	95	Very high	81 Å²	81	55.1 Å²	55.1	43%	0.433	27%	0.268	S	S	.	.			trans	-93.9	105.9	-179.6	-179.7	4.9	0	0	0	111.6	S254 R255	D252-S254 PolarHBondContact O-N 2.71Å; D252-S254 VanDerWaalsContact OD1-CB 3.24Å; D252-S254 WeakPolarHBondContact OD1-CB 3.28Å; D252-S254 PolarHBondContact OD1-N 2.83Å; D252-S254 PolarHBondContact OD1-OG 2.87Å; D252-S254 PolarHBondContact OD2-OG 2.93Å; D252-R255 PolarHBondContact O-N 2.82Å
253	A	95.1	Very high	94.6	Very high	6 Å²	6	51.2 Å²	51.2	5%	0.05	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-12.8	178.8	0	0	0	0	0	114.4	E228 W229 R255	E228-A253 HydrophobicContact CB-CB 3.84Å; E228-A253 WeakPolarHBondContact O-CB 3.34Å; W229-A253 HydrophobicContact CD2-CB 4.36Å; W229-A253 HydrophobicContact CZ2-CB 3.93Å; A253-R255 PolarHBondContact O-N 3.16Å
254	S	94.9	Very high	94	Very high	62 Å²	62	50 Å²	50	43%	0.434	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-10.8	175.2	77.3	0	0	0	0	113	D252 E293	D252-S254 PolarHBondContact O-N 2.71Å; D252-S254 VanDerWaalsContact OD1-CB 3.24Å; D252-S254 WeakPolarHBondContact OD1-CB 3.28Å; D252-S254 PolarHBondContact OD1-N 2.83Å; D252-S254 PolarHBondContact OD1-OG 2.87Å; D252-S254 PolarHBondContact OD2-OG 2.93Å; S254-E293 WeakPolarHBondContact O-CB 3.42Å; S254-E293 WeakPolarHBondContact O-CG 3.28Å
255	R	96.5	Very high	92.9	Very high	165 Å²	165	51.1 Å²	51.1	62%	0.623	26%	0.261	S	S	*	.	S	Bend	trans	-101.5	145.5	177.1	-64	179.5	64.9	-177.4	-0.4	111.1	D252 A253 L257 S291	D252-R255 PolarHBondContact O-N 2.82Å; A253-R255 PolarHBondContact O-N 3.16Å; R255-L257 PolarHBondContact O-N 3.44Å; R255-S291 WeakPolarHBondContact O-CB 3.22Å; R255-S291 PolarHBondContact O-OG 2.87Å
256	P	97.5	Very high	91.7	Very high	43 Å²	43	54.7 Å²	54.7	28%	0.279	28%	0.276	S	S	.	.			trans	-59.4	119.7	170	-22.2	33.8	0	0	0	110.3	E293 T294 L297 V328	P256-E293 HydrophobicContact CG-CG 3.8Å; P256-T294 WeakPolarHBondContact CA-OG1 3.37Å; P256-L297 HydrophobicContact CG-CD1 3.91Å; P256-V328 HydrophobicContact CB-CG1 3.44Å; P256-V328 VanDerWaalsContact CB-CG1 3.44Å; P256-V328 HydrophobicContact CB-CG2 4.28Å
257	L	96.4	Very high	90.4	Very high	46 Å²	46	53.3 Å²	53.3	24%	0.241	28%	0.279	C	S	.	.			trans	-148.5	135.4	-179.8	-71.1	174.3	0	0	0	110.3	W229 R255 S291 T294	W229-L257 HydrophobicContact CH2-CB 4.25Å; W229-L257 HydrophobicContact CH2-CD1 3.79Å; W229-L257 HydrophobicContact CZ3-CB 4.21Å; R255-L257 PolarHBondContact O-N 3.44Å; L257-S291 PolarHBondContact N-OG 2.96Å; L257-S291 VanDerWaalsContact N-OG 3.15Å; L257-S291 PolarHBondContact O-N 3.25Å; L257-T294 PolarHBondContact N-OG1 3.37Å; L257-T294 PolarHBondContact O-OG1 3.1Å
258	M	96.4	Very high	88.8	Confident	1 Å²	1	58.2 Å²	58.2	1%	0.005	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	121	172.6	-177.8	167	62	0	0	109.5	I288 V289 L290 N319 V322 V328 K329 C330 T331	M258-I288 HydrophobicContact CG-CG2 3.79Å; M258-I288 HydrophobicContact SD-CG2 4.02Å; M258-V289 WeakPolarHBondContact CA-O 3.42Å; M258-L290 HydrophobicContact CB-CD2 4.05Å; M258-L290 HydrophobicContact CG-CD2 3.69Å; M258-L290 HydrophobicContact SD-CD2 3.85Å; M258-N319 HydrophobicContact CE-CB 4.34Å; M258-N319 WeakPolarHBondContact CE-OD1 3.46Å; M258-V322 HydrophobicContact CE-CG1 4.15Å; M258-V322 HydrophobicContact SD-CB 4.19Å; M258-V322 HydrophobicContact SD-CG1 3.92Å; M258-V322 HydrophobicContact SD-CG2 4.29Å; M258-V328 HydrophobicContact CB-CG2 4.46Å; M258-K329 VanDerWaalsContact CE-C 3.45Å; M258-C330 HydrophobicContact CE-CB 4.21Å; M258-C330 VanDerWaalsContact CE-N 3.29Å; M258-T331 PolarHBondContact O-N 3.18Å; M258-T331 PolarHBondContact O-OG1 3.44Å
259	L	95.8	Very high	87.3	Confident	7 Å²	7	60.4 Å²	60.4	4%	0.037	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	147.9	-176.4	-42.5	168.6	0	0	0	110	W229 L248 L251 V289 T331	W229-L259 HydrophobicContact CZ3-CD1 4.18Å; L248-L259 HydrophobicContact CD2-CD1 3.78Å; L251-L259 HydrophobicContact CD1-CD1 3.61Å; L251-L259 HydrophobicContact CD1-CD2 4.39Å; L259-V289 HydrophobicContact CB-CB 4.12Å; L259-V289 HydrophobicContact CD1-CB 4.48Å; L259-V289 HydrophobicContact CD1-CG1 4.45Å; L259-V289 PolarHBondContact N-O 2.98Å; L259-V289 PolarHBondContact O-N 3.34Å; L259-T331 HydrophobicContact CD2-CG2 4.47Å; L259-T331 WeakPolarHBondContact CD2-OG1 3.5Å
260	G	94.5	Very high	85.6	Confident	0 Å²	0	58 Å²	58	0%	0	31%	0.306	C	S	.	.	S	Bend	trans	160.8	-174	-179.8	0	0	0	0	0	109.5	A262 M336	G260-A262 PolarHBondContact O-N 3Å; G260-M336 WeakPolarHBondContact O-CB 3.47Å
261	Q	93.4	Very high	84	Confident	10 Å²	10	56.9 Å²	56.9	5%	0.047	31%	0.309	C	S	.	.			trans	-77.6	111.2	173.5	-173.4	176.8	-8	0	0	110.3	G263 C282 M283 T286 Q337 F340 Y344	Q261-G263 PolarHBondContact O-N 2.82Å; Q261-C282 CarbonylContact O-C 3.54Å; Q261-C282 WeakPolarHBondContact O-CA 3.49Å; Q261-M283 HydrophobicContact CG-SD 4.3Å; Q261-M283 PolarHBondContact O-N 2.92Å; Q261-T286 HydrophobicContact CB-CG2 4.09Å; Q261-T286 WeakPolarHBondContact CB-OG1 3.35Å; Q261-T286 VanDerWaalsContact OE1-CG2 3.27Å; Q261-Q337 HydrophobicContact CG-CG 4.33Å; Q261-F340 HydrophobicContact CB-CB 3.97Å; Q261-F340 PolarHBondContact OE1-O 3.2Å; Q261-F340 VanDerWaalsContact OE1-O 3.08Å; Q261-Y344 PolarHBondContact NE2-OH 2.78Å; Q261-Y344 VanDerWaalsContact NE2-OH 3.15Å
262	A	89.3	Confident	82.2	Confident	4 Å²	4	61.4 Å²	61.4	3%	0.033	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	125.8	173.8	0	0	0	0	0	111.4	G260 P280 Y281	G260-A262 PolarHBondContact O-N 3Å; A262-P280 HydrophobicContact CB-CB 4.07Å; A262-Y281 CarbonylContact C-O 3.47Å; A262-Y281 WeakPolarHBondContact CA-O 3.38Å
263	G	84.7	Confident	80.5	Confident	9 Å²	9	58 Å²	58	9%	0.093	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	166.3	175.3	0	0	0	0	0	112.4	Q261 P280 Y281	Q261-G263 PolarHBondContact O-N 2.82Å; G263-P280 WeakPolarHBondContact O-CA 3.3Å; G263-Y281 PolarHBondContact N-O 3.44Å; G263-Y281 VanDerWaalsContact O-CD1 3.25Å; G263-Y281 WeakPolarHBondContact O-CD1 3.48Å; G263-Y281 PolarHBondContact O-N 3.4Å; G263-Y281 VanDerWaalsContact O-N 3.08Å
264	F	81.1	Confident	78.5	Confident	73 Å²	73	60 Å²	60	32%	0.32	33%	0.329	S	S	.	.			trans	-119.8	12.7	179.2	-58.9	-81.9	0	0	0	112.3	H270 G278 P280 W332	F264-H270 PolarHBondContact O-CE1 3.28Å; F264-G278 WeakPolarHBondContact CE1-O 3.44Å; F264-P280 HydrophobicContact CD1-CB 4.49Å; F264-P280 HydrophobicContact CE1-CB 3.87Å; F264-P280 HydrophobicContact CE1-CG 4.47Å; F264-P280 HydrophobicContact CZ-CB 4.11Å; F264-W332 AromaticContact CE2-NE1 3.86Å; F264-W332 AromaticContact CZ-NE1 3.64Å
265	G	75.1	Confident	77	Confident	23 Å²	23	58.6 Å²	58.6	24%	0.237	32%	0.317	C	S	.	.			trans	77	175	-170.4	0	0	0	0	0	112.9	Y281	G265-Y281 VanDerWaalsContact CA-OH 3.3Å; G265-Y281 WeakPolarHBondContact CA-OH 3.42Å; G265-Y281 PolarHBondContact N-OH 3.32Å
266	K	72	Confident	75.4	Confident	126 Å²	126	54.3 Å²	54.3	55%	0.548	31%	0.312	S	S	.	.			trans	-69.3	150.7	172.1	-68.5	179.3	179.1	178.2	0	110	E268 E269 H270	K266-E268 PolarHBondContact O-N 2.92Å; K266-E268 VanDerWaalsContact O-N 3.1Å; K266-E269 HydrophobicContact CB-CG 4.22Å; K266-E269 PolarHBondContact N-OE2 2.83Å; K266-E269 WeakPolarHBondContact O-CA 3.34Å; K266-E269 PolarHBondContact O-N 3.08Å; K266-H270 PolarHBondContact O-N 3.47Å; K266-H270 PolarHBondContact O-ND1 2.87Å
267	P	65.9	Low	73.6	Confident	109 Å²	109	60.2 Å²	60.2	71%	0.708	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-47.9	-38.5	172	-29.1	36.4	0	0	0	113.3	E269 H270	P267-E269 PolarHBondContact O-N 3.46Å; P267-H270 VanDerWaalsContact CA-ND1 3.28Å; P267-H270 WeakPolarHBondContact CA-ND1 3.41Å; P267-H270 PolarHBondContact O-N 3.21Å
268	E	61.7	Low	72.2	Confident	138 Å²	138	61 Å²	61	65%	0.645	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-69.2	-15.5	179	-60.6	133.4	-145.5	0	0	114.8	K266 K272	K266-E268 PolarHBondContact O-N 2.92Å; K266-E268 VanDerWaalsContact O-N 3.1Å; E268-K272 WeakPolarHBondContact O-CE 3.34Å; E268-K272 PolarHBondContact O-NZ 3.43Å
269	E	65.4	Low	71.3	Confident	47 Å²	47	62.3 Å²	62.3	22%	0.22	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-107	-3.3	-178.7	-62	179.1	139.7	0	0	112.6	K266 P267 G271 K272 L273 H313	K266-E269 HydrophobicContact CB-CG 4.22Å; K266-E269 PolarHBondContact N-OE2 2.83Å; K266-E269 WeakPolarHBondContact O-CA 3.34Å; K266-E269 PolarHBondContact O-N 3.08Å; P267-E269 PolarHBondContact O-N 3.46Å; E269-G271 PolarHBondContact O-N 3.3Å; E269-K272 WeakPolarHBondContact O-CA 3.19Å; E269-K272 WeakPolarHBondContact O-CB 3.32Å; E269-K272 PolarHBondContact O-N 2.83Å; E269-L273 HydrophobicContact CB-CD1 4.5Å; E269-L273 HydrophobicContact CB-CD2 4.33Å; E269-L273 HydrophobicContact CB-CG 4.13Å; E269-L273 PolarHBondContact O-N 3.13Å; E269-H313 IonicContact OE1-CE1 3.47Å; E269-H313 PolarHBondContact OE1-CE1 3.34Å; E269-H313 IonicContact OE1-NE2 3.11Å; E269-H313 PolarHBondContact OE1-NE2 2.88Å; E269-H313 IonicContact OE2-NE2 3.74Å
270	H	59.9	Low	70.7	Confident	114 Å²	114	63 Å²	63	53%	0.528	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	128.3	175.6	-79.3	62.5	0	0	0	109.8	F264 K266 P267 K272	F264-H270 PolarHBondContact O-CE1 3.28Å; K266-H270 PolarHBondContact O-N 3.47Å; K266-H270 PolarHBondContact O-ND1 2.87Å; P267-H270 VanDerWaalsContact CA-ND1 3.28Å; P267-H270 WeakPolarHBondContact CA-ND1 3.41Å; P267-H270 PolarHBondContact O-N 3.21Å; H270-K272 PolarHBondContact O-N 2.84Å
271	G	59.7	Low	70.5	Confident	66 Å²	66	63.7 Å²	63.7	68%	0.68	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.5	-21.1	-172.3	0	0	0	0	0	115.4	E269	E269-G271 PolarHBondContact O-N 3.3Å
272	K	57	Low	70.5	Confident	160 Å²	160	63.2 Å²	63.2	70%	0.696	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-23.9	176.1	-61.3	-177.9	-175	155.1	0	113.1	E268 E269 H270 G274	E268-K272 WeakPolarHBondContact O-CE 3.34Å; E268-K272 PolarHBondContact O-NZ 3.43Å; E269-K272 WeakPolarHBondContact O-CA 3.19Å; E269-K272 WeakPolarHBondContact O-CB 3.32Å; E269-K272 PolarHBondContact O-N 2.83Å; H270-K272 PolarHBondContact O-N 2.84Å; K272-G274 PolarHBondContact O-N 2.87Å
273	L	58.4	Low	70.6	Confident	8 Å²	8	64.9 Å²	64.9	4%	0.042	38%	0.379	C	S	.	.	S	Bend	trans	-73.4	-11.6	178.4	-64.7	-178.9	0	0	0	113.1	E269 L275 Y281 H313 V316 R320	E269-L273 HydrophobicContact CB-CD1 4.5Å; E269-L273 HydrophobicContact CB-CD2 4.33Å; E269-L273 HydrophobicContact CB-CG 4.13Å; E269-L273 PolarHBondContact O-N 3.13Å; L273-L275 HydrophobicContact CB-CD1 4.15Å; L273-L275 HydrophobicContact CB-CG 4.24Å; L273-L275 HydrophobicContact CD1-CD1 4.26Å; L273-L275 PolarHBondContact O-N 3.06Å; L273-Y281 HydrophobicContact CD1-CE1 3.9Å; L273-H313 WeakPolarHBondContact CD2-CD2 3.32Å; L273-V316 HydrophobicContact CD1-CG2 4.46Å; L273-V316 HydrophobicContact CD2-CG2 4.38Å; L273-R320 PolarHBondContact O-NH2 3.43Å
274	G	54	Low	70.8	Confident	49 Å²	49	64.6 Å²	64.6	51%	0.505	38%	0.376	S	S	.	.			trans	61.3	25	-177.4	0	0	0	0	0	114.2	K272 R320	K272-G274 PolarHBondContact O-N 2.87Å; G274-R320 PolarHBondContact O-NH2 3.43Å
275	L	63.4	Low	71.3	Confident	33 Å²	33	61.7 Å²	61.7	17%	0.173	37%	0.368	C	S	.	.			trans	-83.7	148.5	168.3	-66.3	168.4	0	0	0	108	L273 Y281 V316 R320	L273-L275 HydrophobicContact CB-CD1 4.15Å; L273-L275 HydrophobicContact CB-CG 4.24Å; L273-L275 HydrophobicContact CD1-CD1 4.26Å; L273-L275 PolarHBondContact O-N 3.06Å; L275-Y281 HydrophobicContact CD1-CD1 3.41Å; L275-Y281 VanDerWaalsContact CD1-CD1 3.41Å; L275-Y281 HydrophobicContact CD1-CE1 3.88Å; L275-Y281 HydrophobicContact CD1-CG 4.29Å; L275-V316 HydrophobicContact CD1-CG1 4.29Å; L275-V316 HydrophobicContact CD2-CG1 4.05Å; L275-V316 HydrophobicContact CG-CG1 4.14Å; L275-R320 HydrophobicContact CD2-CG 4.47Å
276	S	61.7	Low	72.2	Confident	75 Å²	75	60.7 Å²	60.7	52%	0.524	36%	0.357	S	S	.	.			trans	-62	146.8	171.2	-35.1	0	0	0	0	108.8	G278 E279	S276-G278 PolarHBondContact O-N 3.45Å; S276-E279 WeakPolarHBondContact CB-OE2 3.49Å; S276-E279 PolarHBondContact N-OE2 2.83Å; S276-E279 VanDerWaalsContact N-OE2 3.16Å; S276-E279 PolarHBondContact O-N 3.37Å; S276-E279 PolarHBondContact OG-OE2 3.07Å
277	D	60.7	Low	73.3	Confident	167 Å²	167	54.7 Å²	54.7	89%	0.893	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.7	115	-176.9	-78.3	-26.2	0	0	0	111.5
278	G	66.3	Low	74.8	Confident	61 Å²	61	49.5 Å²	49.5	63%	0.629	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.2	13.8	176.8	0	0	0	0	0	116.8	F264 S276 P280	F264-G278 WeakPolarHBondContact CE1-O 3.44Å; S276-G278 PolarHBondContact O-N 3.45Å; G278-P280 WeakPolarHBondContact O-CD 3.34Å
279	E	77.2	Confident	76.5	Confident	30 Å²	30	43 Å²	43	14%	0.14	27%	0.267	C	S	.	.			trans	-80.2	119.5	173.9	-69.4	-171.2	127.6	0	0	112.6	S276 Q323 K329	S276-E279 WeakPolarHBondContact CB-OE2 3.49Å; S276-E279 PolarHBondContact N-OE2 2.83Å; S276-E279 VanDerWaalsContact N-OE2 3.16Å; S276-E279 PolarHBondContact O-N 3.37Å; S276-E279 PolarHBondContact OG-OE2 3.07Å; E279-Q323 PolarHBondContact OE1-NE2 3.19Å; E279-K329 WeakPolarHBondContact OE1-CE 3.24Å; E279-K329 IonicContact OE1-NZ 2.66Å; E279-K329 PolarHBondContact OE1-NZ 3.01Å
280	P	83.9	Confident	78.1	Confident	22 Å²	22	40.9 Å²	40.9	14%	0.143	26%	0.257	C	S	.	.			trans	-78	140.4	177.3	30.7	-32.6	0	0	0	111.5	A262 G263 F264 G278 W332	A262-P280 HydrophobicContact CB-CB 4.07Å; G263-P280 WeakPolarHBondContact O-CA 3.3Å; F264-P280 HydrophobicContact CD1-CB 4.49Å; F264-P280 HydrophobicContact CE1-CB 3.87Å; F264-P280 HydrophobicContact CE1-CG 4.47Å; F264-P280 HydrophobicContact CZ-CB 4.11Å; G278-P280 WeakPolarHBondContact O-CD 3.34Å; P280-W332 HydrophobicContact CG-CB 4.18Å; P280-W332 HydrophobicContact CG-CG 4.46Å
281	Y	89.1	Confident	79.9	Confident	13 Å²	13	35.4 Å²	35.4	5%	0.051	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	152.9	170	68.3	-84.3	0	0	0	110.3	A262 G263 G265 L273 L275 M283 V316 N319	A262-Y281 CarbonylContact C-O 3.47Å; A262-Y281 WeakPolarHBondContact CA-O 3.38Å; G263-Y281 PolarHBondContact N-O 3.44Å; G263-Y281 VanDerWaalsContact O-CD1 3.25Å; G263-Y281 WeakPolarHBondContact O-CD1 3.48Å; G263-Y281 PolarHBondContact O-N 3.4Å; G263-Y281 VanDerWaalsContact O-N 3.08Å; G265-Y281 VanDerWaalsContact CA-OH 3.3Å; G265-Y281 WeakPolarHBondContact CA-OH 3.42Å; G265-Y281 PolarHBondContact N-OH 3.32Å; L273-Y281 HydrophobicContact CD1-CE1 3.9Å; L275-Y281 HydrophobicContact CD1-CD1 3.41Å; L275-Y281 VanDerWaalsContact CD1-CD1 3.41Å; L275-Y281 HydrophobicContact CD1-CE1 3.88Å; L275-Y281 HydrophobicContact CD1-CG 4.29Å; Y281-M283 HydrophobicContact CE2-CG 4.33Å; Y281-M283 PolarHBondContact O-N 2.92Å; Y281-V316 HydrophobicContact CD1-CG2 4.26Å; Y281-V316 HydrophobicContact CD2-CG2 3.81Å; Y281-V316 HydrophobicContact CE1-CG2 4.08Å; Y281-V316 HydrophobicContact CE2-CG2 3.62Å; Y281-V316 HydrophobicContact CG-CG2 4.12Å; Y281-N319 WeakPolarHBondContact CA-OD1 3.3Å
282	C	93.5	Very high	81.7	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	118.6	174.7	-69.5	0	0	0	0	108.6	Q261 I288 N319 C330	Q261-C282 CarbonylContact O-C 3.54Å; Q261-C282 WeakPolarHBondContact O-CA 3.49Å; C282-I288 HydrophobicContact CB-CD1 4.21Å; C282-I288 HydrophobicContact CB-CG1 3.83Å; C282-I288 HydrophobicContact CB-CG2 4.28Å; C282-N319 PolarHBondContact N-ND2 2.95Å; C282-N319 PolarHBondContact N-OD1 2.85Å; C282-N319 PolarHBondContact O-ND2 2.9Å; C282-N319 VanDerWaalsContact O-ND2 3.14Å; C282-C330 WeakPolarHBondContact CA-SG 3.29Å; C282-C330 HydrophobicContact CB-CB 3.92Å; C282-C330 WeakPolarHBondContact CB-SG 3.4Å; C282-C330 VanDerWaalsContact N-CB 3.26Å; C282-C330 PolarHBondContact N-SG 2.87Å; C282-C330 VanDerWaalsContact SG-CA 3.6Å; C282-C330 WeakPolarHBondContact SG-CB 3.41Å; C282-C330 CovalentContact SG-SG 2.04Å; C282-C330 PolarHBondContact SG-SG 3.18Å
283	M	91.6	Very high	83.6	Confident	39 Å²	39	28.9 Å²	28.9	19%	0.192	18%	0.184	C	C	.	.			trans	-62.8	132.4	176.9	-64.6	178.6	61.4	0	0	110.4	Q261 Y281 G285 T286 D315 Y344	Q261-M283 HydrophobicContact CG-SD 4.3Å; Q261-M283 PolarHBondContact O-N 2.92Å; Y281-M283 HydrophobicContact CE2-CG 4.33Å; Y281-M283 PolarHBondContact O-N 2.92Å; M283-G285 PolarHBondContact O-N 2.98Å; M283-T286 PolarHBondContact O-OG1 3.32Å; M283-D315 WeakPolarHBondContact CA-OD2 3.36Å; M283-Y344 HydrophobicContact CE-CE1 4.38Å
284	G	89.3	Confident	85.5	Confident	3 Å²	3	28.5 Å²	28.5	3%	0.031	18%	0.182	C	C	.	.	S	Bend	trans	-62.4	-40.4	-173.7	0	0	0	0	0	114	R232 T286 G287 D315	R232-G284 PolarHBondContact NH1-O 3.04Å; G284-T286 VanDerWaalsContact C-N 3.35Å; G284-T286 PolarHBondContact O-N 3.31Å; G284-G287 WeakPolarHBondContact O-CA 3.49Å; G284-G287 PolarHBondContact O-N 3.23Å; G284-D315 VanDerWaalsContact N-CB 3.34Å; G284-D315 PolarHBondContact N-OD2 3.18Å
285	G	91.5	Very high	87.6	Confident	13 Å²	13	26.2 Å²	26.2	13%	0.134	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-41.1	-173.1	0	0	0	0	0	115	D234 M283 G287 H366	D234-G285 VanDerWaalsContact OD2-CA 3.28Å; D234-G285 WeakPolarHBondContact OD2-CA 3.32Å; M283-G285 PolarHBondContact O-N 2.98Å; G285-G287 PolarHBondContact O-N 3.43Å; G285-H366 VanDerWaalsContact C-CD2 3.48Å; G285-H366 VanDerWaalsContact C-CG 3.44Å; G285-H366 WeakPolarHBondContact CA-NE2 2.96Å; G285-H366 WeakPolarHBondContact O-CB 3.44Å; G285-H366 PolarHBondContact O-CD2 3.29Å
286	T	93.8	Very high	89.2	Confident	1 Å²	1	29.9 Å²	29.9	1%	0.006	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-2.2	177.2	54.5	0	0	0	0	113.6	Q261 M283 G284 F340 N342 V364 H366	Q261-T286 HydrophobicContact CB-CG2 4.09Å; Q261-T286 WeakPolarHBondContact CB-OG1 3.35Å; Q261-T286 VanDerWaalsContact OE1-CG2 3.27Å; M283-T286 PolarHBondContact O-OG1 3.32Å; G284-T286 VanDerWaalsContact C-N 3.35Å; G284-T286 PolarHBondContact O-N 3.31Å; T286-F340 HydrophobicContact CG2-CB 4.28Å; T286-F340 WeakPolarHBondContact O-CD1 3.42Å; T286-N342 HydrophobicContact CG2-CB 3.94Å; T286-V364 WeakPolarHBondContact O-CG1 3.28Å; T286-H366 HydrophobicContact CG2-CB 4.29Å
287	G	95.7	Very high	90.9	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.01	16%	0.155	C	C	.	.			trans	78	161	-170.4	0	0	0	0	0	113.8	R232 G284 G285	R232-G287 CarbonylContact O-C 3.59Å; R232-G287 WeakPolarHBondContact O-CA 3.41Å; G284-G287 WeakPolarHBondContact O-CA 3.49Å; G284-G287 PolarHBondContact O-N 3.23Å; G285-G287 PolarHBondContact O-N 3.43Å
288	I	97.4	Very high	92.6	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	122.4	-177	-57.3	171.3	0	0	0	107.8	R232 M258 C282 L290 D315 L318	R232-I288 PolarHBondContact N-O 3.48Å; R232-I288 PolarHBondContact O-N 2.99Å; M258-I288 HydrophobicContact CG-CG2 3.79Å; M258-I288 HydrophobicContact SD-CG2 4.02Å; C282-I288 HydrophobicContact CB-CD1 4.21Å; C282-I288 HydrophobicContact CB-CG1 3.83Å; C282-I288 HydrophobicContact CB-CG2 4.28Å; I288-L290 HydrophobicContact CG2-CD2 4.01Å; I288-L290 HydrophobicContact CG2-CG 4.29Å; I288-D315 HydrophobicContact CD1-CB 4.46Å; I288-L318 HydrophobicContact CD1-CD2 3.81Å
289	V	98.1	Very high	94	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	126.1	175.4	-175.3	0	0	0	0	109.4	W229 F230 L231 L244 L248 M258 L259 F340	W229-V289 HydrophobicContact CB-CG1 4.46Å; W229-V289 HydrophobicContact CE3-CG1 3.78Å; W229-V289 HydrophobicContact CZ3-CG1 4.44Å; F230-V289 CarbonylContact O-C 3.6Å; F230-V289 WeakPolarHBondContact O-CA 3.49Å; L231-V289 HydrophobicContact CB-CG2 4.48Å; L231-V289 HydrophobicContact CD1-CG2 3.73Å; L244-V289 HydrophobicContact CD1-CG2 4.33Å; L248-V289 HydrophobicContact CD1-CG1 4.38Å; L248-V289 HydrophobicContact CD2-CG1 3.87Å; M258-V289 WeakPolarHBondContact CA-O 3.42Å; L259-V289 HydrophobicContact CB-CB 4.12Å; L259-V289 HydrophobicContact CD1-CB 4.48Å; L259-V289 HydrophobicContact CD1-CG1 4.45Å; L259-V289 PolarHBondContact N-O 2.98Å; L259-V289 PolarHBondContact O-N 3.34Å; V289-F340 HydrophobicContact CG2-CE1 4.2Å; V289-F340 HydrophobicContact CG2-CZ 4.02Å
290	L	98.2	Very high	94.9	Very high	3 Å²	3	17.9 Å²	17.9	2%	0.016	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	132.3	178.4	-58.8	172.4	0	0	0	109.1	I216 F230 M258 I288 T294 L295 V322	I216-L290 HydrophobicContact CG2-CD1 4.26Å; F230-L290 PolarHBondContact N-O 3.34Å; F230-L290 PolarHBondContact O-N 2.9Å; M258-L290 HydrophobicContact CB-CD2 4.05Å; M258-L290 HydrophobicContact CG-CD2 3.69Å; M258-L290 HydrophobicContact SD-CD2 3.85Å; I288-L290 HydrophobicContact CG2-CD2 4.01Å; I288-L290 HydrophobicContact CG2-CG 4.29Å; L290-T294 HydrophobicContact CD2-CG2 3.9Å; L290-L295 HydrophobicContact CD1-CD1 4.04Å; L290-V322 HydrophobicContact CD2-CG2 4.25Å
291	S	98.1	Very high	95.4	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	154.4	167.2	68.7	0	0	0	0	110.6	R255 L257 E293 T294 L295	R255-S291 WeakPolarHBondContact O-CB 3.22Å; R255-S291 PolarHBondContact O-OG 2.87Å; L257-S291 PolarHBondContact N-OG 2.96Å; L257-S291 VanDerWaalsContact N-OG 3.15Å; L257-S291 PolarHBondContact O-N 3.25Å; S291-E293 PolarHBondContact O-N 3.35Å; S291-T294 WeakPolarHBondContact O-CB 3.29Å; S291-T294 PolarHBondContact O-N 3.21Å; S291-T294 PolarHBondContact OG-N 3.03Å; S291-T294 PolarHBondContact OG-OG1 2.89Å; S291-L295 PolarHBondContact O-N 2.62Å
292	R	97.3	Very high	95.6	Very high	52 Å²	52	21.7 Å²	21.7	20%	0.196	10%	0.1	C	C	.	.	H	α-helix	trans	-50.5	-42.1	173.3	-176.9	-172.7	69.5	-138.1	-2.4	111.5	G224 E228 F230 L295 R296	G224-R292 WeakPolarHBondContact O-CD 3.25Å; G224-R292 WeakPolarHBondContact O-CG 3.25Å; E228-R292 VanDerWaalsContact O-CB 3.27Å; E228-R292 WeakPolarHBondContact O-CB 3.23Å; E228-R292 PolarHBondContact O-N 3.23Å; F230-R292 HydrophobicContact CE2-CB 4.21Å; F230-R292 HydrophobicContact CE2-CG 4.39Å; R292-L295 PolarHBondContact O-N 2.7Å; R292-R296 VanDerWaalsContact O-CB 3.29Å; R292-R296 WeakPolarHBondContact O-CB 3.3Å; R292-R296 PolarHBondContact O-N 3.07Å
293	E	97.4	Very high	95.4	Very high	37 Å²	37	25.8 Å²	25.8	17%	0.173	12%	0.119	C	C	.	.	H	α-helix	trans	-65.5	-40.8	179.9	-175.1	61.8	-169.3	0	0	112.6	S254 P256 S291 L295 R296 L297	S254-E293 WeakPolarHBondContact O-CB 3.42Å; S254-E293 WeakPolarHBondContact O-CG 3.28Å; P256-E293 HydrophobicContact CG-CG 3.8Å; S291-E293 PolarHBondContact O-N 3.35Å; E293-L295 VanDerWaalsContact C-N 3.3Å; E293-L295 PolarHBondContact O-N 3.11Å; E293-R296 WeakPolarHBondContact O-CB 3.35Å; E293-R296 PolarHBondContact O-N 3.09Å; E293-R296 IonicContact OE1-CZ 2.57Å; E293-R296 IonicContact OE1-NE 3.93Å; E293-R296 PolarHBondContact OE1-NE 2.96Å; E293-R296 IonicContact OE1-NH2 2.68Å; E293-R296 PolarHBondContact OE1-NH2 3.45Å; E293-R296 IonicContact OE2-CZ 3.39Å; E293-R296 IonicContact OE2-NE 3.28Å; E293-R296 PolarHBondContact OE2-NE 3.33Å; E293-R296 IonicContact OE2-NH2 3.72Å; E293-L297 HydrophobicContact CG-CD1 4.21Å; E293-L297 WeakPolarHBondContact O-CG 3.38Å; E293-L297 PolarHBondContact O-N 3.38Å
294	T	98.1	Very high	95.5	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-59.9	-44.5	174.5	-51.1	0	0	0	0	111.2	P256 L257 L290 S291 L297 T298 V322 A326 V328	P256-T294 WeakPolarHBondContact CA-OG1 3.37Å; L257-T294 PolarHBondContact N-OG1 3.37Å; L257-T294 PolarHBondContact O-OG1 3.1Å; L290-T294 HydrophobicContact CD2-CG2 3.9Å; S291-T294 WeakPolarHBondContact O-CB 3.29Å; S291-T294 PolarHBondContact O-N 3.21Å; S291-T294 PolarHBondContact OG-N 3.03Å; S291-T294 PolarHBondContact OG-OG1 2.89Å; T294-L297 PolarHBondContact O-N 2.88Å; T294-T298 WeakPolarHBondContact O-CB 3.48Å; T294-T298 PolarHBondContact O-N 3.43Å; T294-T298 PolarHBondContact O-OG1 2.98Å; T294-V322 HydrophobicContact CG2-CG1 3.49Å; T294-V322 VanDerWaalsContact CG2-CG1 3.49Å; T294-A326 HydrophobicContact CG2-CB 3.95Å; T294-V328 HydrophobicContact CG2-CG2 3.86Å
295	L	96.7	Very high	95.6	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.005	13%	0.132	C	C	.	.	H	α-helix	trans	-69.9	-38.9	-179.2	-165.9	66.9	0	0	0	111.4	I216 M219 Y220 F230 L290 S291 R292 E293 L297 T298 A299	I216-L295 HydrophobicContact CB-CD1 3.85Å; M219-L295 HydrophobicContact CB-CD2 4.33Å; Y220-L295 HydrophobicContact CD2-CB 4.43Å; Y220-L295 HydrophobicContact CD2-CD2 4.22Å; Y220-L295 HydrophobicContact CD2-CG 4.05Å; Y220-L295 HydrophobicContact CG-CD2 4.45Å; Y220-L295 HydrophobicContact CG-CG 4.23Å; F230-L295 HydrophobicContact CB-CD2 4.05Å; F230-L295 HydrophobicContact CD1-CD2 3.73Å; F230-L295 HydrophobicContact CD2-CB 4.4Å; F230-L295 HydrophobicContact CD2-CD2 3.54Å; F230-L295 HydrophobicContact CE1-CD2 4.05Å; F230-L295 HydrophobicContact CE2-CD2 3.9Å; F230-L295 HydrophobicContact CG-CD2 3.47Å; F230-L295 VanDerWaalsContact CG-CD2 3.47Å; F230-L295 HydrophobicContact CZ-CD2 4.15Å; L290-L295 HydrophobicContact CD1-CD1 4.04Å; S291-L295 PolarHBondContact O-N 2.62Å; R292-L295 PolarHBondContact O-N 2.7Å; E293-L295 VanDerWaalsContact C-N 3.3Å; E293-L295 PolarHBondContact O-N 3.11Å; L295-L297 VanDerWaalsContact C-N 3.31Å; L295-L297 PolarHBondContact O-N 3.14Å; L295-T298 PolarHBondContact O-N 3.39Å; L295-A299 HydrophobicContact CD1-CB 4.12Å; L295-A299 HydrophobicContact CG-CB 4.2Å; L295-A299 WeakPolarHBondContact O-CB 3.24Å; L295-A299 PolarHBondContact O-N 3.32Å
296	R	97.4	Very high	95.5	Very high	109 Å²	109	29.8 Å²	29.8	41%	0.411	14%	0.138	S	C	.	.	H	α-helix	trans	-57.2	-42.6	173.9	-168.9	-168.7	71	74.6	-2.8	112.4	Y220 R292 E293 P300	Y220-R296 HydrophobicContact CE2-CB 3.77Å; Y220-R296 HydrophobicContact CE2-CG 3.99Å; Y220-R296 VanDerWaalsContact OH-CG 3.3Å; Y220-R296 WeakPolarHBondContact OH-CG 3.49Å; R292-R296 VanDerWaalsContact O-CB 3.29Å; R292-R296 WeakPolarHBondContact O-CB 3.3Å; R292-R296 PolarHBondContact O-N 3.07Å; E293-R296 WeakPolarHBondContact O-CB 3.35Å; E293-R296 PolarHBondContact O-N 3.09Å; E293-R296 IonicContact OE1-CZ 2.57Å; E293-R296 IonicContact OE1-NE 3.93Å; E293-R296 PolarHBondContact OE1-NE 2.96Å; E293-R296 IonicContact OE1-NH2 2.68Å; E293-R296 PolarHBondContact OE1-NH2 3.45Å; E293-R296 IonicContact OE2-CZ 3.39Å; E293-R296 IonicContact OE2-NE 3.28Å; E293-R296 PolarHBondContact OE2-NE 3.33Å; E293-R296 IonicContact OE2-NH2 3.72Å; R296-P300 VanDerWaalsContact O-CD 3.29Å; R296-P300 WeakPolarHBondContact O-CD 3.49Å
297	L	97.6	Very high	95.2	Very high	44 Å²	44	34.8 Å²	34.8	23%	0.23	17%	0.17	C	C	.	.	H	α-helix	trans	-76.2	-29.5	-179.9	-69.5	171.5	0	0	0	112.8	P256 E293 T294 L295 Y301 F325 A326	P256-L297 HydrophobicContact CG-CD1 3.91Å; E293-L297 HydrophobicContact CG-CD1 4.21Å; E293-L297 WeakPolarHBondContact O-CG 3.38Å; E293-L297 PolarHBondContact O-N 3.38Å; T294-L297 PolarHBondContact O-N 2.88Å; L295-L297 VanDerWaalsContact C-N 3.31Å; L295-L297 PolarHBondContact O-N 3.14Å; L297-Y301 VanDerWaalsContact O-CD2 3.24Å; L297-Y301 WeakPolarHBondContact O-CD2 3.01Å; L297-F325 WeakPolarHBondContact O-CB 3.34Å; L297-A326 HydrophobicContact CB-CB 3.86Å; L297-A326 HydrophobicContact CD1-CB 4.15Å
298	T	97	Very high	94.8	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.006	19%	0.191	C	C	.	.	H	α-helix	trans	-98.7	-47	-172.6	-49.3	0	0	0	0	113.3	I216 T294 L295 P300 Y301 V302 C321 V322	I216-T298 HydrophobicContact CD1-CG2 4.49Å; T294-T298 WeakPolarHBondContact O-CB 3.48Å; T294-T298 PolarHBondContact O-N 3.43Å; T294-T298 PolarHBondContact O-OG1 2.98Å; L295-T298 PolarHBondContact O-N 3.39Å; T298-P300 VanDerWaalsContact C-CD 3.48Å; T298-Y301 PolarHBondContact O-N 3.4Å; T298-V302 HydrophobicContact CG2-CG1 4.27Å; T298-V302 PolarHBondContact O-N 3.5Å; T298-C321 HydrophobicContact CG2-CB 4.44Å; T298-V322 HydrophobicContact CG2-CG2 3.97Å
299	A	95.4	Very high	94.1	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-57	-38.7	-168.5	0	0	0	0	0	115.3	Y220 L295 Y301 V302	Y220-A299 HydrophobicContact CD1-CB 3.68Å; Y220-A299 HydrophobicContact CG-CB 3.59Å; L295-A299 HydrophobicContact CD1-CB 4.12Å; L295-A299 HydrophobicContact CG-CB 4.2Å; L295-A299 WeakPolarHBondContact O-CB 3.24Å; L295-A299 PolarHBondContact O-N 3.32Å; A299-Y301 PolarHBondContact O-N 3.28Å; A299-V302 VanDerWaalsContact O-CG2 3.26Å; A299-V302 WeakPolarHBondContact O-CG2 3.49Å
300	P	95.3	Very high	93.2	Very high	37 Å²	37	45.5 Å²	45.5	24%	0.24	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-61.8	-28.9	176	-24.7	36.2	0	0	0	113.3	Y220 R296 T298 H303	Y220-P300 HydrophobicContact CD1-CG 4.49Å; Y220-P300 HydrophobicContact CE1-CG 4.1Å; R296-P300 VanDerWaalsContact O-CD 3.29Å; R296-P300 WeakPolarHBondContact O-CD 3.49Å; T298-P300 VanDerWaalsContact C-CD 3.48Å; P300-H303 PolarHBondContact O-CE1 3.36Å; P300-H303 PolarHBondContact O-ND1 2.93Å
301	Y	95.3	Very high	92.4	Very high	112 Å²	112	45.9 Å²	45.9	44%	0.439	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-106	2.3	-170.5	-51	-70.4	0	0	0	114.4	L297 T298 A299 H303 L304 F325	L297-Y301 VanDerWaalsContact O-CD2 3.24Å; L297-Y301 WeakPolarHBondContact O-CD2 3.01Å; T298-Y301 PolarHBondContact O-N 3.4Å; A299-Y301 PolarHBondContact O-N 3.28Å; Y301-H303 PolarHBondContact O-N 3.18Å; Y301-L304 HydrophobicContact CD1-CD1 4.28Å; Y301-L304 VanDerWaalsContact O-CB 3.31Å; Y301-L304 WeakPolarHBondContact O-CB 3.29Å; Y301-L304 PolarHBondContact O-N 3.46Å; Y301-F325 VanDerWaalsContact CB-CE1 3.46Å; Y301-F325 VanDerWaalsContact CB-CZ 3.47Å; Y301-F325 HydrophobicContact CD1-CE1 4.35Å; Y301-F325 AromaticContact CD2-CD1 3.73Å; Y301-F325 HydrophobicContact CD2-CD1 3.73Å; Y301-F325 HydrophobicContact CD2-CE1 4.15Å; Y301-F325 HydrophobicContact CD2-CG 4.18Å; Y301-F325 AromaticContact CG-CD1 3.81Å; Y301-F325 HydrophobicContact CG-CD1 3.81Å; Y301-F325 AromaticContact CG-CE1 3.75Å; Y301-F325 HydrophobicContact CG-CE1 3.75Å; Y301-F325 HydrophobicContact CG-CG 4.37Å; Y301-F325 HydrophobicContact CG-CZ 4.25Å
302	V	92.5	Very high	91.7	Very high	2 Å²	2	51.7 Å²	51.7	1%	0.012	27%	0.269	C	S	.	.	H	α-helix	trans	-55.2	-28.6	179.9	-68	0	0	0	0	114	M213 I216 R217 T298 A299 L304 C305 L306	M213-V302 HydrophobicContact CB-CB 4.34Å; M213-V302 HydrophobicContact SD-CB 4.27Å; M213-V302 HydrophobicContact SD-CG1 4.18Å; I216-V302 HydrophobicContact CD1-CG1 3.53Å; I216-V302 HydrophobicContact CG1-CG1 4.11Å; R217-V302 HydrophobicContact CB-CG2 3.73Å; R217-V302 HydrophobicContact CG-CG2 4.01Å; T298-V302 HydrophobicContact CG2-CG1 4.27Å; T298-V302 PolarHBondContact O-N 3.5Å; A299-V302 VanDerWaalsContact O-CG2 3.26Å; A299-V302 WeakPolarHBondContact O-CG2 3.49Å; V302-L304 PolarHBondContact O-N 3.22Å; V302-C305 WeakPolarHBondContact O-CB 3.44Å; V302-C305 PolarHBondContact O-N 3.37Å; V302-L306 PolarHBondContact O-N 3.29Å
303	H	90.1	Very high	91.2	Very high	86 Å²	86	51.5 Å²	51.5	40%	0.398	27%	0.271	S	S	.	.	H	α-helix	trans	-65.4	-23.5	176.8	66.7	-82.1	0	0	0	112.8	P300 Y301 P307	P300-H303 PolarHBondContact O-CE1 3.36Å; P300-H303 PolarHBondContact O-ND1 2.93Å; Y301-H303 PolarHBondContact O-N 3.18Å; H303-P307 VanDerWaalsContact O-CD 3.29Å; H303-P307 WeakPolarHBondContact O-CD 3.37Å
304	L	93.4	Very high	90.9	Very high	81 Å²	81	50.3 Å²	50.3	42%	0.424	27%	0.265	S	S	.	.	H	α-helix	trans	-79.9	-18.4	172.9	-56.9	178.2	0	0	0	112.3	Y301 V302 L308 F325	Y301-L304 HydrophobicContact CD1-CD1 4.28Å; Y301-L304 VanDerWaalsContact O-CB 3.31Å; Y301-L304 WeakPolarHBondContact O-CB 3.29Å; Y301-L304 PolarHBondContact O-N 3.46Å; V302-L304 PolarHBondContact O-N 3.22Å; L304-L308 WeakPolarHBondContact O-CD1 3.26Å; L304-F325 HydrophobicContact CB-CZ 4.1Å; L304-F325 HydrophobicContact CD1-CE1 4.43Å; L304-F325 HydrophobicContact CD1-CZ 3.99Å
305	C	91.5	Very high	90.6	Very high	11 Å²	11	51.4 Å²	51.4	7%	0.074	27%	0.271	C	S	.	.	H	α-helix	trans	-83	-32.2	176.3	-61.8	0	0	0	0	112.4	M213 V302 L308 V309 C321 F325	M213-C305 HydrophobicContact CE-CB 4.33Å; V302-C305 WeakPolarHBondContact O-CB 3.44Å; V302-C305 PolarHBondContact O-N 3.37Å; C305-L308 PolarHBondContact O-N 2.97Å; C305-V309 PolarHBondContact O-N 2.84Å; C305-C321 HydrophobicContact CB-CB 3.72Å; C305-C321 WeakPolarHBondContact CB-SG 3.28Å; C305-C321 WeakPolarHBondContact SG-CA 3.38Å; C305-C321 WeakPolarHBondContact SG-CB 3.44Å; C305-C321 CovalentContact SG-SG 2.03Å; C305-C321 PolarHBondContact SG-SG 2.79Å; C305-F325 WeakPolarHBondContact SG-CE2 3.27Å
306	L	88.6	Confident	90.3	Very high	47 Å²	47	51.3 Å²	51.3	25%	0.246	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-56.2	-41	-177.2	-68.4	172.1	0	0	0	114.1	K210 M213 V302 L308 V309	K210-L306 HydrophobicContact CB-CD2 4.37Å; K210-L306 HydrophobicContact CG-CD2 4.32Å; M213-L306 HydrophobicContact CB-CD2 3.86Å; M213-L306 HydrophobicContact CB-CG 4.48Å; M213-L306 HydrophobicContact CG-CD2 3.87Å; V302-L306 PolarHBondContact O-N 3.29Å; L306-L308 VanDerWaalsContact C-N 3.25Å; L306-L308 PolarHBondContact O-N 2.84Å; L306-V309 WeakPolarHBondContact O-CG2 3.38Å
307	P	88.3	Confident	89.9	Confident	107 Å²	107	46.5 Å²	46.5	70%	0.695	25%	0.253	S	S	*	.	G	3₁₀ helix	trans	-74.3	-13	176.4	-17.4	33.1	0	0	0	114.2	H303	H303-P307 VanDerWaalsContact O-CD 3.29Å; H303-P307 WeakPolarHBondContact O-CD 3.37Å
308	L	86.2	Confident	89.7	Confident	86 Å²	86	44.4 Å²	44.4	45%	0.45	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-100.9	4.5	-175.3	-59.7	176.8	0	0	0	113	L304 C305 L306 S310	L304-L308 WeakPolarHBondContact O-CD1 3.26Å; C305-L308 PolarHBondContact O-N 2.97Å; L306-L308 VanDerWaalsContact C-N 3.25Å; L306-L308 PolarHBondContact O-N 2.84Å; L308-S310 PolarHBondContact O-N 3.13Å; L308-S310 VanDerWaalsContact O-N 3.14Å; L308-S310 PolarHBondContact O-OG 3.36Å
309	V	83.6	Confident	89.5	Confident	49 Å²	49	44.7 Å²	44.7	30%	0.297	24%	0.243	S	C	.	.			trans	-55.1	119.8	178.2	167.9	0	0	0	0	109.3	Q209 C305 L306 S311 E317	Q209-V309 HydrophobicContact CB-CG2 4.36Å; Q209-V309 HydrophobicContact CG-CG1 4.15Å; C305-V309 PolarHBondContact O-N 2.84Å; L306-V309 WeakPolarHBondContact O-CG2 3.38Å; V309-S311 VanDerWaalsContact CG1-O 3.28Å; V309-S311 WeakPolarHBondContact CG1-O 3.5Å; V309-E317 HydrophobicContact CB-CG 4.32Å; V309-E317 HydrophobicContact CG1-CG 3.85Å; V309-E317 HydrophobicContact CG2-CB 4.46Å; V309-E317 HydrophobicContact CG2-CG 4.08Å
310	S	79.5	Confident	89.3	Confident	90 Å²	90	47 Å²	47	63%	0.629	25%	0.252	S	S	*	.			trans	-111.8	-7.1	-175.6	-53.1	0	0	0	0	113	L308 E317	L308-S310 PolarHBondContact O-N 3.13Å; L308-S310 VanDerWaalsContact O-N 3.14Å; L308-S310 PolarHBondContact O-OG 3.36Å; S310-E317 PolarHBondContact N-OE1 3.05Å; S310-E317 VanDerWaalsContact N-OE1 3.07Å
311	S	81.9	Confident	89.2	Confident	12 Å²	12	45.3 Å²	45.3	8%	0.084	24%	0.241	C	C	.	.	S	Bend	trans	-138.2	160.1	-177.8	78.6	0	0	0	0	112	Q209 V309 H313 E317	Q209-S311 PolarHBondContact NE2-O 3.15Å; V309-S311 VanDerWaalsContact CG1-O 3.28Å; V309-S311 WeakPolarHBondContact CG1-O 3.5Å; S311-H313 PolarHBondContact O-N 2.83Å; S311-H313 PolarHBondContact OG-N 3.08Å; S311-H313 PolarHBondContact OG-O 3.3Å; S311-E317 WeakPolarHBondContact CA-OE1 3.47Å; S311-E317 VanDerWaalsContact CB-OE1 3.25Å; S311-E317 WeakPolarHBondContact CB-OE1 3.36Å; S311-E317 PolarHBondContact N-OE1 2.87Å; S311-E317 PolarHBondContact OG-OE1 2.85Å
312	N	83.1	Confident	89.2	Confident	121 Å²	121	40 Å²	40	65%	0.647	22%	0.22	S	C	*	.	S	Bend	trans	-81.9	5.2	173.6	-67.8	-28	0	0	0	113.1	P207	P207-N312 WeakPolarHBondContact CB-O 3.46Å; P207-N312 HydrophobicContact CG-CB 4.24Å
313	H	86.8	Confident	89.2	Confident	48 Å²	48	42.6 Å²	42.6	22%	0.222	23%	0.232	C	C	.	.			trans	-101.8	104.7	-175.7	-69.7	-69.6	0	0	0	109.8	E269 L273 S311 D315 V316 E317	E269-H313 IonicContact OE1-CE1 3.47Å; E269-H313 PolarHBondContact OE1-CE1 3.34Å; E269-H313 IonicContact OE1-NE2 3.11Å; E269-H313 PolarHBondContact OE1-NE2 2.88Å; E269-H313 IonicContact OE2-NE2 3.74Å; L273-H313 WeakPolarHBondContact CD2-CD2 3.32Å; S311-H313 PolarHBondContact O-N 2.83Å; S311-H313 PolarHBondContact OG-N 3.08Å; S311-H313 PolarHBondContact OG-O 3.3Å; H313-D315 VanDerWaalsContact C-N 3.31Å; H313-D315 PolarHBondContact O-N 3.34Å; H313-V316 HydrophobicContact CB-CB 3.97Å; H313-V316 HydrophobicContact CB-CG2 3.68Å; H313-V316 WeakPolarHBondContact O-CB 3.22Å; H313-V316 PolarHBondContact O-N 3.34Å; H313-E317 PolarHBondContact O-N 3.5Å
314	E	90.2	Very high	89.3	Confident	13 Å²	13	46.3 Å²	46.3	6%	0.061	24%	0.243	C	C	.	.	H	α-helix	trans	-59.2	-39.8	-176	167.4	-84.6	138.8	0	0	113.6	P208 Q209 S212 R232 V316 E317 L318	P208-E314 HydrophobicContact CG-CB 3.99Å; P208-E314 HydrophobicContact CG-CG 4.17Å; Q209-E314 HydrophobicContact CG-CB 4.12Å; S212-E314 WeakPolarHBondContact CB-OE1 2.99Å; S212-E314 PolarHBondContact OG-OE1 2.87Å; R232-E314 IonicContact CZ-OE2 3.56Å; R232-E314 IonicContact NE-OE1 3.26Å; R232-E314 IonicContact NE-OE2 3.53Å; R232-E314 IonicContact NH2-OE1 3.97Å; R232-E314 IonicContact NH2-OE2 2.73Å; R232-E314 PolarHBondContact NH2-OE2 2.96Å; E314-V316 PolarHBondContact O-N 3.12Å; E314-E317 PolarHBondContact O-N 3.5Å; E314-L318 WeakPolarHBondContact O-CB 3.34Å; E314-L318 PolarHBondContact O-N 3.41Å
315	D	91.5	Very high	89.5	Confident	22 Å²	22	45 Å²	45	12%	0.118	23%	0.234	C	C	.	.	H	α-helix	trans	-62.2	-43.1	177.5	55.4	-6.9	0	0	0	111.6	M283 G284 I288 H313 E317 L318 N319	M283-D315 WeakPolarHBondContact CA-OD2 3.36Å; G284-D315 VanDerWaalsContact N-CB 3.34Å; G284-D315 PolarHBondContact N-OD2 3.18Å; I288-D315 HydrophobicContact CD1-CB 4.46Å; H313-D315 VanDerWaalsContact C-N 3.31Å; H313-D315 PolarHBondContact O-N 3.34Å; D315-E317 PolarHBondContact O-N 2.84Å; D315-L318 PolarHBondContact O-N 2.85Å; D315-N319 WeakPolarHBondContact O-CB 3.46Å; D315-N319 PolarHBondContact O-N 3.22Å; D315-N319 PolarHBondContact O-ND2 3.32Å
316	V	90.2	Very high	89.7	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-59.4	-45.5	175	177.5	0	0	0	0	111.2	L273 L275 Y281 H313 E314 N319 R320	L273-V316 HydrophobicContact CD1-CG2 4.46Å; L273-V316 HydrophobicContact CD2-CG2 4.38Å; L275-V316 HydrophobicContact CD1-CG1 4.29Å; L275-V316 HydrophobicContact CD2-CG1 4.05Å; L275-V316 HydrophobicContact CG-CG1 4.14Å; Y281-V316 HydrophobicContact CD1-CG2 4.26Å; Y281-V316 HydrophobicContact CD2-CG2 3.81Å; Y281-V316 HydrophobicContact CE1-CG2 4.08Å; Y281-V316 HydrophobicContact CE2-CG2 3.62Å; Y281-V316 HydrophobicContact CG-CG2 4.12Å; H313-V316 HydrophobicContact CB-CB 3.97Å; H313-V316 HydrophobicContact CB-CG2 3.68Å; H313-V316 WeakPolarHBondContact O-CB 3.22Å; H313-V316 PolarHBondContact O-N 3.34Å; E314-V316 PolarHBondContact O-N 3.12Å; V316-N319 PolarHBondContact O-N 3.24Å; V316-R320 WeakPolarHBondContact O-CG 3.3Å; V316-R320 PolarHBondContact O-N 3.3Å
317	E	90.9	Very high	89.9	Confident	8 Å²	8	45.7 Å²	45.7	4%	0.037	25%	0.253	C	S	.	.	H	α-helix	trans	-67.8	-38.9	179.3	-59	-52	154.3	0	0	113.1	Q209 M213 V309 S310 S311 H313 E314 D315 N319 R320 C321	Q209-E317 HydrophobicContact CG-CG 4.1Å; M213-E317 VanDerWaalsContact CE-C 3.45Å; M213-E317 HydrophobicContact CE-CB 4.09Å; M213-E317 VanDerWaalsContact CE-O 3.29Å; M213-E317 WeakPolarHBondContact CE-O 3.48Å; V309-E317 HydrophobicContact CB-CG 4.32Å; V309-E317 HydrophobicContact CG1-CG 3.85Å; V309-E317 HydrophobicContact CG2-CB 4.46Å; V309-E317 HydrophobicContact CG2-CG 4.08Å; S310-E317 PolarHBondContact N-OE1 3.05Å; S310-E317 VanDerWaalsContact N-OE1 3.07Å; S311-E317 WeakPolarHBondContact CA-OE1 3.47Å; S311-E317 VanDerWaalsContact CB-OE1 3.25Å; S311-E317 WeakPolarHBondContact CB-OE1 3.36Å; S311-E317 PolarHBondContact N-OE1 2.87Å; S311-E317 PolarHBondContact OG-OE1 2.85Å; H313-E317 PolarHBondContact O-N 3.5Å; E314-E317 PolarHBondContact O-N 3.5Å; D315-E317 PolarHBondContact O-N 2.84Å; E317-N319 VanDerWaalsContact C-N 3.34Å; E317-R320 PolarHBondContact O-N 3.36Å; E317-R320 IonicContact OE1-CZ 2.8Å; E317-R320 IonicContact OE1-NH1 3.18Å; E317-R320 PolarHBondContact OE1-NH1 3.44Å; E317-R320 IonicContact OE2-CZ 3.44Å; E317-R320 IonicContact OE2-NH1 3.41Å; E317-R320 PolarHBondContact OE2-NH1 2.97Å; E317-C321 WeakPolarHBondContact O-CB 3.18Å; E317-C321 PolarHBondContact O-N 3.1Å
318	L	92.9	Very high	90.2	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-60.3	-46.4	173.7	176.7	57.7	0	0	0	110.8	M213 I216 I288 E314 D315 R320 C321 V322	M213-L318 VanDerWaalsContact CE-CA 3.49Å; M213-L318 HydrophobicContact CE-CB 4.28Å; M213-L318 HydrophobicContact SD-CD1 4.21Å; I216-L318 HydrophobicContact CD1-CD1 3.45Å; I216-L318 VanDerWaalsContact CD1-CD1 3.45Å; I216-L318 HydrophobicContact CG1-CD1 4.23Å; I216-L318 HydrophobicContact CG2-CD1 4.42Å; I288-L318 HydrophobicContact CD1-CD2 3.81Å; E314-L318 WeakPolarHBondContact O-CB 3.34Å; E314-L318 PolarHBondContact O-N 3.41Å; D315-L318 PolarHBondContact O-N 2.85Å; L318-R320 PolarHBondContact O-N 2.93Å; L318-C321 PolarHBondContact O-N 3.35Å; L318-V322 HydrophobicContact CD1-CG2 4.21Å; L318-V322 WeakPolarHBondContact O-CG2 3.38Å; L318-V322 PolarHBondContact O-N 3.49Å
319	N	93	Very high	90.4	Very high	6 Å²	6	42.2 Å²	42.2	3%	0.032	23%	0.226	C	C	.	.	H	α-helix	trans	-60.3	-43.5	176.9	-82.6	-101.6	0	0	0	111.7	M258 Y281 C282 D315 V316 E317 C321 V322 Q323	M258-N319 HydrophobicContact CE-CB 4.34Å; M258-N319 WeakPolarHBondContact CE-OD1 3.46Å; Y281-N319 WeakPolarHBondContact CA-OD1 3.3Å; C282-N319 PolarHBondContact N-ND2 2.95Å; C282-N319 PolarHBondContact N-OD1 2.85Å; C282-N319 PolarHBondContact O-ND2 2.9Å; C282-N319 VanDerWaalsContact O-ND2 3.14Å; D315-N319 WeakPolarHBondContact O-CB 3.46Å; D315-N319 PolarHBondContact O-N 3.22Å; D315-N319 PolarHBondContact O-ND2 3.32Å; V316-N319 PolarHBondContact O-N 3.24Å; E317-N319 VanDerWaalsContact C-N 3.34Å; N319-C321 VanDerWaalsContact C-N 3.35Å; N319-C321 PolarHBondContact O-N 2.81Å; N319-V322 PolarHBondContact O-N 2.88Å; N319-Q323 WeakPolarHBondContact O-CB 3.46Å; N319-Q323 PolarHBondContact O-N 2.9Å
320	R	90.6	Very high	90.8	Very high	48 Å²	48	40.1 Å²	40.1	18%	0.181	21%	0.213	C	C	.	.	H	α-helix	trans	-60.3	-43.1	175	-77.9	-178	175.3	138.5	-7.8	112.8	L273 G274 L275 V316 E317 L318 Q323 R324	L273-R320 PolarHBondContact O-NH2 3.43Å; G274-R320 PolarHBondContact O-NH2 3.43Å; L275-R320 HydrophobicContact CD2-CG 4.47Å; V316-R320 WeakPolarHBondContact O-CG 3.3Å; V316-R320 PolarHBondContact O-N 3.3Å; E317-R320 PolarHBondContact O-N 3.36Å; E317-R320 IonicContact OE1-CZ 2.8Å; E317-R320 IonicContact OE1-NH1 3.18Å; E317-R320 PolarHBondContact OE1-NH1 3.44Å; E317-R320 IonicContact OE2-CZ 3.44Å; E317-R320 IonicContact OE2-NH1 3.41Å; E317-R320 PolarHBondContact OE2-NH1 2.97Å; L318-R320 PolarHBondContact O-N 2.93Å; R320-Q323 PolarHBondContact O-N 3.08Å; R320-R324 VanDerWaalsContact O-CB 3.29Å; R320-R324 WeakPolarHBondContact O-CB 3.27Å; R320-R324 PolarHBondContact O-N 3.17Å
321	C	93.4	Very high	91.3	Very high	3 Å²	3	38 Å²	38	2%	0.02	20%	0.196	C	C	.	.	H	α-helix	trans	-64.2	-44.3	179.7	-165.6	0	0	0	0	111.2	M213 T298 C305 E317 L318 N319 R324 F325	M213-C321 HydrophobicContact CE-CB 3.74Å; M213-C321 HydrophobicContact SD-CB 4.15Å; T298-C321 HydrophobicContact CG2-CB 4.44Å; C305-C321 HydrophobicContact CB-CB 3.72Å; C305-C321 WeakPolarHBondContact CB-SG 3.28Å; C305-C321 WeakPolarHBondContact SG-CA 3.38Å; C305-C321 WeakPolarHBondContact SG-CB 3.44Å; C305-C321 CovalentContact SG-SG 2.03Å; C305-C321 PolarHBondContact SG-SG 2.79Å; E317-C321 WeakPolarHBondContact O-CB 3.18Å; E317-C321 PolarHBondContact O-N 3.1Å; L318-C321 PolarHBondContact O-N 3.35Å; N319-C321 VanDerWaalsContact C-N 3.35Å; N319-C321 PolarHBondContact O-N 2.81Å; C321-R324 PolarHBondContact O-N 3.03Å; C321-F325 WeakPolarHBondContact O-CD2 3.36Å; C321-F325 PolarHBondContact O-N 2.89Å; C321-F325 VanDerWaalsContact O-N 3.1Å
322	V	95.2	Very high	91.3	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-62.1	-45.6	174.3	171.4	0	0	0	0	111.2	M258 L290 T294 T298 L318 N319 R324 F325 A326 G327 V328	M258-V322 HydrophobicContact CE-CG1 4.15Å; M258-V322 HydrophobicContact SD-CB 4.19Å; M258-V322 HydrophobicContact SD-CG1 3.92Å; M258-V322 HydrophobicContact SD-CG2 4.29Å; L290-V322 HydrophobicContact CD2-CG2 4.25Å; T294-V322 HydrophobicContact CG2-CG1 3.49Å; T294-V322 VanDerWaalsContact CG2-CG1 3.49Å; T298-V322 HydrophobicContact CG2-CG2 3.97Å; L318-V322 HydrophobicContact CD1-CG2 4.21Å; L318-V322 WeakPolarHBondContact O-CG2 3.38Å; L318-V322 PolarHBondContact O-N 3.49Å; N319-V322 PolarHBondContact O-N 2.88Å; V322-R324 VanDerWaalsContact C-N 3.31Å; V322-R324 PolarHBondContact O-N 3.46Å; V322-F325 PolarHBondContact O-N 2.86Å; V322-A326 HydrophobicContact CG1-CB 4.27Å; V322-A326 WeakPolarHBondContact O-CA 3.49Å; V322-A326 WeakPolarHBondContact O-CB 3.45Å; V322-A326 PolarHBondContact O-N 2.81Å; V322-G327 PolarHBondContact O-N 2.98Å; V322-V328 HydrophobicContact CG1-CG2 3.64Å
323	Q	92.6	Very high	91.1	Very high	56 Å²	56	42 Å²	42	26%	0.262	21%	0.207	S	C	.	.	H	α-helix	trans	-61.8	-40.3	177.5	-177.9	174.2	-3.5	0	0	111.7	E279 N319 R320 G327 V328 K329	E279-Q323 PolarHBondContact OE1-NE2 3.19Å; N319-Q323 WeakPolarHBondContact O-CB 3.46Å; N319-Q323 PolarHBondContact O-N 2.9Å; R320-Q323 PolarHBondContact O-N 3.08Å; Q323-G327 VanDerWaalsContact O-CA 3.23Å; Q323-G327 WeakPolarHBondContact O-CA 3.49Å; Q323-G327 PolarHBondContact O-N 2.94Å; Q323-G327 VanDerWaalsContact O-N 3.13Å; Q323-V328 WeakPolarHBondContact CA-O 3.45Å; Q323-K329 HydrophobicContact CG-CG 4.41Å
324	R	93	Very high	90.5	Very high	165 Å²	165	48 Å²	48	62%	0.623	23%	0.228	S	C	*	.	H	α-helix	trans	-64.7	-42.7	179.7	-178.2	175.9	-178.4	124.4	-0	113	R320 C321 V322	R320-R324 VanDerWaalsContact O-CB 3.29Å; R320-R324 WeakPolarHBondContact O-CB 3.27Å; R320-R324 PolarHBondContact O-N 3.17Å; C321-R324 PolarHBondContact O-N 3.03Å; V322-R324 VanDerWaalsContact C-N 3.31Å; V322-R324 PolarHBondContact O-N 3.46Å
325	F	96.3	Very high	90.1	Very high	52 Å²	52	49.3 Å²	49.3	23%	0.228	23%	0.234	C	C	.	.	H	α-helix	trans	-103.7	-33.4	-170.9	-71.7	-69.5	0	0	0	114.5	L297 Y301 L304 C305 C321 V322	L297-F325 WeakPolarHBondContact O-CB 3.34Å; Y301-F325 VanDerWaalsContact CB-CE1 3.46Å; Y301-F325 VanDerWaalsContact CB-CZ 3.47Å; Y301-F325 HydrophobicContact CD1-CE1 4.35Å; Y301-F325 AromaticContact CD2-CD1 3.73Å; Y301-F325 HydrophobicContact CD2-CD1 3.73Å; Y301-F325 HydrophobicContact CD2-CE1 4.15Å; Y301-F325 HydrophobicContact CD2-CG 4.18Å; Y301-F325 AromaticContact CG-CD1 3.81Å; Y301-F325 HydrophobicContact CG-CD1 3.81Å; Y301-F325 AromaticContact CG-CE1 3.75Å; Y301-F325 HydrophobicContact CG-CE1 3.75Å; Y301-F325 HydrophobicContact CG-CG 4.37Å; Y301-F325 HydrophobicContact CG-CZ 4.25Å; L304-F325 HydrophobicContact CB-CZ 4.1Å; L304-F325 HydrophobicContact CD1-CE1 4.43Å; L304-F325 HydrophobicContact CD1-CZ 3.99Å; C305-F325 WeakPolarHBondContact SG-CE2 3.27Å; C321-F325 WeakPolarHBondContact O-CD2 3.36Å; C321-F325 PolarHBondContact O-N 2.89Å; C321-F325 VanDerWaalsContact O-N 3.1Å; V322-F325 PolarHBondContact O-N 2.86Å
326	A	96.2	Very high	89.9	Confident	12 Å²	12	49.1 Å²	49.1	10%	0.099	23%	0.233	C	C	.	.	H	α-helix	trans	-101.2	-10.2	177.6	0	0	0	0	0	113.5	T294 L297 V322 V328	T294-A326 HydrophobicContact CG2-CB 3.95Å; L297-A326 HydrophobicContact CB-CB 3.86Å; L297-A326 HydrophobicContact CD1-CB 4.15Å; V322-A326 HydrophobicContact CG1-CB 4.27Å; V322-A326 WeakPolarHBondContact O-CA 3.49Å; V322-A326 WeakPolarHBondContact O-CB 3.45Å; V322-A326 PolarHBondContact O-N 2.81Å; A326-V328 HydrophobicContact CB-CG2 4.07Å; A326-V328 PolarHBondContact O-N 3.36Å
327	G	93.3	Very high	89.7	Confident	61 Å²	61	53.3 Å²	53.3	63%	0.629	25%	0.253	S	S	*	.			trans	70.2	15.2	177.1	0	0	0	0	0	114.6	V322 Q323	V322-G327 PolarHBondContact O-N 2.98Å; Q323-G327 VanDerWaalsContact O-CA 3.23Å; Q323-G327 WeakPolarHBondContact O-CA 3.49Å; Q323-G327 PolarHBondContact O-N 2.94Å; Q323-G327 VanDerWaalsContact O-N 3.13Å
328	V	93.3	Very high	89.5	Confident	27 Å²	27	55.4 Å²	55.4	16%	0.164	27%	0.268	C	S	.	.			trans	-115.8	145.4	-177.7	-65.9	0	0	0	0	112.9	P256 M258 T294 V322 Q323 A326	P256-V328 HydrophobicContact CB-CG1 3.44Å; P256-V328 VanDerWaalsContact CB-CG1 3.44Å; P256-V328 HydrophobicContact CB-CG2 4.28Å; M258-V328 HydrophobicContact CB-CG2 4.46Å; T294-V328 HydrophobicContact CG2-CG2 3.86Å; V322-V328 HydrophobicContact CG1-CG2 3.64Å; Q323-V328 WeakPolarHBondContact CA-O 3.45Å; A326-V328 HydrophobicContact CB-CG2 4.07Å; A326-V328 PolarHBondContact O-N 3.36Å
329	K	91.2	Very high	89.5	Confident	94 Å²	94	57 Å²	57	41%	0.409	28%	0.277	S	S	.	.			trans	-105.4	171.4	175.2	-54	-172.5	-167.2	-167.8	0	110.1	M258 E279 Q323 T331	M258-K329 VanDerWaalsContact CE-C 3.45Å; E279-K329 WeakPolarHBondContact OE1-CE 3.24Å; E279-K329 IonicContact OE1-NZ 2.66Å; E279-K329 PolarHBondContact OE1-NZ 3.01Å; Q323-K329 HydrophobicContact CG-CG 4.41Å; K329-T331 PolarHBondContact O-N 3.23Å
330	C	92.4	Very high	89.7	Confident	5 Å²	5	56.7 Å²	56.7	3%	0.034	28%	0.275	C	S	.	.	B	Isolated β-bridge	trans	-63	135.9	173.2	-169.6	0	0	0	0	110.3	M258 C282 W332	M258-C330 HydrophobicContact CE-CB 4.21Å; M258-C330 VanDerWaalsContact CE-N 3.29Å; C282-C330 WeakPolarHBondContact CA-SG 3.29Å; C282-C330 HydrophobicContact CB-CB 3.92Å; C282-C330 WeakPolarHBondContact CB-SG 3.4Å; C282-C330 VanDerWaalsContact N-CB 3.26Å; C282-C330 PolarHBondContact N-SG 2.87Å; C282-C330 VanDerWaalsContact SG-CA 3.6Å; C282-C330 WeakPolarHBondContact SG-CB 3.41Å; C282-C330 CovalentContact SG-SG 2.04Å; C282-C330 PolarHBondContact SG-SG 3.18Å; C330-W332 PolarHBondContact O-N 3.05Å
331	T	89.3	Confident	89.8	Confident	45 Å²	45	56.8 Å²	56.8	28%	0.276	28%	0.276	S	S	.	.			trans	-63	112.3	179.8	-62.9	0	0	0	0	110.9	M258 L259 K329 S333 M336	M258-T331 PolarHBondContact O-N 3.18Å; M258-T331 PolarHBondContact O-OG1 3.44Å; L259-T331 HydrophobicContact CD2-CG2 4.47Å; L259-T331 WeakPolarHBondContact CD2-OG1 3.5Å; K329-T331 PolarHBondContact O-N 3.23Å; T331-S333 PolarHBondContact O-N 3.35Å; T331-M336 HydrophobicContact CG2-CG 4.32Å
332	W	82	Confident	89.8	Confident	181 Å²	181	57.4 Å²	57.4	69%	0.686	28%	0.279	S	S	*	.			trans	-90.3	93.3	179.3	-169.3	59.4	0	0	0	111.1	F264 P280 C330	F264-W332 AromaticContact CE2-NE1 3.86Å; F264-W332 AromaticContact CZ-NE1 3.64Å; P280-W332 HydrophobicContact CG-CB 4.18Å; P280-W332 HydrophobicContact CG-CG 4.46Å; C330-W332 PolarHBondContact O-N 3.05Å
333	S	78.4	Confident	89.6	Confident	37 Å²	37	58.4 Å²	58.4	26%	0.259	28%	0.284	S	S	.	.			trans	-136.1	138.6	172.4	166.7	0	0	0	0	109.6	T331 E335 M336	T331-S333 PolarHBondContact O-N 3.35Å; S333-E335 PolarHBondContact O-N 3.33Å; S333-E335 VanDerWaalsContact O-N 3.15Å; S333-E335 PolarHBondContact OG-N 3.02Å; S333-M336 WeakPolarHBondContact O-CB 3.18Å; S333-M336 PolarHBondContact O-N 2.88Å
334	Y	75.6	Confident	89.4	Confident	173 Å²	173	63.5 Å²	63.5	68%	0.678	30%	0.302	S	S	*	.	H	α-helix	trans	-55.5	-30	173.9	77.3	-85.9	0	0	0	111.7	Q337	Y334-Q337 PolarHBondContact O-N 3.02Å
335	E	80.3	Confident	89	Confident	40 Å²	40	59 Å²	59	19%	0.187	30%	0.296	C	S	.	.	H	α-helix	trans	-68.7	-34.9	178.3	-60.4	-172.7	-172.7	0	0	111.6	S333 Q337 S338 L339 R479	S333-E335 PolarHBondContact O-N 3.33Å; S333-E335 VanDerWaalsContact O-N 3.15Å; S333-E335 PolarHBondContact OG-N 3.02Å; E335-Q337 PolarHBondContact O-N 2.81Å; E335-S338 PolarHBondContact O-N 3.23Å; E335-S338 PolarHBondContact O-OG 2.83Å; E335-L339 WeakPolarHBondContact O-CG 3.4Å; E335-L339 PolarHBondContact O-N 3.35Å; E335-R479 IonicContact OE1-CZ 3.62Å; E335-R479 IonicContact OE1-NH1 2.76Å; E335-R479 PolarHBondContact OE1-NH1 2.9Å; E335-R479 IonicContact OE1-NH2 3.75Å; E335-R479 PolarHBondContact OE1-NH2 2.8Å; E335-R479 IonicContact OE2-CZ 3.87Å; E335-R479 IonicContact OE2-NH1 2.66Å; E335-R479 PolarHBondContact OE2-NH1 2.85Å; E335-R479 IonicContact OE2-NH2 3.5Å; E335-R479 PolarHBondContact OE2-NH2 3.07Å
336	M	87.7	Confident	88.4	Confident	18 Å²	18	58.6 Å²	58.6	9%	0.089	31%	0.306	C	S	.	.	H	α-helix	trans	-62.1	-33.3	-179.6	-68.3	-58.1	110.4	0	0	112	G260 T331 S333 S338 L339 F340	G260-M336 WeakPolarHBondContact O-CB 3.47Å; T331-M336 HydrophobicContact CG2-CG 4.32Å; S333-M336 WeakPolarHBondContact O-CB 3.18Å; S333-M336 PolarHBondContact O-N 2.88Å; M336-S338 VanDerWaalsContact C-N 3.28Å; M336-S338 PolarHBondContact O-N 3.2Å; M336-L339 HydrophobicContact CE-CD1 3.73Å; M336-L339 PolarHBondContact O-N 2.83Å; M336-F340 WeakPolarHBondContact O-CA 3.18Å; M336-F340 WeakPolarHBondContact O-CB 3.29Å; M336-F340 PolarHBondContact O-N 2.91Å; M336-F340 HydrophobicContact SD-CD2 4.31Å; M336-F340 HydrophobicContact SD-CE2 4.24Å
337	Q	86.2	Confident	87.5	Confident	89 Å²	89	63 Å²	63	42%	0.416	34%	0.336	S	S	.	.	H	α-helix	trans	-66	-29.9	174.7	-64.9	179.4	-9.1	0	0	113.1	Q261 Y334 E335	Q261-Q337 HydrophobicContact CG-CG 4.33Å; Y334-Q337 PolarHBondContact O-N 3.02Å; E335-Q337 PolarHBondContact O-N 2.81Å
338	S	87.2	Confident	86.9	Confident	52 Å²	52	65.8 Å²	65.8	36%	0.364	33%	0.333	S	S	.	.	H	α-helix	trans	-85	-30.4	176.6	67.1	0	0	0	0	113.2	E335 M336 A362	E335-S338 PolarHBondContact O-N 3.23Å; E335-S338 PolarHBondContact O-OG 2.83Å; M336-S338 VanDerWaalsContact C-N 3.28Å; M336-S338 PolarHBondContact O-N 3.2Å; S338-A362 WeakPolarHBondContact O-CA 3.39Å
339	L	93.1	Very high	86.4	Confident	33 Å²	33	65.1 Å²	65.1	17%	0.173	33%	0.33	C	S	.	.	H	α-helix	trans	-82.3	-38	179	-62.8	179.9	0	0	0	111.7	L247 E335 M336 I363 V364	L247-L339 HydrophobicContact CD2-CD1 4.28Å; E335-L339 WeakPolarHBondContact O-CG 3.4Å; E335-L339 PolarHBondContact O-N 3.35Å; M336-L339 HydrophobicContact CE-CD1 3.73Å; M336-L339 PolarHBondContact O-N 2.83Å; L339-I363 HydrophobicContact CB-CD1 4.2Å; L339-I363 HydrophobicContact CB-CG1 4.28Å; L339-I363 HydrophobicContact CD1-CD1 4.18Å; L339-I363 HydrophobicContact CD2-CD1 3.98Å; L339-I363 HydrophobicContact CD2-CG1 4.01Å; L339-I363 HydrophobicContact CG-CD1 4.34Å; L339-I363 WeakPolarHBondContact O-CA 3.24Å; L339-I363 WeakPolarHBondContact O-CB 3.43Å; L339-I363 PolarHBondContact O-N 3.06Å; L339-V364 PolarHBondContact O-N 3.35Å
340	F	95.6	Very high	86.2	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	85.6	172.1	-69.4	-101.1	0	0	0	107.4	L244 Q261 T286 V289 M336 V364	L244-F340 HydrophobicContact CD1-CZ 4.23Å; Q261-F340 HydrophobicContact CB-CB 3.97Å; Q261-F340 PolarHBondContact OE1-O 3.2Å; Q261-F340 VanDerWaalsContact OE1-O 3.08Å; T286-F340 HydrophobicContact CG2-CB 4.28Å; T286-F340 WeakPolarHBondContact O-CD1 3.42Å; V289-F340 HydrophobicContact CG2-CE1 4.2Å; V289-F340 HydrophobicContact CG2-CZ 4.02Å; M336-F340 WeakPolarHBondContact O-CA 3.18Å; M336-F340 WeakPolarHBondContact O-CB 3.29Å; M336-F340 PolarHBondContact O-N 2.91Å; M336-F340 HydrophobicContact SD-CD2 4.31Å; M336-F340 HydrophobicContact SD-CE2 4.24Å; F340-V364 HydrophobicContact CD1-CB 3.88Å; F340-V364 HydrophobicContact CD1-CG1 4.48Å; F340-V364 HydrophobicContact CD1-CG2 3.72Å; F340-V364 HydrophobicContact CE1-CB 4.33Å; F340-V364 HydrophobicContact CE1-CG2 3.64Å; F340-V364 HydrophobicContact CG-CB 4.42Å; F340-V364 HydrophobicContact CG-CG2 4.45Å; F340-V364 HydrophobicContact CZ-CG2 4.31Å
341	Y	94.2	Very high	85.5	Confident	50 Å²	50	64.7 Å²	64.7	20%	0.196	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	113.9	-168.8	179.4	-111.9	0	0	0	111.7	N343 F350 E358 V364 L365 H366	Y341-N343 HydrophobicContact CE1-CB 3.87Å; Y341-F350 HydrophobicContact CD1-CE1 4.1Å; Y341-F350 HydrophobicContact CD1-CZ 4.07Å; Y341-F350 AromaticContact CE1-CE1 3.93Å; Y341-F350 HydrophobicContact CE1-CE1 3.93Å; Y341-F350 HydrophobicContact CE1-CZ 4.11Å; Y341-E358 HydrophobicContact CD1-CB 4.38Å; Y341-E358 HydrophobicContact CD2-CB 4.2Å; Y341-E358 HydrophobicContact CE1-CB 3.9Å; Y341-E358 HydrophobicContact CE2-CB 3.72Å; Y341-E358 HydrophobicContact CE2-CG 4Å; Y341-V364 PolarHBondContact N-O 2.89Å; Y341-L365 HydrophobicContact CD1-CD2 4.39Å; Y341-H366 PolarHBondContact O-N 2.94Å
342	N	92.9	Very high	84.9	Confident	16 Å²	16	65.1 Å²	65.1	9%	0.086	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	119.1	167.9	-177.9	77.3	0	0	0	111.7	T286 Y344 H366	T286-N342 HydrophobicContact CG2-CB 3.94Å; N342-Y344 HydrophobicContact CB-CE2 4.31Å; N342-Y344 WeakPolarHBondContact ND2-CD1 3.46Å; N342-Y344 WeakPolarHBondContact ND2-CE1 3.13Å; N342-Y344 WeakPolarHBondContact ND2-CE2 3.41Å; N342-Y344 WeakPolarHBondContact O-CD2 2.94Å; N342-Y344 WeakPolarHBondContact O-CE2 3.25Å; N342-H366 CarbonylContact C-O 3.48Å; N342-H366 WeakPolarHBondContact CA-O 3.45Å; N342-H366 PolarHBondContact OD1-CE1 3.08Å; N342-H366 VanDerWaalsContact OD1-CE1 3.28Å; N342-H366 PolarHBondContact OD1-ND1 3Å
343	N	90.9	Very high	84.3	Confident	20 Å²	20	60.4 Å²	60.4	11%	0.107	34%	0.336	C	S	.	.			trans	-86.4	110.7	174.6	-169.9	-22.1	0	0	0	110.9	Y341 S345 A349 F350 H366	Y341-N343 HydrophobicContact CE1-CB 3.87Å; N343-S345 PolarHBondContact O-N 2.88Å; N343-S345 WeakPolarHBondContact OD1-CB 3.41Å; N343-S345 PolarHBondContact OD1-N 2.8Å; N343-S345 PolarHBondContact OD1-OG 3.3Å; N343-A349 HydrophobicContact CB-CB 4.09Å; N343-F350 HydrophobicContact CB-CE1 4.12Å; N343-F350 HydrophobicContact CB-CE2 3.83Å; N343-F350 HydrophobicContact CB-CZ 3.6Å; N343-H366 PolarHBondContact N-O 3.33Å
344	Y	87.9	Confident	84.6	Confident	164 Å²	164	59.9 Å²	59.9	64%	0.643	33%	0.329	S	S	*	.			trans	-79.8	7.8	-178.1	-61.8	-85.7	0	0	0	114.4	Q261 M283 N342 G346	Q261-Y344 PolarHBondContact NE2-OH 2.78Å; Q261-Y344 VanDerWaalsContact NE2-OH 3.15Å; M283-Y344 HydrophobicContact CE-CE1 4.38Å; N342-Y344 HydrophobicContact CB-CE2 4.31Å; N342-Y344 WeakPolarHBondContact ND2-CD1 3.46Å; N342-Y344 WeakPolarHBondContact ND2-CE1 3.13Å; N342-Y344 WeakPolarHBondContact ND2-CE2 3.41Å; N342-Y344 WeakPolarHBondContact O-CD2 2.94Å; N342-Y344 WeakPolarHBondContact O-CE2 3.25Å; Y344-G346 PolarHBondContact O-N 3.4Å
345	S	85	Confident	84.5	Confident	71 Å²	71	52.2 Å²	52.2	50%	0.497	30%	0.3	S	S	.	.			trans	-73.7	8.6	-178.7	-51.5	0	0	0	0	114.5	N343 S347 Q348	N343-S345 PolarHBondContact O-N 2.88Å; N343-S345 WeakPolarHBondContact OD1-CB 3.41Å; N343-S345 PolarHBondContact OD1-N 2.8Å; N343-S345 PolarHBondContact OD1-OG 3.3Å; S345-S347 PolarHBondContact O-N 3.08Å; S345-Q348 PolarHBondContact O-N 2.65Å; S345-Q348 VanDerWaalsContact O-N 3.07Å
346	G	83.3	Confident	84.5	Confident	42 Å²	42	52.1 Å²	52.1	43%	0.433	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	62.7	-124.7	175.7	0	0	0	0	0	112.8	Y344 Q348 A349	Y344-G346 PolarHBondContact O-N 3.4Å; G346-Q348 PolarHBondContact O-N 3.01Å; G346-A349 VanDerWaalsContact O-CB 3.3Å; G346-A349 WeakPolarHBondContact O-CB 3.32Å; G346-A349 PolarHBondContact O-N 3.45Å
347	S	78.5	Confident	84	Confident	106 Å²	106	52.7 Å²	52.7	74%	0.741	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-67.6	-15.3	177	52.5	0	0	0	0	113.8	S345 A349 T351	S345-S347 PolarHBondContact O-N 3.08Å; S347-A349 VanDerWaalsContact C-N 3.34Å; S347-T351 WeakPolarHBondContact O-CG2 3.2Å
348	Q	79.5	Confident	84	Confident	119 Å²	119	52.8 Å²	52.8	56%	0.556	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-92.4	7.6	175.2	-59.9	-60.4	-29.7	0	0	112.9	S345 G346 F350 T351	S345-Q348 PolarHBondContact O-N 2.65Å; S345-Q348 VanDerWaalsContact O-N 3.07Å; G346-Q348 PolarHBondContact O-N 3.01Å; Q348-F350 PolarHBondContact O-N 3.47Å; Q348-F350 VanDerWaalsContact O-N 3.11Å; Q348-T351 WeakPolarHBondContact CA-OG1 3.28Å; Q348-T351 PolarHBondContact O-N 3.43Å; Q348-T351 PolarHBondContact O-OG1 2.89Å; Q348-T351 VanDerWaalsContact O-OG1 3.05Å; Q348-T351 PolarHBondContact OE1-OG1 3Å
349	A	83.2	Confident	84.1	Confident	12 Å²	12	50.4 Å²	50.4	10%	0.099	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	117.9	176.4	0	0	0	0	0	110.1	N343 G346 S347 T351 P367	N343-A349 HydrophobicContact CB-CB 4.09Å; G346-A349 VanDerWaalsContact O-CB 3.3Å; G346-A349 WeakPolarHBondContact O-CB 3.32Å; G346-A349 PolarHBondContact O-N 3.45Å; S347-A349 VanDerWaalsContact C-N 3.34Å; A349-T351 PolarHBondContact O-N 3.13Å; A349-T351 VanDerWaalsContact O-N 3.15Å; A349-P367 HydrophobicContact CB-CG 4.17Å
350	F	86.5	Confident	83.7	Confident	11 Å²	11	49.8 Å²	49.8	5%	0.048	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.7	22.9	178.5	-44.2	-73	0	0	0	114.8	Y341 N343 Q348 G352 F354 V359 L365 P367 L368 V373 M377	Y341-F350 HydrophobicContact CD1-CE1 4.1Å; Y341-F350 HydrophobicContact CD1-CZ 4.07Å; Y341-F350 AromaticContact CE1-CE1 3.93Å; Y341-F350 HydrophobicContact CE1-CE1 3.93Å; Y341-F350 HydrophobicContact CE1-CZ 4.11Å; N343-F350 HydrophobicContact CB-CE1 4.12Å; N343-F350 HydrophobicContact CB-CE2 3.83Å; N343-F350 HydrophobicContact CB-CZ 3.6Å; Q348-F350 PolarHBondContact O-N 3.47Å; Q348-F350 VanDerWaalsContact O-N 3.11Å; F350-G352 VanDerWaalsContact C-N 3.28Å; F350-F354 HydrophobicContact CB-CD1 4.49Å; F350-F354 HydrophobicContact CB-CE1 3.94Å; F350-F354 VanDerWaalsContact O-CE1 3.27Å; F350-F354 WeakPolarHBondContact O-CE1 3.35Å; F350-V359 HydrophobicContact CD1-CG2 4.04Å; F350-V359 HydrophobicContact CE1-CG2 3.9Å; F350-L365 HydrophobicContact CD1-CD2 4.43Å; F350-L365 HydrophobicContact CE1-CB 4.4Å; F350-L365 HydrophobicContact CE1-CD2 3.61Å; F350-L365 HydrophobicContact CZ-CB 3.94Å; F350-L365 HydrophobicContact CZ-CD2 3.99Å; F350-P367 VanDerWaalsContact CD2-O 3.3Å; F350-P367 WeakPolarHBondContact CD2-O 3.48Å; F350-P367 WeakPolarHBondContact CE2-O 3.35Å; F350-L368 HydrophobicContact CD2-CD1 3.99Å; F350-L368 HydrophobicContact CD2-CG 4.07Å; F350-L368 HydrophobicContact CE2-CD1 3.86Å; F350-L368 HydrophobicContact CE2-CG 4.43Å; F350-V373 HydrophobicContact CB-CG1 3.94Å; F350-M377 HydrophobicContact CB-CE 3.99Å; F350-M377 HydrophobicContact CD1-CE 3.65Å; F350-M377 HydrophobicContact CE1-CE 4.3Å; F350-M377 HydrophobicContact CG-CE 3.86Å
351	T	78.9	Confident	83.1	Confident	80 Å²	80	53.7 Å²	53.7	49%	0.491	31%	0.305	S	S	.	.	S	Bend	trans	-78.4	-17.3	171	56	0	0	0	0	112.5	S347 Q348 A349	S347-T351 WeakPolarHBondContact O-CG2 3.2Å; Q348-T351 WeakPolarHBondContact CA-OG1 3.28Å; Q348-T351 PolarHBondContact O-N 3.43Å; Q348-T351 PolarHBondContact O-OG1 2.89Å; Q348-T351 VanDerWaalsContact O-OG1 3.05Å; Q348-T351 PolarHBondContact OE1-OG1 3Å; A349-T351 PolarHBondContact O-N 3.13Å; A349-T351 VanDerWaalsContact O-N 3.15Å
352	G	75.2	Confident	83.1	Confident	53 Å²	53	51.3 Å²	51.3	55%	0.546	30%	0.295	S	S	.	.	S	Bend	trans	-94.6	-153.2	179	0	0	0	0	0	114.1	F350	F350-G352 VanDerWaalsContact C-N 3.28Å
353	D	71.1	Confident	83.2	Confident	82 Å²	82	51 Å²	51	44%	0.439	29%	0.293	S	S	.	.			trans	-68.3	132.2	178.7	-176.4	13.1	0	0	0	112.1	N355 Y461	D353-N355 VanDerWaalsContact C-N 3.31Å; D353-N355 WeakPolarHBondContact OD1-CB 3.34Å; D353-N355 PolarHBondContact OD1-N 3.38Å; D353-Y461 VanDerWaalsContact CG-CE2 3.47Å; D353-Y461 WeakPolarHBondContact OD1-CE2 3.46Å; D353-Y461 WeakPolarHBondContact OD2-CD2 3.4Å; D353-Y461 WeakPolarHBondContact OD2-CE2 3.5Å
354	F	83	Confident	83.6	Confident	27 Å²	27	50.1 Å²	50.1	12%	0.118	29%	0.289	C	S	.	.	S	Bend	trans	-79.8	-11.6	173.3	-58.3	-34.5	0	0	0	113.2	F350 V356 V359 V373 A376 M377 H380	F350-F354 HydrophobicContact CB-CD1 4.49Å; F350-F354 HydrophobicContact CB-CE1 3.94Å; F350-F354 VanDerWaalsContact O-CE1 3.27Å; F350-F354 WeakPolarHBondContact O-CE1 3.35Å; F354-V356 PolarHBondContact O-N 3.37Å; F354-V359 HydrophobicContact CB-CG1 4.28Å; F354-V359 VanDerWaalsContact O-CB 3.28Å; F354-V359 WeakPolarHBondContact O-CB 3.4Å; F354-V359 WeakPolarHBondContact O-CG1 3.17Å; F354-V373 HydrophobicContact CE1-CG1 4.34Å; F354-V373 HydrophobicContact CZ-CG1 4.21Å; F354-A376 VanDerWaalsContact CE2-C 3.4Å; F354-A376 HydrophobicContact CE2-CB 3.64Å; F354-A376 HydrophobicContact CZ-CB 3.89Å; F354-M377 HydrophobicContact CB-SD 4.41Å; F354-M377 HydrophobicContact CD1-CE 3.5Å; F354-M377 VanDerWaalsContact CD1-CE 3.5Å; F354-M377 HydrophobicContact CD1-SD 3.98Å; F354-M377 HydrophobicContact CD2-SD 4.34Å; F354-M377 HydrophobicContact CE1-CE 3.54Å; F354-M377 HydrophobicContact CE1-SD 4.32Å; F354-M377 HydrophobicContact CE2-CB 4.44Å; F354-M377 HydrophobicContact CG-CE 4.14Å; F354-M377 HydrophobicContact CG-SD 3.99Å; F354-M377 HydrophobicContact CZ-CB 4.41Å; F354-M377 HydrophobicContact CZ-CE 4.19Å; F354-H380 HydrophobicContact CB-CB 4.42Å; F354-H380 HydrophobicContact CD2-CB 3.7Å; F354-H380 AromaticContact CD2-CG 3.95Å; F354-H380 HydrophobicContact CE2-CB 4.47Å; F354-H380 HydrophobicContact CG-CB 4.49Å
355	N	73.9	Confident	84	Confident	12 Å²	12	42.3 Å²	42.3	6%	0.064	26%	0.258	C	S	.	.			trans	-87.7	54.9	-178.9	-146.6	-25.1	0	0	0	113.4	D353 Q360 Y461 N465	D353-N355 VanDerWaalsContact C-N 3.31Å; D353-N355 WeakPolarHBondContact OD1-CB 3.34Å; D353-N355 PolarHBondContact OD1-N 3.38Å; N355-Q360 PolarHBondContact OD1-NE2 3.42Å; N355-Y461 HydrophobicContact CB-CD2 4.41Å; N355-Y461 HydrophobicContact CB-CE2 3.36Å; N355-Y461 WeakPolarHBondContact CB-OH 3.14Å; N355-Y461 PolarHBondContact ND2-OH 2.89Å; N355-Y461 VanDerWaalsContact ND2-OH 3.17Å; N355-N465 WeakPolarHBondContact CB-ND2 3.16Å; N355-N465 VanDerWaalsContact CG-CG 3.44Å; N355-N465 PolarHBondContact ND2-ND2 2.82Å; N355-N465 PolarHBondContact ND2-OD1 2.92Å
356	V	80.7	Confident	84.6	Confident	38 Å²	38	40.1 Å²	40.1	23%	0.23	24%	0.24	C	C	.	.	S	Bend	trans	-114.8	145.6	175.5	-61.4	0	0	0	0	109.6	F354 E358 V359 Q360	F354-V356 PolarHBondContact O-N 3.37Å; V356-E358 WeakPolarHBondContact CB-OE2 2.93Å; V356-E358 PolarHBondContact O-N 2.84Å; V356-E358 VanDerWaalsContact O-N 3.08Å; V356-V359 HydrophobicContact CG2-CB 3.93Å; V356-V359 HydrophobicContact CG2-CG2 3.54Å; V356-V359 PolarHBondContact O-N 3.11Å; V356-Q360 WeakPolarHBondContact O-CG 3.47Å; V356-Q360 PolarHBondContact O-N 3.3Å
357	P	78.3	Confident	85.2	Confident	29 Å²	29	38.8 Å²	38.8	19%	0.188	22%	0.224	C	C	.	.	H	α-helix	trans	-51.5	-36.8	-175.8	-30.4	37.8	0	0	0	114	V359 Q360 H361 Y468	P357-V359 VanDerWaalsContact C-N 3.31Å; P357-V359 PolarHBondContact O-N 2.81Å; P357-Q360 PolarHBondContact O-N 3.02Å; P357-H361 PolarHBondContact O-N 2.93Å; P357-H361 VanDerWaalsContact O-N 3.1Å; P357-H361 PolarHBondContact O-ND1 2.94Å; P357-Y468 HydrophobicContact CB-CE1 4.5Å; P357-Y468 WeakPolarHBondContact CD-OH 3.31Å; P357-Y468 HydrophobicContact CG-CD1 4.05Å; P357-Y468 HydrophobicContact CG-CE1 3.32Å; P357-Y468 HydrophobicContact CG-CE2 3.88Å; P357-Y468 VanDerWaalsContact CG-OH 3.24Å; P357-Y468 WeakPolarHBondContact CG-OH 3.09Å
358	E	84.8	Confident	85.9	Confident	92 Å²	92	33.8 Å²	33.8	43%	0.43	19%	0.189	S	C	.	.	H	α-helix	trans	-62.3	-39.3	-179.5	-59	77.5	-170.5	0	0	111.2	Y341 V356 A362	Y341-E358 HydrophobicContact CD1-CB 4.38Å; Y341-E358 HydrophobicContact CD2-CB 4.2Å; Y341-E358 HydrophobicContact CE1-CB 3.9Å; Y341-E358 HydrophobicContact CE2-CB 3.72Å; Y341-E358 HydrophobicContact CE2-CG 4Å; V356-E358 WeakPolarHBondContact CB-OE2 2.93Å; V356-E358 PolarHBondContact O-N 2.84Å; V356-E358 VanDerWaalsContact O-N 3.08Å; E358-A362 VanDerWaalsContact O-CB 3.28Å; E358-A362 WeakPolarHBondContact O-CB 3.2Å; E358-A362 PolarHBondContact O-N 3.09Å
359	V	89.3	Confident	86.5	Confident	2 Å²	2	33.7 Å²	33.7	1%	0.012	19%	0.186	C	C	.	.	H	α-helix	trans	-78.2	-39.2	177.2	172.4	0	0	0	0	111.3	F350 F354 V356 P357 H361 A362 L365 M377 F381	F350-V359 HydrophobicContact CD1-CG2 4.04Å; F350-V359 HydrophobicContact CE1-CG2 3.9Å; F354-V359 HydrophobicContact CB-CG1 4.28Å; F354-V359 VanDerWaalsContact O-CB 3.28Å; F354-V359 WeakPolarHBondContact O-CB 3.4Å; F354-V359 WeakPolarHBondContact O-CG1 3.17Å; V356-V359 HydrophobicContact CG2-CB 3.93Å; V356-V359 HydrophobicContact CG2-CG2 3.54Å; V356-V359 PolarHBondContact O-N 3.11Å; P357-V359 VanDerWaalsContact C-N 3.31Å; P357-V359 PolarHBondContact O-N 2.81Å; V359-H361 PolarHBondContact O-N 3.18Å; V359-A362 PolarHBondContact O-N 2.89Å; V359-L365 HydrophobicContact CB-CD2 4.05Å; V359-L365 HydrophobicContact CG1-CD2 3.85Å; V359-L365 HydrophobicContact CG2-CD2 3.82Å; V359-M377 HydrophobicContact CG1-CE 4.45Å; V359-M377 HydrophobicContact CG1-SD 3.87Å; V359-F381 HydrophobicContact CG1-CE1 4.46Å; V359-F381 HydrophobicContact CG1-CE2 4.42Å; V359-F381 HydrophobicContact CG1-CZ 3.73Å; V359-F381 WeakPolarHBondContact O-CZ 3.43Å
360	Q	84.4	Confident	86.9	Confident	20 Å²	20	39.2 Å²	39.2	9%	0.093	21%	0.21	C	C	.	.	H	α-helix	trans	-63.7	-40.9	-176.8	-68.4	-61	-12.8	0	0	113.4	R240 R243 N355 V356 P357 H380	R240-Q360 PolarHBondContact NH1-O 3.39Å; R243-Q360 PolarHBondContact NH1-O 2.81Å; N355-Q360 PolarHBondContact OD1-NE2 3.42Å; V356-Q360 WeakPolarHBondContact O-CG 3.47Å; V356-Q360 PolarHBondContact O-N 3.3Å; P357-Q360 PolarHBondContact O-N 3.02Å; Q360-H380 PolarHBondContact NE2-NE2 2.89Å
361	H	84.8	Confident	87.2	Confident	82 Å²	82	40.3 Å²	40.3	38%	0.38	22%	0.219	S	C	.	.	H	α-helix	trans	-85	-24.5	-177.6	-66.9	92	0	0	0	113.1	P357 V359 D472	P357-H361 PolarHBondContact O-N 2.93Å; P357-H361 VanDerWaalsContact O-N 3.1Å; P357-H361 PolarHBondContact O-ND1 2.94Å; V359-H361 PolarHBondContact O-N 3.18Å; H361-D472 IonicContact CE1-OD1 3.37Å; H361-D472 IonicContact NE2-OD1 2.64Å; H361-D472 PolarHBondContact NE2-OD1 3.41Å
362	A	93.4	Very high	87.8	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.223	C	C	.	.			trans	-60.3	141.9	-179.3	0	0	0	0	0	112.5	R240 S338 E358 V359 L365	R240-A362 WeakPolarHBondContact CD-O 3.36Å; R240-A362 PolarHBondContact NH1-O 3.38Å; S338-A362 WeakPolarHBondContact O-CA 3.39Å; E358-A362 VanDerWaalsContact O-CB 3.28Å; E358-A362 WeakPolarHBondContact O-CB 3.2Å; E358-A362 PolarHBondContact O-N 3.09Å; V359-A362 PolarHBondContact O-N 2.89Å; A362-L365 HydrophobicContact CB-CD1 4.36Å; A362-L365 HydrophobicContact CB-CD2 4.13Å; A362-L365 HydrophobicContact CB-CG 3.89Å
363	I	95.8	Very high	88.6	Confident	9 Å²	9	38.8 Å²	38.8	5%	0.046	21%	0.205	C	C	.	.	S	Bend	trans	-91.8	-42.2	166.4	-63.1	-180	0	0	0	109	R240 R243 L244 L247 L339	R240-I363 WeakPolarHBondContact CB-O 3.43Å; R240-I363 PolarHBondContact N-O 3.29Å; R243-I363 HydrophobicContact CB-CD1 4.42Å; R243-I363 HydrophobicContact CB-CG1 4Å; R243-I363 HydrophobicContact CB-CG2 4.34Å; L244-I363 HydrophobicContact CB-CG2 3.58Å; L244-I363 HydrophobicContact CD1-CG2 4.19Å; L244-I363 HydrophobicContact CG-CG2 4.43Å; L247-I363 HydrophobicContact CB-CD1 4.2Å; L247-I363 HydrophobicContact CD2-CD1 3.96Å; L339-I363 HydrophobicContact CB-CD1 4.2Å; L339-I363 HydrophobicContact CB-CG1 4.28Å; L339-I363 HydrophobicContact CD1-CD1 4.18Å; L339-I363 HydrophobicContact CD2-CD1 3.98Å; L339-I363 HydrophobicContact CD2-CG1 4.01Å; L339-I363 HydrophobicContact CG-CD1 4.34Å; L339-I363 WeakPolarHBondContact O-CA 3.24Å; L339-I363 WeakPolarHBondContact O-CB 3.43Å; L339-I363 PolarHBondContact O-N 3.06Å
364	V	97.6	Very high	89.7	Confident	1 Å²	1	34.9 Å²	34.9	1%	0.006	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	133.4	179.9	-172.4	0	0	0	0	109.7	V237 F238 V239 T286 L339 F340 Y341	V237-V364 HydrophobicContact CG2-CG1 3.18Å; F238-V364 CarbonylContact O-C 3.58Å; F238-V364 WeakPolarHBondContact O-CA 3.44Å; V239-V364 HydrophobicContact CG1-CG2 4.32Å; V239-V364 HydrophobicContact CG2-CG1 4.11Å; V239-V364 HydrophobicContact CG2-CG2 4.26Å; T286-V364 WeakPolarHBondContact O-CG1 3.28Å; L339-V364 PolarHBondContact O-N 3.35Å; F340-V364 HydrophobicContact CD1-CB 3.88Å; F340-V364 HydrophobicContact CD1-CG1 4.48Å; F340-V364 HydrophobicContact CD1-CG2 3.72Å; F340-V364 HydrophobicContact CE1-CB 4.33Å; F340-V364 HydrophobicContact CE1-CG2 3.64Å; F340-V364 HydrophobicContact CG-CB 4.42Å; F340-V364 HydrophobicContact CG-CG2 4.45Å; F340-V364 HydrophobicContact CZ-CG2 4.31Å; Y341-V364 PolarHBondContact N-O 2.89Å
365	L	97.2	Very high	90.2	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	132.9	178.9	-60	112	0	0	0	110.6	F238 Y341 F350 V359 A362 L368 M377 F381	F238-L365 HydrophobicContact CB-CB 4.4Å; F238-L365 HydrophobicContact CD1-CD1 3.77Å; F238-L365 PolarHBondContact N-O 3.1Å; F238-L365 PolarHBondContact O-N 3.47Å; Y341-L365 HydrophobicContact CD1-CD2 4.39Å; F350-L365 HydrophobicContact CD1-CD2 4.43Å; F350-L365 HydrophobicContact CE1-CB 4.4Å; F350-L365 HydrophobicContact CE1-CD2 3.61Å; F350-L365 HydrophobicContact CZ-CB 3.94Å; F350-L365 HydrophobicContact CZ-CD2 3.99Å; V359-L365 HydrophobicContact CB-CD2 4.05Å; V359-L365 HydrophobicContact CG1-CD2 3.85Å; V359-L365 HydrophobicContact CG2-CD2 3.82Å; A362-L365 HydrophobicContact CB-CD1 4.36Å; A362-L365 HydrophobicContact CB-CD2 4.13Å; A362-L365 HydrophobicContact CB-CG 3.89Å; L365-L368 HydrophobicContact CB-CD1 3.99Å; L365-L368 WeakPolarHBondContact O-CD1 3.39Å; L365-M377 HydrophobicContact CD2-CE 4.3Å; L365-F381 HydrophobicContact CD1-CE2 3.77Å; L365-F381 HydrophobicContact CD1-CZ 3.98Å
366	H	96.5	Very high	91	Very high	26 Å²	26	37.1 Å²	37.1	12%	0.12	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	147.5	177.2	163.8	-86.7	0	0	0	110.7	D236 V237 G285 T286 Y341 N342 N343	D236-H366 IonicContact OD1-CD2 2.98Å; D236-H366 PolarHBondContact OD1-CD2 3.44Å; D236-H366 VanDerWaalsContact OD1-CD2 3.28Å; D236-H366 IonicContact OD1-NE2 2.69Å; V237-H366 HydrophobicContact CG2-CB 4.41Å; G285-H366 VanDerWaalsContact C-CD2 3.48Å; G285-H366 VanDerWaalsContact C-CG 3.44Å; G285-H366 WeakPolarHBondContact CA-NE2 2.96Å; G285-H366 WeakPolarHBondContact O-CB 3.44Å; G285-H366 PolarHBondContact O-CD2 3.29Å; T286-H366 HydrophobicContact CG2-CB 4.29Å; Y341-H366 PolarHBondContact O-N 2.94Å; N342-H366 CarbonylContact C-O 3.48Å; N342-H366 WeakPolarHBondContact CA-O 3.45Å; N342-H366 PolarHBondContact OD1-CE1 3.08Å; N342-H366 VanDerWaalsContact OD1-CE1 3.28Å; N342-H366 PolarHBondContact OD1-ND1 3Å; N343-H366 PolarHBondContact N-O 3.33Å
367	P	96.1	Very high	91.6	Very high	13 Å²	13	35.3 Å²	35.3	8%	0.084	19%	0.188	C	C	.	.			cis	-94.8	144.2	-6.8	34.1	-31.8	0	0	0	113.3	D236 A349 F350 K369	D236-P367 CarbonylContact O-C 3.53Å; A349-P367 HydrophobicContact CB-CG 4.17Å; F350-P367 VanDerWaalsContact CD2-O 3.3Å; F350-P367 WeakPolarHBondContact CD2-O 3.48Å; F350-P367 WeakPolarHBondContact CE2-O 3.35Å; P367-K369 HydrophobicContact CB-CG 4.23Å
368	L	94	Very high	92.4	Very high	2 Å²	2	36.3 Å²	36.3	1%	0.01	19%	0.189	C	C	.	.			trans	-115.9	76	170.1	-73.2	87.8	0	0	0	109.7	D236 F238 F350 L365 E370 V373 M374 M377	D236-L368 PolarHBondContact O-N 2.97Å; F238-L368 HydrophobicContact CB-CD1 3.83Å; F238-L368 HydrophobicContact CB-CD2 4.01Å; F350-L368 HydrophobicContact CD2-CD1 3.99Å; F350-L368 HydrophobicContact CD2-CG 4.07Å; F350-L368 HydrophobicContact CE2-CD1 3.86Å; F350-L368 HydrophobicContact CE2-CG 4.43Å; L365-L368 HydrophobicContact CB-CD1 3.99Å; L365-L368 WeakPolarHBondContact O-CD1 3.39Å; L368-E370 PolarHBondContact O-N 3.09Å; L368-V373 HydrophobicContact CD2-CG1 4.26Å; L368-M374 HydrophobicContact CB-CE 4.46Å; L368-M374 HydrophobicContact CD2-CB 4.18Å; L368-M374 HydrophobicContact CD2-CG 4.42Å; L368-M377 HydrophobicContact CD2-CB 3.89Å; L368-M377 HydrophobicContact CD2-CE 4.26Å; L368-M377 HydrophobicContact CD2-CG 4.16Å
369	K	91.9	Very high	92.7	Very high	117 Å²	117	38.6 Å²	38.6	51%	0.509	19%	0.193	S	C	.	.			trans	-70	-29.8	-173	-66.3	-175.6	177.8	-178.9	0	114.4	R163 D236 P367	R163-K369 PolarHBondContact NE-O 3.34Å; R163-K369 VanDerWaalsContact NE-O 3.1Å; D236-K369 HydrophobicContact CB-CG 4.4Å; P367-K369 HydrophobicContact CB-CG 4.23Å
370	E	92.2	Very high	92.6	Very high	127 Å²	127	39.4 Å²	39.4	59%	0.593	20%	0.197	S	C	*	.	S	Bend	trans	-95.6	121.6	-177.8	-70.6	-67.9	166.1	0	0	110.4	L368 A372 V373 M374	L368-E370 PolarHBondContact O-N 3.09Å; E370-A372 PolarHBondContact O-N 2.69Å; E370-A372 VanDerWaalsContact O-N 3.15Å; E370-V373 HydrophobicContact CB-CB 4.3Å; E370-V373 HydrophobicContact CB-CG2 3.81Å; E370-V373 PolarHBondContact O-N 2.83Å; E370-M374 PolarHBondContact O-N 2.5Å
371	P	92.9	Very high	92.9	Very high	35 Å²	35	39.2 Å²	39.2	23%	0.227	20%	0.196	C	C	.	.	H	α-helix	trans	-52.8	-36.6	177.6	-30.8	37.4	0	0	0	114	A166 V373 M374 H375	A166-P371 HydrophobicContact CB-CB 4Å; P371-V373 VanDerWaalsContact C-N 3.31Å; P371-V373 PolarHBondContact O-N 2.96Å; P371-M374 WeakPolarHBondContact O-CB 3.41Å; P371-M374 PolarHBondContact O-N 3.24Å; P371-H375 PolarHBondContact O-N 3.23Å; P371-H375 VanDerWaalsContact O-N 3.08Å; P371-H375 PolarHBondContact O-ND1 2.84Å
372	A	90.6	Very high	93.1	Very high	71 Å²	71	38.5 Å²	38.5	59%	0.587	19%	0.192	S	C	*	.	H	α-helix	trans	-61.8	-38.2	178.8	0	0	0	0	0	112.5	E370 H375 A376	E370-A372 PolarHBondContact O-N 2.69Å; E370-A372 VanDerWaalsContact O-N 3.15Å; A372-H375 PolarHBondContact O-N 3.46Å; A372-A376 WeakPolarHBondContact O-CB 3.22Å; A372-A376 PolarHBondContact O-N 3.38Å
373	V	92.1	Very high	92.6	Very high	29 Å²	29	46 Å²	46	18%	0.176	22%	0.22	C	C	.	.	H	α-helix	trans	-69	-39.5	177.6	-179.2	0	0	0	0	110.2	F350 F354 L368 E370 P371 H375 A376 M377	F350-V373 HydrophobicContact CB-CG1 3.94Å; F354-V373 HydrophobicContact CE1-CG1 4.34Å; F354-V373 HydrophobicContact CZ-CG1 4.21Å; L368-V373 HydrophobicContact CD2-CG1 4.26Å; E370-V373 HydrophobicContact CB-CB 4.3Å; E370-V373 HydrophobicContact CB-CG2 3.81Å; E370-V373 PolarHBondContact O-N 2.83Å; P371-V373 VanDerWaalsContact C-N 3.31Å; P371-V373 PolarHBondContact O-N 2.96Å; V373-H375 PolarHBondContact O-N 2.88Å; V373-A376 PolarHBondContact O-N 3.47Å; V373-M377 WeakPolarHBondContact O-CB 3.45Å; V373-M377 PolarHBondContact O-N 2.7Å
374	M	94	Very high	91.8	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-61.1	-44.4	175.3	-167.6	-177.8	-70.2	0	0	112.3	A166 I167 T170 F238 L368 E370 P371 M377 Y378	A166-M374 HydrophobicContact CB-SD 3.67Å; I167-M374 HydrophobicContact CG1-CE 3.85Å; I167-M374 HydrophobicContact CG1-SD 3.76Å; T170-M374 HydrophobicContact CG2-CG 4.43Å; F238-M374 HydrophobicContact CD2-CG 3.99Å; L368-M374 HydrophobicContact CB-CE 4.46Å; L368-M374 HydrophobicContact CD2-CB 4.18Å; L368-M374 HydrophobicContact CD2-CG 4.42Å; E370-M374 PolarHBondContact O-N 2.5Å; P371-M374 WeakPolarHBondContact O-CB 3.41Å; P371-M374 PolarHBondContact O-N 3.24Å; M374-M377 PolarHBondContact O-N 2.67Å; M374-Y378 WeakPolarHBondContact O-CB 3.35Å; M374-Y378 PolarHBondContact O-N 3.26Å
375	H	94.4	Very high	91.1	Very high	61 Å²	61	52 Å²	52	28%	0.282	25%	0.248	S	C	.	.	H	α-helix	trans	-66.5	-36.8	174.7	-71.2	85.3	0	0	0	112.5	P371 A372 V373 R379	P371-H375 PolarHBondContact O-N 3.23Å; P371-H375 VanDerWaalsContact O-N 3.08Å; P371-H375 PolarHBondContact O-ND1 2.84Å; A372-H375 PolarHBondContact O-N 3.46Å; V373-H375 PolarHBondContact O-N 2.88Å; H375-R379 WeakPolarHBondContact O-CG 3.48Å; H375-R379 PolarHBondContact O-N 3.01Å; H375-R379 PolarHBondContact O-NE 3.05Å
376	A	90.6	Very high	90.3	Very high	25 Å²	25	56.8 Å²	56.8	21%	0.207	27%	0.271	C	S	.	.	H	α-helix	trans	-64.9	-43.9	175	0	0	0	0	0	111.3	F354 A372 V373 R379 H380	F354-A376 VanDerWaalsContact CE2-C 3.4Å; F354-A376 HydrophobicContact CE2-CB 3.64Å; F354-A376 HydrophobicContact CZ-CB 3.89Å; A372-A376 WeakPolarHBondContact O-CB 3.22Å; A372-A376 PolarHBondContact O-N 3.38Å; V373-A376 PolarHBondContact O-N 3.47Å; A376-R379 PolarHBondContact O-N 2.84Å; A376-H380 WeakPolarHBondContact O-CB 3.23Å; A376-H380 PolarHBondContact O-N 3.28Å
377	M	92.7	Very high	89.1	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-61.5	-43.8	175.4	-170.6	69.7	72.3	0	0	111.4	F238 F350 F354 V359 L365 L368 V373 M374 H380 F381	F238-M377 HydrophobicContact CD1-CG 4.02Å; F238-M377 HydrophobicContact CD2-CB 4.4Å; F238-M377 HydrophobicContact CD2-CG 4.21Å; F238-M377 HydrophobicContact CE1-CG 4.16Å; F238-M377 HydrophobicContact CE2-CB 4.47Å; F238-M377 HydrophobicContact CE2-CG 4.36Å; F238-M377 HydrophobicContact CG-CG 4.04Å; F238-M377 HydrophobicContact CZ-CG 4.33Å; F350-M377 HydrophobicContact CB-CE 3.99Å; F350-M377 HydrophobicContact CD1-CE 3.65Å; F350-M377 HydrophobicContact CE1-CE 4.3Å; F350-M377 HydrophobicContact CG-CE 3.86Å; F354-M377 HydrophobicContact CB-SD 4.41Å; F354-M377 HydrophobicContact CD1-CE 3.5Å; F354-M377 VanDerWaalsContact CD1-CE 3.5Å; F354-M377 HydrophobicContact CD1-SD 3.98Å; F354-M377 HydrophobicContact CD2-SD 4.34Å; F354-M377 HydrophobicContact CE1-CE 3.54Å; F354-M377 HydrophobicContact CE1-SD 4.32Å; F354-M377 HydrophobicContact CE2-CB 4.44Å; F354-M377 HydrophobicContact CG-CE 4.14Å; F354-M377 HydrophobicContact CG-SD 3.99Å; F354-M377 HydrophobicContact CZ-CB 4.41Å; F354-M377 HydrophobicContact CZ-CE 4.19Å; V359-M377 HydrophobicContact CG1-CE 4.45Å; V359-M377 HydrophobicContact CG1-SD 3.87Å; L365-M377 HydrophobicContact CD2-CE 4.3Å; L368-M377 HydrophobicContact CD2-CB 3.89Å; L368-M377 HydrophobicContact CD2-CE 4.26Å; L368-M377 HydrophobicContact CD2-CG 4.16Å; V373-M377 WeakPolarHBondContact O-CB 3.45Å; V373-M377 PolarHBondContact O-N 2.7Å; M374-M377 PolarHBondContact O-N 2.67Å; M377-H380 WeakPolarHBondContact O-CB 3.36Å; M377-H380 PolarHBondContact O-N 3.06Å; M377-F381 HydrophobicContact CG-CD2 4.01Å; M377-F381 HydrophobicContact CG-CE2 3.7Å; M377-F381 WeakPolarHBondContact O-CD2 3.41Å; M377-F381 PolarHBondContact O-N 3.28Å; M377-F381 VanDerWaalsContact O-N 3.09Å; M377-F381 HydrophobicContact SD-CD2 4.27Å; M377-F381 HydrophobicContact SD-CE2 3.58Å; M377-F381 VanDerWaalsContact SD-CE2 3.58Å; M377-F381 HydrophobicContact SD-CZ 4.25Å
378	Y	95.2	Very high	88.2	Confident	49 Å²	49	60.2 Å²	60.2	19%	0.192	30%	0.295	C	S	.	.	H	α-helix	trans	-59.8	-48.6	175.6	-172.9	-117.3	0	0	0	112.1	T170 F238 M374 H380 F381 K382	T170-Y378 HydrophobicContact CG2-CD1 4.09Å; T170-Y378 HydrophobicContact CG2-CG 3.89Å; T170-Y378 WeakPolarHBondContact O-CE2 3.23Å; F238-Y378 HydrophobicContact CE2-CD2 4.06Å; F238-Y378 HydrophobicContact CE2-CG 4.45Å; F238-Y378 HydrophobicContact CZ-CD2 4.01Å; M374-Y378 WeakPolarHBondContact O-CB 3.35Å; M374-Y378 PolarHBondContact O-N 3.26Å; Y378-H380 VanDerWaalsContact C-N 3.29Å; Y378-H380 PolarHBondContact O-N 3.26Å; Y378-F381 PolarHBondContact O-N 3.1Å; Y378-K382 HydrophobicContact CD1-CG 4.32Å; Y378-K382 HydrophobicContact CD2-CG 4.42Å; Y378-K382 HydrophobicContact CE1-CG 3.99Å; Y378-K382 HydrophobicContact CE2-CD 4.49Å; Y378-K382 HydrophobicContact CE2-CG 4.07Å; Y378-K382 WeakPolarHBondContact O-CB 3.33Å; Y378-K382 WeakPolarHBondContact O-CG 3.45Å; Y378-K382 PolarHBondContact O-N 2.89Å; Y378-K382 WeakPolarHBondContact OH-CE 3.28Å
379	R	91.2	Very high	87.5	Confident	141 Å²	141	65 Å²	65	53%	0.532	32%	0.32	S	S	.	.	H	α-helix	trans	-60.8	-38.3	176.5	-74.9	-176	-65.8	163.8	-1.2	112	H375 A376 K382 R383	H375-R379 WeakPolarHBondContact O-CG 3.48Å; H375-R379 PolarHBondContact O-N 3.01Å; H375-R379 PolarHBondContact O-NE 3.05Å; A376-R379 PolarHBondContact O-N 2.84Å; R379-K382 PolarHBondContact O-N 2.88Å; R379-R383 VanDerWaalsContact O-CG 3.3Å; R379-R383 WeakPolarHBondContact O-CG 3.35Å; R379-R383 PolarHBondContact O-N 2.88Å
380	H	87.4	Confident	86.5	Confident	18 Å²	18	62 Å²	62	8%	0.083	31%	0.306	C	S	.	.	H	α-helix	trans	-58.8	-56	175.9	176.5	74.6	0	0	0	111.5	F354 Q360 A376 M377 Y378 K382 R383 Q384	F354-H380 HydrophobicContact CB-CB 4.42Å; F354-H380 HydrophobicContact CD2-CB 3.7Å; F354-H380 AromaticContact CD2-CG 3.95Å; F354-H380 HydrophobicContact CE2-CB 4.47Å; F354-H380 HydrophobicContact CG-CB 4.49Å; Q360-H380 PolarHBondContact NE2-NE2 2.89Å; A376-H380 WeakPolarHBondContact O-CB 3.23Å; A376-H380 PolarHBondContact O-N 3.28Å; M377-H380 WeakPolarHBondContact O-CB 3.36Å; M377-H380 PolarHBondContact O-N 3.06Å; Y378-H380 VanDerWaalsContact C-N 3.29Å; Y378-H380 PolarHBondContact O-N 3.26Å; H380-K382 VanDerWaalsContact C-N 3.31Å; H380-K382 PolarHBondContact O-N 2.87Å; H380-R383 PolarHBondContact O-N 2.75Å; H380-Q384 WeakPolarHBondContact O-CG 3.49Å; H380-Q384 PolarHBondContact O-N 2.8Å; H380-Q384 VanDerWaalsContact O-N 3.16Å
381	F	91	Very high	85.3	Confident	17 Å²	17	60.7 Å²	60.7	8%	0.075	30%	0.303	C	S	.	.	H	α-helix	trans	-64.7	-33.9	178.7	-72.4	-60.9	0	0	0	113.1	F238 R240 V359 L365 M377 Y378 Q384 E385	F238-F381 HydrophobicContact CD1-CD2 4.33Å; F238-F381 HydrophobicContact CD1-CE2 4.15Å; F238-F381 AromaticContact CE1-CD2 3.45Å; F238-F381 HydrophobicContact CE1-CD2 3.45Å; F238-F381 VanDerWaalsContact CE1-CD2 3.45Å; F238-F381 AromaticContact CE1-CE2 3.7Å; F238-F381 HydrophobicContact CE1-CE2 3.7Å; F238-F381 AromaticContact CZ-CD2 3.9Å; F238-F381 HydrophobicContact CZ-CD2 3.9Å; R240-F381 HydrophobicContact CG-CD2 4.44Å; R240-F381 HydrophobicContact CG-CE2 4.38Å; V359-F381 HydrophobicContact CG1-CE1 4.46Å; V359-F381 HydrophobicContact CG1-CE2 4.42Å; V359-F381 HydrophobicContact CG1-CZ 3.73Å; V359-F381 WeakPolarHBondContact O-CZ 3.43Å; L365-F381 HydrophobicContact CD1-CE2 3.77Å; L365-F381 HydrophobicContact CD1-CZ 3.98Å; M377-F381 HydrophobicContact CG-CD2 4.01Å; M377-F381 HydrophobicContact CG-CE2 3.7Å; M377-F381 WeakPolarHBondContact O-CD2 3.41Å; M377-F381 PolarHBondContact O-N 3.28Å; M377-F381 VanDerWaalsContact O-N 3.09Å; M377-F381 HydrophobicContact SD-CD2 4.27Å; M377-F381 HydrophobicContact SD-CE2 3.58Å; M377-F381 VanDerWaalsContact SD-CE2 3.58Å; M377-F381 HydrophobicContact SD-CZ 4.25Å; Y378-F381 PolarHBondContact O-N 3.1Å; F381-Q384 VanDerWaalsContact CD1-OE1 3.24Å; F381-Q384 PolarHBondContact O-N 2.94Å; F381-E385 WeakPolarHBondContact O-CB 3.4Å; F381-E385 PolarHBondContact O-N 3.34Å
382	K	89.1	Confident	84.3	Confident	66 Å²	66	65.5 Å²	65.5	29%	0.287	32%	0.317	S	S	.	.	H	α-helix	trans	-65.5	-38	174.6	-77.4	-58.7	-171.7	-179.6	0	113.2	Y378 R379 H380 Q384 E385 M386	Y378-K382 HydrophobicContact CD1-CG 4.32Å; Y378-K382 HydrophobicContact CD2-CG 4.42Å; Y378-K382 HydrophobicContact CE1-CG 3.99Å; Y378-K382 HydrophobicContact CE2-CD 4.49Å; Y378-K382 HydrophobicContact CE2-CG 4.07Å; Y378-K382 WeakPolarHBondContact O-CB 3.33Å; Y378-K382 WeakPolarHBondContact O-CG 3.45Å; Y378-K382 PolarHBondContact O-N 2.89Å; Y378-K382 WeakPolarHBondContact OH-CE 3.28Å; R379-K382 PolarHBondContact O-N 2.88Å; H380-K382 VanDerWaalsContact C-N 3.31Å; H380-K382 PolarHBondContact O-N 2.87Å; K382-Q384 VanDerWaalsContact C-N 3.31Å; K382-Q384 PolarHBondContact O-N 2.88Å; K382-E385 VanDerWaalsContact CD-OE2 3.31Å; K382-E385 WeakPolarHBondContact CD-OE2 3.38Å; K382-E385 IonicContact NZ-OE1 3.92Å; K382-E385 IonicContact NZ-OE2 2.92Å; K382-E385 PolarHBondContact NZ-OE2 3.01Å; K382-E385 PolarHBondContact O-N 3.41Å; K382-M386 WeakPolarHBondContact O-CB 3.49Å; K382-M386 PolarHBondContact O-N 2.8Å
383	R	81.5	Confident	83.4	Confident	157 Å²	157	63.3 Å²	63.3	59%	0.592	30%	0.295	S	S	*	.	H	α-helix	trans	-63	-39.7	172.6	-74	172	-173.5	161.9	0.1	111.8	R379 H380 M386 A387	R379-R383 VanDerWaalsContact O-CG 3.3Å; R379-R383 WeakPolarHBondContact O-CG 3.35Å; R379-R383 PolarHBondContact O-N 2.88Å; H380-R383 PolarHBondContact O-N 2.75Å; R383-M386 PolarHBondContact O-N 3.02Å; R383-A387 WeakPolarHBondContact O-CB 3.19Å; R383-A387 PolarHBondContact O-N 3.44Å
384	Q	79.1	Confident	82	Confident	45 Å²	45	63.9 Å²	63.9	21%	0.21	30%	0.296	C	S	.	.	H	α-helix	trans	-66.5	-45.3	176.4	-64.1	-174.1	-49.9	0	0	112.2	H380 F381 K382 M386 A387 D388	H380-Q384 WeakPolarHBondContact O-CG 3.49Å; H380-Q384 PolarHBondContact O-N 2.8Å; H380-Q384 VanDerWaalsContact O-N 3.16Å; F381-Q384 VanDerWaalsContact CD1-OE1 3.24Å; F381-Q384 PolarHBondContact O-N 2.94Å; K382-Q384 VanDerWaalsContact C-N 3.31Å; K382-Q384 PolarHBondContact O-N 2.88Å; Q384-M386 VanDerWaalsContact C-N 3.27Å; Q384-M386 PolarHBondContact O-N 2.85Å; Q384-A387 PolarHBondContact O-N 2.79Å; Q384-D388 WeakPolarHBondContact O-CB 3.33Å; Q384-D388 PolarHBondContact O-N 3.08Å
385	E	83.7	Confident	80.7	Confident	91 Å²	91	66 Å²	66	43%	0.425	31%	0.307	S	S	.	.	H	α-helix	trans	-58.9	-41.4	175.6	-173.3	179.7	-175	0	0	111.2	K174 F381 K382 L389	K174-E385 IonicContact NZ-OE2 3.73Å; F381-E385 WeakPolarHBondContact O-CB 3.4Å; F381-E385 PolarHBondContact O-N 3.34Å; K382-E385 VanDerWaalsContact CD-OE2 3.31Å; K382-E385 WeakPolarHBondContact CD-OE2 3.38Å; K382-E385 IonicContact NZ-OE1 3.92Å; K382-E385 IonicContact NZ-OE2 2.92Å; K382-E385 PolarHBondContact NZ-OE2 3.01Å; K382-E385 PolarHBondContact O-N 3.41Å; E385-L389 VanDerWaalsContact O-CB 3.3Å; E385-L389 WeakPolarHBondContact O-CB 3.4Å; E385-L389 PolarHBondContact O-N 3.34Å
386	M	79.4	Confident	79.5	Confident	101 Å²	101	65.9 Å²	65.9	50%	0.498	31%	0.308	S	S	.	.	H	α-helix	trans	-64.7	-43.7	175.8	-169.8	178.6	79.4	0	0	112.1	K382 R383 Q384 L389 Y390	K382-M386 WeakPolarHBondContact O-CB 3.49Å; K382-M386 PolarHBondContact O-N 2.8Å; R383-M386 PolarHBondContact O-N 3.02Å; Q384-M386 VanDerWaalsContact C-N 3.27Å; Q384-M386 PolarHBondContact O-N 2.85Å; M386-L389 PolarHBondContact O-N 3.03Å; M386-Y390 WeakPolarHBondContact O-CB 3.24Å; M386-Y390 PolarHBondContact O-N 3.3Å
387	A	72.7	Confident	78.3	Confident	41 Å²	41	65.3 Å²	65.3	34%	0.339	30%	0.302	S	S	.	.	H	α-helix	trans	-63	-47.8	175.9	0	0	0	0	0	111.6	R383 Q384 L389 Y390 D391	R383-A387 WeakPolarHBondContact O-CB 3.19Å; R383-A387 PolarHBondContact O-N 3.44Å; Q384-A387 PolarHBondContact O-N 2.79Å; A387-L389 VanDerWaalsContact C-N 3.28Å; A387-L389 PolarHBondContact O-N 2.78Å; A387-Y390 WeakPolarHBondContact O-CB 3.32Å; A387-Y390 PolarHBondContact O-N 3.27Å; A387-Y390 VanDerWaalsContact O-N 3.17Å; A387-D391 PolarHBondContact O-N 2.77Å
388	D	75.7	Confident	76.8	Confident	70 Å²	70	70.9 Å²	70.9	37%	0.374	33%	0.328	S	S	.	.	H	α-helix	trans	-57.6	-40.3	175.7	-92.4	-30.4	0	0	0	112.3	Q384 R392	Q384-D388 WeakPolarHBondContact O-CB 3.33Å; Q384-D388 PolarHBondContact O-N 3.08Å; D388-R392 VanDerWaalsContact O-CG 3.28Å; D388-R392 WeakPolarHBondContact O-CG 3.17Å; D388-R392 PolarHBondContact O-N 2.83Å
389	L	79.7	Confident	75.5	Confident	102 Å²	102	73.3 Å²	73.3	53%	0.534	34%	0.344	S	S	.	.	H	α-helix	trans	-69.7	-42.6	177.9	-176.7	63	0	0	0	111	E385 M386 A387 R392 I393	E385-L389 VanDerWaalsContact O-CB 3.3Å; E385-L389 WeakPolarHBondContact O-CB 3.4Å; E385-L389 PolarHBondContact O-N 3.34Å; M386-L389 PolarHBondContact O-N 3.03Å; A387-L389 VanDerWaalsContact C-N 3.28Å; A387-L389 PolarHBondContact O-N 2.78Å; L389-R392 WeakPolarHBondContact O-CB 3.47Å; L389-R392 PolarHBondContact O-N 2.86Å; L389-I393 HydrophobicContact CG-CD1 4.13Å; L389-I393 WeakPolarHBondContact O-CG1 3.19Å; L389-I393 PolarHBondContact O-N 3Å
390	Y	70.9	Confident	74	Confident	55 Å²	55	69.1 Å²	69.1	22%	0.216	35%	0.345	C	S	.	.	H	α-helix	trans	-60.8	-45.9	177.4	-165.5	-92.6	0	0	0	111.4	M386 A387 R392 I393 Q394 L536 P537	M386-Y390 WeakPolarHBondContact O-CB 3.24Å; M386-Y390 PolarHBondContact O-N 3.3Å; A387-Y390 WeakPolarHBondContact O-CB 3.32Å; A387-Y390 PolarHBondContact O-N 3.27Å; A387-Y390 VanDerWaalsContact O-N 3.17Å; Y390-R392 VanDerWaalsContact C-N 3.29Å; Y390-R392 PolarHBondContact O-N 2.8Å; Y390-I393 WeakPolarHBondContact O-CB 2.84Å; Y390-I393 PolarHBondContact O-N 3.48Å; Y390-I393 VanDerWaalsContact O-N 3.13Å; Y390-Q394 HydrophobicContact CD1-CG 3.9Å; Y390-Q394 HydrophobicContact CE1-CG 3.56Å; Y390-Q394 VanDerWaalsContact CZ-NE2 3.29Å; Y390-Q394 WeakPolarHBondContact O-CG 3.34Å; Y390-Q394 PolarHBondContact O-N 3.4Å; Y390-Q394 PolarHBondContact OH-NE2 2.69Å; Y390-L536 HydrophobicContact CD1-CD2 3.73Å; Y390-L536 HydrophobicContact CD2-CD2 4.37Å; Y390-L536 HydrophobicContact CE1-CD2 4.08Å; Y390-L536 HydrophobicContact CG-CD2 3.91Å; Y390-P537 HydrophobicContact CE2-CG 3.94Å; Y390-P537 WeakPolarHBondContact OH-CD 3.3Å; Y390-P537 WeakPolarHBondContact OH-CG 3.35Å
391	D	67.2	Low	72.7	Confident	99 Å²	99	72.2 Å²	72.2	53%	0.529	36%	0.359	S	S	.	.	H	α-helix	trans	-59.8	-39.5	175.9	-76.9	-6.9	0	0	0	112.2	A387 Q394 L395	A387-D391 PolarHBondContact O-N 2.77Å; D391-Q394 PolarHBondContact O-N 2.87Å; D391-L395 WeakPolarHBondContact O-CG 3.43Å; D391-L395 PolarHBondContact O-N 2.89Å
392	R	72.8	Confident	71	Confident	136 Å²	136	76.9 Å²	76.9	51%	0.513	38%	0.376	S	S	.	.	H	α-helix	trans	-64.7	-43.9	174.3	-72.1	173.9	-165.9	-144.5	7.3	111.8	D388 L389 Y390 Q394 L395 L396	D388-R392 VanDerWaalsContact O-CG 3.28Å; D388-R392 WeakPolarHBondContact O-CG 3.17Å; D388-R392 PolarHBondContact O-N 2.83Å; L389-R392 WeakPolarHBondContact O-CB 3.47Å; L389-R392 PolarHBondContact O-N 2.86Å; Y390-R392 VanDerWaalsContact C-N 3.29Å; Y390-R392 PolarHBondContact O-N 2.8Å; R392-Q394 VanDerWaalsContact C-N 3.31Å; R392-Q394 PolarHBondContact O-N 2.89Å; R392-L395 PolarHBondContact O-N 3.23Å; R392-L396 VanDerWaalsContact O-CG 3.3Å; R392-L396 WeakPolarHBondContact O-CG 3.47Å; R392-L396 PolarHBondContact O-N 3.05Å
393	I	70.3	Confident	69.6	Low	25 Å²	25	80.7 Å²	80.7	13%	0.128	40%	0.4	C	S	.	.	H	α-helix	trans	-60	-44.7	176.7	-69.1	166	0	0	0	109.9	L389 Y390 L395 L396 L397 L405 F414	L389-I393 HydrophobicContact CG-CD1 4.13Å; L389-I393 WeakPolarHBondContact O-CG1 3.19Å; L389-I393 PolarHBondContact O-N 3Å; Y390-I393 WeakPolarHBondContact O-CB 2.84Å; Y390-I393 PolarHBondContact O-N 3.48Å; Y390-I393 VanDerWaalsContact O-N 3.13Å; I393-L395 PolarHBondContact O-N 3.15Å; I393-L396 PolarHBondContact O-N 3.38Å; I393-L397 HydrophobicContact CG2-CD1 4.02Å; I393-L397 HydrophobicContact CG2-CG 4.36Å; I393-L397 WeakPolarHBondContact O-CG 3.27Å; I393-L397 PolarHBondContact O-N 2.99Å; I393-L405 HydrophobicContact CG2-CD2 4.5Å; I393-F414 HydrophobicContact CG2-CE1 4.38Å
394	Q	64.3	Low	68.6	Low	41 Å²	41	78 Å²	78	19%	0.192	40%	0.397	C	S	.	.	H	α-helix	trans	-62.1	-41.3	177.8	-69.9	-57.6	-35.8	0	0	112.8	Y390 D391 R392 L397 H398	Y390-Q394 HydrophobicContact CD1-CG 3.9Å; Y390-Q394 HydrophobicContact CE1-CG 3.56Å; Y390-Q394 VanDerWaalsContact CZ-NE2 3.29Å; Y390-Q394 WeakPolarHBondContact O-CG 3.34Å; Y390-Q394 PolarHBondContact O-N 3.4Å; Y390-Q394 PolarHBondContact OH-NE2 2.69Å; D391-Q394 PolarHBondContact O-N 2.87Å; R392-Q394 VanDerWaalsContact C-N 3.31Å; R392-Q394 PolarHBondContact O-N 2.89Å; Q394-L397 PolarHBondContact O-N 3.26Å; Q394-H398 WeakPolarHBondContact O-CB 3.04Å; Q394-H398 PolarHBondContact O-N 2.82Å
395	L	65.7	Low	67.3	Low	46 Å²	46	76.5 Å²	76.5	24%	0.241	39%	0.39	C	S	.	.	H	α-helix	trans	-63	-41.7	174.7	-73.8	166.8	0	0	0	112.4	R14 D391 R392 I393 H398 N399	R14-L395 HydrophobicContact CB-CD1 3.79Å; R14-L395 HydrophobicContact CG-CD1 3.63Å; D391-L395 WeakPolarHBondContact O-CG 3.43Å; D391-L395 PolarHBondContact O-N 2.89Å; R392-L395 PolarHBondContact O-N 3.23Å; I393-L395 PolarHBondContact O-N 3.15Å; L395-H398 PolarHBondContact O-N 3.45Å; L395-N399 WeakPolarHBondContact O-CB 3.47Å; L395-N399 VanDerWaalsContact O-CG 3.3Å; L395-N399 PolarHBondContact O-N 2.91Å
396	L	70	Confident	66.1	Low	59 Å²	59	74.7 Å²	74.7	31%	0.309	39%	0.39	S	S	.	.	H	α-helix	trans	-65	-42.3	176.5	-68.3	168.2	0	0	0	111.4	R392 I393 H398 N399 E401 L405	R392-L396 VanDerWaalsContact O-CG 3.3Å; R392-L396 WeakPolarHBondContact O-CG 3.47Å; R392-L396 PolarHBondContact O-N 3.05Å; I393-L396 PolarHBondContact O-N 3.38Å; L396-H398 VanDerWaalsContact C-N 3.34Å; L396-H398 PolarHBondContact O-N 2.97Å; L396-N399 PolarHBondContact O-N 3.28Å; L396-E401 VanDerWaalsContact CD2-OE2 3.3Å; L396-E401 WeakPolarHBondContact CD2-OE2 3.48Å; L396-E401 PolarHBondContact O-N 2.95Å; L396-L405 HydrophobicContact CB-CD1 3.84Å
397	L	65	Low	65.2	Low	12 Å²	12	73.6 Å²	73.6	6%	0.063	39%	0.392	C	S	.	.	H	α-helix	trans	-59.8	-43.6	173.1	-72.8	171.1	0	0	0	111.7	I393 Q394 G400 W402 L405 F414	I393-L397 HydrophobicContact CG2-CD1 4.02Å; I393-L397 HydrophobicContact CG2-CG 4.36Å; I393-L397 WeakPolarHBondContact O-CG 3.27Å; I393-L397 PolarHBondContact O-N 2.99Å; Q394-L397 PolarHBondContact O-N 3.26Å; L397-G400 PolarHBondContact O-N 2.77Å; L397-W402 HydrophobicContact CD2-CD2 4.16Å; L397-W402 HydrophobicContact CD2-CE3 4.14Å; L397-W402 HydrophobicContact CD2-CH2 4.05Å; L397-W402 HydrophobicContact CD2-CZ2 4.06Å; L397-W402 HydrophobicContact CD2-CZ3 4.08Å; L397-L405 HydrophobicContact CB-CD1 4.35Å; L397-L405 HydrophobicContact CD2-CB 4.38Å; L397-L405 HydrophobicContact CD2-CD1 3.4Å; L397-L405 HydrophobicContact CG-CD1 3.5Å; L397-F414 HydrophobicContact CD1-CB 4.3Å; L397-F414 HydrophobicContact CD1-CD1 4.23Å; L397-F414 HydrophobicContact CD1-CG 4.25Å
398	H	60.2	Low	64.6	Low	118 Å²	118	78.5 Å²	78.5	55%	0.546	41%	0.408	S	S	.	.	H	α-helix	trans	-67.7	-37.2	-179.3	-173.5	72.9	0	0	0	112.9	Q394 L395 L396 G400	Q394-H398 WeakPolarHBondContact O-CB 3.04Å; Q394-H398 PolarHBondContact O-N 2.82Å; L395-H398 PolarHBondContact O-N 3.45Å; L396-H398 VanDerWaalsContact C-N 3.34Å; L396-H398 PolarHBondContact O-N 2.97Å; H398-G400 PolarHBondContact O-N 3.17Å; H398-G400 VanDerWaalsContact O-N 3.09Å
399	N	68	Low	63.8	Low	100 Å²	100	78.7 Å²	78.7	54%	0.535	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	1.6	178.9	-73.5	-8.8	0	0	0	114	L395 L396	L395-N399 WeakPolarHBondContact O-CB 3.47Å; L395-N399 VanDerWaalsContact O-CG 3.3Å; L395-N399 PolarHBondContact O-N 2.91Å; L396-N399 PolarHBondContact O-N 3.28Å
400	G	60.1	Low	62.2	Low	53 Å²	53	79.7 Å²	79.7	55%	0.546	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.1	12.2	177.2	0	0	0	0	0	114.1	L397 H398 W402	L397-G400 PolarHBondContact O-N 2.77Å; H398-G400 PolarHBondContact O-N 3.17Å; H398-G400 VanDerWaalsContact O-N 3.09Å; G400-W402 PolarHBondContact O-N 3.29Å
401	E	60.8	Low	61.4	Low	82 Å²	82	81.1 Å²	81.1	38%	0.383	45%	0.448	S	S	.	.			trans	-79.3	36.2	175.4	-61.8	-175.4	-171.7	0	0	112.4	L396 N403 L404 L405	L396-E401 VanDerWaalsContact CD2-OE2 3.3Å; L396-E401 WeakPolarHBondContact CD2-OE2 3.48Å; L396-E401 PolarHBondContact O-N 2.95Å; E401-N403 PolarHBondContact O-N 2.57Å; E401-L404 HydrophobicContact CB-CB 4.28Å; E401-L404 WeakPolarHBondContact O-CB 3.45Å; E401-L404 PolarHBondContact O-N 3.47Å; E401-L405 PolarHBondContact O-N 3.21Å
402	W	55.8	Low	60.4	Low	115 Å²	115	82.5 Å²	82.5	44%	0.436	45%	0.451	S	S	.	.	H	α-helix	trans	-54.4	-38.4	179.4	-91.2	98	0	0	0	112.4	L397 G400 L404 L405 A406 F414	L397-W402 HydrophobicContact CD2-CD2 4.16Å; L397-W402 HydrophobicContact CD2-CE3 4.14Å; L397-W402 HydrophobicContact CD2-CH2 4.05Å; L397-W402 HydrophobicContact CD2-CZ2 4.06Å; L397-W402 HydrophobicContact CD2-CZ3 4.08Å; G400-W402 PolarHBondContact O-N 3.29Å; W402-L404 VanDerWaalsContact C-N 3.3Å; W402-L404 PolarHBondContact O-N 2.79Å; W402-L405 PolarHBondContact O-N 2.93Å; W402-A406 WeakPolarHBondContact O-CB 3.44Å; W402-A406 PolarHBondContact O-N 3.43Å; W402-F414 HydrophobicContact CH2-CB 4.17Å
403	N	57.7	Low	59	Low	147 Å²	147	82.8 Å²	82.8	79%	0.786	47%	0.468	S	S	*	.	H	α-helix	trans	-66	-31.4	179.8	-67.3	-18.4	0	0	0	112.7	E401 S407	E401-N403 PolarHBondContact O-N 2.57Å; N403-S407 PolarHBondContact O-OG 2.94Å
404	L	60.5	Low	57.8	Low	101 Å²	101	83.5 Å²	83.5	53%	0.529	47%	0.471	S	S	.	.	H	α-helix	trans	-76	-34.8	179.5	-160.2	105.3	0	0	0	111.6	E401 W402 S407 H408	E401-L404 HydrophobicContact CB-CB 4.28Å; E401-L404 WeakPolarHBondContact O-CB 3.45Å; E401-L404 PolarHBondContact O-N 3.47Å; W402-L404 VanDerWaalsContact C-N 3.3Å; W402-L404 PolarHBondContact O-N 2.79Å; L404-S407 PolarHBondContact O-OG 2.85Å; L404-H408 PolarHBondContact O-ND1 3.43Å
405	L	53	Low	56.8	Low	13 Å²	13	85.4 Å²	85.4	7%	0.068	49%	0.487	C	S	.	.	H	α-helix	trans	-83.7	-38.9	178.6	-76	167.1	0	0	0	112.8	I393 L396 L397 E401 W402 S407 H408 F409	I393-L405 HydrophobicContact CG2-CD2 4.5Å; L396-L405 HydrophobicContact CB-CD1 3.84Å; L397-L405 HydrophobicContact CB-CD1 4.35Å; L397-L405 HydrophobicContact CD2-CB 4.38Å; L397-L405 HydrophobicContact CD2-CD1 3.4Å; L397-L405 HydrophobicContact CG-CD1 3.5Å; E401-L405 PolarHBondContact O-N 3.21Å; W402-L405 PolarHBondContact O-N 2.93Å; L405-S407 PolarHBondContact O-N 3.39Å; L405-H408 PolarHBondContact O-N 2.94Å; L405-H408 VanDerWaalsContact O-N 3.1Å; L405-F409 HydrophobicContact CD2-CD2 4.22Å; L405-F409 HydrophobicContact CD2-CE2 3.95Å; L405-F409 WeakPolarHBondContact O-CD2 3.3Å; L405-F409 PolarHBondContact O-N 3.5Å
406	A	57.4	Low	55.7	Low	52 Å²	52	92 Å²	92	43%	0.43	51%	0.513	S	S	.	.	H	α-helix	trans	-61.9	-30	178	0	0	0	0	0	112.6	W402	W402-A406 WeakPolarHBondContact O-CB 3.44Å; W402-A406 PolarHBondContact O-N 3.43Å
407	S	61.8	Low	54.4	Low	78 Å²	78	92.5 Å²	92.5	55%	0.545	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-28.7	175.6	62.7	0	0	0	0	113.6	N403 L404 L405	N403-S407 PolarHBondContact O-OG 2.94Å; L404-S407 PolarHBondContact O-OG 2.85Å; L405-S407 PolarHBondContact O-N 3.39Å
408	H	60	Low	53.3	Low	144 Å²	144	96 Å²	96	67%	0.667	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-25	178.5	-76	82.4	0	0	0	113.5	L404 L405	L404-H408 PolarHBondContact O-ND1 3.43Å; L405-H408 PolarHBondContact O-N 2.94Å; L405-H408 VanDerWaalsContact O-N 3.1Å
409	F	58.6	Low	52.4	Low	74 Å²	74	94 Å²	94	33%	0.325	55%	0.547	S	S	.	.	S	Bend	trans	-123.1	47.6	-173.6	-64.1	-77.3	0	0	0	112.2	L405 G411 Q412 F414	L405-F409 HydrophobicContact CD2-CD2 4.22Å; L405-F409 HydrophobicContact CD2-CE2 3.95Å; L405-F409 WeakPolarHBondContact O-CD2 3.3Å; L405-F409 PolarHBondContact O-N 3.5Å; F409-G411 PolarHBondContact O-N 2.89Å; F409-G411 VanDerWaalsContact O-N 3.13Å; F409-Q412 PolarHBondContact O-N 2.68Å; F409-F414 HydrophobicContact CB-CE2 3.67Å; F409-F414 HydrophobicContact CB-CZ 4.02Å; F409-F414 HydrophobicContact CD1-CZ 4.15Å; F409-F414 HydrophobicContact CD2-CE2 4.03Å; F409-F414 AromaticContact CD2-CZ 3.85Å; F409-F414 HydrophobicContact CD2-CZ 3.85Å; F409-F414 HydrophobicContact CE2-CZ 4.35Å; F409-F414 AromaticContact CG-CE2 3.89Å; F409-F414 HydrophobicContact CG-CE2 3.89Å; F409-F414 AromaticContact CG-CZ 3.75Å; F409-F414 HydrophobicContact CG-CZ 3.75Å
410	T	46.4	Very low	51.4	Low	123 Å²	123	93.4 Å²	93.4	76%	0.755	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	119.5	174.4	48.5	0	0	0	0	110.3
411	G	53.7	Low	50.6	Low	86 Å²	86	97.5 Å²	97.5	89%	0.887	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	95	-4.3	176.7	0	0	0	0	0	117	F409	F409-G411 PolarHBondContact O-N 2.89Å; F409-G411 VanDerWaalsContact O-N 3.13Å
412	Q	47.1	Very low	50	Low	128 Å²	128	100.3 Å²	100.3	60%	0.598	57%	0.565	S	S	*	*			trans	-100.5	116.6	171.6	-71.4	-174.1	7.8	0	0	111.3	F409 F414	F409-Q412 PolarHBondContact O-N 2.68Å; Q412-F414 PolarHBondContact O-N 3.33Å
413	T	42.2	Very low	49.7	Very low	142 Å²	142	98.2 Å²	98.2	87%	0.871	57%	0.566	S	S	*	*			trans	-74.8	100.6	171	33	0	0	0	0	109.8
414	F	45.9	Very low	49.3	Very low	39 Å²	39	102.8 Å²	102.8	17%	0.171	57%	0.572	C	S	.	*	P	Polyproline II helix	trans	-67.7	130.6	165.2	-67.1	-82	0	0	0	108.7	I393 L397 W402 F409 Q412 K416	I393-F414 HydrophobicContact CG2-CE1 4.38Å; L397-F414 HydrophobicContact CD1-CB 4.3Å; L397-F414 HydrophobicContact CD1-CD1 4.23Å; L397-F414 HydrophobicContact CD1-CG 4.25Å; W402-F414 HydrophobicContact CH2-CB 4.17Å; F409-F414 HydrophobicContact CB-CE2 3.67Å; F409-F414 HydrophobicContact CB-CZ 4.02Å; F409-F414 HydrophobicContact CD1-CZ 4.15Å; F409-F414 HydrophobicContact CD2-CE2 4.03Å; F409-F414 AromaticContact CD2-CZ 3.85Å; F409-F414 HydrophobicContact CD2-CZ 3.85Å; F409-F414 HydrophobicContact CE2-CZ 4.35Å; F409-F414 AromaticContact CG-CE2 3.89Å; F409-F414 HydrophobicContact CG-CE2 3.89Å; F409-F414 AromaticContact CG-CZ 3.75Å; F409-F414 HydrophobicContact CG-CZ 3.75Å; Q412-F414 PolarHBondContact O-N 3.33Å; F414-K416 PolarHBondContact O-N 2.81Å; F414-K416 VanDerWaalsContact O-N 3.16Å
415	P	43.4	Very low	48.9	Very low	82 Å²	82	101.1 Å²	101.1	53%	0.532	57%	0.568	S	S	.	*	P	Polyproline II helix	trans	-56.2	126.7	174.2	20.2	-28.4	0	0	0	108.3	S417	P415-S417 PolarHBondContact O-N 3.08Å; P415-S417 VanDerWaalsContact O-N 3.08Å
416	K	41.2	Very low	49.1	Very low	184 Å²	184	106.1 Å²	106.1	80%	0.8	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-49.3	122.3	171.8	-80.2	179.8	176.2	176.6	0	106.9	F414 S418	F414-K416 PolarHBondContact O-N 2.81Å; F414-K416 VanDerWaalsContact O-N 3.16Å; K416-S418 PolarHBondContact O-N 2.93Å
417	S	42.6	Very low	48.9	Very low	69 Å²	69	106 Å²	106	48%	0.483	60%	0.6	S	S	.	*			trans	-44.6	106.3	171.9	171.4	0	0	0	0	107.9	P415 S419	P415-S417 PolarHBondContact O-N 3.08Å; P415-S417 VanDerWaalsContact O-N 3.08Å; S417-S419 PolarHBondContact O-N 3.17Å; S417-S419 VanDerWaalsContact O-N 3.11Å
418	S	42.9	Very low	48.7	Very low	85 Å²	85	106.1 Å²	106.1	59%	0.594	61%	0.606	S	S	*	*			trans	-49.6	124	163.4	-41	0	0	0	0	105.2	K416 L420	K416-S418 PolarHBondContact O-N 2.93Å; S418-L420 PolarHBondContact O-N 2.91Å; S418-L420 VanDerWaalsContact O-N 3.09Å
419	S	41.8	Very low	48.5	Very low	78 Å²	78	105.6 Å²	105.6	55%	0.545	61%	0.613	S	S	.	*			trans	-45.9	123.9	-179.8	179	0	0	0	0	109.6	S417 L421	S417-S419 PolarHBondContact O-N 3.17Å; S417-S419 VanDerWaalsContact O-N 3.11Å; S419-L421 PolarHBondContact O-N 3.23Å; S419-L421 VanDerWaalsContact O-N 3.11Å; S419-L421 WeakPolarHBondContact OG-CB 3.05Å; S419-L421 WeakPolarHBondContact OG-CD1 3.43Å; S419-L421 VanDerWaalsContact OG-CG 3.29Å; S419-L421 WeakPolarHBondContact OG-CG 3.16Å; S419-L421 PolarHBondContact OG-N 3.03Å
420	L	47.1	Very low	48.3	Very low	87 Å²	87	104.9 Å²	104.9	46%	0.455	62%	0.621	S	S	.	*			trans	-66.7	-2.6	174.6	-71.2	171.4	0	0	0	112.4	S418 E422	S418-L420 PolarHBondContact O-N 2.91Å; S418-L420 VanDerWaalsContact O-N 3.09Å; L420-E422 PolarHBondContact O-N 2.99Å
421	L	42.8	Very low	49	Very low	138 Å²	138	103.8 Å²	103.8	72%	0.723	61%	0.608	S	S	*	*	S	Bend	trans	-58.3	123.6	167.9	-67.6	168.6	0	0	0	107.6	S419 P423	S419-L421 PolarHBondContact O-N 3.23Å; S419-L421 VanDerWaalsContact O-N 3.11Å; S419-L421 WeakPolarHBondContact OG-CB 3.05Å; S419-L421 WeakPolarHBondContact OG-CD1 3.43Å; S419-L421 VanDerWaalsContact OG-CG 3.29Å; S419-L421 WeakPolarHBondContact OG-CG 3.16Å; S419-L421 PolarHBondContact OG-N 3.03Å; L421-P423 VanDerWaalsContact O-N 3.15Å
422	E	48.6	Very low	49.8	Very low	142 Å²	142	102.6 Å²	102.6	66%	0.664	58%	0.582	S	S	*	*			trans	-36.7	124.6	170.1	-85.9	-179	140.8	0	0	109.3	L420 R424	L420-E422 PolarHBondContact O-N 2.99Å; E422-R424 PolarHBondContact O-N 3.3Å
423	P	49.5	Very low	51.1	Low	70 Å²	70	100.2 Å²	100.2	46%	0.455	58%	0.576	S	S	.	*			trans	-53.8	111.6	169.5	-16.3	26.2	0	0	0	106.5	L421 C425	L421-P423 VanDerWaalsContact O-N 3.15Å; P423-C425 PolarHBondContact O-N 3.47Å
424	R	48	Very low	53.1	Low	243 Å²	243	96.9 Å²	96.9	92%	0.917	55%	0.547	S	S	*	.			trans	-61.4	110.9	173.2	-75	-170.9	177.2	-171.3	-0.1	105.7	E422 S426	E422-R424 PolarHBondContact O-N 3.3Å; R424-S426 PolarHBondContact O-N 3.08Å
425	C	52.4	Low	55.1	Low	66 Å²	66	97.1 Å²	97.1	45%	0.446	55%	0.549	S	S	.	.			trans	-60.5	122.1	179.2	-68	0	0	0	0	108.1	P423 S427 M431	P423-C425 PolarHBondContact O-N 3.47Å; C425-S427 VanDerWaalsContact C-N 3.27Å; C425-M431 HydrophobicContact CB-CE 4.06Å; C425-M431 HydrophobicContact CB-CG 4.18Å
426	S	57.8	Low	57.3	Low	118 Å²	118	95.7 Å²	95.7	83%	0.825	53%	0.534	S	S	*	.	S	Bend	trans	-73.4	-22.2	177.2	48.8	0	0	0	0	112.4	R424	R424-S426 PolarHBondContact O-N 3.08Å
427	S	52.4	Low	59.7	Low	49 Å²	49	87 Å²	87	34%	0.343	50%	0.496	S	S	.	.			trans	-153.4	150.9	-179.8	172.3	0	0	0	0	111.2	C425 T429 A430	C425-S427 VanDerWaalsContact C-N 3.27Å; S427-T429 PolarHBondContact O-N 3.4Å; S427-T429 PolarHBondContact OG-N 3.28Å; S427-T429 VanDerWaalsContact OG-N 3.11Å; S427-T429 PolarHBondContact OG-OG1 2.86Å; S427-A430 PolarHBondContact O-N 3.4Å
428	A	58.9	Low	61.9	Low	81 Å²	81	88.6 Å²	88.6	67%	0.669	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-61.3	-31.3	170.2	0	0	0	0	0	112.8	A430 M431	A428-A430 VanDerWaalsContact C-N 3.3Å; A428-A430 PolarHBondContact O-N 2.89Å; A428-M431 PolarHBondContact O-N 2.81Å
429	T	55.7	Low	63.8	Low	134 Å²	134	87.6 Å²	87.6	82%	0.822	49%	0.489	S	S	*	.	G	3₁₀ helix	trans	-75.4	-18	177.2	54	0	0	0	0	113.5	S427 M431	S427-T429 PolarHBondContact O-N 3.4Å; S427-T429 PolarHBondContact OG-N 3.28Å; S427-T429 VanDerWaalsContact OG-N 3.11Å; S427-T429 PolarHBondContact OG-OG1 2.86Å; T429-M431 VanDerWaalsContact C-N 3.33Å
430	A	54.5	Low	65.8	Low	59 Å²	59	86.1 Å²	86.1	49%	0.488	48%	0.478	S	S	.	.	G	3₁₀ helix	trans	-87.5	-2	176.1	0	0	0	0	0	112.7	S427 A428 N432	S427-A430 PolarHBondContact O-N 3.4Å; A428-A430 VanDerWaalsContact C-N 3.3Å; A428-A430 PolarHBondContact O-N 2.89Å; A430-N432 PolarHBondContact O-N 2.8Å
431	M	60.8	Low	67.7	Low	99 Å²	99	85 Å²	85	49%	0.488	47%	0.47	S	S	.	.	S	Bend	trans	-74.2	124.4	178.2	-68.6	-169.3	-168.1	0	0	110.8	C425 A428 T429 V433	C425-M431 HydrophobicContact CB-CE 4.06Å; C425-M431 HydrophobicContact CB-CG 4.18Å; A428-M431 PolarHBondContact O-N 2.81Å; T429-M431 VanDerWaalsContact C-N 3.33Å; M431-V433 PolarHBondContact O-N 2.89Å
432	N	69.5	Low	69.7	Low	62 Å²	62	78.5 Å²	78.5	33%	0.332	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-61.8	124.6	163.3	-72.2	-43.9	0	0	0	109.4	A430 W434 E498	A430-N432 PolarHBondContact O-N 2.8Å; N432-W434 PolarHBondContact O-N 2.93Å; N432-E498 WeakPolarHBondContact CB-OE1 3.42Å; N432-E498 PolarHBondContact ND2-OE1 2.81Å; N432-E498 PolarHBondContact ND2-OE2 2.83Å
433	V	75.4	Confident	71.4	Confident	77 Å²	77	75.2 Å²	75.2	47%	0.467	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-75	123.5	-174.2	-165.4	0	0	0	0	110.2	M431 Q435	M431-V433 PolarHBondContact O-N 2.89Å; V433-Q435 PolarHBondContact O-N 2.92Å; V433-Q435 PolarHBondContact O-NE2 2.9Å
434	W	85	Confident	72.5	Confident	72 Å²	72	73.8 Å²	73.8	27%	0.273	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-60.6	124.3	173.2	-73.4	97.3	0	0	0	111.3	N432 S445 Y494 R496 D504 I506	N432-W434 PolarHBondContact O-N 2.93Å; W434-S445 WeakPolarHBondContact O-CB 3.45Å; W434-S445 PolarHBondContact O-OG 2.82Å; W434-Y494 HydrophobicContact CB-CD1 4.31Å; W434-R496 HydrophobicContact CD2-CB 4.3Å; W434-R496 HydrophobicContact CD2-CG 4Å; W434-R496 HydrophobicContact CE3-CB 4.18Å; W434-R496 HydrophobicContact CE3-CG 3.92Å; W434-R496 HydrophobicContact CH2-CG 4.11Å; W434-R496 HydrophobicContact CZ2-CG 4.14Å; W434-R496 HydrophobicContact CZ3-CG 3.99Å; W434-D504 HydrophobicContact CH2-CB 3.54Å; W434-D504 HydrophobicContact CZ2-CB 4.34Å; W434-D504 HydrophobicContact CZ3-CB 3.94Å; W434-I506 HydrophobicContact CD2-CD1 4.41Å; W434-I506 HydrophobicContact CE3-CD1 4.29Å; W434-I506 HydrophobicContact CE3-CG1 4.42Å; W434-I506 HydrophobicContact CH2-CD1 3.84Å; W434-I506 HydrophobicContact CH2-CG1 3.64Å; W434-I506 HydrophobicContact CZ2-CD1 4Å; W434-I506 HydrophobicContact CZ2-CG1 4.3Å; W434-I506 HydrophobicContact CZ3-CD1 4.01Å; W434-I506 HydrophobicContact CZ3-CG1 3.73Å
435	Q	86.6	Confident	73.3	Confident	44 Å²	44	64.3 Å²	64.3	21%	0.206	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	124.5	174.6	-54.1	-59.1	-46.6	0	0	108.4	V433 S445 Y494 W495	V433-Q435 PolarHBondContact O-N 2.92Å; V433-Q435 PolarHBondContact O-NE2 2.9Å; Q435-S445 PolarHBondContact NE2-O 2.81Å; Q435-S445 VanDerWaalsContact OE1-N 3.11Å; Q435-Y494 CarbonylContact O-C 3.42Å; Q435-Y494 WeakPolarHBondContact O-CA 3.26Å; Q435-W495 HydrophobicContact CB-CD2 4.19Å; Q435-W495 HydrophobicContact CB-CG 4.32Å; Q435-W495 HydrophobicContact CB-CZ2 4.02Å; Q435-W495 PolarHBondContact N-O 3.45Å; Q435-W495 PolarHBondContact O-N 3.47Å
436	F	89.8	Confident	73.6	Confident	52 Å²	52	65 Å²	65	23%	0.228	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	145.6	178.5	172.6	-109	0	0	0	110.4	Q438 Y443 Y492 G493 Y494	F436-Q438 HydrophobicContact CE1-CB 4.33Å; F436-Q438 HydrophobicContact CZ-CB 4.2Å; F436-Y443 AromaticContact CD1-CD2 3.31Å; F436-Y443 HydrophobicContact CD1-CD2 3.31Å; F436-Y443 AromaticContact CD1-CE2 3.91Å; F436-Y443 HydrophobicContact CD1-CE2 3.91Å; F436-Y443 AromaticContact CD1-CG 3.84Å; F436-Y443 HydrophobicContact CD1-CG 3.84Å; F436-Y443 AromaticContact CE1-CD2 3.68Å; F436-Y443 HydrophobicContact CE1-CD2 3.68Å; F436-Y443 AromaticContact CE1-CE2 3.75Å; F436-Y443 HydrophobicContact CE1-CE2 3.75Å; F436-Y443 HydrophobicContact CE1-CG 4.44Å; F436-Y443 HydrophobicContact CG-CD2 4.38Å; F436-Y443 PolarHBondContact N-O 3.11Å; F436-Y443 PolarHBondContact O-N 3.4Å; F436-Y492 AromaticContact CE2-CD2 3.84Å; F436-Y492 HydrophobicContact CE2-CD2 3.84Å; F436-Y492 HydrophobicContact CE2-CG 4.05Å; F436-G493 WeakPolarHBondContact CD2-O 3.5Å; F436-Y494 HydrophobicContact CB-CD1 3.95Å; F436-Y494 HydrophobicContact CB-CE1 3.82Å; F436-Y494 AromaticContact CD2-CD1 4Å; F436-Y494 HydrophobicContact CD2-CD1 4Å; F436-Y494 AromaticContact CD2-CE1 3.49Å; F436-Y494 HydrophobicContact CD2-CE1 3.49Å; F436-Y494 VanDerWaalsContact CD2-CE1 3.49Å; F436-Y494 HydrophobicContact CD2-CE2 4.18Å; F436-Y494 AromaticContact CD2-CZ 3.58Å; F436-Y494 HydrophobicContact CE2-CE1 4.47Å; F436-Y494 HydrophobicContact CG-CD1 4.48Å; F436-Y494 HydrophobicContact CG-CE1 4.05Å
437	F	91.2	Very high	73.7	Confident	1 Å²	1	61.8 Å²	61.8	0%	0.004	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	149.1	170.8	74.2	-87.7	0	0	0	112.1	F441 A442 M455 V463 T490 Y492 G493 W495 L507	F437-F441 CarbonylContact C-O 3.58Å; F437-F441 VanDerWaalsContact CA-O 3.32Å; F437-F441 WeakPolarHBondContact CA-O 3.4Å; F437-F441 WeakPolarHBondContact CB-O 3.41Å; F437-A442 HydrophobicContact CB-CB 4.45Å; F437-M455 HydrophobicContact CB-CE 4.49Å; F437-M455 HydrophobicContact CB-SD 4Å; F437-M455 HydrophobicContact CD2-CE 3.86Å; F437-M455 HydrophobicContact CD2-SD 3.62Å; F437-M455 HydrophobicContact CE2-CE 4.25Å; F437-M455 HydrophobicContact CE2-SD 4.42Å; F437-M455 HydrophobicContact CG-CE 4.15Å; F437-M455 HydrophobicContact CG-SD 4.06Å; F437-V463 HydrophobicContact CE1-CG2 4.3Å; F437-V463 HydrophobicContact CE2-CG1 4.09Å; F437-V463 HydrophobicContact CE2-CG2 4.33Å; F437-V463 HydrophobicContact CZ-CG1 3.86Å; F437-V463 HydrophobicContact CZ-CG2 3.83Å; F437-T490 HydrophobicContact CE2-CG2 3.9Å; F437-T490 HydrophobicContact CZ-CG2 4.05Å; F437-Y492 CarbonylContact O-C 3.54Å; F437-Y492 VanDerWaalsContact O-CA 3.24Å; F437-Y492 WeakPolarHBondContact O-CA 3.49Å; F437-Y492 VanDerWaalsContact O-CB 3.29Å; F437-Y492 WeakPolarHBondContact O-CB 3.06Å; F437-G493 WeakPolarHBondContact CD1-O 3.35Å; F437-G493 PolarHBondContact N-O 2.84Å; F437-G493 PolarHBondContact O-N 3.06Å; F437-W495 HydrophobicContact CB-CE3 4.31Å; F437-W495 HydrophobicContact CB-CH2 4.05Å; F437-W495 HydrophobicContact CB-CZ3 3.49Å; F437-W495 VanDerWaalsContact CB-CZ3 3.49Å; F437-W495 HydrophobicContact CD1-CD2 4.39Å; F437-W495 AromaticContact CD1-CE3 3.21Å; F437-W495 HydrophobicContact CD1-CE3 3.21Å; F437-W495 HydrophobicContact CD1-CH2 4.44Å; F437-W495 AromaticContact CD1-CZ3 3.24Å; F437-W495 HydrophobicContact CD1-CZ3 3.24Å; F437-W495 HydrophobicContact CD2-CZ3 4.41Å; F437-W495 AromaticContact CE1-CE3 3.65Å; F437-W495 HydrophobicContact CE1-CE3 3.65Å; F437-W495 HydrophobicContact CE1-CZ3 4.01Å; F437-W495 AromaticContact CG-CE3 3.96Å; F437-W495 HydrophobicContact CG-CE3 3.96Å; F437-W495 HydrophobicContact CG-CH2 4.47Å; F437-W495 AromaticContact CG-CZ3 3.47Å; F437-W495 HydrophobicContact CG-CZ3 3.47Å; F437-W495 VanDerWaalsContact CG-CZ3 3.47Å; F437-L507 HydrophobicContact CE1-CD2 4.09Å; F437-L507 HydrophobicContact CZ-CD2 3.65Å
438	Q	90.2	Very high	73.7	Confident	103 Å²	103	62.2 Å²	62.2	48%	0.481	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	104.8	169	-175.5	-179.3	-0.3	0	0	106.3	F436 F441 Y443 L491	F436-Q438 HydrophobicContact CE1-CB 4.33Å; F436-Q438 HydrophobicContact CZ-CB 4.2Å; Q438-F441 CarbonylContact C-O 3.55Å; Q438-F441 PolarHBondContact N-O 3.41Å; Q438-F441 PolarHBondContact O-N 3.27Å; Q438-F441 VanDerWaalsContact O-O 3.11Å; Q438-Y443 HydrophobicContact CB-CE2 4.31Å; Q438-L491 WeakPolarHBondContact CG-O 3.31Å
439	S	82.7	Confident	73.4	Confident	64 Å²	64	61 Å²	61	45%	0.448	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.5	128.5	-170.2	-175.4	0	0	0	0	111.1
440	P	82.8	Confident	73.6	Confident	47 Å²	47	56.3 Å²	56.3	31%	0.305	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	cis	-96.7	13.5	11.8	38.8	-37.6	0	0	0	115.2	R454 M455	P440-R454 WeakPolarHBondContact O-CA 3.35Å; P440-M455 PolarHBondContact O-N 3.1Å
441	F	86.3	Confident	74	Confident	64 Å²	64	56.2 Å²	56.2	28%	0.281	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	144.3	-173.1	-58	-70.1	0	0	0	113	F437 Q438 Y443 R452 H453	F437-F441 CarbonylContact C-O 3.58Å; F437-F441 VanDerWaalsContact CA-O 3.32Å; F437-F441 WeakPolarHBondContact CA-O 3.4Å; F437-F441 WeakPolarHBondContact CB-O 3.41Å; Q438-F441 CarbonylContact C-O 3.55Å; Q438-F441 PolarHBondContact N-O 3.41Å; Q438-F441 PolarHBondContact O-N 3.27Å; Q438-F441 VanDerWaalsContact O-O 3.11Å; F441-Y443 HydrophobicContact CB-CE2 4.07Å; F441-R452 HydrophobicContact CB-CG 3.86Å; F441-R452 HydrophobicContact CD1-CG 3.99Å; F441-R452 HydrophobicContact CG-CG 4Å; F441-H453 CarbonylContact C-O 3.57Å; F441-H453 VanDerWaalsContact CA-O 3.3Å; F441-H453 WeakPolarHBondContact CA-O 3.49Å
442	A	86.6	Confident	74.6	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.008	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	150.5	169.7	0	0	0	0	0	110	F437 H453 M455 W495	F437-A442 HydrophobicContact CB-CB 4.45Å; A442-H453 VanDerWaalsContact CB-CE1 3.49Å; A442-H453 WeakPolarHBondContact CB-CE1 3.44Å; A442-H453 PolarHBondContact N-O 3.38Å; A442-H453 PolarHBondContact O-N 3.4Å; A442-M455 HydrophobicContact CB-CG 3.9Å; A442-W495 HydrophobicContact CB-CH2 3.67Å; A442-W495 HydrophobicContact CB-CZ2 4.31Å
443	Y	82.8	Confident	74.7	Confident	74 Å²	74	58.1 Å²	58.1	29%	0.29	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	119.8	-178	-58	-95.4	0	0	0	107.6	F436 Q438 F441 S445 R452	F436-Y443 AromaticContact CD1-CD2 3.31Å; F436-Y443 HydrophobicContact CD1-CD2 3.31Å; F436-Y443 AromaticContact CD1-CE2 3.91Å; F436-Y443 HydrophobicContact CD1-CE2 3.91Å; F436-Y443 AromaticContact CD1-CG 3.84Å; F436-Y443 HydrophobicContact CD1-CG 3.84Å; F436-Y443 AromaticContact CE1-CD2 3.68Å; F436-Y443 HydrophobicContact CE1-CD2 3.68Å; F436-Y443 AromaticContact CE1-CE2 3.75Å; F436-Y443 HydrophobicContact CE1-CE2 3.75Å; F436-Y443 HydrophobicContact CE1-CG 4.44Å; F436-Y443 HydrophobicContact CG-CD2 4.38Å; F436-Y443 PolarHBondContact N-O 3.11Å; F436-Y443 PolarHBondContact O-N 3.4Å; Q438-Y443 HydrophobicContact CB-CE2 4.31Å; F441-Y443 HydrophobicContact CB-CE2 4.07Å; Y443-S445 PolarHBondContact O-N 3.49Å; Y443-R452 HydrophobicContact CD1-CB 4.08Å; Y443-R452 HydrophobicContact CD1-CG 4.2Å; Y443-R452 HydrophobicContact CE1-CB 3.8Å; Y443-R452 HydrophobicContact CE1-CG 3.58Å
444	C	72.8	Confident	74.8	Confident	40 Å²	40	63.3 Å²	63.3	27%	0.27	34%	0.339	S	S	.	.			trans	-74.7	127	176.8	-74.3	0	0	0	0	110.9	C450	C444-C450 HydrophobicContact CB-CB 3.14Å; C444-C450 WeakPolarHBondContact CB-SG 3.14Å; C444-C450 WeakPolarHBondContact SG-CB 3.21Å; C444-C450 CovalentContact SG-SG 2.02Å; C444-C450 PolarHBondContact SG-SG 3.2Å
445	S	65.4	Low	74.5	Confident	43 Å²	43	60.2 Å²	60.2	30%	0.301	33%	0.328	S	S	.	.	S	Bend	trans	-95.6	133.6	171.4	-59.3	0	0	0	0	109.7	W434 Q435 Y443	W434-S445 WeakPolarHBondContact O-CB 3.45Å; W434-S445 PolarHBondContact O-OG 2.82Å; Q435-S445 PolarHBondContact NE2-O 2.81Å; Q435-S445 VanDerWaalsContact OE1-N 3.11Å; Y443-S445 PolarHBondContact O-N 3.49Å
446	G	59.3	Low	74.1	Confident	81 Å²	81	65 Å²	65	84%	0.835	35%	0.348	S	S	*	.	S	Bend	trans	91.1	-12.7	174	0	0	0	0	0	116.4
447	A	58.2	Low	73.3	Confident	50 Å²	50	67.3 Å²	67.3	41%	0.413	37%	0.371	S	S	.	.			trans	-110.1	106.9	172.5	0	0	0	0	0	109.4	E449 C450	A447-E449 PolarHBondContact O-N 3.08Å; A447-E449 VanDerWaalsContact O-N 3.09Å; A447-C450 HydrophobicContact CB-CB 4.03Å; A447-C450 PolarHBondContact O-N 3.16Å; A447-C450 VanDerWaalsContact O-N 3.12Å
448	S	52.6	Low	72.5	Confident	59 Å²	59	77.6 Å²	77.6	41%	0.413	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-26.5	177.2	62.9	0	0	0	0	112.1	K797	S448-K797 WeakPolarHBondContact O-CD 3.27Å; S448-K797 WeakPolarHBondContact O-CE 3.27Å; S448-K797 PolarHBondContact O-NZ 2.92Å
449	E	53.6	Low	72.2	Confident	56 Å²	56	75.1 Å²	75.1	26%	0.262	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-2.4	-178.2	-65.8	176.3	-177.6	0	0	115	A447 P451 Y691 H709	A447-E449 PolarHBondContact O-N 3.08Å; A447-E449 VanDerWaalsContact O-N 3.09Å; E449-P451 WeakPolarHBondContact O-CD 2.88Å; E449-Y691 PolarHBondContact OE1-OH 3.45Å; E449-H709 WeakPolarHBondContact OE1-CB 3.49Å; E449-H709 WeakPolarHBondContact OE2-CB 3.33Å
450	C	60.3	Low	72.2	Confident	35 Å²	35	75.3 Å²	75.3	24%	0.236	39%	0.393	C	S	.	.			trans	-100.9	100.6	178.7	179.3	0	0	0	0	111.4	C444 A447	C444-C450 HydrophobicContact CB-CB 3.14Å; C444-C450 WeakPolarHBondContact CB-SG 3.14Å; C444-C450 WeakPolarHBondContact SG-CB 3.21Å; C444-C450 CovalentContact SG-SG 2.02Å; C444-C450 PolarHBondContact SG-SG 3.2Å; A447-C450 HydrophobicContact CB-CB 4.03Å; A447-C450 PolarHBondContact O-N 3.16Å; A447-C450 VanDerWaalsContact O-N 3.12Å
451	P	62.5	Low	71.9	Confident	56 Å²	56	77 Å²	77	36%	0.364	39%	0.393	S	S	.	.			trans	-73.1	168.5	179.9	31.1	-36	0	0	0	112.4	E449 H453 F713	E449-P451 WeakPolarHBondContact O-CD 2.88Å; P451-H453 PolarHBondContact O-CD2 2.69Å; P451-H453 PolarHBondContact O-N 3.22Å; P451-H453 VanDerWaalsContact O-N 3.08Å; P451-F713 HydrophobicContact CG-CE2 3.37Å; P451-F713 HydrophobicContact CG-CZ 3.59Å
452	R	72.5	Confident	71.8	Confident	146 Å²	146	75 Å²	75	55%	0.551	39%	0.389	S	S	*	.			trans	-47.6	116.7	165.3	-179.8	-171.2	70.3	123.1	-0.7	109.4	F441 Y443	F441-R452 HydrophobicContact CB-CG 3.86Å; F441-R452 HydrophobicContact CD1-CG 3.99Å; F441-R452 HydrophobicContact CG-CG 4Å; Y443-R452 HydrophobicContact CD1-CB 4.08Å; Y443-R452 HydrophobicContact CD1-CG 4.2Å; Y443-R452 HydrophobicContact CE1-CB 3.8Å; Y443-R452 HydrophobicContact CE1-CG 3.58Å
453	H	72.7	Confident	71.9	Confident	55 Å²	55	75.3 Å²	75.3	26%	0.255	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	160.3	178.6	67.5	86.2	0	0	0	110.7	F441 A442 P451	F441-H453 CarbonylContact C-O 3.57Å; F441-H453 VanDerWaalsContact CA-O 3.3Å; F441-H453 WeakPolarHBondContact CA-O 3.49Å; A442-H453 VanDerWaalsContact CB-CE1 3.49Å; A442-H453 WeakPolarHBondContact CB-CE1 3.44Å; A442-H453 PolarHBondContact N-O 3.38Å; A442-H453 PolarHBondContact O-N 3.4Å; P451-H453 PolarHBondContact O-CD2 2.69Å; P451-H453 PolarHBondContact O-N 3.22Å; P451-H453 VanDerWaalsContact O-N 3.08Å
454	R	75.9	Confident	72	Confident	186 Å²	186	77 Å²	77	70%	0.702	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.8	137.6	172.6	-164.9	174.1	-179.7	175.2	-0.4	108.8	P440 K456	P440-R454 WeakPolarHBondContact O-CA 3.35Å; R454-K456 PolarHBondContact O-N 3.01Å
455	M	80.2	Confident	72.4	Confident	8 Å²	8	76 Å²	76	4%	0.039	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-57.1	138.4	171.5	-69.9	176.8	69.6	0	0	109.4	F437 P440 A442 Q459 M460 V463 W495	F437-M455 HydrophobicContact CB-CE 4.49Å; F437-M455 HydrophobicContact CB-SD 4Å; F437-M455 HydrophobicContact CD2-CE 3.86Å; F437-M455 HydrophobicContact CD2-SD 3.62Å; F437-M455 HydrophobicContact CE2-CE 4.25Å; F437-M455 HydrophobicContact CE2-SD 4.42Å; F437-M455 HydrophobicContact CG-CE 4.15Å; F437-M455 HydrophobicContact CG-SD 4.06Å; P440-M455 PolarHBondContact O-N 3.1Å; A442-M455 HydrophobicContact CB-CG 3.9Å; M455-Q459 HydrophobicContact CE-CB 4.21Å; M455-M460 HydrophobicContact CB-CG 3.47Å; M455-M460 VanDerWaalsContact CB-CG 3.47Å; M455-M460 HydrophobicContact CB-SD 4.17Å; M455-M460 HydrophobicContact CE-CG 4.19Å; M455-M460 HydrophobicContact CG-CG 4.45Å; M455-M460 HydrophobicContact SD-CG 4.26Å; M455-V463 HydrophobicContact CE-CG2 4.22Å; M455-W495 HydrophobicContact CE-CH2 4.31Å; M455-W495 HydrophobicContact CE-CZ3 3.72Å; M455-W495 HydrophobicContact CG-CH2 4.48Å
456	K	77.6	Confident	73.3	Confident	144 Å²	144	74.1 Å²	74.1	63%	0.626	38%	0.375	S	S	*	.	P	Polyproline II helix	trans	-63	146.7	173.5	-63.5	178.2	-179.7	177.8	0	108.7	R454 R458 Q459 M460	R454-K456 PolarHBondContact O-N 3.01Å; K456-R458 PolarHBondContact O-N 3.07Å; K456-Q459 HydrophobicContact CB-CG 4.2Å; K456-Q459 WeakPolarHBondContact O-CA 3.44Å; K456-Q459 WeakPolarHBondContact O-CB 3.43Å; K456-Q459 PolarHBondContact O-N 3.34Å; K456-M460 PolarHBondContact O-N 3.4Å
457	S	72.1	Confident	74.7	Confident	101 Å²	101	70.3 Å²	70.3	71%	0.706	34%	0.335	S	S	*	.	H	α-helix	trans	-51.7	-42.3	178.3	53.3	0	0	0	0	112.2	Q459 M460 Y461	S457-Q459 VanDerWaalsContact C-N 3.35Å; S457-Q459 PolarHBondContact O-N 3.19Å; S457-M460 PolarHBondContact O-N 3.05Å; S457-Y461 WeakPolarHBondContact O-CB 3.49Å; S457-Y461 PolarHBondContact O-N 3.05Å
458	R	75.6	Confident	75.9	Confident	217 Å²	217	69.4 Å²	69.4	82%	0.819	32%	0.322	S	S	*	.	H	α-helix	trans	-60.8	-36.1	174.8	-66.8	-176.7	-178.4	155.3	1.5	113.9	K456 A462	K456-R458 PolarHBondContact O-N 3.07Å; R458-A462 WeakPolarHBondContact O-CB 3.28Å; R458-A462 PolarHBondContact O-N 3.15Å
459	Q	82.7	Confident	77.1	Confident	50 Å²	50	71.6 Å²	71.6	23%	0.234	33%	0.325	C	S	.	.	H	α-helix	trans	-73.7	-44.1	177.8	-68.1	171.1	-48	0	0	111.2	M455 K456 S457 Y461 A462 V463 W495	M455-Q459 HydrophobicContact CE-CB 4.21Å; K456-Q459 HydrophobicContact CB-CG 4.2Å; K456-Q459 WeakPolarHBondContact O-CA 3.44Å; K456-Q459 WeakPolarHBondContact O-CB 3.43Å; K456-Q459 PolarHBondContact O-N 3.34Å; S457-Q459 VanDerWaalsContact C-N 3.35Å; S457-Q459 PolarHBondContact O-N 3.19Å; Q459-Y461 PolarHBondContact O-N 3.36Å; Q459-A462 PolarHBondContact O-N 3.29Å; Q459-V463 PolarHBondContact O-N 2.74Å; Q459-W495 VanDerWaalsContact NE2-CZ2 3.31Å
460	M	83.1	Confident	78.4	Confident	68 Å²	68	69.6 Å²	69.6	34%	0.335	32%	0.316	S	S	.	.	H	α-helix	trans	-59.5	-41.2	174.1	-66	-178.1	64.4	0	0	111.1	M455 K456 S457 R464	M455-M460 HydrophobicContact CB-CG 3.47Å; M455-M460 VanDerWaalsContact CB-CG 3.47Å; M455-M460 HydrophobicContact CB-SD 4.17Å; M455-M460 HydrophobicContact CE-CG 4.19Å; M455-M460 HydrophobicContact CG-CG 4.45Å; M455-M460 HydrophobicContact SD-CG 4.26Å; K456-M460 PolarHBondContact O-N 3.4Å; S457-M460 PolarHBondContact O-N 3.05Å; M460-R464 WeakPolarHBondContact O-CA 3.38Å; M460-R464 PolarHBondContact O-N 2.79Å
461	Y	77.8	Confident	79.5	Confident	82 Å²	82	68.3 Å²	68.3	32%	0.322	31%	0.307	S	S	.	.	H	α-helix	trans	-60.7	-49.8	174.3	177.7	-98.8	0	0	0	112	D353 N355 S457 Q459 V463 R464 N465	D353-Y461 VanDerWaalsContact CG-CE2 3.47Å; D353-Y461 WeakPolarHBondContact OD1-CE2 3.46Å; D353-Y461 WeakPolarHBondContact OD2-CD2 3.4Å; D353-Y461 WeakPolarHBondContact OD2-CE2 3.5Å; N355-Y461 HydrophobicContact CB-CD2 4.41Å; N355-Y461 HydrophobicContact CB-CE2 3.36Å; N355-Y461 WeakPolarHBondContact CB-OH 3.14Å; N355-Y461 PolarHBondContact ND2-OH 2.89Å; N355-Y461 VanDerWaalsContact ND2-OH 3.17Å; S457-Y461 WeakPolarHBondContact O-CB 3.49Å; S457-Y461 PolarHBondContact O-N 3.05Å; Q459-Y461 PolarHBondContact O-N 3.36Å; Y461-V463 PolarHBondContact O-N 2.94Å; Y461-R464 CarbonylContact O-C 3.49Å; Y461-R464 WeakPolarHBondContact O-CA 3.47Å; Y461-R464 PolarHBondContact O-N 3.46Å; Y461-R464 VanDerWaalsContact O-N 3.15Å; Y461-N465 WeakPolarHBondContact CD1-OD1 3.3Å; Y461-N465 WeakPolarHBondContact CE1-OD1 3.5Å; Y461-N465 WeakPolarHBondContact CE2-ND2 3.3Å; Y461-N465 PolarHBondContact O-N 2.81Å; Y461-N465 PolarHBondContact O-ND2 3.11Å; Y461-N465 PolarHBondContact OH-OD1 3.09Å
462	A	83.6	Confident	80.1	Confident	23 Å²	23	68.9 Å²	68.9	19%	0.19	31%	0.307	C	S	.	.	H	α-helix	trans	-58.5	-50.1	178.9	0	0	0	0	0	112.3	R458 Q459 R464 N465 I466	R458-A462 WeakPolarHBondContact O-CB 3.28Å; R458-A462 PolarHBondContact O-N 3.15Å; Q459-A462 PolarHBondContact O-N 3.29Å; A462-R464 VanDerWaalsContact C-N 3.28Å; A462-R464 PolarHBondContact O-N 3.38Å; A462-N465 PolarHBondContact O-N 2.83Å; A462-I466 WeakPolarHBondContact O-CB 3.42Å; A462-I466 WeakPolarHBondContact O-CD1 3.27Å; A462-I466 VanDerWaalsContact O-CG1 3.25Å; A462-I466 WeakPolarHBondContact O-CG1 3.38Å; A462-I466 PolarHBondContact O-N 3.26Å
463	V	88.6	Confident	80.2	Confident	7 Å²	7	65.8 Å²	65.8	4%	0.042	30%	0.3	C	S	.	.	H	α-helix	trans	-60.4	-41.6	175.7	175.4	0	0	0	0	111	F437 M455 Q459 Y461 A467 T490 Y505 L507	F437-V463 HydrophobicContact CE1-CG2 4.3Å; F437-V463 HydrophobicContact CE2-CG1 4.09Å; F437-V463 HydrophobicContact CE2-CG2 4.33Å; F437-V463 HydrophobicContact CZ-CG1 3.86Å; F437-V463 HydrophobicContact CZ-CG2 3.83Å; M455-V463 HydrophobicContact CE-CG2 4.22Å; Q459-V463 PolarHBondContact O-N 2.74Å; Y461-V463 PolarHBondContact O-N 2.94Å; V463-A467 WeakPolarHBondContact O-CB 3.18Å; V463-A467 PolarHBondContact O-N 3.39Å; V463-T490 HydrophobicContact CG1-CG2 4.17Å; V463-Y505 HydrophobicContact CG2-CD1 4.47Å; V463-Y505 HydrophobicContact CG2-CE1 4.21Å; V463-L507 HydrophobicContact CG1-CD2 4.1Å
464	R	85.6	Confident	80.5	Confident	111 Å²	111	66 Å²	66	42%	0.419	30%	0.302	S	S	.	.	H	α-helix	trans	-33.7	-71.5	163.1	174.9	-118.6	-160.9	167.4	0.1	112.9	M460 Y461 A462 A467 Y468 Y487	M460-R464 WeakPolarHBondContact O-CA 3.38Å; M460-R464 PolarHBondContact O-N 2.79Å; Y461-R464 CarbonylContact O-C 3.49Å; Y461-R464 WeakPolarHBondContact O-CA 3.47Å; Y461-R464 PolarHBondContact O-N 3.46Å; Y461-R464 VanDerWaalsContact O-N 3.15Å; A462-R464 VanDerWaalsContact C-N 3.28Å; A462-R464 PolarHBondContact O-N 3.38Å; R464-A467 PolarHBondContact O-N 2.93Å; R464-Y468 HydrophobicContact CG-CD2 3.84Å; R464-Y468 HydrophobicContact CG-CE2 3.39Å; R464-Y468 VanDerWaalsContact NE-CE2 3.29Å; R464-Y468 PolarHBondContact NE-OH 3.12Å; R464-Y468 PolarHBondContact NH2-OH 2.85Å; R464-Y468 WeakPolarHBondContact O-CD2 3.48Å; R464-Y468 PolarHBondContact O-N 2.86Å; R464-Y487 HydrophobicContact CG-CE1 4.38Å
465	N	80.6	Confident	80.7	Confident	17 Å²	17	58.8 Å²	58.8	9%	0.091	28%	0.277	C	S	.	.	H	α-helix	trans	-70	-41.6	-168.4	-48.4	168.1	0	0	0	111	N355 Y461 A462 A467 Y468 E469	N355-N465 WeakPolarHBondContact CB-ND2 3.16Å; N355-N465 VanDerWaalsContact CG-CG 3.44Å; N355-N465 PolarHBondContact ND2-ND2 2.82Å; N355-N465 PolarHBondContact ND2-OD1 2.92Å; Y461-N465 WeakPolarHBondContact CD1-OD1 3.3Å; Y461-N465 WeakPolarHBondContact CE1-OD1 3.5Å; Y461-N465 WeakPolarHBondContact CE2-ND2 3.3Å; Y461-N465 PolarHBondContact O-N 2.81Å; Y461-N465 PolarHBondContact O-ND2 3.11Å; Y461-N465 PolarHBondContact OH-OD1 3.09Å; A462-N465 PolarHBondContact O-N 2.83Å; N465-A467 VanDerWaalsContact C-N 3.27Å; N465-A467 PolarHBondContact O-N 3.35Å; N465-Y468 PolarHBondContact O-N 3.37Å; N465-E469 WeakPolarHBondContact O-CG 3.17Å; N465-E469 PolarHBondContact O-N 3.35Å
466	I	85.2	Confident	80.3	Confident	5 Å²	5	63.6 Å²	63.6	3%	0.026	30%	0.297	C	S	.	.	H	α-helix	trans	-55.9	-45.2	176	-72.5	167.6	0	0	0	110.3	A462 Y468 E469 I470 Y505 L507 L531	A462-I466 WeakPolarHBondContact O-CB 3.42Å; A462-I466 WeakPolarHBondContact O-CD1 3.27Å; A462-I466 VanDerWaalsContact O-CG1 3.25Å; A462-I466 WeakPolarHBondContact O-CG1 3.38Å; A462-I466 PolarHBondContact O-N 3.26Å; I466-Y468 VanDerWaalsContact C-N 3.35Å; I466-Y468 PolarHBondContact O-N 2.63Å; I466-E469 PolarHBondContact O-N 2.99Å; I466-I470 HydrophobicContact CG2-CD1 3.91Å; I466-I470 WeakPolarHBondContact O-CD1 3.2Å; I466-I470 WeakPolarHBondContact O-CG1 3.16Å; I466-I470 PolarHBondContact O-N 3.35Å; I466-Y505 HydrophobicContact CD1-CD1 4.33Å; I466-Y505 HydrophobicContact CD1-CD2 3.67Å; I466-Y505 HydrophobicContact CD1-CE1 3.95Å; I466-Y505 HydrophobicContact CD1-CE2 3.2Å; I466-Y505 HydrophobicContact CD1-CG 4.19Å; I466-L507 HydrophobicContact CG2-CD1 3.74Å; I466-L531 HydrophobicContact CD1-CD1 4.28Å; I466-L531 HydrophobicContact CG1-CD1 4.49Å; I466-L531 HydrophobicContact CG2-CD1 3.52Å; I466-L531 HydrophobicContact CG2-CD2 3.46Å; I466-L531 VanDerWaalsContact CG2-CD2 3.46Å; I466-L531 HydrophobicContact CG2-CG 4.12Å
467	A	87.5	Confident	79.7	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-61.2	-42.8	177	0	0	0	0	0	112	V463 R464 N465 I470 I471 Y487 L509	V463-A467 WeakPolarHBondContact O-CB 3.18Å; V463-A467 PolarHBondContact O-N 3.39Å; R464-A467 PolarHBondContact O-N 2.93Å; N465-A467 VanDerWaalsContact C-N 3.27Å; N465-A467 PolarHBondContact O-N 3.35Å; A467-I470 PolarHBondContact O-N 3.5Å; A467-I471 WeakPolarHBondContact O-CG1 3.41Å; A467-I471 PolarHBondContact O-N 3.46Å; A467-Y487 HydrophobicContact CB-CD2 3.84Å; A467-Y487 HydrophobicContact CB-CE2 3.61Å; A467-L509 HydrophobicContact CB-CD2 4.17Å
468	Y	82.8	Confident	79.6	Confident	32 Å²	32	55.5 Å²	55.5	13%	0.125	25%	0.249	C	C	.	.	H	α-helix	trans	-65.8	-42.3	176	-73	-52	0	0	0	113.1	P357 R464 N465 I466 I470 I471 D472 Y487	P357-Y468 HydrophobicContact CB-CE1 4.5Å; P357-Y468 WeakPolarHBondContact CD-OH 3.31Å; P357-Y468 HydrophobicContact CG-CD1 4.05Å; P357-Y468 HydrophobicContact CG-CE1 3.32Å; P357-Y468 HydrophobicContact CG-CE2 3.88Å; P357-Y468 VanDerWaalsContact CG-OH 3.24Å; P357-Y468 WeakPolarHBondContact CG-OH 3.09Å; R464-Y468 HydrophobicContact CG-CD2 3.84Å; R464-Y468 HydrophobicContact CG-CE2 3.39Å; R464-Y468 VanDerWaalsContact NE-CE2 3.29Å; R464-Y468 PolarHBondContact NE-OH 3.12Å; R464-Y468 PolarHBondContact NH2-OH 2.85Å; R464-Y468 WeakPolarHBondContact O-CD2 3.48Å; R464-Y468 PolarHBondContact O-N 2.86Å; N465-Y468 PolarHBondContact O-N 3.37Å; I466-Y468 VanDerWaalsContact C-N 3.35Å; I466-Y468 PolarHBondContact O-N 2.63Å; Y468-I470 VanDerWaalsContact C-N 3.31Å; Y468-I470 PolarHBondContact O-N 3.38Å; Y468-I471 PolarHBondContact O-N 3.06Å; Y468-D472 PolarHBondContact O-N 3.02Å; Y468-Y487 HydrophobicContact CD1-CD1 4.38Å; Y468-Y487 AromaticContact CE1-CD1 3.7Å; Y468-Y487 HydrophobicContact CE1-CD1 3.7Å; Y468-Y487 HydrophobicContact CE1-CG 4.25Å; Y468-Y487 AromaticContact CZ-CD1 3.98Å
469	E	77.8	Confident	79	Confident	105 Å²	105	53.5 Å²	53.5	49%	0.491	24%	0.241	S	C	.	.	H	α-helix	trans	-59	-42.6	175.4	-74.2	172.1	-168	0	0	111.4	N465 I466 I471 D472 M473	N465-E469 WeakPolarHBondContact O-CG 3.17Å; N465-E469 PolarHBondContact O-N 3.35Å; I466-E469 PolarHBondContact O-N 2.99Å; E469-I471 VanDerWaalsContact C-N 3.33Å; E469-I471 PolarHBondContact O-N 3.08Å; E469-D472 PolarHBondContact O-N 3.41Å; E469-M473 WeakPolarHBondContact O-CB 3.5Å; E469-M473 VanDerWaalsContact O-CG 3.32Å; E469-M473 WeakPolarHBondContact O-CG 3.27Å; E469-M473 PolarHBondContact O-N 2.89Å
470	I	82.9	Confident	78.4	Confident	13 Å²	13	58 Å²	58	7%	0.067	26%	0.262	C	S	.	.	H	α-helix	trans	-59.8	-44.4	173.5	-65.2	161.4	0	0	0	110.8	I466 A467 Y468 M473 M474 L507 L509 V529 L531	I466-I470 HydrophobicContact CG2-CD1 3.91Å; I466-I470 WeakPolarHBondContact O-CD1 3.2Å; I466-I470 WeakPolarHBondContact O-CG1 3.16Å; I466-I470 PolarHBondContact O-N 3.35Å; A467-I470 PolarHBondContact O-N 3.5Å; Y468-I470 VanDerWaalsContact C-N 3.31Å; Y468-I470 PolarHBondContact O-N 3.38Å; I470-M473 HydrophobicContact CG1-CE 4.28Å; I470-M473 WeakPolarHBondContact O-CB 3.48Å; I470-M473 PolarHBondContact O-N 2.81Å; I470-M474 HydrophobicContact CG2-CG 4.33Å; I470-M474 HydrophobicContact CG2-SD 3.94Å; I470-M474 WeakPolarHBondContact O-CB 3.39Å; I470-M474 VanDerWaalsContact O-CG 3.24Å; I470-M474 WeakPolarHBondContact O-CG 3.44Å; I470-M474 PolarHBondContact O-N 3.17Å; I470-L507 HydrophobicContact CD1-CD1 4.38Å; I470-L509 HydrophobicContact CD1-CD1 4.09Å; I470-L509 HydrophobicContact CG2-CD1 4.44Å; I470-V529 HydrophobicContact CD1-CB 4.44Å; I470-V529 HydrophobicContact CD1-CG1 4.07Å; I470-L531 HydrophobicContact CD1-CD2 3.37Å; I470-L531 HydrophobicContact CG1-CD2 4.21Å
471	I	82.7	Confident	78.1	Confident	8 Å²	8	61.3 Å²	61.3	4%	0.041	27%	0.271	C	S	.	.	H	α-helix	trans	-66.6	-41.5	179.6	-65.7	-34.5	0	0	0	111.9	A467 Y468 E469 M473 M474 N475 V485 L511	A467-I471 WeakPolarHBondContact O-CG1 3.41Å; A467-I471 PolarHBondContact O-N 3.46Å; Y468-I471 PolarHBondContact O-N 3.06Å; E469-I471 VanDerWaalsContact C-N 3.33Å; E469-I471 PolarHBondContact O-N 3.08Å; I471-M473 VanDerWaalsContact C-N 3.32Å; I471-M473 PolarHBondContact O-N 3.49Å; I471-M474 HydrophobicContact CD1-SD 3.79Å; I471-M474 PolarHBondContact O-N 3.37Å; I471-N475 WeakPolarHBondContact CG2-ND2 3.49Å; I471-N475 VanDerWaalsContact O-CB 3.29Å; I471-N475 WeakPolarHBondContact O-CB 3.49Å; I471-N475 PolarHBondContact O-N 3.35Å; I471-N475 PolarHBondContact O-ND2 3.39Å; I471-V485 HydrophobicContact CD1-CG1 4.17Å; I471-V485 VanDerWaalsContact CG2-O 3.26Å; I471-V485 WeakPolarHBondContact CG2-O 3.39Å; I471-L511 HydrophobicContact CD1-CD1 3.95Å; I471-L511 HydrophobicContact CD1-CD2 3.57Å; I471-L511 HydrophobicContact CD1-CG 4.39Å; I471-L511 HydrophobicContact CG1-CD2 4.3Å
472	D	75.1	Confident	78.2	Confident	68 Å²	68	57.7 Å²	57.7	36%	0.364	26%	0.258	S	S	.	.	H	α-helix	trans	-61.4	-42.6	175.3	-76.4	-2	0	0	0	110.8	H361 Y468 E469 N475 K476	H361-D472 IonicContact CE1-OD1 3.37Å; H361-D472 IonicContact NE2-OD1 2.64Å; H361-D472 PolarHBondContact NE2-OD1 3.41Å; Y468-D472 PolarHBondContact O-N 3.02Å; E469-D472 PolarHBondContact O-N 3.41Å; D472-N475 CarbonylContact O-C 3.56Å; D472-N475 PolarHBondContact O-N 3.44Å; D472-K476 PolarHBondContact O-N 3.2Å
473	M	73.6	Confident	78.3	Confident	81 Å²	81	59 Å²	59	40%	0.399	26%	0.258	S	S	.	.	H	α-helix	trans	-60.4	-47	171.9	-72.9	-167.3	-62.5	0	0	112.2	V16 E469 I470 I471 N475 K476	V16-M473 HydrophobicContact CG2-CE 4.33Å; V16-M473 HydrophobicContact CG2-SD 4.13Å; E469-M473 WeakPolarHBondContact O-CB 3.5Å; E469-M473 VanDerWaalsContact O-CG 3.32Å; E469-M473 WeakPolarHBondContact O-CG 3.27Å; E469-M473 PolarHBondContact O-N 2.89Å; I470-M473 HydrophobicContact CG1-CE 4.28Å; I470-M473 WeakPolarHBondContact O-CB 3.48Å; I470-M473 PolarHBondContact O-N 2.81Å; I471-M473 VanDerWaalsContact C-N 3.32Å; I471-M473 PolarHBondContact O-N 3.49Å; M473-N475 PolarHBondContact O-N 2.92Å; M473-K476 WeakPolarHBondContact O-CB 3.21Å; M473-K476 PolarHBondContact O-N 3.16Å
474	M	78.9	Confident	78.1	Confident	60 Å²	60	62.3 Å²	62.3	30%	0.296	27%	0.274	S	S	.	.	H	α-helix	trans	-63.2	-29.7	178.8	-73.2	176.7	75	0	0	113	I470 I471 R483 V485 L511	I470-M474 HydrophobicContact CG2-CG 4.33Å; I470-M474 HydrophobicContact CG2-SD 3.94Å; I470-M474 WeakPolarHBondContact O-CB 3.39Å; I470-M474 VanDerWaalsContact O-CG 3.24Å; I470-M474 WeakPolarHBondContact O-CG 3.44Å; I470-M474 PolarHBondContact O-N 3.17Å; I471-M474 HydrophobicContact CD1-SD 3.79Å; I471-M474 PolarHBondContact O-N 3.37Å; M474-R483 PolarHBondContact O-NH1 3.03Å; M474-R483 VanDerWaalsContact O-NH1 3.15Å; M474-V485 HydrophobicContact CE-CB 4.48Å; M474-V485 HydrophobicContact CE-CG1 4.15Å; M474-V485 HydrophobicContact CE-CG2 4.15Å; M474-L511 HydrophobicContact CE-CD1 4.11Å; M474-L511 HydrophobicContact SD-CD1 4.22Å
475	N	80	Confident	78.2	Confident	34 Å²	34	57.2 Å²	57.2	18%	0.182	26%	0.255	C	S	.	.	H	α-helix	trans	-93.1	-11.7	-178.8	-76.9	-26.6	0	0	0	114.3	I471 D472 M473 Y477 G478 V485	I471-N475 WeakPolarHBondContact CG2-ND2 3.49Å; I471-N475 VanDerWaalsContact O-CB 3.29Å; I471-N475 WeakPolarHBondContact O-CB 3.49Å; I471-N475 PolarHBondContact O-N 3.35Å; I471-N475 PolarHBondContact O-ND2 3.39Å; D472-N475 CarbonylContact O-C 3.56Å; D472-N475 PolarHBondContact O-N 3.44Å; M473-N475 PolarHBondContact O-N 2.92Å; N475-Y477 PolarHBondContact O-N 3.39Å; N475-G478 PolarHBondContact O-N 2.95Å; N475-V485 PolarHBondContact ND2-O 3.2Å; N475-V485 PolarHBondContact OD1-N 2.77Å; N475-V485 PolarHBondContact OD1-O 3.22Å
476	K	72.6	Confident	78.5	Confident	109 Å²	109	59 Å²	59	47%	0.474	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47	-39.1	-178.7	-171	-179.7	179.2	-164.4	0	113.7	D472 M473	D472-K476 PolarHBondContact O-N 3.2Å; M473-K476 WeakPolarHBondContact O-CB 3.21Å; M473-K476 PolarHBondContact O-N 3.16Å
477	Y	65.5	Low	78.7	Confident	73 Å²	73	60.9 Å²	60.9	29%	0.286	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117	19.4	174.7	-51.9	-79.5	0	0	0	113	N475 R479 Q480 R481	N475-Y477 PolarHBondContact O-N 3.39Å; Y477-R479 VanDerWaalsContact C-N 3.35Å; Y477-R479 PolarHBondContact O-N 2.76Å; Y477-Q480 PolarHBondContact O-N 3.08Å; Y477-R481 WeakPolarHBondContact O-CB 3.3Å; Y477-R481 WeakPolarHBondContact O-CG 3.43Å; Y477-R481 PolarHBondContact O-N 3.48Å; Y477-R481 VanDerWaalsContact O-N 3.1Å
478	G	70	Confident	78.8	Confident	2 Å²	2	65.2 Å²	65.2	2%	0.021	29%	0.291	C	S	.	.	H	α-helix	trans	-57.9	-44.2	-177.6	0	0	0	0	0	112.4	N475 R481 G482 R483	N475-G478 PolarHBondContact O-N 2.95Å; G478-R481 CarbonylContact O-C 3.37Å; G478-R481 WeakPolarHBondContact O-CA 3.45Å; G478-R481 PolarHBondContact O-N 3.04Å; G478-G482 PolarHBondContact O-N 3.03Å; G478-R483 CarbonylContact C-O 3.36Å; G478-R483 WeakPolarHBondContact CA-O 3.39Å; G478-R483 PolarHBondContact O-N 3.43Å
479	R	63.6	Low	79.3	Confident	175 Å²	175	65.7 Å²	65.7	66%	0.66	30%	0.299	S	S	*	.	H	α-helix	trans	-61	-47.4	178.7	-68.7	-172.1	-174.7	-169.7	2.2	112.7	E335 Y477 R481 G482	E335-R479 IonicContact OE1-CZ 3.62Å; E335-R479 IonicContact OE1-NH1 2.76Å; E335-R479 PolarHBondContact OE1-NH1 2.9Å; E335-R479 IonicContact OE1-NH2 3.75Å; E335-R479 PolarHBondContact OE1-NH2 2.8Å; E335-R479 IonicContact OE2-CZ 3.87Å; E335-R479 IonicContact OE2-NH1 2.66Å; E335-R479 PolarHBondContact OE2-NH1 2.85Å; E335-R479 IonicContact OE2-NH2 3.5Å; E335-R479 PolarHBondContact OE2-NH2 3.07Å; Y477-R479 VanDerWaalsContact C-N 3.35Å; Y477-R479 PolarHBondContact O-N 2.76Å; R479-R481 VanDerWaalsContact C-N 3.26Å; R479-R481 PolarHBondContact O-N 3.49Å; R479-G482 PolarHBondContact O-N 2.02Å
480	Q	70	Confident	80	Confident	144 Å²	144	61.3 Å²	61.3	67%	0.673	28%	0.279	S	S	*	.	H	α-helix	trans	-58.1	-43	175.9	-68.3	175.6	-5.4	0	0	110.7	Y477 G482 K517	Y477-Q480 PolarHBondContact O-N 3.08Å; Q480-G482 VanDerWaalsContact C-N 3.26Å; Q480-G482 PolarHBondContact O-N 2.77Å; Q480-K517 PolarHBondContact O-NZ 3.25Å
481	R	75.8	Confident	80.4	Confident	139 Å²	139	63.4 Å²	63.4	53%	0.525	29%	0.29	S	S	.	.	H	α-helix	trans	-75.4	-6.8	177.1	-66.3	178.8	174.5	128.3	2.7	114.2	Y477 G478 R479 R483	Y477-R481 WeakPolarHBondContact O-CB 3.3Å; Y477-R481 WeakPolarHBondContact O-CG 3.43Å; Y477-R481 PolarHBondContact O-N 3.48Å; Y477-R481 VanDerWaalsContact O-N 3.1Å; G478-R481 CarbonylContact O-C 3.37Å; G478-R481 WeakPolarHBondContact O-CA 3.45Å; G478-R481 PolarHBondContact O-N 3.04Å; R479-R481 VanDerWaalsContact C-N 3.26Å; R479-R481 PolarHBondContact O-N 3.49Å; R481-R483 VanDerWaalsContact C-N 3.34Å; R481-R483 HydrophobicContact CB-CG 3.97Å; R481-R483 PolarHBondContact O-N 2.94Å
482	G	80.2	Confident	81	Confident	5 Å²	5	66.3 Å²	66.3	5%	0.052	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.1	27.6	-179.8	0	0	0	0	0	114.9	G478 R479 Q480 L516 K517	G478-G482 PolarHBondContact O-N 3.03Å; R479-G482 PolarHBondContact O-N 2.02Å; Q480-G482 VanDerWaalsContact C-N 3.26Å; Q480-G482 PolarHBondContact O-N 2.77Å; G482-L516 PolarHBondContact O-N 3.28Å; G482-K517 PolarHBondContact O-N 3.03Å; G482-K517 VanDerWaalsContact O-N 3.15Å
483	R	85.7	Confident	81.9	Confident	52 Å²	52	63.1 Å²	63.1	20%	0.196	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	157.4	-178.8	61.9	166.6	-178.2	79.8	-5.1	111.6	M474 G478 R481 Y513 K514	M474-R483 PolarHBondContact O-NH1 3.03Å; M474-R483 VanDerWaalsContact O-NH1 3.15Å; G478-R483 CarbonylContact C-O 3.36Å; G478-R483 WeakPolarHBondContact CA-O 3.39Å; G478-R483 PolarHBondContact O-N 3.43Å; R481-R483 VanDerWaalsContact C-N 3.34Å; R481-R483 HydrophobicContact CB-CG 3.97Å; R481-R483 PolarHBondContact O-N 2.94Å; R483-Y513 HydrophobicContact CB-CE1 4.36Å; R483-Y513 HydrophobicContact CB-CE2 4.16Å; R483-Y513 WeakPolarHBondContact CB-OH 3.49Å; R483-Y513 WeakPolarHBondContact CD-OH 3.24Å; R483-Y513 HydrophobicContact CG-CE2 4.48Å; R483-K514 CarbonylContact C-O 3.56Å; R483-K514 WeakPolarHBondContact CA-O 3.13Å
484	M	83.7	Confident	82.8	Confident	75 Å²	75	63.1 Å²	63.1	37%	0.369	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	148.7	171.6	-174.1	172.9	-167.3	0	0	109.3	K514 L516	M484-K514 HydrophobicContact CB-CB 4.43Å; M484-K514 PolarHBondContact N-O 3.48Å; M484-K514 PolarHBondContact O-N 2.97Å; M484-L516 HydrophobicContact CB-CD1 4.12Å
485	V	87.7	Confident	83.3	Confident	4 Å²	4	61.5 Å²	61.5	2%	0.024	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	134.1	175.9	-174.7	0	0	0	0	108	I471 M474 N475 L511 M512 Y513	I471-V485 HydrophobicContact CD1-CG1 4.17Å; I471-V485 VanDerWaalsContact CG2-O 3.26Å; I471-V485 WeakPolarHBondContact CG2-O 3.39Å; M474-V485 HydrophobicContact CE-CB 4.48Å; M474-V485 HydrophobicContact CE-CG1 4.15Å; M474-V485 HydrophobicContact CE-CG2 4.15Å; N475-V485 PolarHBondContact ND2-O 3.2Å; N475-V485 PolarHBondContact OD1-N 2.77Å; N475-V485 PolarHBondContact OD1-O 3.22Å; V485-L511 HydrophobicContact CG1-CB 3.72Å; V485-L511 HydrophobicContact CG1-CD1 3.79Å; V485-L511 HydrophobicContact CG1-CG 4.23Å; V485-M512 CarbonylContact C-O 3.54Å; V485-M512 WeakPolarHBondContact CA-O 3.41Å; V485-Y513 HydrophobicContact CG2-CD2 4.05Å
486	E	87.1	Confident	83.6	Confident	56 Å²	56	61.4 Å²	61.4	26%	0.262	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	136.4	177.2	-66.1	171.5	-177.9	0	0	109.8	L511 M512 K514	E486-L511 CarbonylContact O-C 3.53Å; E486-L511 WeakPolarHBondContact O-CA 3.5Å; E486-M512 HydrophobicContact CB-CB 4.22Å; E486-M512 PolarHBondContact N-O 3.41Å; E486-M512 PolarHBondContact O-N 2.84Å; E486-K514 VanDerWaalsContact CD-CE 3.43Å; E486-K514 VanDerWaalsContact OE1-CE 3.3Å; E486-K514 WeakPolarHBondContact OE1-CE 3.43Å; E486-K514 IonicContact OE1-NZ 3.34Å; E486-K514 PolarHBondContact OE1-NZ 2.79Å; E486-K514 WeakPolarHBondContact OE2-CE 3.45Å; E486-K514 IonicContact OE2-NZ 2.87Å; E486-K514 PolarHBondContact OE2-NZ 3.08Å
487	Y	89.2	Confident	84.2	Confident	43 Å²	43	59.6 Å²	59.6	17%	0.169	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	131.1	173.9	174	-109.7	0	0	0	110.3	R464 A467 Y468 S489 T490 L509 L511	R464-Y487 HydrophobicContact CG-CE1 4.38Å; A467-Y487 HydrophobicContact CB-CD2 3.84Å; A467-Y487 HydrophobicContact CB-CE2 3.61Å; Y468-Y487 HydrophobicContact CD1-CD1 4.38Å; Y468-Y487 AromaticContact CE1-CD1 3.7Å; Y468-Y487 HydrophobicContact CE1-CD1 3.7Å; Y468-Y487 HydrophobicContact CE1-CG 4.25Å; Y468-Y487 AromaticContact CZ-CD1 3.98Å; Y487-S489 VanDerWaalsContact CE2-C 3.43Å; Y487-T490 PolarHBondContact OH-N 3.48Å; Y487-T490 PolarHBondContact OH-OG1 3.13Å; Y487-L509 HydrophobicContact CE2-CD2 4.23Å; Y487-L511 HydrophobicContact CD2-CD2 4.28Å
488	Q	90.9	Very high	84.8	Confident	92 Å²	92	57.4 Å²	57.4	43%	0.43	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	-58.5	171	-60.9	-68.1	-59.7	0	0	110.4	L510 M512 L524	Q488-L510 HydrophobicContact CB-CB 4.47Å; Q488-L510 HydrophobicContact CB-CD2 4.36Å; Q488-L510 HydrophobicContact CB-CG 4.23Å; Q488-L510 VanDerWaalsContact CB-O 3.28Å; Q488-L510 WeakPolarHBondContact CB-O 3.46Å; Q488-L510 PolarHBondContact N-O 3.24Å; Q488-M512 HydrophobicContact CG-CB 4.08Å; Q488-L524 HydrophobicContact CG-CD2 3.96Å
489	S	91.5	Very high	85.1	Confident	42 Å²	42	62 Å²	62	29%	0.294	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.7	153	-178.1	58.9	0	0	0	0	111.9	Y487 L510	Y487-S489 VanDerWaalsContact CE2-C 3.43Å; S489-L510 PolarHBondContact N-O 3.22Å; S489-L510 WeakPolarHBondContact O-CB 3.18Å; S489-L510 PolarHBondContact O-N 2.64Å
490	T	92.6	Very high	85.4	Confident	12 Å²	12	59.5 Å²	59.5	7%	0.074	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	117	161.5	-53.6	0	0	0	0	108.9	F437 V463 Y487 Y492 L507 L509	F437-T490 HydrophobicContact CE2-CG2 3.9Å; F437-T490 HydrophobicContact CZ-CG2 4.05Å; V463-T490 HydrophobicContact CG1-CG2 4.17Å; Y487-T490 PolarHBondContact OH-N 3.48Å; Y487-T490 PolarHBondContact OH-OG1 3.13Å; T490-Y492 WeakPolarHBondContact CG2-O 3.11Å; T490-L507 HydrophobicContact CG2-CD2 4.33Å; T490-L509 HydrophobicContact CG2-CD2 4.17Å; T490-L509 WeakPolarHBondContact OG1-CD2 3.43Å
491	L	92.8	Very high	85.6	Confident	58 Å²	58	53.9 Å²	53.9	30%	0.304	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	-53.3	179.9	-64.5	178.1	0	0	0	110.2	Q438 D508 L510 R526	Q438-L491 WeakPolarHBondContact CG-O 3.31Å; L491-D508 HydrophobicContact CB-CB 4.46Å; L491-D508 PolarHBondContact N-O 3.21Å; L491-L510 HydrophobicContact CD1-CB 4.47Å; L491-L510 HydrophobicContact CD2-CB 4.22Å; L491-L510 HydrophobicContact CD2-CD2 4.43Å; L491-L510 HydrophobicContact CG-CB 4.16Å; L491-R526 HydrophobicContact CD1-CG 4.07Å
492	Y	94.4	Very high	85.8	Confident	69 Å²	69	47.2 Å²	47.2	27%	0.271	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	172.7	172.4	66.5	-94.4	0	0	0	109.6	F436 F437 T490 Y494 D508 H528	F436-Y492 AromaticContact CE2-CD2 3.84Å; F436-Y492 HydrophobicContact CE2-CD2 3.84Å; F436-Y492 HydrophobicContact CE2-CG 4.05Å; F437-Y492 CarbonylContact O-C 3.54Å; F437-Y492 VanDerWaalsContact O-CA 3.24Å; F437-Y492 WeakPolarHBondContact O-CA 3.49Å; F437-Y492 VanDerWaalsContact O-CB 3.29Å; F437-Y492 WeakPolarHBondContact O-CB 3.06Å; T490-Y492 WeakPolarHBondContact CG2-O 3.11Å; Y492-Y494 HydrophobicContact CD2-CE2 4.09Å; Y492-Y494 AromaticContact CE2-CE2 3.91Å; Y492-Y494 HydrophobicContact CE2-CE2 3.91Å; Y492-D508 HydrophobicContact CD1-CB 3.96Å; Y492-D508 HydrophobicContact CD2-CB 4.33Å; Y492-D508 HydrophobicContact CE1-CB 3.74Å; Y492-D508 WeakPolarHBondContact CE1-OD2 3.28Å; Y492-D508 HydrophobicContact CE2-CB 4.11Å; Y492-D508 HydrophobicContact CG-CB 4.26Å; Y492-D508 PolarHBondContact O-N 2.92Å; Y492-H528 PolarHBondContact OH-CE1 3.12Å; Y492-H528 VanDerWaalsContact OH-CE1 3.28Å
493	G	94	Very high	86.2	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.7	-179.3	167.9	0	0	0	0	0	113.3	F436 F437 I506	F436-G493 WeakPolarHBondContact CD2-O 3.5Å; F437-G493 WeakPolarHBondContact CD1-O 3.35Å; F437-G493 PolarHBondContact N-O 2.84Å; F437-G493 PolarHBondContact O-N 3.06Å; G493-I506 CarbonylContact C-O 3.55Å; G493-I506 WeakPolarHBondContact CA-O 3.35Å
494	Y	91.9	Very high	86.3	Confident	82 Å²	82	45.6 Å²	45.6	32%	0.322	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	144.4	172.8	-56.3	-96	0	0	0	108.8	W434 Q435 F436 Y492 Y505 I506	W434-Y494 HydrophobicContact CB-CD1 4.31Å; Q435-Y494 CarbonylContact O-C 3.42Å; Q435-Y494 WeakPolarHBondContact O-CA 3.26Å; F436-Y494 HydrophobicContact CB-CD1 3.95Å; F436-Y494 HydrophobicContact CB-CE1 3.82Å; F436-Y494 AromaticContact CD2-CD1 4Å; F436-Y494 HydrophobicContact CD2-CD1 4Å; F436-Y494 AromaticContact CD2-CE1 3.49Å; F436-Y494 HydrophobicContact CD2-CE1 3.49Å; F436-Y494 VanDerWaalsContact CD2-CE1 3.49Å; F436-Y494 HydrophobicContact CD2-CE2 4.18Å; F436-Y494 AromaticContact CD2-CZ 3.58Å; F436-Y494 HydrophobicContact CE2-CE1 4.47Å; F436-Y494 HydrophobicContact CG-CD1 4.48Å; F436-Y494 HydrophobicContact CG-CE1 4.05Å; Y492-Y494 HydrophobicContact CD2-CE2 4.09Å; Y492-Y494 AromaticContact CE2-CE2 3.91Å; Y492-Y494 HydrophobicContact CE2-CE2 3.91Å; Y494-Y505 CarbonylContact O-C 2.99Å; Y494-Y505 VanDerWaalsContact O-CA 3.32Å; Y494-Y505 WeakPolarHBondContact O-CA 3.35Å; Y494-I506 HydrophobicContact CD2-CB 4.02Å; Y494-I506 HydrophobicContact CD2-CD1 4.3Å; Y494-I506 HydrophobicContact CD2-CG2 4.2Å; Y494-I506 HydrophobicContact CG-CD1 4.49Å; Y494-I506 PolarHBondContact N-O 3.45Å; Y494-I506 PolarHBondContact O-N 2.73Å
495	W	90	Very high	86.6	Confident	26 Å²	26	42.8 Å²	42.8	10%	0.098	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	154.6	165.8	72.2	72.6	0	0	0	111.6	Q435 F437 A442 M455 Q459 T503 D504 Y505	Q435-W495 HydrophobicContact CB-CD2 4.19Å; Q435-W495 HydrophobicContact CB-CG 4.32Å; Q435-W495 HydrophobicContact CB-CZ2 4.02Å; Q435-W495 PolarHBondContact N-O 3.45Å; Q435-W495 PolarHBondContact O-N 3.47Å; F437-W495 HydrophobicContact CB-CE3 4.31Å; F437-W495 HydrophobicContact CB-CH2 4.05Å; F437-W495 HydrophobicContact CB-CZ3 3.49Å; F437-W495 VanDerWaalsContact CB-CZ3 3.49Å; F437-W495 HydrophobicContact CD1-CD2 4.39Å; F437-W495 AromaticContact CD1-CE3 3.21Å; F437-W495 HydrophobicContact CD1-CE3 3.21Å; F437-W495 HydrophobicContact CD1-CH2 4.44Å; F437-W495 AromaticContact CD1-CZ3 3.24Å; F437-W495 HydrophobicContact CD1-CZ3 3.24Å; F437-W495 HydrophobicContact CD2-CZ3 4.41Å; F437-W495 AromaticContact CE1-CE3 3.65Å; F437-W495 HydrophobicContact CE1-CE3 3.65Å; F437-W495 HydrophobicContact CE1-CZ3 4.01Å; F437-W495 AromaticContact CG-CE3 3.96Å; F437-W495 HydrophobicContact CG-CE3 3.96Å; F437-W495 HydrophobicContact CG-CH2 4.47Å; F437-W495 AromaticContact CG-CZ3 3.47Å; F437-W495 HydrophobicContact CG-CZ3 3.47Å; F437-W495 VanDerWaalsContact CG-CZ3 3.47Å; A442-W495 HydrophobicContact CB-CH2 3.67Å; A442-W495 HydrophobicContact CB-CZ2 4.31Å; M455-W495 HydrophobicContact CE-CH2 4.31Å; M455-W495 HydrophobicContact CE-CZ3 3.72Å; M455-W495 HydrophobicContact CG-CH2 4.48Å; Q459-W495 VanDerWaalsContact NE2-CZ2 3.31Å; W495-T503 HydrophobicContact CB-CG2 4.45Å; W495-D504 WeakPolarHBondContact CA-O 3.47Å; W495-Y505 HydrophobicContact CB-CD1 3.82Å; W495-Y505 HydrophobicContact CB-CE1 3.96Å
496	R	87	Confident	86.9	Confident	32 Å²	32	44 Å²	44	12%	0.121	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	151.6	163.5	61.9	172.9	-177	-164.2	-2.4	109.3	W434 E498 T503 D504	W434-R496 HydrophobicContact CD2-CB 4.3Å; W434-R496 HydrophobicContact CD2-CG 4Å; W434-R496 HydrophobicContact CE3-CB 4.18Å; W434-R496 HydrophobicContact CE3-CG 3.92Å; W434-R496 HydrophobicContact CH2-CG 4.11Å; W434-R496 HydrophobicContact CZ2-CG 4.14Å; W434-R496 HydrophobicContact CZ3-CG 3.99Å; R496-E498 IonicContact NE-OE1 3.84Å; R496-T503 CarbonylContact O-C 3.13Å; R496-T503 WeakPolarHBondContact O-CA 3.03Å; R496-T503 WeakPolarHBondContact O-CG2 3.31Å; R496-D504 HydrophobicContact CG-CB 3.77Å; R496-D504 IonicContact CZ-OD2 2.6Å; R496-D504 VanDerWaalsContact CZ-OD2 3.28Å; R496-D504 PolarHBondContact N-O 2.66Å; R496-D504 VanDerWaalsContact N-O 3.08Å; R496-D504 IonicContact NE-OD2 3.91Å; R496-D504 PolarHBondContact NE-OD2 3.15Å; R496-D504 IonicContact NH2-OD2 2.81Å; R496-D504 PolarHBondContact NH2-OD2 3.31Å; R496-D504 PolarHBondContact O-N 2.66Å
497	V	84.1	Confident	87.2	Confident	70 Å²	70	41.3 Å²	41.3	42%	0.424	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	120.9	175.9	178.3	0	0	0	0	108	P499 T503 F535	V497-P499 WeakPolarHBondContact O-CD 3.17Å; V497-T503 HydrophobicContact CG2-CG2 4.16Å; V497-F535 HydrophobicContact CG1-CE2 4.22Å; V497-F535 HydrophobicContact CG1-CZ 3.73Å
498	E	78.7	Confident	87.5	Confident	28 Å²	28	39.2 Å²	39.2	13%	0.131	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	104.4	169.5	-71.1	-61.3	146.5	0	0	107.8	N432 R496 T500 V501 G502 F535	N432-E498 WeakPolarHBondContact CB-OE1 3.42Å; N432-E498 PolarHBondContact ND2-OE1 2.81Å; N432-E498 PolarHBondContact ND2-OE2 2.83Å; R496-E498 IonicContact NE-OE1 3.84Å; E498-T500 PolarHBondContact O-N 2.8Å; E498-V501 HydrophobicContact CB-CB 4.02Å; E498-V501 HydrophobicContact CB-CG2 4.47Å; E498-V501 PolarHBondContact O-N 3.19Å; E498-G502 PolarHBondContact N-O 3.1Å; E498-G502 PolarHBondContact O-N 2.79Å; E498-F535 WeakPolarHBondContact O-CE2 3.44Å
499	P	76	Confident	87.6	Confident	97 Å²	97	34.9 Å²	34.9	63%	0.63	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-30.3	-169.6	-28.5	35.9	0	0	0	115	V497	V497-P499 WeakPolarHBondContact O-CD 3.17Å
500	T	70.8	Confident	87.8	Confident	123 Å²	123	34.7 Å²	34.7	76%	0.755	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-6.5	-178.6	52.4	0	0	0	0	113.9	E498	E498-T500 PolarHBondContact O-N 2.8Å
501	V	73	Confident	87.9	Confident	26 Å²	26	34.3 Å²	34.3	16%	0.158	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130.6	-56.9	-169.9	-177.5	0	0	0	0	112	E498 R532 L534 F535	E498-V501 HydrophobicContact CB-CB 4.02Å; E498-V501 HydrophobicContact CB-CG2 4.47Å; E498-V501 PolarHBondContact O-N 3.19Å; V501-R532 HydrophobicContact CG1-CG 4.49Å; V501-L534 HydrophobicContact CG1-CD2 3.61Å; V501-L534 WeakPolarHBondContact O-CA 3.48Å; V501-F535 PolarHBondContact O-N 3.21Å
502	G	81.4	Confident	87.8	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	158	-158	-168.3	0	0	0	0	0	114	E498 Q533 F535	E498-G502 PolarHBondContact N-O 3.1Å; E498-G502 PolarHBondContact O-N 2.79Å; G502-Q533 CarbonylContact C-O 3.6Å; G502-Q533 WeakPolarHBondContact CA-O 3.31Å; G502-F535 VanDerWaalsContact CA-CD2 3.46Å
503	T	87.3	Confident	87.7	Confident	16 Å²	16	33.2 Å²	33.2	10%	0.098	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	126	177.4	-49.5	0	0	0	0	110.6	W495 R496 V497 Y505 Q533	W495-T503 HydrophobicContact CB-CG2 4.45Å; R496-T503 CarbonylContact O-C 3.13Å; R496-T503 WeakPolarHBondContact O-CA 3.03Å; R496-T503 WeakPolarHBondContact O-CG2 3.31Å; V497-T503 HydrophobicContact CG2-CG2 4.16Å; T503-Y505 HydrophobicContact CG2-CD2 4.14Å; T503-Y505 HydrophobicContact CG2-CE1 4Å; T503-Y505 HydrophobicContact CG2-CE2 3.42Å; T503-Y505 VanDerWaalsContact CG2-CE2 3.42Å; T503-Y505 WeakPolarHBondContact CG2-OH 3.5Å; T503-Q533 PolarHBondContact N-O 2.85Å; T503-Q533 PolarHBondContact O-N 3.28Å
504	D	88.6	Confident	87.5	Confident	7 Å²	7	36.5 Å²	36.5	4%	0.037	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	142.4	173	-65.3	-18	0	0	0	110.1	W434 W495 R496 R532	W434-D504 HydrophobicContact CH2-CB 3.54Å; W434-D504 HydrophobicContact CZ2-CB 4.34Å; W434-D504 HydrophobicContact CZ3-CB 3.94Å; W495-D504 WeakPolarHBondContact CA-O 3.47Å; R496-D504 HydrophobicContact CG-CB 3.77Å; R496-D504 IonicContact CZ-OD2 2.6Å; R496-D504 VanDerWaalsContact CZ-OD2 3.28Å; R496-D504 PolarHBondContact N-O 2.66Å; R496-D504 VanDerWaalsContact N-O 3.08Å; R496-D504 IonicContact NE-OD2 3.91Å; R496-D504 PolarHBondContact NE-OD2 3.15Å; R496-D504 IonicContact NH2-OD2 2.81Å; R496-D504 PolarHBondContact NH2-OD2 3.31Å; R496-D504 PolarHBondContact O-N 2.66Å; D504-R532 VanDerWaalsContact CG-NH2 3.32Å; D504-R532 WeakPolarHBondContact OD1-CG 3.46Å; D504-R532 IonicContact OD1-CZ 3.94Å; D504-R532 VanDerWaalsContact OD1-CZ 3.29Å; D504-R532 IonicContact OD1-NE 2.78Å; D504-R532 PolarHBondContact OD1-NE 3.09Å; D504-R532 IonicContact OD1-NH2 2.93Å; D504-R532 PolarHBondContact OD1-NH2 2.82Å; D504-R532 VanDerWaalsContact OD1-NH2 3.08Å; D504-R532 IonicContact OD2-CZ 2.73Å; D504-R532 IonicContact OD2-NE 3.82Å; D504-R532 IonicContact OD2-NH2 3.74Å; D504-R532 PolarHBondContact OD2-NH2 3.02Å
505	Y	90.7	Very high	87.2	Confident	16 Å²	16	38.9 Å²	38.9	6%	0.063	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	140	175.1	-57.6	-95.2	0	0	0	111.7	V463 I466 Y494 W495 T503 L507 Y530 L531 Q533	V463-Y505 HydrophobicContact CG2-CD1 4.47Å; V463-Y505 HydrophobicContact CG2-CE1 4.21Å; I466-Y505 HydrophobicContact CD1-CD1 4.33Å; I466-Y505 HydrophobicContact CD1-CD2 3.67Å; I466-Y505 HydrophobicContact CD1-CE1 3.95Å; I466-Y505 HydrophobicContact CD1-CE2 3.2Å; I466-Y505 HydrophobicContact CD1-CG 4.19Å; Y494-Y505 CarbonylContact O-C 2.99Å; Y494-Y505 VanDerWaalsContact O-CA 3.32Å; Y494-Y505 WeakPolarHBondContact O-CA 3.35Å; W495-Y505 HydrophobicContact CB-CD1 3.82Å; W495-Y505 HydrophobicContact CB-CE1 3.96Å; T503-Y505 HydrophobicContact CG2-CD2 4.14Å; T503-Y505 HydrophobicContact CG2-CE1 4Å; T503-Y505 HydrophobicContact CG2-CE2 3.42Å; T503-Y505 VanDerWaalsContact CG2-CE2 3.42Å; T503-Y505 WeakPolarHBondContact CG2-OH 3.5Å; Y505-L507 HydrophobicContact CD1-CD2 4.4Å; Y505-Y530 WeakPolarHBondContact O-CA 3.27Å; Y505-L531 HydrophobicContact CD2-CD1 3.67Å; Y505-L531 HydrophobicContact CD2-CG 4.45Å; Y505-L531 HydrophobicContact CE2-CD1 4.5Å; Y505-L531 HydrophobicContact CG-CD1 4.25Å; Y505-L531 PolarHBondContact N-O 3Å; Y505-L531 PolarHBondContact O-N 3.24Å; Y505-Q533 HydrophobicContact CE2-CB 4.11Å
506	I	92.3	Very high	86.7	Confident	28 Å²	28	41.4 Å²	41.4	14%	0.144	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	114.7	162.5	-53	175.4	0	0	0	105.7	W434 G493 Y494 V529 Y530	W434-I506 HydrophobicContact CD2-CD1 4.41Å; W434-I506 HydrophobicContact CE3-CD1 4.29Å; W434-I506 HydrophobicContact CE3-CG1 4.42Å; W434-I506 HydrophobicContact CH2-CD1 3.84Å; W434-I506 HydrophobicContact CH2-CG1 3.64Å; W434-I506 HydrophobicContact CZ2-CD1 4Å; W434-I506 HydrophobicContact CZ2-CG1 4.3Å; W434-I506 HydrophobicContact CZ3-CD1 4.01Å; W434-I506 HydrophobicContact CZ3-CG1 3.73Å; G493-I506 CarbonylContact C-O 3.55Å; G493-I506 WeakPolarHBondContact CA-O 3.35Å; Y494-I506 HydrophobicContact CD2-CB 4.02Å; Y494-I506 HydrophobicContact CD2-CD1 4.3Å; Y494-I506 HydrophobicContact CD2-CG2 4.2Å; Y494-I506 HydrophobicContact CG-CD1 4.49Å; Y494-I506 PolarHBondContact N-O 3.45Å; Y494-I506 PolarHBondContact O-N 2.73Å; I506-V529 WeakPolarHBondContact CA-O 3.49Å; I506-Y530 HydrophobicContact CB-CD1 4.32Å; I506-Y530 HydrophobicContact CB-CE1 4.22Å; I506-Y530 HydrophobicContact CD1-CD1 4.16Å; I506-Y530 HydrophobicContact CD1-CE1 3.73Å; I506-Y530 HydrophobicContact CG1-CD1 3.65Å; I506-Y530 HydrophobicContact CG1-CE1 3.65Å; I506-Y530 HydrophobicContact CG2-CD1 4.13Å; I506-Y530 HydrophobicContact CG2-CE1 3.67Å
507	L	94.2	Very high	86.2	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	129.1	-176.4	-57	-178.6	0	0	0	110.2	F437 V463 I466 I470 T490 Y505 L509 H528 V529 L531	F437-L507 HydrophobicContact CE1-CD2 4.09Å; F437-L507 HydrophobicContact CZ-CD2 3.65Å; V463-L507 HydrophobicContact CG1-CD2 4.1Å; I466-L507 HydrophobicContact CG2-CD1 3.74Å; I470-L507 HydrophobicContact CD1-CD1 4.38Å; T490-L507 HydrophobicContact CG2-CD2 4.33Å; Y505-L507 HydrophobicContact CD1-CD2 4.4Å; L507-L509 HydrophobicContact CB-CD2 3.83Å; L507-L509 HydrophobicContact CB-CG 4.08Å; L507-L509 HydrophobicContact CD1-CD2 4.3Å; L507-H528 CarbonylContact O-C 3.57Å; L507-H528 VanDerWaalsContact O-CA 3.32Å; L507-H528 WeakPolarHBondContact O-CA 3.4Å; L507-V529 PolarHBondContact N-O 3.03Å; L507-V529 PolarHBondContact O-N 2.78Å; L507-L531 HydrophobicContact CD1-CD2 4.02Å
508	D	95	Very high	85.9	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	104.5	164.4	-175.2	1.2	0	0	0	109.4	L491 Y492 R526 H528	L491-D508 HydrophobicContact CB-CB 4.46Å; L491-D508 PolarHBondContact N-O 3.21Å; Y492-D508 HydrophobicContact CD1-CB 3.96Å; Y492-D508 HydrophobicContact CD2-CB 4.33Å; Y492-D508 HydrophobicContact CE1-CB 3.74Å; Y492-D508 WeakPolarHBondContact CE1-OD2 3.28Å; Y492-D508 HydrophobicContact CE2-CB 4.11Å; Y492-D508 HydrophobicContact CG-CB 4.26Å; Y492-D508 PolarHBondContact O-N 2.92Å; D508-R526 IonicContact OD1-NE 2.66Å; D508-R526 IonicContact OD2-CZ 3.69Å; D508-R526 IonicContact OD2-NE 2.73Å; D508-R526 PolarHBondContact OD2-NE 3.02Å; D508-R526 IonicContact OD2-NH2 2.78Å; D508-R526 PolarHBondContact OD2-NH2 2.77Å; D508-H528 IonicContact OD1-CE1 3.95Å; D508-H528 IonicContact OD2-CE1 2.79Å; D508-H528 PolarHBondContact OD2-CE1 3.5Å; D508-H528 IonicContact OD2-NE2 3.76Å
509	L	94.3	Very high	86	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	128.2	-175.1	-55	179.9	0	0	0	110.5	A467 I470 Y487 T490 L507 L511 R526 R527 V529	A467-L509 HydrophobicContact CB-CD2 4.17Å; I470-L509 HydrophobicContact CD1-CD1 4.09Å; I470-L509 HydrophobicContact CG2-CD1 4.44Å; Y487-L509 HydrophobicContact CE2-CD2 4.23Å; T490-L509 HydrophobicContact CG2-CD2 4.17Å; T490-L509 WeakPolarHBondContact OG1-CD2 3.43Å; L507-L509 HydrophobicContact CB-CD2 3.83Å; L507-L509 HydrophobicContact CB-CG 4.08Å; L507-L509 HydrophobicContact CD1-CD2 4.3Å; L509-L511 HydrophobicContact CB-CD2 3.82Å; L509-L511 HydrophobicContact CB-CG 4.09Å; L509-R526 CarbonylContact O-C 3.55Å; L509-R526 WeakPolarHBondContact O-CA 3.39Å; L509-R527 PolarHBondContact N-O 2.92Å; L509-R527 PolarHBondContact O-N 3.09Å; L509-V529 HydrophobicContact CD1-CG2 3.99Å
510	L	94.9	Very high	86.3	Confident	39 Å²	39	58.3 Å²	58.3	20%	0.204	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	120	164.7	-175	66	0	0	0	109	Q488 S489 L491 L524 R526	Q488-L510 HydrophobicContact CB-CB 4.47Å; Q488-L510 HydrophobicContact CB-CD2 4.36Å; Q488-L510 HydrophobicContact CB-CG 4.23Å; Q488-L510 VanDerWaalsContact CB-O 3.28Å; Q488-L510 WeakPolarHBondContact CB-O 3.46Å; Q488-L510 PolarHBondContact N-O 3.24Å; S489-L510 PolarHBondContact N-O 3.22Å; S489-L510 WeakPolarHBondContact O-CB 3.18Å; S489-L510 PolarHBondContact O-N 2.64Å; L491-L510 HydrophobicContact CD1-CB 4.47Å; L491-L510 HydrophobicContact CD2-CB 4.22Å; L491-L510 HydrophobicContact CD2-CD2 4.43Å; L491-L510 HydrophobicContact CG-CB 4.16Å; L510-L524 HydrophobicContact CD1-CB 4.26Å; L510-L524 HydrophobicContact CD1-CD2 4.39Å; L510-L524 HydrophobicContact CG-CD2 4.33Å; L510-R526 HydrophobicContact CD1-CG 3.99Å
511	L	93.8	Very high	87.1	Confident	3 Å²	3	55.5 Å²	55.5	2%	0.016	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	146.7	-173.1	-52.2	-179.3	0	0	0	110.5	I471 M474 V485 E486 Y487 L509 L524 V525 R527	I471-L511 HydrophobicContact CD1-CD1 3.95Å; I471-L511 HydrophobicContact CD1-CD2 3.57Å; I471-L511 HydrophobicContact CD1-CG 4.39Å; I471-L511 HydrophobicContact CG1-CD2 4.3Å; M474-L511 HydrophobicContact CE-CD1 4.11Å; M474-L511 HydrophobicContact SD-CD1 4.22Å; V485-L511 HydrophobicContact CG1-CB 3.72Å; V485-L511 HydrophobicContact CG1-CD1 3.79Å; V485-L511 HydrophobicContact CG1-CG 4.23Å; E486-L511 CarbonylContact O-C 3.53Å; E486-L511 WeakPolarHBondContact O-CA 3.5Å; Y487-L511 HydrophobicContact CD2-CD2 4.28Å; L509-L511 HydrophobicContact CB-CD2 3.82Å; L509-L511 HydrophobicContact CB-CG 4.09Å; L511-L524 CarbonylContact O-C 3.59Å; L511-L524 WeakPolarHBondContact O-CA 3.5Å; L511-V525 PolarHBondContact N-O 3.49Å; L511-V525 PolarHBondContact O-N 3.49Å; L511-R527 HydrophobicContact CD1-CB 4.12Å; L511-R527 HydrophobicContact CD1-CG 4.09Å
512	M	92.6	Very high	88	Confident	37 Å²	37	58.2 Å²	58.2	18%	0.182	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	110.6	169.9	-176.8	67.8	72.8	0	0	109.3	V485 E486 Q488 K514 L524	V485-M512 CarbonylContact C-O 3.54Å; V485-M512 WeakPolarHBondContact CA-O 3.41Å; E486-M512 HydrophobicContact CB-CB 4.22Å; E486-M512 PolarHBondContact N-O 3.41Å; E486-M512 PolarHBondContact O-N 2.84Å; Q488-M512 HydrophobicContact CG-CB 4.08Å; M512-K514 HydrophobicContact CG-CG 4.19Å; M512-L524 HydrophobicContact CB-CD2 4.41Å; M512-L524 HydrophobicContact CE-CD2 3.47Å; M512-L524 VanDerWaalsContact CE-CD2 3.47Å; M512-L524 HydrophobicContact CE-CG 3.91Å; M512-L524 HydrophobicContact SD-CD2 4.07Å; M512-L524 HydrophobicContact SD-CG 4.34Å
513	Y	91.3	Very high	88.6	Confident	67 Å²	67	63 Å²	63	26%	0.263	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	120.4	174.1	-175.6	-80.1	0	0	0	109.9	R483 V485 R515 S522 M523	R483-Y513 HydrophobicContact CB-CE1 4.36Å; R483-Y513 HydrophobicContact CB-CE2 4.16Å; R483-Y513 WeakPolarHBondContact CB-OH 3.49Å; R483-Y513 WeakPolarHBondContact CD-OH 3.24Å; R483-Y513 HydrophobicContact CG-CE2 4.48Å; V485-Y513 HydrophobicContact CG2-CD2 4.05Å; Y513-R515 HydrophobicContact CE1-CB 4.28Å; Y513-S522 CarbonylContact O-C 3.54Å; Y513-S522 VanDerWaalsContact O-CA 3.3Å; Y513-S522 WeakPolarHBondContact O-CA 3.47Å; Y513-M523 HydrophobicContact CD1-CE 3.52Å; Y513-M523 HydrophobicContact CD1-CG 4.27Å; Y513-M523 HydrophobicContact CD2-CE 4.47Å; Y513-M523 HydrophobicContact CE1-CE 4Å; Y513-M523 HydrophobicContact CG-CE 3.79Å; Y513-M523 HydrophobicContact CG-CG 4.47Å; Y513-M523 PolarHBondContact N-O 2.97Å; Y513-M523 PolarHBondContact O-N 3.47Å
514	K	88.9	Confident	89	Confident	69 Å²	69	67 Å²	67	30%	0.3	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	117.6	176.8	-64.9	-176.6	179.8	173.1	0	110.3	R483 M484 E486 M512	R483-K514 CarbonylContact C-O 3.56Å; R483-K514 WeakPolarHBondContact CA-O 3.13Å; M484-K514 HydrophobicContact CB-CB 4.43Å; M484-K514 PolarHBondContact N-O 3.48Å; M484-K514 PolarHBondContact O-N 2.97Å; E486-K514 VanDerWaalsContact CD-CE 3.43Å; E486-K514 VanDerWaalsContact OE1-CE 3.3Å; E486-K514 WeakPolarHBondContact OE1-CE 3.43Å; E486-K514 IonicContact OE1-NZ 3.34Å; E486-K514 PolarHBondContact OE1-NZ 2.79Å; E486-K514 WeakPolarHBondContact OE2-CE 3.45Å; E486-K514 IonicContact OE2-NZ 2.87Å; E486-K514 PolarHBondContact OE2-NZ 3.08Å; M512-K514 HydrophobicContact CG-CG 4.19Å
515	R	86.3	Confident	89.3	Confident	132 Å²	132	68.4 Å²	68.4	50%	0.498	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	121.4	171.2	-172.2	178	177.1	165.2	3.2	109.3	Y513 K517 R520 T521	Y513-R515 HydrophobicContact CE1-CB 4.28Å; R515-K517 WeakPolarHBondContact CG-O 3.42Å; R515-K517 PolarHBondContact NE-O 3.47Å; R515-R520 WeakPolarHBondContact O-CA 3.47Å; R515-T521 WeakPolarHBondContact CB-OG1 3.4Å; R515-T521 PolarHBondContact N-O 2.66Å
516	L	79.4	Confident	89.4	Confident	80 Å²	80	74.1 Å²	74.1	42%	0.419	36%	0.359	S	S	.	.			trans	-100	-26.7	-177.7	-58.2	178.3	0	0	0	112.8	G482 M484	G482-L516 PolarHBondContact O-N 3.28Å; M484-L516 HydrophobicContact CB-CD1 4.12Å
517	K	76.5	Confident	89.4	Confident	125 Å²	125	79.9 Å²	79.9	54%	0.543	38%	0.379	S	S	.	.	S	Bend	trans	-95.6	125.9	175.3	-75.7	-177.7	-178.5	173.6	0	111.9	Q480 G482 R515	Q480-K517 PolarHBondContact O-NZ 3.25Å; G482-K517 PolarHBondContact O-N 3.03Å; G482-K517 VanDerWaalsContact O-N 3.15Å; R515-K517 WeakPolarHBondContact CG-O 3.42Å; R515-K517 PolarHBondContact NE-O 3.47Å
518	G	78.3	Confident	89.3	Confident	65 Å²	65	84 Å²	84	67%	0.67	40%	0.398	S	S	*	.	S	Bend	trans	89.1	-144.6	-178.2	0	0	0	0	0	112.3	R520	G518-R520 PolarHBondContact O-N 3.39Å; G518-R520 VanDerWaalsContact O-N 3.15Å
519	K	81.3	Confident	88.9	Confident	179 Å²	179	84.6 Å²	84.6	78%	0.778	40%	0.402	S	S	*	.	S	Bend	trans	-63.8	116	173.4	-169.4	174.5	-176.9	177.3	0	108.8	T521	K519-T521 HydrophobicContact CG-CG2 4.38Å; K519-T521 PolarHBondContact O-N 3.04Å
520	R	81.1	Confident	88.6	Confident	212 Å²	212	88.9 Å²	88.9	80%	0.8	42%	0.419	S	S	*	.			trans	-61.7	120.5	175.8	-69.7	-176.3	178.9	-178.3	0.3	108.8	R515 G518	R515-R520 WeakPolarHBondContact O-CA 3.47Å; G518-R520 PolarHBondContact O-N 3.39Å; G518-R520 VanDerWaalsContact O-N 3.15Å
521	T	88.7	Confident	88.1	Confident	65 Å²	65	88.1 Å²	88.1	40%	0.399	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	137.3	178.5	55.9	0	0	0	0	109.3	R515 K519	R515-T521 WeakPolarHBondContact CB-OG1 3.4Å; R515-T521 PolarHBondContact N-O 2.66Å; K519-T521 HydrophobicContact CG-CG2 4.38Å; K519-T521 PolarHBondContact O-N 3.04Å
522	S	91.1	Very high	87.5	Confident	83 Å²	83	91 Å²	91	58%	0.58	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113	132.9	172.1	52.4	0	0	0	0	109.2	Y513	Y513-S522 CarbonylContact O-C 3.54Å; Y513-S522 VanDerWaalsContact O-CA 3.3Å; Y513-S522 WeakPolarHBondContact O-CA 3.47Å
523	M	93.6	Very high	86.8	Confident	100 Å²	100	93.1 Å²	93.1	49%	0.493	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	143.3	176.1	62.7	-177	-177	0	0	110.6	Y513 V525	Y513-M523 HydrophobicContact CD1-CE 3.52Å; Y513-M523 HydrophobicContact CD1-CG 4.27Å; Y513-M523 HydrophobicContact CD2-CE 4.47Å; Y513-M523 HydrophobicContact CE1-CE 4Å; Y513-M523 HydrophobicContact CG-CE 3.79Å; Y513-M523 HydrophobicContact CG-CG 4.47Å; Y513-M523 PolarHBondContact N-O 2.97Å; Y513-M523 PolarHBondContact O-N 3.47Å; M523-V525 HydrophobicContact CE-CG2 4.11Å; M523-V525 HydrophobicContact CG-CG2 4.02Å
524	L	96.8	Very high	86	Confident	101 Å²	101	94.2 Å²	94.2	53%	0.529	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	134.6	171.9	-71.3	171.9	0	0	0	109.8	Q488 L510 L511 M512	Q488-L524 HydrophobicContact CG-CD2 3.96Å; L510-L524 HydrophobicContact CD1-CB 4.26Å; L510-L524 HydrophobicContact CD1-CD2 4.39Å; L510-L524 HydrophobicContact CG-CD2 4.33Å; L511-L524 CarbonylContact O-C 3.59Å; L511-L524 WeakPolarHBondContact O-CA 3.5Å; M512-L524 HydrophobicContact CB-CD2 4.41Å; M512-L524 HydrophobicContact CE-CD2 3.47Å; M512-L524 VanDerWaalsContact CE-CD2 3.47Å; M512-L524 HydrophobicContact CE-CG 3.91Å; M512-L524 HydrophobicContact SD-CD2 4.07Å; M512-L524 HydrophobicContact SD-CG 4.34Å
525	V	94	Very high	85.2	Confident	36 Å²	36	95.9 Å²	95.9	22%	0.218	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	133.5	-178.2	-177.3	0	0	0	0	108.5	L511 M523 R527	L511-V525 PolarHBondContact N-O 3.49Å; L511-V525 PolarHBondContact O-N 3.49Å; M523-V525 HydrophobicContact CE-CG2 4.11Å; M523-V525 HydrophobicContact CG-CG2 4.02Å; V525-R527 HydrophobicContact CG1-CG 4.34Å
526	R	94.3	Very high	84.3	Confident	136 Å²	136	94 Å²	94	51%	0.513	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	140.7	170.1	-71.3	175.2	66.1	-170.6	2.9	110.3	L491 D508 L509 L510	L491-R526 HydrophobicContact CD1-CG 4.07Å; D508-R526 IonicContact OD1-NE 2.66Å; D508-R526 IonicContact OD2-CZ 3.69Å; D508-R526 IonicContact OD2-NE 2.73Å; D508-R526 PolarHBondContact OD2-NE 3.02Å; D508-R526 IonicContact OD2-NH2 2.78Å; D508-R526 PolarHBondContact OD2-NH2 2.77Å; L509-R526 CarbonylContact O-C 3.55Å; L509-R526 WeakPolarHBondContact O-CA 3.39Å; L510-R526 HydrophobicContact CD1-CG 3.99Å
527	R	91.9	Very high	83.4	Confident	148 Å²	148	92.4 Å²	92.4	56%	0.558	45%	0.446	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.3	123.2	175.1	-74.4	-63.9	176.7	179.5	-4.5	110.7	L509 L511 V525	L509-R527 PolarHBondContact N-O 2.92Å; L509-R527 PolarHBondContact O-N 3.09Å; L511-R527 HydrophobicContact CD1-CB 4.12Å; L511-R527 HydrophobicContact CD1-CG 4.09Å; V525-R527 HydrophobicContact CG1-CG 4.34Å
528	H	90.9	Very high	82.7	Confident	87 Å²	87	94.7 Å²	94.7	40%	0.403	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	128	166.4	-61.3	-77.5	0	0	0	108.9	Y492 L507 D508	Y492-H528 PolarHBondContact OH-CE1 3.12Å; Y492-H528 VanDerWaalsContact OH-CE1 3.28Å; L507-H528 CarbonylContact O-C 3.57Å; L507-H528 VanDerWaalsContact O-CA 3.32Å; L507-H528 WeakPolarHBondContact O-CA 3.4Å; D508-H528 IonicContact OD1-CE1 3.95Å; D508-H528 IonicContact OD2-CE1 2.79Å; D508-H528 PolarHBondContact OD2-CE1 3.5Å; D508-H528 IonicContact OD2-NE2 3.76Å
529	V	87.5	Confident	81.6	Confident	12 Å²	12	98.6 Å²	98.6	7%	0.073	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	131.5	179.1	-170.5	0	0	0	0	109.2	I470 I506 L507 L509 L531	I470-V529 HydrophobicContact CD1-CB 4.44Å; I470-V529 HydrophobicContact CD1-CG1 4.07Å; I506-V529 WeakPolarHBondContact CA-O 3.49Å; L507-V529 PolarHBondContact N-O 3.03Å; L507-V529 PolarHBondContact O-N 2.78Å; L509-V529 HydrophobicContact CD1-CG2 3.99Å; V529-L531 HydrophobicContact CG1-CD2 4.12Å
530	Y	87.3	Confident	80.5	Confident	91 Å²	91	94.7 Å²	94.7	36%	0.357	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	128.6	170.8	-60.6	-91.4	0	0	0	108.1	Y505 I506	Y505-Y530 WeakPolarHBondContact O-CA 3.27Å; I506-Y530 HydrophobicContact CB-CD1 4.32Å; I506-Y530 HydrophobicContact CB-CE1 4.22Å; I506-Y530 HydrophobicContact CD1-CD1 4.16Å; I506-Y530 HydrophobicContact CD1-CE1 3.73Å; I506-Y530 HydrophobicContact CG1-CD1 3.65Å; I506-Y530 HydrophobicContact CG1-CE1 3.65Å; I506-Y530 HydrophobicContact CG2-CD1 4.13Å; I506-Y530 HydrophobicContact CG2-CE1 3.67Å
531	L	84.1	Confident	79.3	Confident	22 Å²	22	89.7 Å²	89.7	12%	0.115	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	155.4	177.9	65.4	105.7	0	0	0	111.3	I466 I470 Y505 L507 V529	I466-L531 HydrophobicContact CD1-CD1 4.28Å; I466-L531 HydrophobicContact CG1-CD1 4.49Å; I466-L531 HydrophobicContact CG2-CD1 3.52Å; I466-L531 HydrophobicContact CG2-CD2 3.46Å; I466-L531 VanDerWaalsContact CG2-CD2 3.46Å; I466-L531 HydrophobicContact CG2-CG 4.12Å; I470-L531 HydrophobicContact CD1-CD2 3.37Å; I470-L531 HydrophobicContact CG1-CD2 4.21Å; Y505-L531 HydrophobicContact CD2-CD1 3.67Å; Y505-L531 HydrophobicContact CD2-CG 4.45Å; Y505-L531 HydrophobicContact CE2-CD1 4.5Å; Y505-L531 HydrophobicContact CG-CD1 4.25Å; Y505-L531 PolarHBondContact N-O 3Å; Y505-L531 PolarHBondContact O-N 3.24Å; L507-L531 HydrophobicContact CD1-CD2 4.02Å; V529-L531 HydrophobicContact CG1-CD2 4.12Å
532	R	81.1	Confident	77.7	Confident	63 Å²	63	94.6 Å²	94.6	24%	0.238	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	118.7	176.8	171	169.6	-75.7	-179.4	-2	108.5	V501 D504 L534	V501-R532 HydrophobicContact CG1-CG 4.49Å; D504-R532 VanDerWaalsContact CG-NH2 3.32Å; D504-R532 WeakPolarHBondContact OD1-CG 3.46Å; D504-R532 IonicContact OD1-CZ 3.94Å; D504-R532 VanDerWaalsContact OD1-CZ 3.29Å; D504-R532 IonicContact OD1-NE 2.78Å; D504-R532 PolarHBondContact OD1-NE 3.09Å; D504-R532 IonicContact OD1-NH2 2.93Å; D504-R532 PolarHBondContact OD1-NH2 2.82Å; D504-R532 VanDerWaalsContact OD1-NH2 3.08Å; D504-R532 IonicContact OD2-CZ 2.73Å; D504-R532 IonicContact OD2-NE 3.82Å; D504-R532 IonicContact OD2-NH2 3.74Å; D504-R532 PolarHBondContact OD2-NH2 3.02Å; R532-L534 HydrophobicContact CG-CD2 4.01Å
533	Q	78.7	Confident	75.6	Confident	82 Å²	82	94.1 Å²	94.1	38%	0.383	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	107.4	170.5	-174.4	176.2	30.4	0	0	108.2	G502 T503 Y505	G502-Q533 CarbonylContact C-O 3.6Å; G502-Q533 WeakPolarHBondContact CA-O 3.31Å; T503-Q533 PolarHBondContact N-O 2.85Å; T503-Q533 PolarHBondContact O-N 3.28Å; Y505-Q533 HydrophobicContact CE2-CB 4.11Å
534	L	75	Confident	73.2	Confident	91 Å²	91	96 Å²	96	48%	0.476	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	146.5	178	-63	175.3	0	0	0	110.6	V501 R532	V501-L534 HydrophobicContact CG1-CD2 3.61Å; V501-L534 WeakPolarHBondContact O-CA 3.48Å; R532-L534 HydrophobicContact CG-CD2 4.01Å
535	F	71.6	Confident	70.7	Confident	103 Å²	103	95.2 Å²	95.2	45%	0.452	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-67.3	142.1	162.5	-66.1	-47.9	0	0	0	109.3	V497 E498 V501 G502	V497-F535 HydrophobicContact CG1-CE2 4.22Å; V497-F535 HydrophobicContact CG1-CZ 3.73Å; E498-F535 WeakPolarHBondContact O-CE2 3.44Å; V501-F535 PolarHBondContact O-N 3.21Å; G502-F535 VanDerWaalsContact CA-CD2 3.46Å
536	L	68.2	Low	68.4	Low	94 Å²	94	99.5 Å²	99.5	49%	0.492	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-62.2	154.3	163.3	-70.6	170	0	0	0	108.8	Y390 L538	Y390-L536 HydrophobicContact CD1-CD2 3.73Å; Y390-L536 HydrophobicContact CD2-CD2 4.37Å; Y390-L536 HydrophobicContact CE1-CD2 4.08Å; Y390-L536 HydrophobicContact CG-CD2 3.91Å; L536-L538 PolarHBondContact O-N 3.48Å
537	P	60.1	Low	66.2	Low	46 Å²	46	94.8 Å²	94.8	30%	0.299	50%	0.504	S	S	.	.	P	Polyproline II helix	trans	-49.3	142.2	169.8	-25.5	33.8	0	0	0	110.2	Y390 Q539	Y390-P537 HydrophobicContact CE2-CG 3.94Å; Y390-P537 WeakPolarHBondContact OH-CD 3.3Å; Y390-P537 WeakPolarHBondContact OH-CG 3.35Å; P537-Q539 PolarHBondContact O-N 3.14Å
538	L	62.1	Low	64.1	Low	172 Å²	172	91.9 Å²	91.9	90%	0.901	50%	0.497	S	S	*	.			trans	-55.7	112.7	174.8	-178.5	68.7	0	0	0	108.7	L536	L536-L538 PolarHBondContact O-N 3.48Å
539	Q	55.2	Low	61.8	Low	148 Å²	148	92.7 Å²	92.7	69%	0.692	51%	0.51	S	S	*	.			trans	-105.7	104.4	169.5	-71.1	-171.4	-11.9	0	0	107.2	P537	P537-Q539 PolarHBondContact O-N 3.14Å
540	A	57.2	Low	59.8	Low	97 Å²	97	97.2 Å²	97.2	80%	0.802	55%	0.548	S	S	*	.			trans	-82.3	114.6	164.2	0	0	0	0	0	107
541	T	56	Low	58.1	Low	107 Å²	107	96.9 Å²	96.9	66%	0.656	55%	0.553	S	S	*	*			trans	-95.2	143.5	163.1	53.6	0	0	0	0	107.6	A543	T541-A543 PolarHBondContact O-N 2.87Å
542	D	55.3	Low	56.6	Low	167 Å²	167	99.5 Å²	99.5	89%	0.893	58%	0.578	S	S	*	*			trans	-67.4	65.4	157.3	-62.3	-29.5	0	0	0	107.9	I544	D542-I544 PolarHBondContact O-N 2.86Å
543	A	46.3	Very low	55.4	Low	73 Å²	73	104 Å²	104	60%	0.603	61%	0.606	S	S	*	*			trans	-69.3	88.8	162.3	0	0	0	0	0	104	T541 D545	T541-A543 PolarHBondContact O-N 2.87Å; A543-D545 PolarHBondContact O-N 3.47Å
544	I	42.9	Very low	55.1	Low	141 Å²	141	103.6 Å²	103.6	72%	0.723	61%	0.607	S	S	*	*			trans	-53.3	103.4	156.5	-58.3	172	0	0	0	103	D542 T546	D542-I544 PolarHBondContact O-N 2.86Å; I544-T546 HydrophobicContact CG2-CG2 4.07Å; I544-T546 PolarHBondContact O-N 3.13Å
545	D	45.6	Very low	55.3	Low	83 Å²	83	100.6 Å²	100.6	44%	0.444	59%	0.592	S	S	.	*			trans	-69.5	84.2	177.2	-165.6	-7.2	0	0	0	106.6	A543 S547 H548	A543-D545 PolarHBondContact O-N 3.47Å; D545-S547 PolarHBondContact O-N 3.09Å; D545-S547 WeakPolarHBondContact OD1-CB 3.5Å; D545-S547 PolarHBondContact OD1-N 3.24Å; D545-S547 VanDerWaalsContact OD1-N 3.08Å; D545-S547 PolarHBondContact OD1-OG 2.94Å; D545-H548 PolarHBondContact O-N 2.81Å; D545-H548 VanDerWaalsContact O-N 3.11Å; D545-H548 IonicContact OD2-CD2 3.08Å; D545-H548 PolarHBondContact OD2-CD2 3.37Å; D545-H548 IonicContact OD2-NE2 3.88Å; D545-H548 PolarHBondContact OD2-NE2 3.35Å
546	T	45.8	Very low	55.8	Low	127 Å²	127	99.5 Å²	99.5	78%	0.779	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	-5.1	174.4	51.7	0	0	0	0	111.3	I544	I544-T546 HydrophobicContact CG2-CG2 4.07Å; I544-T546 PolarHBondContact O-N 3.13Å
547	S	47.8	Very low	56.6	Low	36 Å²	36	100.2 Å²	100.2	25%	0.252	60%	0.595	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.3	-18.4	173.8	85.7	0	0	0	0	113.7	D545	D545-S547 PolarHBondContact O-N 3.09Å; D545-S547 WeakPolarHBondContact OD1-CB 3.5Å; D545-S547 PolarHBondContact OD1-N 3.24Å; D545-S547 VanDerWaalsContact OD1-N 3.08Å; D545-S547 PolarHBondContact OD1-OG 2.94Å
548	H	46.8	Very low	58.1	Low	88 Å²	88	100.2 Å²	100.2	41%	0.407	59%	0.594	S	S	.	*	S	Bend	trans	-87.6	120.3	162.1	-69.5	-60.5	0	0	0	107.6	D545 A550	D545-H548 PolarHBondContact O-N 2.81Å; D545-H548 VanDerWaalsContact O-N 3.11Å; D545-H548 IonicContact OD2-CD2 3.08Å; D545-H548 PolarHBondContact OD2-CD2 3.37Å; D545-H548 IonicContact OD2-NE2 3.88Å; D545-H548 PolarHBondContact OD2-NE2 3.35Å; H548-A550 PolarHBondContact O-N 2.9Å
549	P	44.2	Very low	59.7	Low	103 Å²	103	94.4 Å²	94.4	67%	0.669	57%	0.566	S	S	*	*			trans	-51	138.5	169.7	14.1	-19.9	0	0	0	107.8	D551	P549-D551 PolarHBondContact O-N 3.11Å
550	A	45.7	Very low	61.8	Low	107 Å²	107	87.4 Å²	87.4	88%	0.884	53%	0.533	S	S	*	.	S	Bend	trans	-59.9	19.2	-171.4	0	0	0	0	0	115.6	H548	H548-A550 PolarHBondContact O-N 2.9Å
551	D	50.5	Low	63.7	Low	85 Å²	85	83.9 Å²	83.9	46%	0.455	50%	0.5	S	S	.	.			trans	-122.1	50	-165.4	-94.1	22.1	0	0	0	109	P549 D553 N554 V555	P549-D551 PolarHBondContact O-N 3.11Å; D551-D553 PolarHBondContact O-N 3.07Å; D551-N554 HydrophobicContact CB-CB 3.58Å; D551-N554 WeakPolarHBondContact O-CA 3.49Å; D551-N554 WeakPolarHBondContact O-CB 3.37Å; D551-N554 PolarHBondContact O-N 3.21Å; D551-N554 PolarHBondContact OD2-ND2 3.09Å; D551-V555 WeakPolarHBondContact O-CG2 3.12Å; D551-V555 PolarHBondContact O-N 2.99Å
552	A	53.2	Low	65.7	Low	76 Å²	76	78.8 Å²	78.8	63%	0.628	47%	0.468	S	S	*	.	H	α-helix	trans	-53	-33.5	169.1	0	0	0	0	0	111.1	N554 V555	A552-N554 VanDerWaalsContact C-N 3.28Å; A552-N554 PolarHBondContact O-N 3.31Å; A552-V555 PolarHBondContact O-N 3.48Å
553	D	56.4	Low	67.8	Low	158 Å²	158	70.8 Å²	70.8	85%	0.845	43%	0.426	S	S	*	.	H	α-helix	trans	-66.5	-25.6	173.8	-70.3	-23.9	0	0	0	113.3	D551	D551-D553 PolarHBondContact O-N 3.07Å
554	N	72.5	Confident	70.3	Confident	73 Å²	73	67.3 Å²	67.3	39%	0.39	40%	0.397	S	S	.	.	H	α-helix	trans	-90.2	-16	-178.8	-146.4	-12.6	0	0	0	112.6	D551 A552 N556 L557	D551-N554 HydrophobicContact CB-CB 3.58Å; D551-N554 WeakPolarHBondContact O-CA 3.49Å; D551-N554 WeakPolarHBondContact O-CB 3.37Å; D551-N554 PolarHBondContact O-N 3.21Å; D551-N554 PolarHBondContact OD2-ND2 3.09Å; A552-N554 VanDerWaalsContact C-N 3.28Å; A552-N554 PolarHBondContact O-N 3.31Å; N554-N556 VanDerWaalsContact C-N 3.27Å; N554-N556 PolarHBondContact O-N 2.86Å; N554-L557 WeakPolarHBondContact O-CB 2.93Å; N554-L557 PolarHBondContact O-N 3.16Å; N554-L557 VanDerWaalsContact OD1-CD1 3.23Å; N554-L557 WeakPolarHBondContact OD1-CD1 3.38Å
555	V	78.8	Confident	72.9	Confident	28 Å²	28	61 Å²	61	17%	0.17	37%	0.365	C	S	.	.	H	α-helix	trans	-56.7	-42.6	-179.3	177.9	0	0	0	0	111	D551 A552 L557 V558 R673 L674	D551-V555 WeakPolarHBondContact O-CG2 3.12Å; D551-V555 PolarHBondContact O-N 2.99Å; A552-V555 PolarHBondContact O-N 3.48Å; V555-L557 PolarHBondContact O-N 3.03Å; V555-V558 WeakPolarHBondContact O-CB 3.45Å; V555-V558 PolarHBondContact O-N 3.41Å; V555-R673 HydrophobicContact CG1-CB 3.36Å; V555-R673 HydrophobicContact CG1-CG 4.37Å; V555-R673 VanDerWaalsContact O-CD 3.26Å; V555-R673 WeakPolarHBondContact O-CD 3.44Å; V555-L674 HydrophobicContact CG1-CD2 4.11Å; V555-L674 HydrophobicContact CG1-CG 4.5Å; V555-L674 HydrophobicContact CG2-CD2 4.45Å
556	N	81.2	Confident	75.4	Confident	80 Å²	80	57.1 Å²	57.1	43%	0.428	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-13.1	-179.7	-69.1	-28.1	0	0	0	113.9	N554 V558 H670	N554-N556 VanDerWaalsContact C-N 3.27Å; N554-N556 PolarHBondContact O-N 2.86Å; N556-V558 VanDerWaalsContact C-N 3.33Å; N556-H670 PolarHBondContact OD1-ND1 3.05Å
557	L	85.3	Confident	77.7	Confident	110 Å²	110	53.6 Å²	53.6	58%	0.576	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-15.3	174.3	-64.4	175.3	0	0	0	112.5	N554 V555 T559	N554-L557 WeakPolarHBondContact O-CB 2.93Å; N554-L557 PolarHBondContact O-N 3.16Å; N554-L557 VanDerWaalsContact OD1-CD1 3.23Å; N554-L557 WeakPolarHBondContact OD1-CD1 3.38Å; V555-L557 PolarHBondContact O-N 3.03Å; L557-T559 PolarHBondContact O-N 3.24Å
558	V	92.3	Very high	79.8	Confident	46 Å²	46	57.3 Å²	57.3	28%	0.279	33%	0.331	S	S	.	.	S	Bend	trans	-72.2	117.2	178.1	-177.2	0	0	0	0	110.4	V555 N556 V560 L654 R673	V555-V558 WeakPolarHBondContact O-CB 3.45Å; V555-V558 PolarHBondContact O-N 3.41Å; N556-V558 VanDerWaalsContact C-N 3.33Å; V558-V560 PolarHBondContact O-N 3.24Å; V558-L654 HydrophobicContact CG1-CB 3.91Å; V558-L654 HydrophobicContact CG1-CD2 3.84Å; V558-R673 HydrophobicContact CB-CG 4.46Å; V558-R673 PolarHBondContact O-NE 3.44Å
559	T	95.6	Very high	82.1	Confident	50 Å²	50	56.3 Å²	56.3	31%	0.307	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-70.1	125.8	175	-57.3	0	0	0	0	111.2	L557 K590	L557-T559 PolarHBondContact O-N 3.24Å; T559-K590 WeakPolarHBondContact CA-O 3.35Å
560	V	97.7	Very high	84.6	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	117.9	172.8	-177.3	0	0	0	0	109.5	V558 V562 K590 V591 S592 L654 F656 L669 I672 R673	V558-V560 PolarHBondContact O-N 3.24Å; V560-V562 HydrophobicContact CG1-CG2 4.3Å; V560-V562 PolarHBondContact O-N 3.22Å; V560-K590 PolarHBondContact N-O 3.48Å; V560-V591 WeakPolarHBondContact O-CA 3.27Å; V560-S592 PolarHBondContact O-N 3.45Å; V560-L654 HydrophobicContact CG2-CD2 4.13Å; V560-F656 HydrophobicContact CG1-CB 3.87Å; V560-L669 HydrophobicContact CB-CD2 4.2Å; V560-L669 HydrophobicContact CG1-CD2 4.18Å; V560-L669 HydrophobicContact CG2-CD2 4.33Å; V560-I672 HydrophobicContact CG1-CG2 4.09Å; V560-I672 HydrophobicContact CG2-CG2 4.11Å; V560-R673 HydrophobicContact CG2-CG 4Å
561	H	98.3	Very high	86.9	Confident	23 Å²	23	52.5 Å²	52.5	11%	0.106	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	100.7	176.6	-62.8	89.2	0	0	0	110.5	S592 S653 L654 M655 F656	H561-S592 CarbonylContact C-O 3.6Å; H561-S592 WeakPolarHBondContact CD2-CB 3.12Å; H561-S592 PolarHBondContact CD2-OG 2.92Å; H561-S653 PolarHBondContact CE1-OG 3.33Å; H561-S653 VanDerWaalsContact CE1-OG 3.29Å; H561-S653 WeakPolarHBondContact ND1-CB 3.5Å; H561-L654 PolarHBondContact N-O 2.99Å; H561-L654 PolarHBondContact ND1-O 3.11Å; H561-M655 CarbonylContact O-C 3.56Å; H561-M655 WeakPolarHBondContact O-CA 3.5Å; H561-F656 PolarHBondContact O-N 3.08Å
562	V	98.4	Very high	89.1	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	115.3	178.3	-173.8	0	0	0	0	109.2	V560 V564 F576 F580 S592 L593 I594 F656 A658 F664	V560-V562 HydrophobicContact CG1-CG2 4.3Å; V560-V562 PolarHBondContact O-N 3.22Å; V562-V564 HydrophobicContact CG1-CG2 4Å; V562-F576 HydrophobicContact CG1-CZ 4.44Å; V562-F580 HydrophobicContact CG2-CE2 4.21Å; V562-S592 PolarHBondContact N-O 3.23Å; V562-L593 HydrophobicContact CB-CD1 4.33Å; V562-L593 HydrophobicContact CG1-CD1 4.34Å; V562-I594 PolarHBondContact O-N 3.31Å; V562-F656 WeakPolarHBondContact CA-O 3.26Å; V562-F656 HydrophobicContact CG1-CD1 4.29Å; V562-F656 HydrophobicContact CG2-CD1 4.34Å; V562-A658 HydrophobicContact CG1-CB 4.1Å; V562-F664 HydrophobicContact CG1-CZ 4.24Å; V562-F664 HydrophobicContact CG2-CZ 4.29Å
563	I	98.6	Very high	91.2	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	121.4	-179.1	-61.2	158.7	0	0	0	108.8	I594 L642 A646 M655 F656 F657 A658	I563-I594 WeakPolarHBondContact CA-O 3.49Å; I563-I594 HydrophobicContact CG1-CB 4.16Å; I563-I594 HydrophobicContact CG1-CD1 4.25Å; I563-L642 HydrophobicContact CB-CD2 4.49Å; I563-L642 HydrophobicContact CG2-CD2 3.94Å; I563-A646 HydrophobicContact CD1-CB 4.41Å; I563-M655 HydrophobicContact CD1-CB 4.32Å; I563-M655 HydrophobicContact CD1-CG 4.38Å; I563-M655 HydrophobicContact CD1-SD 4.13Å; I563-F656 PolarHBondContact N-O 3.47Å; I563-F657 HydrophobicContact CB-CD1 4.16Å; I563-F657 HydrophobicContact CD1-CD1 3.97Å; I563-F657 HydrophobicContact CD1-CE1 3.62Å; I563-A658 PolarHBondContact O-N 3.08Å; I563-A658 VanDerWaalsContact O-N 3.07Å
564	V	98.4	Very high	93.2	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	114.3	-175	-174.7	0	0	0	0	110.7	V562 F576 L593 I594 V595 V596 A658 V660	V562-V564 HydrophobicContact CG1-CG2 4Å; V564-F576 HydrophobicContact CG2-CE1 4.33Å; V564-F576 HydrophobicContact CG2-CE2 4.47Å; V564-F576 HydrophobicContact CG2-CZ 3.94Å; V564-L593 HydrophobicContact CG2-CD1 4.06Å; V564-I594 PolarHBondContact N-O 3.35Å; V564-V595 WeakPolarHBondContact O-CA 3.25Å; V564-V596 PolarHBondContact O-N 3.31Å; V564-A658 HydrophobicContact CG2-CB 4.41Å; V564-V660 HydrophobicContact CG1-CB 3.92Å; V564-V660 HydrophobicContact CG1-CG2 4.48Å
565	P	97.5	Very high	94.2	Very high	8 Å²	8	42.5 Å²	42.5	5%	0.052	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	136.2	172	30.4	-27.9	0	0	0	110.7	F636 R638 A641 L642 A658	P565-F636 HydrophobicContact CB-CE2 4.16Å; P565-F636 HydrophobicContact CB-CZ 4.24Å; P565-R638 HydrophobicContact CG-CG 3.93Å; P565-A641 HydrophobicContact CB-CB 3.68Å; P565-L642 HydrophobicContact CG-CD2 4.14Å; P565-L642 HydrophobicContact CG-CG 4.39Å; P565-A658 WeakPolarHBondContact CD-O 3.46Å
566	L	97.5	Very high	95.1	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	137.8	-172.3	-170.3	69.3	0	0	0	113.2	R569 L573 V595 V596 L597 F598 I609 V660	L566-R569 HydrophobicContact CD1-CB 3.89Å; L566-L573 HydrophobicContact CD1-CB 4.42Å; L566-L573 HydrophobicContact CD2-CB 4.32Å; L566-L573 HydrophobicContact CD2-CD1 4.19Å; L566-L573 HydrophobicContact CD2-CD2 3.79Å; L566-L573 HydrophobicContact CD2-CG 4.32Å; L566-V595 HydrophobicContact CB-CG1 3.95Å; L566-V595 HydrophobicContact CD2-CG1 3.87Å; L566-V596 PolarHBondContact N-O 2.93Å; L566-L597 HydrophobicContact CB-CD1 4.35Å; L566-L597 HydrophobicContact CD2-CD1 4.06Å; L566-L597 HydrophobicContact CG-CD1 4.17Å; L566-F598 PolarHBondContact O-N 3.36Å; L566-I609 HydrophobicContact CD2-CD1 3.97Å; L566-I609 HydrophobicContact CD2-CG1 4.28Å; L566-I609 HydrophobicContact CD2-CG2 3.77Å; L566-V660 HydrophobicContact CD1-CB 4.09Å; L566-V660 HydrophobicContact CD1-CG1 4.16Å; L566-V660 HydrophobicContact CD1-CG2 3.86Å
567	H	95.3	Very high	95.9	Very high	54 Å²	54	38 Å²	38	25%	0.25	19%	0.188	C	C	.	.	S	Bend	trans	-155	124.3	171.1	-179.2	64.1	0	0	0	110.9	R569 F598 F636	H567-R569 VanDerWaalsContact C-N 3.3Å; H567-R569 VanDerWaalsContact O-CG 3.31Å; H567-R569 WeakPolarHBondContact O-CG 3.49Å; H567-R569 PolarHBondContact O-N 3Å; H567-F598 HydrophobicContact CB-CB 4.18Å; H567-F598 PolarHBondContact ND1-O 2.04Å; H567-F636 HydrophobicContact CB-CB 4.3Å; H567-F636 HydrophobicContact CB-CD2 3.57Å; H567-F636 HydrophobicContact CB-CE2 4.17Å; H567-F636 HydrophobicContact CB-CG 4.13Å
568	K	92.6	Very high	96.4	Very high	113 Å²	113	35.4 Å²	35.4	49%	0.491	18%	0.184	S	C	.	.	S	Bend	trans	53.9	33.4	175.1	-67	-177.8	178.7	-176.7	0	115.6	S600 D601	K568-S600 VanDerWaalsContact CG-CB 3.43Å; K568-D601 IonicContact NZ-OD2 2.94Å; K568-D601 PolarHBondContact NZ-OD2 3.35Å
569	R	94.3	Very high	96.6	Very high	68 Å²	68	34.6 Å²	34.6	26%	0.257	18%	0.177	S	C	.	.			trans	-131.8	52.7	-173.5	-67.3	-173.2	84.2	170.5	10	114.2	L566 H567 T571 S572 L573 V660 D661	L566-R569 HydrophobicContact CD1-CB 3.89Å; H567-R569 VanDerWaalsContact C-N 3.3Å; H567-R569 VanDerWaalsContact O-CG 3.31Å; H567-R569 WeakPolarHBondContact O-CG 3.49Å; H567-R569 PolarHBondContact O-N 3Å; R569-T571 PolarHBondContact O-N 3.47Å; R569-S572 PolarHBondContact NE-OG 3.08Å; R569-S572 PolarHBondContact O-N 3.27Å; R569-L573 PolarHBondContact O-N 3.48Å; R569-V660 HydrophobicContact CB-CG1 4.37Å; R569-D661 IonicContact CZ-OD1 3.13Å; R569-D661 IonicContact CZ-OD2 2.75Å; R569-D661 IonicContact NH1-OD1 2.89Å; R569-D661 IonicContact NH1-OD2 3.82Å; R569-D661 PolarHBondContact NH1-OD2 2.6Å; R569-D661 IonicContact NH2-OD1 3.97Å; R569-D661 PolarHBondContact NH2-OD1 2.86Å; R569-D661 IonicContact NH2-OD2 3.49Å; R569-D661 PolarHBondContact NH2-OD2 3.16Å
570	L	96.1	Very high	96.7	Very high	27 Å²	27	32.3 Å²	32.3	14%	0.141	16%	0.162	C	C	.	.	H	α-helix	trans	-54.2	-52	178.6	172.3	65.8	0	0	0	112.8	S572 L573 Q574 Q608 I609	L570-S572 VanDerWaalsContact C-N 3.35Å; L570-S572 PolarHBondContact O-N 3.31Å; L570-L573 WeakPolarHBondContact O-CB 3.4Å; L570-L573 PolarHBondContact O-N 2.92Å; L570-L573 VanDerWaalsContact O-N 3.13Å; L570-Q574 HydrophobicContact CD1-CG 4.16Å; L570-Q574 WeakPolarHBondContact O-CG 3.23Å; L570-Q574 PolarHBondContact O-N 3.08Å; L570-Q608 HydrophobicContact CD1-CB 3.79Å; L570-Q608 HydrophobicContact CD2-CB 3.97Å; L570-I609 HydrophobicContact CB-CD1 4.42Å; L570-I609 HydrophobicContact CB-CG1 4.17Å; L570-I609 HydrophobicContact CD1-CG1 3.79Å
571	T	95.3	Very high	96.6	Very high	102 Å²	102	34.4 Å²	34.4	63%	0.626	17%	0.172	S	C	*	.	H	α-helix	trans	-63.9	-39.5	-177.4	54.4	0	0	0	0	112.4	R569 L573 Q574 R575	R569-T571 PolarHBondContact O-N 3.47Å; T571-L573 VanDerWaalsContact C-N 3.34Å; T571-Q574 PolarHBondContact O-N 3.43Å; T571-R575 PolarHBondContact O-N 3.01Å; T571-R575 VanDerWaalsContact O-N 3.08Å
572	S	95.5	Very high	96.5	Very high	10 Å²	10	39.6 Å²	39.6	7%	0.07	19%	0.194	C	C	.	.	H	α-helix	trans	-64.1	-40.9	174.5	-47.1	0	0	0	0	111.1	R569 L570 R575 F576	R569-S572 PolarHBondContact NE-OG 3.08Å; R569-S572 PolarHBondContact O-N 3.27Å; L570-S572 VanDerWaalsContact C-N 3.35Å; L570-S572 PolarHBondContact O-N 3.31Å; S572-R575 PolarHBondContact O-N 2.87Å; S572-F576 WeakPolarHBondContact O-CB 3.32Å; S572-F576 PolarHBondContact O-N 3.43Å
573	L	97.6	Very high	96.3	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-63.9	-45.3	175.8	-179.7	71	0	0	0	111.8	L566 R569 L570 T571 R575 F576 V577 V595 I609 L613 V660	L566-L573 HydrophobicContact CD1-CB 4.42Å; L566-L573 HydrophobicContact CD2-CB 4.32Å; L566-L573 HydrophobicContact CD2-CD1 4.19Å; L566-L573 HydrophobicContact CD2-CD2 3.79Å; L566-L573 HydrophobicContact CD2-CG 4.32Å; R569-L573 PolarHBondContact O-N 3.48Å; L570-L573 WeakPolarHBondContact O-CB 3.4Å; L570-L573 PolarHBondContact O-N 2.92Å; L570-L573 VanDerWaalsContact O-N 3.13Å; T571-L573 VanDerWaalsContact C-N 3.34Å; L573-R575 VanDerWaalsContact C-N 3.31Å; L573-R575 PolarHBondContact O-N 3.32Å; L573-F576 WeakPolarHBondContact O-CB 3.29Å; L573-F576 PolarHBondContact O-N 3.28Å; L573-F576 VanDerWaalsContact O-N 3.17Å; L573-V577 HydrophobicContact CD1-CG2 4.03Å; L573-V577 HydrophobicContact CG-CG2 4.15Å; L573-V577 WeakPolarHBondContact O-CB 3.47Å; L573-V577 WeakPolarHBondContact O-CG2 3.35Å; L573-V577 PolarHBondContact O-N 2.85Å; L573-V595 HydrophobicContact CD1-CG2 4.47Å; L573-I609 HydrophobicContact CD2-CB 4.05Å; L573-I609 HydrophobicContact CD2-CG1 3.9Å; L573-I609 HydrophobicContact CD2-CG2 3.63Å; L573-L613 HydrophobicContact CD2-CD1 4.3Å; L573-L613 HydrophobicContact CD2-CG 4.3Å; L573-V660 HydrophobicContact CB-CG2 4.12Å; L573-V660 HydrophobicContact CD1-CG2 4.28Å
574	Q	97.4	Very high	96.2	Very high	84 Å²	84	42 Å²	42	39%	0.393	21%	0.206	S	C	.	.	H	α-helix	trans	-60	-42.9	178.6	-73.5	173	-28.4	0	0	111.4	L570 T571 A578 T612	L570-Q574 HydrophobicContact CD1-CG 4.16Å; L570-Q574 WeakPolarHBondContact O-CG 3.23Å; L570-Q574 PolarHBondContact O-N 3.08Å; T571-Q574 PolarHBondContact O-N 3.43Å; Q574-A578 WeakPolarHBondContact O-CB 3.37Å; Q574-A578 PolarHBondContact O-N 3.4Å; Q574-T612 HydrophobicContact CG-CG2 4.35Å
575	R	95.3	Very high	96	Very high	88 Å²	88	42 Å²	42	33%	0.332	21%	0.206	S	C	.	.	H	α-helix	trans	-61.1	-47	172.9	-179.4	-179.4	63.2	-154.9	-1.3	111.8	T571 S572 L573 H579 D661	T571-R575 PolarHBondContact O-N 3.01Å; T571-R575 VanDerWaalsContact O-N 3.08Å; S572-R575 PolarHBondContact O-N 2.87Å; L573-R575 VanDerWaalsContact C-N 3.31Å; L573-R575 PolarHBondContact O-N 3.32Å; R575-H579 WeakPolarHBondContact O-CB 3.48Å; R575-H579 PolarHBondContact O-N 2.77Å; R575-D661 IonicContact NH2-OD1 2.68Å; R575-D661 PolarHBondContact NH2-OD1 3.22Å
576	F	97.3	Very high	95.9	Very high	3 Å²	3	49.5 Å²	49.5	1%	0.013	23%	0.233	C	C	.	.	H	α-helix	trans	-59.1	-50.2	178.1	175.1	-91.9	0	0	0	111.5	V562 V564 S572 L573 H579 F580 L593 V660 M662 F664	V562-F576 HydrophobicContact CG1-CZ 4.44Å; V564-F576 HydrophobicContact CG2-CE1 4.33Å; V564-F576 HydrophobicContact CG2-CE2 4.47Å; V564-F576 HydrophobicContact CG2-CZ 3.94Å; S572-F576 WeakPolarHBondContact O-CB 3.32Å; S572-F576 PolarHBondContact O-N 3.43Å; L573-F576 WeakPolarHBondContact O-CB 3.29Å; L573-F576 PolarHBondContact O-N 3.28Å; L573-F576 VanDerWaalsContact O-N 3.17Å; F576-H579 PolarHBondContact O-N 3.2Å; F576-F580 HydrophobicContact CE1-CB 4.29Å; F576-F580 HydrophobicContact CE1-CD2 4.5Å; F576-F580 HydrophobicContact CE1-CG 4.41Å; F576-F580 HydrophobicContact CZ-CD2 4.21Å; F576-F580 VanDerWaalsContact O-CB 3.25Å; F576-F580 WeakPolarHBondContact O-CB 3.19Å; F576-F580 PolarHBondContact O-N 3.25Å; F576-L593 HydrophobicContact CE1-CD1 3.72Å; F576-L593 HydrophobicContact CE1-CD2 4.04Å; F576-L593 HydrophobicContact CZ-CD1 4.07Å; F576-V660 HydrophobicContact CB-CG2 4.14Å; F576-M662 WeakPolarHBondContact CD2-O 3.41Å; F576-F664 AromaticContact CE2-CE1 3.93Å; F576-F664 HydrophobicContact CE2-CE1 3.93Å; F576-F664 HydrophobicContact CE2-CZ 4.42Å; F576-F664 HydrophobicContact CZ-CE1 4.37Å; F576-F664 HydrophobicContact CZ-CZ 4.45Å
577	V	97.6	Very high	95.7	Very high	10 Å²	10	53.4 Å²	53.4	6%	0.061	25%	0.254	C	S	.	.	H	α-helix	trans	-61.9	-47	-179.6	165.5	0	0	0	0	111	L573 H579 F580 E581 T612 L613 L616	L573-V577 HydrophobicContact CD1-CG2 4.03Å; L573-V577 HydrophobicContact CG-CG2 4.15Å; L573-V577 WeakPolarHBondContact O-CB 3.47Å; L573-V577 WeakPolarHBondContact O-CG2 3.35Å; L573-V577 PolarHBondContact O-N 2.85Å; V577-H579 VanDerWaalsContact C-N 3.28Å; V577-H579 PolarHBondContact O-N 3.16Å; V577-F580 PolarHBondContact O-N 2.91Å; V577-E581 VanDerWaalsContact O-CB 3.3Å; V577-E581 WeakPolarHBondContact O-CB 3.47Å; V577-E581 PolarHBondContact O-N 3.44Å; V577-T612 HydrophobicContact CB-CG2 4.38Å; V577-T612 HydrophobicContact CG1-CG2 4.25Å; V577-T612 HydrophobicContact CG2-CG2 4.3Å; V577-L613 HydrophobicContact CG2-CD2 4.09Å; V577-L616 HydrophobicContact CG1-CD1 3.91Å; V577-L616 HydrophobicContact CG1-CD2 3.76Å; V577-L616 HydrophobicContact CG1-CG 4.27Å; V577-L616 HydrophobicContact CG2-CD2 4.47Å
578	A	96.2	Very high	95.6	Very high	57 Å²	57	53.2 Å²	53.2	47%	0.471	27%	0.266	S	S	.	.	H	α-helix	trans	-60	-39.2	177.5	0	0	0	0	0	112.1	Q574 K582	Q574-A578 WeakPolarHBondContact O-CB 3.37Å; Q574-A578 PolarHBondContact O-N 3.4Å; A578-K582 WeakPolarHBondContact O-CB 3.25Å; A578-K582 PolarHBondContact O-N 3.48Å; A578-K582 VanDerWaalsContact O-N 3.16Å
579	H	95.8	Very high	95.6	Very high	29 Å²	29	49.5 Å²	49.5	13%	0.134	25%	0.25	C	S	.	.	H	α-helix	trans	-70.2	-46.5	176.4	-172	85.6	0	0	0	112.3	R575 F576 V577 E581 K582 H583 L663 F664	R575-H579 WeakPolarHBondContact O-CB 3.48Å; R575-H579 PolarHBondContact O-N 2.77Å; F576-H579 PolarHBondContact O-N 3.2Å; V577-H579 VanDerWaalsContact C-N 3.28Å; V577-H579 PolarHBondContact O-N 3.16Å; H579-E581 VanDerWaalsContact C-N 3.34Å; H579-E581 PolarHBondContact O-N 2.96Å; H579-K582 PolarHBondContact O-N 2.73Å; H579-H583 AromaticContact CE1-CD2 3.27Å; H579-H583 PolarHBondContact CE1-CD2 3.48Å; H579-H583 AromaticContact CE1-NE2 3.67Å; H579-H583 AromaticContact CG-CD2 3.96Å; H579-H583 AromaticContact ND1-CD2 3.48Å; H579-H583 PolarHBondContact ND1-CD2 2.92Å; H579-H583 AromaticContact ND1-NE2 3.92Å; H579-H583 AromaticContact NE2-CD2 3.66Å; H579-H583 PolarHBondContact O-CD2 2.9Å; H579-H583 PolarHBondContact O-N 3.46Å; H579-L663 HydrophobicContact CB-CD2 3.82Å; H579-F664 PolarHBondContact NE2-N 3.42Å; H579-F664 PolarHBondContact NE2-O 3Å; H579-F664 VanDerWaalsContact NE2-O 3.12Å
580	F	97.1	Very high	95.6	Very high	2 Å²	2	50.7 Å²	50.7	1%	0.009	26%	0.258	C	S	.	.	H	α-helix	trans	-61.3	-41.6	178.6	-173.6	-97.9	0	0	0	111.5	V562 F576 V577 C584 L585 V591 L593 F664	V562-F580 HydrophobicContact CG2-CE2 4.21Å; F576-F580 HydrophobicContact CE1-CB 4.29Å; F576-F580 HydrophobicContact CE1-CD2 4.5Å; F576-F580 HydrophobicContact CE1-CG 4.41Å; F576-F580 HydrophobicContact CZ-CD2 4.21Å; F576-F580 VanDerWaalsContact O-CB 3.25Å; F576-F580 WeakPolarHBondContact O-CB 3.19Å; F576-F580 PolarHBondContact O-N 3.25Å; V577-F580 PolarHBondContact O-N 2.91Å; F580-C584 HydrophobicContact CD2-CB 4.21Å; F580-C584 HydrophobicContact CE2-CB 4.15Å; F580-C584 HydrophobicContact CG-CB 4.48Å; F580-C584 HydrophobicContact CZ-CB 4.37Å; F580-C584 WeakPolarHBondContact O-CA 3.44Å; F580-C584 WeakPolarHBondContact O-CB 3.39Å; F580-C584 PolarHBondContact O-N 2.91Å; F580-L585 HydrophobicContact CD1-CD1 3.9Å; F580-L585 HydrophobicContact CD1-CD2 4.46Å; F580-L585 HydrophobicContact CD1-CG 3.9Å; F580-L585 HydrophobicContact CE1-CD1 4.02Å; F580-L585 HydrophobicContact CE1-CD2 3.85Å; F580-L585 HydrophobicContact CE1-CG 3.8Å; F580-L585 PolarHBondContact O-N 2.98Å; F580-V591 HydrophobicContact CE1-CG2 3.99Å; F580-V591 HydrophobicContact CE2-CB 4.5Å; F580-V591 HydrophobicContact CE2-CG2 4.36Å; F580-V591 HydrophobicContact CZ-CB 3.87Å; F580-V591 HydrophobicContact CZ-CG2 3.5Å; F580-L593 HydrophobicContact CD1-CD2 4.26Å; F580-L593 HydrophobicContact CE1-CB 4.06Å; F580-L593 HydrophobicContact CE1-CD2 4.26Å; F580-L593 HydrophobicContact CZ-CB 4.15Å; F580-F664 AromaticContact CD2-CE2 4Å; F580-F664 HydrophobicContact CD2-CE2 4Å; F580-F664 AromaticContact CD2-CZ 3.78Å; F580-F664 HydrophobicContact CD2-CZ 3.78Å; F580-F664 HydrophobicContact CE2-CE2 4.09Å; F580-F664 AromaticContact CE2-CZ 3.95Å; F580-F664 HydrophobicContact CE2-CZ 3.95Å
581	E	96.7	Very high	95.7	Very high	43 Å²	43	49.6 Å²	49.6	20%	0.201	25%	0.252	C	S	.	.	H	α-helix	trans	-60.6	-51.2	173.9	-169.3	-163.1	146.7	0	0	111.3	V577 H579 H583 L585 R586 L616 Y620	V577-E581 VanDerWaalsContact O-CB 3.3Å; V577-E581 WeakPolarHBondContact O-CB 3.47Å; V577-E581 PolarHBondContact O-N 3.44Å; H579-E581 VanDerWaalsContact C-N 3.34Å; H579-E581 PolarHBondContact O-N 2.96Å; E581-H583 PolarHBondContact O-N 3.41Å; E581-L585 HydrophobicContact CB-CD1 4.45Å; E581-L585 HydrophobicContact CG-CD1 4.48Å; E581-L585 PolarHBondContact O-N 3.47Å; E581-R586 HydrophobicContact CG-CG 4.34Å; E581-R586 WeakPolarHBondContact O-CB 3.15Å; E581-R586 WeakPolarHBondContact O-CG 3.42Å; E581-R586 PolarHBondContact O-N 3.22Å; E581-R586 IonicContact OE1-CZ 3.19Å; E581-R586 VanDerWaalsContact OE1-CZ 3.27Å; E581-R586 IonicContact OE1-NE 2.83Å; E581-R586 PolarHBondContact OE1-NE 3.49Å; E581-R586 IonicContact OE1-NH2 2.77Å; E581-R586 PolarHBondContact OE1-NH2 3.45Å; E581-L616 HydrophobicContact CB-CD1 4.12Å; E581-L616 HydrophobicContact CG-CD1 4.04Å; E581-Y620 HydrophobicContact CG-CE2 3.64Å; E581-Y620 WeakPolarHBondContact CG-OH 3.48Å; E581-Y620 PolarHBondContact OE1-OH 3.38Å
582	K	95.8	Very high	95.7	Very high	132 Å²	132	44.8 Å²	44.8	57%	0.574	22%	0.223	S	C	*	.	H	α-helix	trans	-62.8	-43.5	-177.3	-179	-179	176.5	-175.4	0	113	A578 H579 N587	A578-K582 WeakPolarHBondContact O-CB 3.25Å; A578-K582 PolarHBondContact O-N 3.48Å; A578-K582 VanDerWaalsContact O-N 3.16Å; H579-K582 PolarHBondContact O-N 2.73Å; K582-N587 PolarHBondContact O-ND2 2.94Å; K582-N587 VanDerWaalsContact O-ND2 3.17Å
583	H	95.1	Very high	95.9	Very high	51 Å²	51	44.4 Å²	44.4	24%	0.236	22%	0.22	C	C	.	.	H	α-helix	trans	-99.5	-24.2	-170.2	-71.3	-76.5	0	0	0	114.3	H579 E581 N587	H579-H583 AromaticContact CE1-CD2 3.27Å; H579-H583 PolarHBondContact CE1-CD2 3.48Å; H579-H583 AromaticContact CE1-NE2 3.67Å; H579-H583 AromaticContact CG-CD2 3.96Å; H579-H583 AromaticContact ND1-CD2 3.48Å; H579-H583 PolarHBondContact ND1-CD2 2.92Å; H579-H583 AromaticContact ND1-NE2 3.92Å; H579-H583 AromaticContact NE2-CD2 3.66Å; H579-H583 PolarHBondContact O-CD2 2.9Å; H579-H583 PolarHBondContact O-N 3.46Å; E581-H583 PolarHBondContact O-N 3.41Å; H583-N587 VanDerWaalsContact C-ND2 3.31Å; H583-N587 PolarHBondContact O-ND2 3.41Å
584	C	95.5	Very high	95.9	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.7	-64.2	179.7	-53.1	0	0	0	0	111.4	F580 N587 G588 E589 V591 L669	F580-C584 HydrophobicContact CD2-CB 4.21Å; F580-C584 HydrophobicContact CE2-CB 4.15Å; F580-C584 HydrophobicContact CG-CB 4.48Å; F580-C584 HydrophobicContact CZ-CB 4.37Å; F580-C584 WeakPolarHBondContact O-CA 3.44Å; F580-C584 WeakPolarHBondContact O-CB 3.39Å; F580-C584 PolarHBondContact O-N 2.91Å; C584-N587 PolarHBondContact O-N 3.37Å; C584-G588 PolarHBondContact O-N 2.84Å; C584-E589 HydrophobicContact CB-CB 4.4Å; C584-E589 WeakPolarHBondContact O-CB 3.46Å; C584-E589 PolarHBondContact O-N 3.23Å; C584-V591 HydrophobicContact CB-CG1 4.46Å; C584-V591 HydrophobicContact CB-CG2 4.19Å; C584-L669 HydrophobicContact CB-CD1 4.36Å
585	L	95.5	Very high	95.9	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-65.7	-49.6	-169.4	-60.8	174.2	0	0	0	113	F580 E581 N587 G588 V591 L616 Y620 S624 I626	F580-L585 HydrophobicContact CD1-CD1 3.9Å; F580-L585 HydrophobicContact CD1-CD2 4.46Å; F580-L585 HydrophobicContact CD1-CG 3.9Å; F580-L585 HydrophobicContact CE1-CD1 4.02Å; F580-L585 HydrophobicContact CE1-CD2 3.85Å; F580-L585 HydrophobicContact CE1-CG 3.8Å; F580-L585 PolarHBondContact O-N 2.98Å; E581-L585 HydrophobicContact CB-CD1 4.45Å; E581-L585 HydrophobicContact CG-CD1 4.48Å; E581-L585 PolarHBondContact O-N 3.47Å; L585-N587 PolarHBondContact O-N 3.49Å; L585-N587 VanDerWaalsContact O-N 3.14Å; L585-G588 PolarHBondContact O-N 2.94Å; L585-V591 HydrophobicContact CD2-CG2 3.81Å; L585-L616 HydrophobicContact CD1-CD1 3.9Å; L585-L616 HydrophobicContact CD1-CD2 3.92Å; L585-L616 HydrophobicContact CD1-CG 3.94Å; L585-Y620 HydrophobicContact CB-CD1 3.88Å; L585-Y620 HydrophobicContact CB-CD2 4.39Å; L585-Y620 HydrophobicContact CB-CE1 3.75Å; L585-Y620 HydrophobicContact CB-CE2 4.28Å; L585-Y620 HydrophobicContact CB-CG 4.21Å; L585-Y620 HydrophobicContact CD1-CD2 3.75Å; L585-Y620 HydrophobicContact CD1-CE2 4.08Å; L585-Y620 HydrophobicContact CD1-CG 4Å; L585-S624 VanDerWaalsContact CD2-OG 3.27Å; L585-S624 WeakPolarHBondContact CD2-OG 3.38Å; L585-I626 HydrophobicContact CD1-CD1 4.27Å
586	R	94.6	Very high	96.1	Very high	165 Å²	165	36.4 Å²	36.4	62%	0.623	19%	0.186	S	C	*	.	G	3₁₀ helix	trans	-62.3	-22.2	178.5	-73.2	-176.3	-174.7	-169.7	2	113.7	E581 G588 Y620	E581-R586 HydrophobicContact CG-CG 4.34Å; E581-R586 WeakPolarHBondContact O-CB 3.15Å; E581-R586 WeakPolarHBondContact O-CG 3.42Å; E581-R586 PolarHBondContact O-N 3.22Å; E581-R586 IonicContact OE1-CZ 3.19Å; E581-R586 VanDerWaalsContact OE1-CZ 3.27Å; E581-R586 IonicContact OE1-NE 2.83Å; E581-R586 PolarHBondContact OE1-NE 3.49Å; E581-R586 IonicContact OE1-NH2 2.77Å; E581-R586 PolarHBondContact OE1-NH2 3.45Å; R586-G588 VanDerWaalsContact C-N 3.35Å; R586-Y620 VanDerWaalsContact CG-OH 3.25Å; R586-Y620 WeakPolarHBondContact CG-OH 3.41Å
587	N	93.4	Very high	96.1	Very high	83 Å²	83	36.4 Å²	36.4	44%	0.444	19%	0.186	S	C	.	.	G	3₁₀ helix	trans	-91.7	4	177.6	-62.5	-55.3	0	0	0	112.8	K582 H583 C584 L585 E589	K582-N587 PolarHBondContact O-ND2 2.94Å; K582-N587 VanDerWaalsContact O-ND2 3.17Å; H583-N587 VanDerWaalsContact C-ND2 3.31Å; H583-N587 PolarHBondContact O-ND2 3.41Å; C584-N587 PolarHBondContact O-N 3.37Å; L585-N587 PolarHBondContact O-N 3.49Å; L585-N587 VanDerWaalsContact O-N 3.14Å; N587-E589 VanDerWaalsContact C-N 3.29Å; N587-E589 PolarHBondContact O-N 2.93Å
588	G	92	Very high	96.1	Very high	49 Å²	49	36 Å²	36	51%	0.505	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.6	20.9	177.4	0	0	0	0	0	114.4	C584 L585 R586	C584-G588 PolarHBondContact O-N 2.84Å; L585-G588 PolarHBondContact O-N 2.94Å; R586-G588 VanDerWaalsContact C-N 3.35Å
589	E	94.3	Very high	96.1	Very high	35 Å²	35	34.5 Å²	34.5	16%	0.164	17%	0.169	C	C	.	.			trans	-62.8	138.7	177.2	-74.8	-67.2	153.3	0	0	111.3	C584 N587 V591 R666 L669 R673	C584-E589 HydrophobicContact CB-CB 4.4Å; C584-E589 WeakPolarHBondContact O-CB 3.46Å; C584-E589 PolarHBondContact O-N 3.23Å; N587-E589 VanDerWaalsContact C-N 3.29Å; N587-E589 PolarHBondContact O-N 2.93Å; E589-V591 HydrophobicContact CB-CG1 4.14Å; E589-V591 PolarHBondContact O-N 3.01Å; E589-R666 HydrophobicContact CG-CB 4.06Å; E589-R666 WeakPolarHBondContact OE1-CB 3.37Å; E589-L669 HydrophobicContact CB-CD1 3.85Å; E589-L669 HydrophobicContact CG-CD1 3.86Å; E589-R673 IonicContact OE2-CZ 3.85Å; E589-R673 IonicContact OE2-NH1 2.69Å; E589-R673 PolarHBondContact OE2-NH1 2.6Å; E589-R673 IonicContact OE2-NH2 2.77Å; E589-R673 PolarHBondContact OE2-NH2 2.9Å; E589-R673 VanDerWaalsContact OE2-NH2 3.09Å
590	K	94.3	Very high	95.9	Very high	94 Å²	94	33.7 Å²	33.7	41%	0.409	17%	0.167	S	C	.	.			trans	-73.8	91	173.3	-64.3	-61	-175.4	-177	0	110	T559 V560 R673	T559-K590 WeakPolarHBondContact CA-O 3.35Å; V560-K590 PolarHBondContact N-O 3.48Å; K590-R673 PolarHBondContact O-NH2 3.33Å; K590-R673 VanDerWaalsContact O-NH2 3.1Å
591	V	96.4	Very high	95.7	Very high	3 Å²	3	39 Å²	39	2%	0.018	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	154.2	179.1	-64.8	0	0	0	0	111.5	V560 F580 C584 L585 E589 S624 L669	V560-V591 WeakPolarHBondContact O-CA 3.27Å; F580-V591 HydrophobicContact CE1-CG2 3.99Å; F580-V591 HydrophobicContact CE2-CB 4.5Å; F580-V591 HydrophobicContact CE2-CG2 4.36Å; F580-V591 HydrophobicContact CZ-CB 3.87Å; F580-V591 HydrophobicContact CZ-CG2 3.5Å; C584-V591 HydrophobicContact CB-CG1 4.46Å; C584-V591 HydrophobicContact CB-CG2 4.19Å; L585-V591 HydrophobicContact CD2-CG2 3.81Å; E589-V591 HydrophobicContact CB-CG1 4.14Å; E589-V591 PolarHBondContact O-N 3.01Å; V591-S624 VanDerWaalsContact O-CB 3.27Å; V591-S624 WeakPolarHBondContact O-CB 2.84Å; V591-S624 PolarHBondContact O-OG 2.93Å; V591-L669 HydrophobicContact CG1-CD1 3.46Å; V591-L669 VanDerWaalsContact CG1-CD1 3.46Å; V591-L669 HydrophobicContact CG1-CD2 3.98Å; V591-L669 HydrophobicContact CG1-CG 4.37Å
592	S	96.9	Very high	95.5	Very high	2 Å²	2	41 Å²	41	1%	0.014	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	137.7	168.2	172.1	0	0	0	0	107.9	V560 H561 V562 N625	V560-S592 PolarHBondContact O-N 3.45Å; H561-S592 CarbonylContact C-O 3.6Å; H561-S592 WeakPolarHBondContact CD2-CB 3.12Å; H561-S592 PolarHBondContact CD2-OG 2.92Å; V562-S592 PolarHBondContact N-O 3.23Å; S592-N625 CarbonylContact C-O 3.59Å; S592-N625 VanDerWaalsContact CA-O 3.27Å; S592-N625 WeakPolarHBondContact CA-O 3.43Å; S592-N625 PolarHBondContact OG-O 3.19Å
593	L	98.2	Very high	95.3	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.005	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	120.2	-179.6	177	61.5	0	0	0	109.5	V562 V564 F576 F580 V595 L613 L616 N625 I626 S627	V562-L593 HydrophobicContact CB-CD1 4.33Å; V562-L593 HydrophobicContact CG1-CD1 4.34Å; V564-L593 HydrophobicContact CG2-CD1 4.06Å; F576-L593 HydrophobicContact CE1-CD1 3.72Å; F576-L593 HydrophobicContact CE1-CD2 4.04Å; F576-L593 HydrophobicContact CZ-CD1 4.07Å; F580-L593 HydrophobicContact CD1-CD2 4.26Å; F580-L593 HydrophobicContact CE1-CB 4.06Å; F580-L593 HydrophobicContact CE1-CD2 4.26Å; F580-L593 HydrophobicContact CZ-CB 4.15Å; L593-V595 HydrophobicContact CD1-CG2 4.15Å; L593-V595 HydrophobicContact CD2-CG2 4.33Å; L593-V595 HydrophobicContact CG-CG2 4.05Å; L593-L613 HydrophobicContact CD2-CD2 4.25Å; L593-L616 HydrophobicContact CD2-CD2 4.4Å; L593-N625 PolarHBondContact N-O 2.95Å; L593-I626 HydrophobicContact CB-CG1 4.48Å; L593-I626 CarbonylContact O-C 3.56Å; L593-I626 WeakPolarHBondContact O-CA 3.45Å; L593-S627 PolarHBondContact O-N 2.79Å
594	I	98.3	Very high	95.3	Very high	5 Å²	5	42 Å²	42	3%	0.026	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	109	177.4	-56.2	177.7	0	0	0	107.9	V562 I563 V564 V596 S627 L648	V562-I594 PolarHBondContact O-N 3.31Å; I563-I594 WeakPolarHBondContact CA-O 3.49Å; I563-I594 HydrophobicContact CG1-CB 4.16Å; I563-I594 HydrophobicContact CG1-CD1 4.25Å; V564-I594 PolarHBondContact N-O 3.35Å; I594-V596 HydrophobicContact CG2-CG2 4.22Å; I594-S627 WeakPolarHBondContact CA-O 3.33Å; I594-L648 HydrophobicContact CD1-CB 4.31Å; I594-L648 HydrophobicContact CG2-CD1 3.89Å
595	V	98.5	Very high	95.3	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	124.2	175	-178	0	0	0	0	109.2	V564 L566 L573 L593 L613 S627 L628 V629	V564-V595 WeakPolarHBondContact O-CA 3.25Å; L566-V595 HydrophobicContact CB-CG1 3.95Å; L566-V595 HydrophobicContact CD2-CG1 3.87Å; L573-V595 HydrophobicContact CD1-CG2 4.47Å; L593-V595 HydrophobicContact CD1-CG2 4.15Å; L593-V595 HydrophobicContact CD2-CG2 4.33Å; L593-V595 HydrophobicContact CG-CG2 4.05Å; V595-L613 HydrophobicContact CB-CD1 3.72Å; V595-L613 HydrophobicContact CG1-CD1 3.94Å; V595-L613 HydrophobicContact CG2-CD1 3.84Å; V595-L613 HydrophobicContact CG2-CD2 3.87Å; V595-S627 PolarHBondContact N-O 3.16Å; V595-L628 HydrophobicContact CB-CD1 4.33Å; V595-L628 HydrophobicContact CG1-CD1 4.27Å; V595-V629 PolarHBondContact O-N 3.48Å
596	V	98.3	Very high	95.3	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	104	178.7	-173.3	0	0	0	0	108.9	V564 L566 I594 V629 L631 A641	V564-V596 PolarHBondContact O-N 3.31Å; L566-V596 PolarHBondContact N-O 2.93Å; I594-V596 HydrophobicContact CG2-CG2 4.22Å; V596-V629 CarbonylContact C-O 3.58Å; V596-V629 WeakPolarHBondContact CA-O 3.47Å; V596-L631 HydrophobicContact CG1-CD1 3.67Å; V596-L631 HydrophobicContact CG1-CD2 3.94Å; V596-L631 HydrophobicContact CG1-CG 3.73Å; V596-A641 HydrophobicContact CB-CB 3.92Å; V596-A641 HydrophobicContact CG1-CB 3.65Å
597	L	98	Very high	95.4	Very high	3 Å²	3	41.5 Å²	41.5	2%	0.016	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	126.9	-173.7	177.5	63.9	0	0	0	111.4	L566 P599 I609 L628 V629 V630 L631	L566-L597 HydrophobicContact CB-CD1 4.35Å; L566-L597 HydrophobicContact CD2-CD1 4.06Å; L566-L597 HydrophobicContact CG-CD1 4.17Å; L597-P599 WeakPolarHBondContact O-CD 3.39Å; L597-I609 HydrophobicContact CD1-CD1 4.13Å; L597-I609 HydrophobicContact CD1-CG2 4.34Å; L597-I609 HydrophobicContact CD2-CG2 3.97Å; L597-L628 HydrophobicContact CB-CD1 3.79Å; L597-L628 HydrophobicContact CD2-CD1 4.41Å; L597-V629 PolarHBondContact N-O 2.88Å; L597-V630 HydrophobicContact CD2-CG2 4.37Å; L597-L631 PolarHBondContact O-N 2.94Å
598	F	96.9	Very high	95.5	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.223	C	C	.	.			trans	-90.3	114	162	-72.7	-101.8	0	0	0	109.2	L566 H567 S600 L631 Q634 P635 F636 N637 F640 A641	L566-F598 PolarHBondContact O-N 3.36Å; H567-F598 HydrophobicContact CB-CB 4.18Å; H567-F598 PolarHBondContact ND1-O 2.04Å; F598-S600 PolarHBondContact O-N 3.49Å; F598-L631 HydrophobicContact CD1-CD1 4.09Å; F598-L631 HydrophobicContact CD2-CD1 4.01Å; F598-L631 HydrophobicContact CE1-CD1 3.73Å; F598-L631 HydrophobicContact CE2-CD1 3.71Å; F598-L631 HydrophobicContact CG-CD1 4.21Å; F598-L631 HydrophobicContact CZ-CD1 3.52Å; F598-Q634 HydrophobicContact CD1-CG 3.77Å; F598-Q634 HydrophobicContact CE1-CG 3.66Å; F598-P635 WeakPolarHBondContact CE1-O 3.44Å; F598-F636 AromaticContact CD2-CD2 3.45Å; F598-F636 HydrophobicContact CD2-CD2 3.45Å; F598-F636 VanDerWaalsContact CD2-CD2 3.45Å; F598-F636 AromaticContact CD2-CE2 3.93Å; F598-F636 HydrophobicContact CD2-CE2 3.93Å; F598-F636 AromaticContact CE2-CD2 3.65Å; F598-F636 HydrophobicContact CE2-CD2 3.65Å; F598-F636 AromaticContact CE2-CE2 3.95Å; F598-F636 HydrophobicContact CE2-CE2 3.95Å; F598-F636 HydrophobicContact CG-CD2 4.03Å; F598-F636 HydrophobicContact CZ-CD2 4.45Å; F598-N637 HydrophobicContact CZ-CB 4.34Å; F598-N637 VanDerWaalsContact CZ-N 3.32Å; F598-N637 VanDerWaalsContact CZ-O 3.29Å; F598-N637 WeakPolarHBondContact CZ-O 3.44Å; F598-F640 HydrophobicContact CE1-CD1 4.47Å; F598-F640 HydrophobicContact CZ-CD1 4.18Å; F598-A641 HydrophobicContact CE2-CB 3.51Å; F598-A641 HydrophobicContact CZ-CB 4.09Å
599	P	95.7	Very high	95.8	Very high	27 Å²	27	38.2 Å²	38.2	18%	0.175	20%	0.199	C	C	.	.			trans	-53.5	138	179.7	-26.6	34	0	0	0	112.4	L597 D606 V630 L631	L597-P599 WeakPolarHBondContact O-CD 3.39Å; P599-D606 VanDerWaalsContact CA-OD2 3.24Å; P599-D606 WeakPolarHBondContact CA-OD2 3.47Å; P599-V630 HydrophobicContact CG-CG1 3.66Å; P599-L631 WeakPolarHBondContact CD-O 3.33Å; P599-L631 WeakPolarHBondContact CG-O 3.21Å
600	S	93.1	Very high	95.9	Very high	11 Å²	11	38.2 Å²	38.2	8%	0.077	21%	0.205	C	C	.	.			trans	-96.6	-178.7	176.2	76.3	0	0	0	0	111.4	K568 F598 D602 S605 D606	K568-S600 VanDerWaalsContact CG-CB 3.43Å; F598-S600 PolarHBondContact O-N 3.49Å; S600-D602 VanDerWaalsContact C-N 3.28Å; S600-D602 PolarHBondContact OG-N 2.72Å; S600-D602 PolarHBondContact OG-O 2.75Å; S600-D602 VanDerWaalsContact OG-O 3.11Å; S600-S605 PolarHBondContact OG-OG 2.85Å; S600-D606 WeakPolarHBondContact CB-OD1 3.48Å; S600-D606 PolarHBondContact N-OD2 3.38Å; S600-D606 VanDerWaalsContact OG-CG 3.28Å; S600-D606 PolarHBondContact OG-OD1 2.81Å; S600-D606 PolarHBondContact OG-OD2 3.35Å
601	D	92.6	Very high	96	Very high	113 Å²	113	38.2 Å²	38.2	60%	0.604	21%	0.206	S	C	*	.	S	Bend	trans	-84.6	-10.4	170.4	-52.8	-62.3	0	0	0	111.7	K568 K633	K568-D601 IonicContact NZ-OD2 2.94Å; K568-D601 PolarHBondContact NZ-OD2 3.35Å; D601-K633 WeakPolarHBondContact OD1-CE 3.42Å; D601-K633 IonicContact OD1-NZ 3.75Å; D601-K633 PolarHBondContact OD1-NZ 2.9Å
602	D	92.9	Very high	96.1	Very high	87 Å²	87	39.4 Å²	39.4	47%	0.465	21%	0.213	S	C	.	.			trans	-99.1	87.4	179	-178.8	-9.8	0	0	0	108.7	S600 E604 S605 D606	S600-D602 VanDerWaalsContact C-N 3.28Å; S600-D602 PolarHBondContact OG-N 2.72Å; S600-D602 PolarHBondContact OG-O 2.75Å; S600-D602 VanDerWaalsContact OG-O 3.11Å; D602-E604 PolarHBondContact O-N 2.93Å; D602-E604 PolarHBondContact OD1-N 2.84Å; D602-S605 WeakPolarHBondContact CB-OG 3.42Å; D602-S605 PolarHBondContact O-N 2.91Å; D602-S605 PolarHBondContact O-OG 3.29Å; D602-S605 PolarHBondContact OD1-N 3.18Å; D602-S605 WeakPolarHBondContact OD2-CB 3.08Å; D602-D606 PolarHBondContact O-N 2.71Å; D602-D606 VanDerWaalsContact O-N 3.14Å
603	S	91.5	Very high	96.1	Very high	97 Å²	97	39.4 Å²	39.4	68%	0.678	21%	0.213	S	C	*	.	H	α-helix	trans	-61.5	-28.2	-178.6	56.3	0	0	0	0	113.2	F607	S603-F607 VanDerWaalsContact O-CB 3.27Å; S603-F607 WeakPolarHBondContact O-CB 3.01Å; S603-F607 PolarHBondContact O-N 3Å
604	E	95.3	Very high	96	Very high	106 Å²	106	44.3 Å²	44.3	50%	0.495	24%	0.236	S	C	.	.	H	α-helix	trans	-69	-45.8	177.4	-178.2	58.1	-147.7	0	0	109.9	D602 D606 F607 Q608	D602-E604 PolarHBondContact O-N 2.93Å; D602-E604 PolarHBondContact OD1-N 2.84Å; E604-D606 VanDerWaalsContact C-N 3.34Å; E604-D606 PolarHBondContact O-N 2.87Å; E604-F607 PolarHBondContact O-N 2.9Å; E604-Q608 WeakPolarHBondContact O-CG 3.4Å; E604-Q608 PolarHBondContact O-N 2.88Å; E604-Q608 PolarHBondContact OE1-NE2 3.29Å
605	S	94.5	Very high	95.9	Very high	13 Å²	13	48.3 Å²	48.3	9%	0.091	26%	0.257	C	S	.	.	H	α-helix	trans	-62.1	-40.3	176.1	78.1	0	0	0	0	112.8	S600 D602 Q608 I609	S600-S605 PolarHBondContact OG-OG 2.85Å; D602-S605 WeakPolarHBondContact CB-OG 3.42Å; D602-S605 PolarHBondContact O-N 2.91Å; D602-S605 PolarHBondContact O-OG 3.29Å; D602-S605 PolarHBondContact OD1-N 3.18Å; D602-S605 WeakPolarHBondContact OD2-CB 3.08Å; S605-Q608 PolarHBondContact O-N 3.14Å; S605-I609 WeakPolarHBondContact O-CG1 3.27Å; S605-I609 PolarHBondContact O-N 3.21Å
606	D	95.1	Very high	95.8	Very high	21 Å²	21	48.7 Å²	48.7	11%	0.112	26%	0.26	C	S	.	.	H	α-helix	trans	-68.3	-37.6	177.5	-75.4	3.7	0	0	0	111.4	P599 S600 D602 E604 I609 A610	P599-D606 VanDerWaalsContact CA-OD2 3.24Å; P599-D606 WeakPolarHBondContact CA-OD2 3.47Å; S600-D606 WeakPolarHBondContact CB-OD1 3.48Å; S600-D606 PolarHBondContact N-OD2 3.38Å; S600-D606 VanDerWaalsContact OG-CG 3.28Å; S600-D606 PolarHBondContact OG-OD1 2.81Å; S600-D606 PolarHBondContact OG-OD2 3.35Å; D602-D606 PolarHBondContact O-N 2.71Å; D602-D606 VanDerWaalsContact O-N 3.14Å; E604-D606 VanDerWaalsContact C-N 3.34Å; E604-D606 PolarHBondContact O-N 2.87Å; D606-I609 WeakPolarHBondContact O-CB 3.42Å; D606-I609 PolarHBondContact O-N 2.96Å; D606-A610 PolarHBondContact O-N 2.86Å
607	F	96.4	Very high	95.7	Very high	121 Å²	121	52.3 Å²	52.3	53%	0.531	28%	0.276	S	S	.	.	H	α-helix	trans	-63.3	-44.6	173.6	179	-98.9	0	0	0	111.3	S603 E604 I609 A610 Q611	S603-F607 VanDerWaalsContact O-CB 3.27Å; S603-F607 WeakPolarHBondContact O-CB 3.01Å; S603-F607 PolarHBondContact O-N 3Å; E604-F607 PolarHBondContact O-N 2.9Å; F607-I609 VanDerWaalsContact C-N 3.33Å; F607-I609 PolarHBondContact O-N 2.79Å; F607-A610 PolarHBondContact O-N 3.45Å; F607-A610 VanDerWaalsContact O-N 3.16Å; F607-Q611 WeakPolarHBondContact O-CB 3.41Å; F607-Q611 PolarHBondContact O-N 3.09Å
608	Q	97.3	Very high	95.6	Very high	64 Å²	64	56.4 Å²	56.4	30%	0.299	30%	0.301	S	S	.	.	H	α-helix	trans	-65.5	-34.5	176.6	-69.8	179.5	15.5	0	0	112.6	L570 E604 S605 T612	L570-Q608 HydrophobicContact CD1-CB 3.79Å; L570-Q608 HydrophobicContact CD2-CB 3.97Å; E604-Q608 WeakPolarHBondContact O-CG 3.4Å; E604-Q608 PolarHBondContact O-N 2.88Å; E604-Q608 PolarHBondContact OE1-NE2 3.29Å; S605-Q608 PolarHBondContact O-N 3.14Å; Q608-T612 WeakPolarHBondContact O-CB 3.01Å; Q608-T612 PolarHBondContact O-N 2.89Å; Q608-T612 PolarHBondContact O-OG1 3.35Å
609	I	97.1	Very high	95.5	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-60.1	-49.7	170.3	-76.5	164.8	0	0	0	110.2	L566 L570 L573 L597 S605 D606 F607 Q611 T612 L613	L566-I609 HydrophobicContact CD2-CD1 3.97Å; L566-I609 HydrophobicContact CD2-CG1 4.28Å; L566-I609 HydrophobicContact CD2-CG2 3.77Å; L570-I609 HydrophobicContact CB-CD1 4.42Å; L570-I609 HydrophobicContact CB-CG1 4.17Å; L570-I609 HydrophobicContact CD1-CG1 3.79Å; L573-I609 HydrophobicContact CD2-CB 4.05Å; L573-I609 HydrophobicContact CD2-CG1 3.9Å; L573-I609 HydrophobicContact CD2-CG2 3.63Å; L597-I609 HydrophobicContact CD1-CD1 4.13Å; L597-I609 HydrophobicContact CD1-CG2 4.34Å; L597-I609 HydrophobicContact CD2-CG2 3.97Å; S605-I609 WeakPolarHBondContact O-CG1 3.27Å; S605-I609 PolarHBondContact O-N 3.21Å; D606-I609 WeakPolarHBondContact O-CB 3.42Å; D606-I609 PolarHBondContact O-N 2.96Å; F607-I609 VanDerWaalsContact C-N 3.33Å; F607-I609 PolarHBondContact O-N 2.79Å; I609-Q611 PolarHBondContact O-N 2.82Å; I609-T612 PolarHBondContact O-N 2.72Å; I609-L613 HydrophobicContact CG2-CD1 4.42Å; I609-L613 PolarHBondContact O-N 2.85Å
610	A	96.6	Very high	95.4	Very high	34 Å²	34	60.7 Å²	60.7	28%	0.281	33%	0.325	S	S	.	.	H	α-helix	trans	-62.2	-43.9	179.9	0	0	0	0	0	111.8	D606 F607 L613 H614 L628	D606-A610 PolarHBondContact O-N 2.86Å; F607-A610 PolarHBondContact O-N 3.45Å; F607-A610 VanDerWaalsContact O-N 3.16Å; A610-L613 PolarHBondContact O-N 3.23Å; A610-H614 VanDerWaalsContact O-CB 3.29Å; A610-H614 WeakPolarHBondContact O-CB 3.48Å; A610-H614 PolarHBondContact O-N 3.07Å; A610-L628 HydrophobicContact CB-CD2 3.75Å
611	Q	97.3	Very high	95.3	Very high	94 Å²	94	66.8 Å²	66.8	44%	0.439	35%	0.352	S	S	.	.	H	α-helix	trans	-63.6	-41.5	177.2	-169.4	178.1	16.6	0	0	112.1	F607 I609 L613 H614 N615	F607-Q611 WeakPolarHBondContact O-CB 3.41Å; F607-Q611 PolarHBondContact O-N 3.09Å; I609-Q611 PolarHBondContact O-N 2.82Å; Q611-L613 VanDerWaalsContact C-N 3.33Å; Q611-L613 PolarHBondContact O-N 3.22Å; Q611-H614 PolarHBondContact O-N 2.73Å; Q611-N615 WeakPolarHBondContact O-CB 3.39Å; Q611-N615 PolarHBondContact O-N 2.8Å; Q611-N615 PolarHBondContact O-ND2 3.31Å; Q611-N615 PolarHBondContact O-OD1 3.31Å
612	T	97.4	Very high	95.1	Very high	28 Å²	28	71.3 Å²	71.3	17%	0.172	37%	0.367	C	S	.	.	H	α-helix	trans	-58.9	-45.1	177.5	-60.2	0	0	0	0	111.2	Q574 V577 Q608 I609 L616	Q574-T612 HydrophobicContact CG-CG2 4.35Å; V577-T612 HydrophobicContact CB-CG2 4.38Å; V577-T612 HydrophobicContact CG1-CG2 4.25Å; V577-T612 HydrophobicContact CG2-CG2 4.3Å; Q608-T612 WeakPolarHBondContact O-CB 3.01Å; Q608-T612 PolarHBondContact O-N 2.89Å; Q608-T612 PolarHBondContact O-OG1 3.35Å; I609-T612 PolarHBondContact O-N 2.72Å; T612-L616 PolarHBondContact O-N 3Å
613	L	97.2	Very high	94.8	Very high	3 Å²	3	72.2 Å²	72.2	2%	0.016	37%	0.368	C	S	.	.	H	α-helix	trans	-74.4	-38	179.3	-69.7	168.5	0	0	0	112.5	L573 V577 L593 V595 I609 A610 Q611 L616 E617 I626 L628	L573-L613 HydrophobicContact CD2-CD1 4.3Å; L573-L613 HydrophobicContact CD2-CG 4.3Å; V577-L613 HydrophobicContact CG2-CD2 4.09Å; L593-L613 HydrophobicContact CD2-CD2 4.25Å; V595-L613 HydrophobicContact CB-CD1 3.72Å; V595-L613 HydrophobicContact CG1-CD1 3.94Å; V595-L613 HydrophobicContact CG2-CD1 3.84Å; V595-L613 HydrophobicContact CG2-CD2 3.87Å; I609-L613 HydrophobicContact CG2-CD1 4.42Å; I609-L613 PolarHBondContact O-N 2.85Å; A610-L613 PolarHBondContact O-N 3.23Å; Q611-L613 VanDerWaalsContact C-N 3.33Å; Q611-L613 PolarHBondContact O-N 3.22Å; L613-L616 PolarHBondContact O-N 2.89Å; L613-E617 WeakPolarHBondContact O-CB 3.42Å; L613-E617 PolarHBondContact O-N 2.87Å; L613-I626 HydrophobicContact CD2-CG2 4.44Å; L613-L628 HydrophobicContact CD1-CB 4.11Å; L613-L628 HydrophobicContact CD1-CD1 3.81Å; L613-L628 HydrophobicContact CD1-CD2 4.28Å; L613-L628 HydrophobicContact CD1-CG 4.28Å
614	H	96.8	Very high	94.8	Very high	104 Å²	104	68.2 Å²	68.2	48%	0.481	34%	0.34	S	S	.	.	H	α-helix	trans	-62.8	-43.3	176	-176.1	58.5	0	0	0	111.8	A610 Q611 L616 E617 V618	A610-H614 VanDerWaalsContact O-CB 3.29Å; A610-H614 WeakPolarHBondContact O-CB 3.48Å; A610-H614 PolarHBondContact O-N 3.07Å; Q611-H614 PolarHBondContact O-N 2.73Å; H614-L616 VanDerWaalsContact C-N 3.29Å; H614-L616 PolarHBondContact O-N 3.28Å; H614-E617 IonicContact ND1-OE2 2.76Å; H614-E617 WeakPolarHBondContact O-CB 3.36Å; H614-E617 PolarHBondContact O-N 3.29Å; H614-V618 WeakPolarHBondContact O-CG2 3.38Å; H614-V618 PolarHBondContact O-N 3.3Å
615	N	96.1	Very high	94.6	Very high	88 Å²	88	67.6 Å²	67.6	47%	0.471	34%	0.34	S	S	.	.	H	α-helix	trans	-59.2	-42.3	174.9	-70.6	-13.7	0	0	0	111.4	Q611 V619	Q611-N615 WeakPolarHBondContact O-CB 3.39Å; Q611-N615 PolarHBondContact O-N 2.8Å; Q611-N615 PolarHBondContact O-ND2 3.31Å; Q611-N615 PolarHBondContact O-OD1 3.31Å; N615-V619 VanDerWaalsContact O-CG2 3.28Å; N615-V619 WeakPolarHBondContact O-CG2 3.36Å; N615-V619 PolarHBondContact O-N 2.97Å
616	L	96.2	Very high	94.7	Very high	9 Å²	9	67.1 Å²	67.1	5%	0.047	34%	0.337	C	S	.	.	H	α-helix	trans	-66.1	-42.6	177.3	-163.7	73.8	0	0	0	111.7	V577 E581 L585 L593 T612 L613 H614 V619 Y620 I626	V577-L616 HydrophobicContact CG1-CD1 3.91Å; V577-L616 HydrophobicContact CG1-CD2 3.76Å; V577-L616 HydrophobicContact CG1-CG 4.27Å; V577-L616 HydrophobicContact CG2-CD2 4.47Å; E581-L616 HydrophobicContact CB-CD1 4.12Å; E581-L616 HydrophobicContact CG-CD1 4.04Å; L585-L616 HydrophobicContact CD1-CD1 3.9Å; L585-L616 HydrophobicContact CD1-CD2 3.92Å; L585-L616 HydrophobicContact CD1-CG 3.94Å; L593-L616 HydrophobicContact CD2-CD2 4.4Å; T612-L616 PolarHBondContact O-N 3Å; L613-L616 PolarHBondContact O-N 2.89Å; H614-L616 VanDerWaalsContact C-N 3.29Å; H614-L616 PolarHBondContact O-N 3.28Å; L616-V619 PolarHBondContact O-N 3.4Å; L616-Y620 HydrophobicContact CD1-CD2 3.99Å; L616-Y620 HydrophobicContact CD1-CE2 4.02Å; L616-Y620 HydrophobicContact CG-CD2 4.3Å; L616-Y620 WeakPolarHBondContact O-CD2 3.31Å; L616-Y620 PolarHBondContact O-N 3.31Å; L616-I626 HydrophobicContact CB-CD1 4.15Å; L616-I626 HydrophobicContact CD2-CD1 3.77Å; L616-I626 HydrophobicContact CG-CD1 3.64Å; L616-I626 WeakPolarHBondContact O-CD1 3.34Å
617	E	95.7	Very high	94.7	Very high	75 Å²	75	67.8 Å²	67.8	35%	0.35	34%	0.343	S	S	.	.	H	α-helix	trans	-58.9	-49.1	176.5	-174.3	-170	-177.8	0	0	111.5	L613 H614 V619 Y620 Q621 I626	L613-E617 WeakPolarHBondContact O-CB 3.42Å; L613-E617 PolarHBondContact O-N 2.87Å; H614-E617 IonicContact ND1-OE2 2.76Å; H614-E617 WeakPolarHBondContact O-CB 3.36Å; H614-E617 PolarHBondContact O-N 3.29Å; E617-V619 VanDerWaalsContact C-N 3.3Å; E617-V619 PolarHBondContact O-N 3.43Å; E617-Y620 CarbonylContact O-C 3.59Å; E617-Y620 PolarHBondContact O-N 3.36Å; E617-Q621 VanDerWaalsContact O-CA 3.27Å; E617-Q621 WeakPolarHBondContact O-CA 3.11Å; E617-Q621 VanDerWaalsContact O-CB 3.3Å; E617-Q621 WeakPolarHBondContact O-CB 3.38Å; E617-Q621 PolarHBondContact O-N 3.23Å; E617-I626 HydrophobicContact CB-CB 4.09Å; E617-I626 HydrophobicContact CB-CG2 4.25Å; E617-I626 HydrophobicContact CG-CB 4.35Å
618	V	95.2	Very high	94.8	Very high	89 Å²	89	64.6 Å²	64.6	54%	0.539	33%	0.331	S	S	.	.	H	α-helix	trans	-60	-40.5	179.8	172.8	0	0	0	0	111.5	H614	H614-V618 WeakPolarHBondContact O-CG2 3.38Å; H614-V618 PolarHBondContact O-N 3.3Å
619	V	95	Very high	94.7	Very high	99 Å²	99	62.9 Å²	62.9	60%	0.6	33%	0.325	S	S	*	.	H	α-helix	trans	-70.1	-38.7	-179.4	176.1	0	0	0	0	111.8	N615 L616 E617	N615-V619 VanDerWaalsContact O-CG2 3.28Å; N615-V619 WeakPolarHBondContact O-CG2 3.36Å; N615-V619 PolarHBondContact O-N 2.97Å; L616-V619 PolarHBondContact O-N 3.4Å; E617-V619 VanDerWaalsContact C-N 3.3Å; E617-V619 PolarHBondContact O-N 3.43Å
620	Y	95	Very high	94.7	Very high	19 Å²	19	67 Å²	67	8%	0.075	35%	0.35	C	S	.	.	H	α-helix	trans	-110.8	12.3	-171.6	-67.1	-79.7	0	0	0	115	E581 L585 R586 L616 E617 K622 Q623 S624	E581-Y620 HydrophobicContact CG-CE2 3.64Å; E581-Y620 WeakPolarHBondContact CG-OH 3.48Å; E581-Y620 PolarHBondContact OE1-OH 3.38Å; L585-Y620 HydrophobicContact CB-CD1 3.88Å; L585-Y620 HydrophobicContact CB-CD2 4.39Å; L585-Y620 HydrophobicContact CB-CE1 3.75Å; L585-Y620 HydrophobicContact CB-CE2 4.28Å; L585-Y620 HydrophobicContact CB-CG 4.21Å; L585-Y620 HydrophobicContact CD1-CD2 3.75Å; L585-Y620 HydrophobicContact CD1-CE2 4.08Å; L585-Y620 HydrophobicContact CD1-CG 4Å; R586-Y620 VanDerWaalsContact CG-OH 3.25Å; R586-Y620 WeakPolarHBondContact CG-OH 3.41Å; L616-Y620 HydrophobicContact CD1-CD2 3.99Å; L616-Y620 HydrophobicContact CD1-CE2 4.02Å; L616-Y620 HydrophobicContact CG-CD2 4.3Å; L616-Y620 WeakPolarHBondContact O-CD2 3.31Å; L616-Y620 PolarHBondContact O-N 3.31Å; E617-Y620 CarbonylContact O-C 3.59Å; E617-Y620 PolarHBondContact O-N 3.36Å; Y620-K622 PolarHBondContact O-N 3.36Å; Y620-Q623 PolarHBondContact O-N 3.23Å; Y620-S624 PolarHBondContact O-N 3.01Å
621	Q	90.9	Very high	94.7	Very high	139 Å²	139	66.3 Å²	66.3	65%	0.65	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.1	-35.1	-174.1	-163.5	-177.3	17.1	0	0	114.3	E617	E617-Q621 VanDerWaalsContact O-CA 3.27Å; E617-Q621 WeakPolarHBondContact O-CA 3.11Å; E617-Q621 VanDerWaalsContact O-CB 3.3Å; E617-Q621 WeakPolarHBondContact O-CB 3.38Å; E617-Q621 PolarHBondContact O-N 3.23Å
622	K	87.5	Confident	94.5	Very high	208 Å²	208	70.7 Å²	70.7	90%	0.904	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-17.8	-179.9	-64.4	-176	-179.3	178.8	0	114	Y620	Y620-K622 PolarHBondContact O-N 3.36Å
623	Q	86.2	Confident	94.4	Very high	105 Å²	105	76.2 Å²	76.2	49%	0.491	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	-34.2	-169.3	-61.7	179.4	33.3	0	0	112.5	Y620	Y620-Q623 PolarHBondContact O-N 3.23Å
624	S	91	Very high	94.2	Very high	14 Å²	14	79.7 Å²	79.7	10%	0.098	40%	0.397	C	S	.	.			trans	-149.1	147.3	-174	-60.4	0	0	0	0	111	L585 V591 Y620	L585-S624 VanDerWaalsContact CD2-OG 3.27Å; L585-S624 WeakPolarHBondContact CD2-OG 3.38Å; V591-S624 VanDerWaalsContact O-CB 3.27Å; V591-S624 WeakPolarHBondContact O-CB 2.84Å; V591-S624 PolarHBondContact O-OG 2.93Å; Y620-S624 PolarHBondContact O-N 3.01Å
625	N	92.8	Very high	94	Very high	92 Å²	92	80 Å²	80	49%	0.492	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	122	171.9	-177.6	-9.9	0	0	0	108.7	S592 L593 S627	S592-N625 CarbonylContact C-O 3.59Å; S592-N625 VanDerWaalsContact CA-O 3.27Å; S592-N625 WeakPolarHBondContact CA-O 3.43Å; S592-N625 PolarHBondContact OG-O 3.19Å; L593-N625 PolarHBondContact N-O 2.95Å; N625-S627 PolarHBondContact OD1-OG 3.07Å
626	I	96.7	Very high	93.8	Very high	4 Å²	4	80 Å²	80	2%	0.021	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	114.4	175.9	-62.4	163	0	0	0	106.3	L585 L593 L613 L616 E617	L585-I626 HydrophobicContact CD1-CD1 4.27Å; L593-I626 HydrophobicContact CB-CG1 4.48Å; L593-I626 CarbonylContact O-C 3.56Å; L593-I626 WeakPolarHBondContact O-CA 3.45Å; L613-I626 HydrophobicContact CD2-CG2 4.44Å; L616-I626 HydrophobicContact CB-CD1 4.15Å; L616-I626 HydrophobicContact CD2-CD1 3.77Å; L616-I626 HydrophobicContact CG-CD1 3.64Å; L616-I626 WeakPolarHBondContact O-CD1 3.34Å; E617-I626 HydrophobicContact CB-CB 4.09Å; E617-I626 HydrophobicContact CB-CG2 4.25Å; E617-I626 HydrophobicContact CG-CB 4.35Å
627	S	95.1	Very high	93.7	Very high	35 Å²	35	80.7 Å²	80.7	25%	0.245	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	131.9	-174.1	-70.2	0	0	0	0	110.7	L593 I594 V595 N625	L593-S627 PolarHBondContact O-N 2.79Å; I594-S627 WeakPolarHBondContact CA-O 3.33Å; V595-S627 PolarHBondContact N-O 3.16Å; N625-S627 PolarHBondContact OD1-OG 3.07Å
628	L	97.2	Very high	93.7	Very high	53 Å²	53	78.4 Å²	78.4	28%	0.277	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	122.4	168.6	173.1	60.7	0	0	0	109.5	V595 L597 A610 L613 V630	V595-L628 HydrophobicContact CB-CD1 4.33Å; V595-L628 HydrophobicContact CG1-CD1 4.27Å; L597-L628 HydrophobicContact CB-CD1 3.79Å; L597-L628 HydrophobicContact CD2-CD1 4.41Å; A610-L628 HydrophobicContact CB-CD2 3.75Å; L613-L628 HydrophobicContact CD1-CB 4.11Å; L613-L628 HydrophobicContact CD1-CD1 3.81Å; L613-L628 HydrophobicContact CD1-CD2 4.28Å; L613-L628 HydrophobicContact CD1-CG 4.28Å; L628-V630 HydrophobicContact CD1-CG2 4.43Å; L628-V630 HydrophobicContact CD2-CG2 4.23Å; L628-V630 HydrophobicContact CG-CG2 4.05Å
629	V	96.5	Very high	93.8	Very high	28 Å²	28	74.1 Å²	74.1	17%	0.17	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	111.7	172.9	177.3	0	0	0	0	109.8	V595 V596 L597 L631 L648	V595-V629 PolarHBondContact O-N 3.48Å; V596-V629 CarbonylContact C-O 3.58Å; V596-V629 WeakPolarHBondContact CA-O 3.47Å; L597-V629 PolarHBondContact N-O 2.88Å; V629-L631 HydrophobicContact CG1-CD2 4.24Å; V629-L648 HydrophobicContact CB-CD1 4.38Å; V629-L648 HydrophobicContact CG2-CD1 3.32Å
630	V	96.3	Very high	93.8	Very high	87 Å²	87	72.9 Å²	72.9	53%	0.527	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	117.7	176.4	-171.8	0	0	0	0	109.1	L597 P599 L628	L597-V630 HydrophobicContact CD2-CG2 4.37Å; P599-V630 HydrophobicContact CG-CG1 3.66Å; L628-V630 HydrophobicContact CD1-CG2 4.43Å; L628-V630 HydrophobicContact CD2-CG2 4.23Å; L628-V630 HydrophobicContact CG-CG2 4.05Å
631	L	96	Very high	93.9	Very high	19 Å²	19	72 Å²	72	10%	0.099	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-80.1	163.7	177.9	-60.5	-179	0	0	0	111.6	V596 L597 F598 P599 V629 F640 R644	V596-L631 HydrophobicContact CG1-CD1 3.67Å; V596-L631 HydrophobicContact CG1-CD2 3.94Å; V596-L631 HydrophobicContact CG1-CG 3.73Å; L597-L631 PolarHBondContact O-N 2.94Å; F598-L631 HydrophobicContact CD1-CD1 4.09Å; F598-L631 HydrophobicContact CD2-CD1 4.01Å; F598-L631 HydrophobicContact CE1-CD1 3.73Å; F598-L631 HydrophobicContact CE2-CD1 3.71Å; F598-L631 HydrophobicContact CG-CD1 4.21Å; F598-L631 HydrophobicContact CZ-CD1 3.52Å; P599-L631 WeakPolarHBondContact CD-O 3.33Å; P599-L631 WeakPolarHBondContact CG-O 3.21Å; V629-L631 HydrophobicContact CG1-CD2 4.24Å; L631-F640 HydrophobicContact CD1-CD1 3.99Å; L631-F640 HydrophobicContact CD1-CE1 3.96Å; L631-F640 HydrophobicContact CD2-CE1 4.36Å; L631-R644 HydrophobicContact CD2-CG 3.92Å
632	K	94.5	Very high	94.3	Very high	187 Å²	187	65.4 Å²	65.4	81%	0.813	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-62.7	146.5	167.9	-65.3	-176.9	179.2	-179	0	110	Q634	K632-Q634 WeakPolarHBondContact O-CG 2.99Å; K632-Q634 PolarHBondContact O-N 3.39Å
633	K	93.7	Very high	94.7	Very high	144 Å²	144	56.3 Å²	56.3	63%	0.626	29%	0.285	S	S	*	.	S	Bend	trans	-57.1	111.8	179.3	-172.1	167.7	-174.2	165.4	0	110.4	D601	D601-K633 WeakPolarHBondContact OD1-CE 3.42Å; D601-K633 IonicContact OD1-NZ 3.75Å; D601-K633 PolarHBondContact OD1-NZ 2.9Å
634	Q	93.7	Very high	95.3	Very high	75 Å²	75	55.9 Å²	55.9	35%	0.35	28%	0.279	S	S	.	.			trans	-159.2	162.7	-177.9	70.5	-170.5	-46.7	0	0	109.8	F598 K632 F640	F598-Q634 HydrophobicContact CD1-CG 3.77Å; F598-Q634 HydrophobicContact CE1-CG 3.66Å; K632-Q634 WeakPolarHBondContact O-CG 2.99Å; K632-Q634 PolarHBondContact O-N 3.39Å; Q634-F640 VanDerWaalsContact NE2-CE1 3.34Å
635	P	91.8	Very high	95.6	Very high	112 Å²	112	55.2 Å²	55.2	73%	0.727	27%	0.274	S	S	*	.			trans	-57.9	143.4	175.7	-23.6	34.4	0	0	0	112.1	F598 N637	F598-P635 WeakPolarHBondContact CE1-O 3.44Å; P635-N637 PolarHBondContact O-N 3.3Å
636	F	93	Very high	95.8	Very high	88 Å²	88	50.8 Å²	50.8	39%	0.386	25%	0.251	S	S	.	.			trans	-58.1	127.8	177.8	178.7	-103.6	0	0	0	111.3	P565 H567 F598 R638	P565-F636 HydrophobicContact CB-CE2 4.16Å; P565-F636 HydrophobicContact CB-CZ 4.24Å; H567-F636 HydrophobicContact CB-CB 4.3Å; H567-F636 HydrophobicContact CB-CD2 3.57Å; H567-F636 HydrophobicContact CB-CE2 4.17Å; H567-F636 HydrophobicContact CB-CG 4.13Å; F598-F636 AromaticContact CD2-CD2 3.45Å; F598-F636 HydrophobicContact CD2-CD2 3.45Å; F598-F636 VanDerWaalsContact CD2-CD2 3.45Å; F598-F636 AromaticContact CD2-CE2 3.93Å; F598-F636 HydrophobicContact CD2-CE2 3.93Å; F598-F636 AromaticContact CE2-CD2 3.65Å; F598-F636 HydrophobicContact CE2-CD2 3.65Å; F598-F636 AromaticContact CE2-CE2 3.95Å; F598-F636 HydrophobicContact CE2-CE2 3.95Å; F598-F636 HydrophobicContact CG-CD2 4.03Å; F598-F636 HydrophobicContact CZ-CD2 4.45Å; F636-R638 HydrophobicContact CE1-CB 4.06Å; F636-R638 HydrophobicContact CZ-CB 4.09Å
637	N	94.6	Very high	95.8	Very high	23 Å²	23	55.6 Å²	55.6	12%	0.123	27%	0.273	C	S	.	.			trans	-138.5	107.7	174.4	-178.8	-28.5	0	0	0	109.1	F598 P635 A639 F640 A641 T733 I735	F598-N637 HydrophobicContact CZ-CB 4.34Å; F598-N637 VanDerWaalsContact CZ-N 3.32Å; F598-N637 VanDerWaalsContact CZ-O 3.29Å; F598-N637 WeakPolarHBondContact CZ-O 3.44Å; P635-N637 PolarHBondContact O-N 3.3Å; N637-A639 PolarHBondContact O-N 3.4Å; N637-A639 WeakPolarHBondContact OD1-CB 3.47Å; N637-A639 PolarHBondContact OD1-N 2.84Å; N637-A639 VanDerWaalsContact OD1-N 3.13Å; N637-F640 HydrophobicContact CB-CB 3.87Å; N637-F640 PolarHBondContact O-N 2.81Å; N637-F640 PolarHBondContact OD1-N 2.79Å; N637-A641 PolarHBondContact O-N 2.94Å; N637-A641 VanDerWaalsContact O-N 3.08Å; N637-T733 PolarHBondContact ND2-O 3.2Å; N637-T733 VanDerWaalsContact ND2-O 3.09Å; N637-I735 PolarHBondContact ND2-O 3.25Å
638	R	94.9	Very high	95.8	Very high	26 Å²	26	57.3 Å²	57.3	10%	0.098	28%	0.279	C	S	.	.	H	α-helix	trans	-59.7	-47.3	-177	-175.2	168.9	176.8	-75.8	-9.1	112.1	P565 F636 F640 A641 L642 D659 G716 E741	P565-R638 HydrophobicContact CG-CG 3.93Å; F636-R638 HydrophobicContact CE1-CB 4.06Å; F636-R638 HydrophobicContact CZ-CB 4.09Å; R638-F640 VanDerWaalsContact C-N 3.33Å; R638-F640 PolarHBondContact O-N 2.93Å; R638-A641 PolarHBondContact O-N 3.11Å; R638-L642 HydrophobicContact CG-CD1 4.04Å; R638-L642 HydrophobicContact CG-CG 4.43Å; R638-L642 WeakPolarHBondContact O-CG 3.42Å; R638-L642 PolarHBondContact O-N 3.08Å; R638-D659 IonicContact CZ-OD1 3.29Å; R638-D659 IonicContact NE-OD1 3.41Å; R638-D659 PolarHBondContact NE-OD1 3.01Å; R638-D659 IonicContact NH2-OD1 2.65Å; R638-D659 PolarHBondContact NH2-OD1 2.78Å; R638-G716 PolarHBondContact NH2-O 3.4Å; R638-E741 WeakPolarHBondContact CD-OE1 3.38Å; R638-E741 IonicContact CZ-OE1 3.93Å; R638-E741 IonicContact NE-OE1 2.75Å; R638-E741 IonicContact NH1-OE1 2.73Å; R638-E741 PolarHBondContact NH1-OE1 3.32Å
639	A	96.5	Very high	95.8	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-57.9	-44.9	177.8	0	0	0	0	0	112.2	N637 L642 S643 M731 E741	N637-A639 PolarHBondContact O-N 3.4Å; N637-A639 WeakPolarHBondContact OD1-CB 3.47Å; N637-A639 PolarHBondContact OD1-N 2.84Å; N637-A639 VanDerWaalsContact OD1-N 3.13Å; A639-L642 PolarHBondContact O-N 3.05Å; A639-S643 PolarHBondContact O-N 3.49Å; A639-S643 PolarHBondContact O-OG 3.1Å; A639-M731 HydrophobicContact CB-CB 3.97Å; A639-M731 HydrophobicContact CB-CE 4.06Å; A639-E741 HydrophobicContact CB-CB 3.89Å; A639-E741 HydrophobicContact CB-CG 3.96Å
640	F	97	Very high	95.7	Very high	72 Å²	72	57.7 Å²	57.7	32%	0.316	29%	0.285	S	S	.	.	H	α-helix	trans	-63.1	-43.9	179	-177.1	-104.3	0	0	0	112.2	F598 L631 Q634 N637 R638 S643 R644 T733	F598-F640 HydrophobicContact CE1-CD1 4.47Å; F598-F640 HydrophobicContact CZ-CD1 4.18Å; L631-F640 HydrophobicContact CD1-CD1 3.99Å; L631-F640 HydrophobicContact CD1-CE1 3.96Å; L631-F640 HydrophobicContact CD2-CE1 4.36Å; Q634-F640 VanDerWaalsContact NE2-CE1 3.34Å; N637-F640 HydrophobicContact CB-CB 3.87Å; N637-F640 PolarHBondContact O-N 2.81Å; N637-F640 PolarHBondContact OD1-N 2.79Å; R638-F640 VanDerWaalsContact C-N 3.33Å; R638-F640 PolarHBondContact O-N 2.93Å; F640-S643 PolarHBondContact O-N 2.88Å; F640-R644 WeakPolarHBondContact O-CB 3.37Å; F640-R644 PolarHBondContact O-N 3.47Å; F640-T733 HydrophobicContact CB-CG2 4.42Å; F640-T733 HydrophobicContact CD2-CG2 4.31Å
641	A	97	Very high	95.6	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-66.6	-41.3	176.6	0	0	0	0	0	113.2	P565 V596 F598 N637 R638 R644 G645	P565-A641 HydrophobicContact CB-CB 3.68Å; V596-A641 HydrophobicContact CB-CB 3.92Å; V596-A641 HydrophobicContact CG1-CB 3.65Å; F598-A641 HydrophobicContact CE2-CB 3.51Å; F598-A641 HydrophobicContact CZ-CB 4.09Å; N637-A641 PolarHBondContact O-N 2.94Å; N637-A641 VanDerWaalsContact O-N 3.08Å; R638-A641 PolarHBondContact O-N 3.11Å; A641-R644 PolarHBondContact O-N 3.11Å; A641-G645 PolarHBondContact O-N 2.52Å
642	L	97.5	Very high	95.4	Very high	1 Å²	1	58.3 Å²	58.3	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-62.8	-43.1	176.5	-69.2	176.4	0	0	0	111.5	I563 P565 R638 A639 R644 G645 A646 F657 M731	I563-L642 HydrophobicContact CB-CD2 4.49Å; I563-L642 HydrophobicContact CG2-CD2 3.94Å; P565-L642 HydrophobicContact CG-CD2 4.14Å; P565-L642 HydrophobicContact CG-CG 4.39Å; R638-L642 HydrophobicContact CG-CD1 4.04Å; R638-L642 HydrophobicContact CG-CG 4.43Å; R638-L642 WeakPolarHBondContact O-CG 3.42Å; R638-L642 PolarHBondContact O-N 3.08Å; A639-L642 PolarHBondContact O-N 3.05Å; L642-R644 PolarHBondContact O-N 2.73Å; L642-G645 PolarHBondContact O-N 3.49Å; L642-A646 WeakPolarHBondContact O-CB 3.17Å; L642-A646 PolarHBondContact O-N 3.1Å; L642-F657 HydrophobicContact CB-CD2 4.39Å; L642-F657 HydrophobicContact CB-CE2 4.28Å; L642-F657 HydrophobicContact CB-CZ 4.38Å; L642-F657 HydrophobicContact CD1-CB 4.28Å; L642-F657 HydrophobicContact CD1-CD2 3.93Å; L642-F657 HydrophobicContact CD1-CG 4.18Å; L642-F657 HydrophobicContact CD2-CB 3.94Å; L642-F657 HydrophobicContact CD2-CD1 4.01Å; L642-F657 HydrophobicContact CD2-CD2 4.37Å; L642-F657 HydrophobicContact CD2-CG 3.86Å; L642-F657 HydrophobicContact CG-CD2 4.46Å; L642-F657 HydrophobicContact CG-CG 4.44Å; L642-M731 HydrophobicContact CB-CG 4.21Å; L642-M731 HydrophobicContact CD1-CE 4.14Å
643	S	97.4	Very high	95.5	Very high	17 Å²	17	49.8 Å²	49.8	12%	0.119	27%	0.27	C	S	.	.	H	α-helix	trans	-59	-46.2	172.4	-75.1	0	0	0	0	112	A639 F640 G645 A646 E647 M731	A639-S643 PolarHBondContact O-N 3.49Å; A639-S643 PolarHBondContact O-OG 3.1Å; F640-S643 PolarHBondContact O-N 2.88Å; S643-G645 VanDerWaalsContact C-N 3.32Å; S643-G645 PolarHBondContact O-N 2.78Å; S643-A646 PolarHBondContact O-N 3.3Å; S643-E647 WeakPolarHBondContact O-CG 3.48Å; S643-E647 PolarHBondContact O-N 3.4Å; S643-M731 WeakPolarHBondContact OG-CB 3.42Å
644	R	97.5	Very high	95.7	Very high	96 Å²	96	43 Å²	43	36%	0.362	24%	0.24	S	C	.	.	H	α-helix	trans	-66	-34.8	-179.9	-173.4	56.2	-178.6	144.2	7.5	112.6	L631 F640 A641 L642 E647	L631-R644 HydrophobicContact CD2-CG 3.92Å; F640-R644 WeakPolarHBondContact O-CB 3.37Å; F640-R644 PolarHBondContact O-N 3.47Å; A641-R644 PolarHBondContact O-N 3.11Å; L642-R644 PolarHBondContact O-N 2.73Å; R644-E647 VanDerWaalsContact CD-OE2 3.25Å; R644-E647 WeakPolarHBondContact CD-OE2 3.5Å; R644-E647 IonicContact CZ-OE2 3.45Å; R644-E647 IonicContact NE-OE2 3.27Å; R644-E647 IonicContact NH1-OE2 3.09Å; R644-E647 PolarHBondContact NH1-OE2 3.26Å
645	G	97.5	Very high	96	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-67.6	-41.9	172.4	0	0	0	0	0	112.2	A641 L642 S643 E647 L648	A641-G645 PolarHBondContact O-N 2.52Å; L642-G645 PolarHBondContact O-N 3.49Å; S643-G645 VanDerWaalsContact C-N 3.32Å; S643-G645 PolarHBondContact O-N 2.78Å; G645-E647 VanDerWaalsContact C-N 3.31Å; G645-E647 PolarHBondContact O-N 2.73Å; G645-L648 WeakPolarHBondContact O-CB 3.38Å; G645-L648 PolarHBondContact O-N 2.62Å; G645-L648 VanDerWaalsContact O-N 3.14Å
646	A	97.7	Very high	96.3	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-63.1	-34.9	177.4	0	0	0	0	0	112.6	I563 L642 S643 L648 C649 M655 F657 R722 F725	I563-A646 HydrophobicContact CD1-CB 4.41Å; L642-A646 WeakPolarHBondContact O-CB 3.17Å; L642-A646 PolarHBondContact O-N 3.1Å; S643-A646 PolarHBondContact O-N 3.3Å; A646-L648 PolarHBondContact O-N 2.97Å; A646-C649 WeakPolarHBondContact O-CB 3.14Å; A646-C649 PolarHBondContact O-N 2.72Å; A646-C649 VanDerWaalsContact O-N 3.09Å; A646-M655 HydrophobicContact CB-CE 4.16Å; A646-M655 HydrophobicContact CB-SD 3.7Å; A646-F657 HydrophobicContact CB-CE1 4.38Å; A646-F657 HydrophobicContact CB-CZ 4.32Å; A646-R722 WeakPolarHBondContact O-CD 3.29Å; A646-R722 PolarHBondContact O-NE 3.49Å; A646-F725 HydrophobicContact CB-CD1 4.27Å; A646-F725 HydrophobicContact CB-CE1 3.92Å; A646-F725 HydrophobicContact CB-CZ 4.37Å
647	E	96.2	Very high	96.5	Very high	104 Å²	104	30 Å²	30	49%	0.486	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-24.3	174.8	-74.4	169	-166.9	0	0	114	S643 R644 G645 C649	S643-E647 WeakPolarHBondContact O-CG 3.48Å; S643-E647 PolarHBondContact O-N 3.4Å; R644-E647 VanDerWaalsContact CD-OE2 3.25Å; R644-E647 WeakPolarHBondContact CD-OE2 3.5Å; R644-E647 IonicContact CZ-OE2 3.45Å; R644-E647 IonicContact NE-OE2 3.27Å; R644-E647 IonicContact NH1-OE2 3.09Å; R644-E647 PolarHBondContact NH1-OE2 3.26Å; G645-E647 VanDerWaalsContact C-N 3.31Å; G645-E647 PolarHBondContact O-N 2.73Å; E647-C649 VanDerWaalsContact C-N 3.35Å
648	L	95.8	Very high	96.7	Very high	72 Å²	72	28.9 Å²	28.9	38%	0.377	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-15.6	177.8	-57.1	167.1	0	0	0	112.3	I594 V629 G645 A646	I594-L648 HydrophobicContact CD1-CB 4.31Å; I594-L648 HydrophobicContact CG2-CD1 3.89Å; V629-L648 HydrophobicContact CB-CD1 4.38Å; V629-L648 HydrophobicContact CG2-CD1 3.32Å; G645-L648 WeakPolarHBondContact O-CB 3.38Å; G645-L648 PolarHBondContact O-N 2.62Å; G645-L648 VanDerWaalsContact O-N 3.14Å; A646-L648 PolarHBondContact O-N 2.97Å
649	C	96.9	Very high	96.7	Very high	7 Å²	7	29.1 Å²	29.1	5%	0.047	17%	0.168	C	C	.	.	S	Bend	trans	-78.4	127.6	177.3	-65.5	0	0	0	0	110	A646 E647 M655	A646-C649 WeakPolarHBondContact O-CB 3.14Å; A646-C649 PolarHBondContact O-N 2.72Å; A646-C649 VanDerWaalsContact O-N 3.09Å; E647-C649 VanDerWaalsContact C-N 3.35Å; C649-M655 HydrophobicContact CB-CG 4.17Å; C649-M655 HydrophobicContact CB-SD 3.92Å
650	P	94.1	Very high	96.7	Very high	81 Å²	81	29.3 Å²	29.3	53%	0.526	17%	0.169	S	C	.	.	P	Polyproline II helix	trans	-62.9	159.9	175.9	23.2	-30.3	0	0	0	111.6	G652 S653	P650-G652 PolarHBondContact O-N 3.32Å; P650-S653 WeakPolarHBondContact CD-OG 3.15Å; P650-S653 VanDerWaalsContact CG-OG 3.26Å; P650-S653 WeakPolarHBondContact CG-OG 3.39Å; P650-S653 WeakPolarHBondContact O-CB 3.33Å; P650-S653 PolarHBondContact O-N 2.83Å; P650-S653 VanDerWaalsContact O-N 3.13Å; P650-S653 PolarHBondContact O-OG 2.96Å
651	A	93.6	Very high	96.6	Very high	88 Å²	88	26 Å²	26	73%	0.727	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.3	138.7	171.3	0	0	0	0	0	110.4	S653	A651-S653 VanDerWaalsContact C-N 3.32Å
652	G	93.4	Very high	96.6	Very high	32 Å²	32	26 Å²	26	33%	0.33	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.9	-2.1	-176.5	0	0	0	0	0	114.7	P650 Y721 E723	P650-G652 PolarHBondContact O-N 3.32Å; G652-Y721 WeakPolarHBondContact O-CD1 3.42Å; G652-E723 WeakPolarHBondContact CA-OE1 3.46Å; G652-E723 WeakPolarHBondContact CA-OE2 3.4Å; G652-E723 PolarHBondContact N-OE1 2.71Å; G652-E723 PolarHBondContact N-OE2 3.23Å
653	S	96.5	Very high	96.6	Very high	8 Å²	8	26.2 Å²	26.2	6%	0.056	16%	0.156	C	C	.	.			trans	-68.7	131.8	179.7	-66.7	0	0	0	0	112.6	H561 P650 A651 Y721 R722	H561-S653 PolarHBondContact CE1-OG 3.33Å; H561-S653 VanDerWaalsContact CE1-OG 3.29Å; H561-S653 WeakPolarHBondContact ND1-CB 3.5Å; P650-S653 WeakPolarHBondContact CD-OG 3.15Å; P650-S653 VanDerWaalsContact CG-OG 3.26Å; P650-S653 WeakPolarHBondContact CG-OG 3.39Å; P650-S653 WeakPolarHBondContact O-CB 3.33Å; P650-S653 PolarHBondContact O-N 2.83Å; P650-S653 VanDerWaalsContact O-N 3.13Å; P650-S653 PolarHBondContact O-OG 2.96Å; A651-S653 VanDerWaalsContact C-N 3.32Å; S653-Y721 CarbonylContact O-C 3.52Å; S653-Y721 WeakPolarHBondContact O-CA 3.36Å; S653-R722 PolarHBondContact O-N 3.02Å
654	L	97.9	Very high	96.6	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.005	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	115.1	164.9	177.9	54.8	0	0	0	108.8	V558 V560 H561 I672 R673 T676 Y721	V558-L654 HydrophobicContact CG1-CB 3.91Å; V558-L654 HydrophobicContact CG1-CD2 3.84Å; V560-L654 HydrophobicContact CG2-CD2 4.13Å; H561-L654 PolarHBondContact N-O 2.99Å; H561-L654 PolarHBondContact ND1-O 3.11Å; L654-I672 HydrophobicContact CD1-CG2 4.29Å; L654-I672 HydrophobicContact CD2-CG2 3.92Å; L654-I672 HydrophobicContact CG-CG2 4.16Å; L654-R673 HydrophobicContact CD2-CB 4.42Å; L654-R673 HydrophobicContact CD2-CG 4.01Å; L654-T676 HydrophobicContact CD1-CG2 3.5Å; L654-Y721 HydrophobicContact CB-CD1 4.4Å; L654-Y721 HydrophobicContact CB-CE1 4.04Å; L654-Y721 HydrophobicContact CD1-CD2 4.46Å; L654-Y721 HydrophobicContact CD1-CE2 4.25Å
655	M	98.4	Very high	96.5	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	150.6	-178.6	-55.9	-177.5	-56.8	0	0	110.6	H561 I563 A646 C649 F657 S719 L720 R722 F725	H561-M655 CarbonylContact O-C 3.56Å; H561-M655 WeakPolarHBondContact O-CA 3.5Å; I563-M655 HydrophobicContact CD1-CB 4.32Å; I563-M655 HydrophobicContact CD1-CG 4.38Å; I563-M655 HydrophobicContact CD1-SD 4.13Å; A646-M655 HydrophobicContact CB-CE 4.16Å; A646-M655 HydrophobicContact CB-SD 3.7Å; C649-M655 HydrophobicContact CB-CG 4.17Å; C649-M655 HydrophobicContact CB-SD 3.92Å; M655-F657 HydrophobicContact CB-CE1 4.44Å; M655-F657 HydrophobicContact CE-CE1 4.38Å; M655-F657 HydrophobicContact CE-CZ 4.39Å; M655-S719 WeakPolarHBondContact O-CA 3.47Å; M655-S719 WeakPolarHBondContact O-CB 3.49Å; M655-L720 WeakPolarHBondContact CB-O 3.36Å; M655-L720 HydrophobicContact CE-CD2 4.38Å; M655-L720 HydrophobicContact CE-CG 4.36Å; M655-L720 PolarHBondContact N-O 3.5Å; M655-L720 PolarHBondContact O-N 3.34Å; M655-L720 VanDerWaalsContact O-N 3.11Å; M655-R722 HydrophobicContact CE-CB 4.41Å; M655-R722 HydrophobicContact SD-CB 4.34Å; M655-F725 HydrophobicContact CE-CB 3.67Å; M655-F725 HydrophobicContact CE-CD1 4.37Å; M655-F725 HydrophobicContact CE-CG 4Å
656	F	98.5	Very high	96.3	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	115.4	170.5	179.8	-126.9	0	0	0	109.7	V560 H561 V562 I563 A658 F664 L668 I672 P685 L717 V718 L765	V560-F656 HydrophobicContact CG1-CB 3.87Å; H561-F656 PolarHBondContact O-N 3.08Å; V562-F656 WeakPolarHBondContact CA-O 3.26Å; V562-F656 HydrophobicContact CG1-CD1 4.29Å; V562-F656 HydrophobicContact CG2-CD1 4.34Å; I563-F656 PolarHBondContact N-O 3.47Å; F656-A658 HydrophobicContact CD1-CB 4.17Å; F656-A658 HydrophobicContact CE1-CB 3.87Å; F656-A658 HydrophobicContact CZ-CB 4.47Å; F656-F664 HydrophobicContact CE1-CE1 4.35Å; F656-L668 HydrophobicContact CE1-CD2 4.01Å; F656-L668 HydrophobicContact CZ-CD2 4.03Å; F656-I672 HydrophobicContact CB-CD1 4.16Å; F656-I672 HydrophobicContact CD1-CD1 3.87Å; F656-I672 HydrophobicContact CD2-CD1 3.67Å; F656-I672 HydrophobicContact CD2-CG1 4.47Å; F656-I672 HydrophobicContact CE1-CD1 4.14Å; F656-I672 HydrophobicContact CE2-CD1 3.97Å; F656-I672 HydrophobicContact CG-CD1 3.63Å; F656-I672 HydrophobicContact CZ-CD1 4.2Å; F656-P685 HydrophobicContact CE2-CG 4.07Å; F656-L717 HydrophobicContact CE2-CB 4.47Å; F656-V718 WeakPolarHBondContact CA-O 3.45Å; F656-V718 WeakPolarHBondContact CD2-O 3.31Å; F656-L765 HydrophobicContact CZ-CD1 4.48Å; F656-L765 HydrophobicContact CZ-CD2 4.3Å
657	F	98.4	Very high	96.2	Very high	1 Å²	1	31.1 Å²	31.1	0%	0.004	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	121.2	175.6	-64.2	-12	0	0	0	109.4	I563 L642 A646 M655 L717 V718 L720 F725 M731 L745	I563-F657 HydrophobicContact CB-CD1 4.16Å; I563-F657 HydrophobicContact CD1-CD1 3.97Å; I563-F657 HydrophobicContact CD1-CE1 3.62Å; L642-F657 HydrophobicContact CB-CD2 4.39Å; L642-F657 HydrophobicContact CB-CE2 4.28Å; L642-F657 HydrophobicContact CB-CZ 4.38Å; L642-F657 HydrophobicContact CD1-CB 4.28Å; L642-F657 HydrophobicContact CD1-CD2 3.93Å; L642-F657 HydrophobicContact CD1-CG 4.18Å; L642-F657 HydrophobicContact CD2-CB 3.94Å; L642-F657 HydrophobicContact CD2-CD1 4.01Å; L642-F657 HydrophobicContact CD2-CD2 4.37Å; L642-F657 HydrophobicContact CD2-CG 3.86Å; L642-F657 HydrophobicContact CG-CD2 4.46Å; L642-F657 HydrophobicContact CG-CG 4.44Å; A646-F657 HydrophobicContact CB-CE1 4.38Å; A646-F657 HydrophobicContact CB-CZ 4.32Å; M655-F657 HydrophobicContact CB-CE1 4.44Å; M655-F657 HydrophobicContact CE-CE1 4.38Å; M655-F657 HydrophobicContact CE-CZ 4.39Å; F657-L717 WeakPolarHBondContact O-CA 3.46Å; F657-V718 HydrophobicContact CB-CG1 4.07Å; F657-V718 HydrophobicContact CD2-CG1 3.62Å; F657-V718 HydrophobicContact CE2-CG1 4.4Å; F657-V718 HydrophobicContact CG-CG1 4.11Å; F657-V718 PolarHBondContact N-O 2.96Å; F657-L720 HydrophobicContact CE2-CD2 4.46Å; F657-F725 HydrophobicContact CE2-CD2 4.08Å; F657-F725 AromaticContact CE2-CE2 3.75Å; F657-F725 HydrophobicContact CE2-CE2 3.75Å; F657-F725 AromaticContact CZ-CD2 3.97Å; F657-F725 HydrophobicContact CZ-CD2 3.97Å; F657-F725 AromaticContact CZ-CE2 3.73Å; F657-F725 HydrophobicContact CZ-CE2 3.73Å; F657-F725 HydrophobicContact CZ-CZ 4.23Å; F657-M731 HydrophobicContact CD2-SD 4.48Å; F657-M731 HydrophobicContact CE2-CG 4.42Å; F657-M731 HydrophobicContact CE2-SD 4Å; F657-L745 HydrophobicContact CD2-CD2 4.46Å; F657-L745 HydrophobicContact CE2-CD2 4.21Å
658	A	97	Very high	96.3	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.153	C	C	.	.			trans	-132.3	157.9	-178.1	0	0	0	0	0	111.8	V562 I563 V564 P565 F656 M662 L717	V562-A658 HydrophobicContact CG1-CB 4.1Å; I563-A658 PolarHBondContact O-N 3.08Å; I563-A658 VanDerWaalsContact O-N 3.07Å; V564-A658 HydrophobicContact CG2-CB 4.41Å; P565-A658 WeakPolarHBondContact CD-O 3.46Å; F656-A658 HydrophobicContact CD1-CB 4.17Å; F656-A658 HydrophobicContact CE1-CB 3.87Å; F656-A658 HydrophobicContact CZ-CB 4.47Å; A658-M662 HydrophobicContact CB-CG 4.39Å; A658-L717 HydrophobicContact CB-CD2 4.44Å
659	D	95.5	Very high	96.3	Very high	31 Å²	31	22.7 Å²	22.7	17%	0.166	14%	0.135	C	C	.	.			trans	-97.7	157.5	169.5	-64.2	-17.9	0	0	0	109.7	R638 D661 M662	R638-D659 IonicContact CZ-OD1 3.29Å; R638-D659 IonicContact NE-OD1 3.41Å; R638-D659 PolarHBondContact NE-OD1 3.01Å; R638-D659 IonicContact NH2-OD1 2.65Å; R638-D659 PolarHBondContact NH2-OD1 2.78Å; D659-D661 PolarHBondContact O-N 3.48Å; D659-D661 VanDerWaalsContact O-N 3.13Å; D659-M662 HydrophobicContact CB-CE 3.88Å; D659-M662 HydrophobicContact CB-CG 4.38Å; D659-M662 WeakPolarHBondContact O-CB 3.45Å; D659-M662 WeakPolarHBondContact O-CG 3.35Å; D659-M662 PolarHBondContact O-N 2.86Å; D659-M662 VanDerWaalsContact O-N 3.13Å
660	V	97.1	Very high	96.2	Very high	5 Å²	5	26 Å²	26	3%	0.03	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-16.7	-178.4	71.8	0	0	0	0	114	V564 L566 R569 L573 F576 M662	V564-V660 HydrophobicContact CG1-CB 3.92Å; V564-V660 HydrophobicContact CG1-CG2 4.48Å; L566-V660 HydrophobicContact CD1-CB 4.09Å; L566-V660 HydrophobicContact CD1-CG1 4.16Å; L566-V660 HydrophobicContact CD1-CG2 3.86Å; R569-V660 HydrophobicContact CB-CG1 4.37Å; L573-V660 HydrophobicContact CB-CG2 4.12Å; L573-V660 HydrophobicContact CD1-CG2 4.28Å; F576-V660 HydrophobicContact CB-CG2 4.14Å; V660-M662 VanDerWaalsContact C-N 3.29Å
661	D	95.4	Very high	96.2	Very high	2 Å²	2	25.2 Å²	25.2	1%	0.011	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	6	176.7	-61	-62.3	0	0	0	114.4	R569 R575 D659 V768 H770	R569-D661 IonicContact CZ-OD1 3.13Å; R569-D661 IonicContact CZ-OD2 2.75Å; R569-D661 IonicContact NH1-OD1 2.89Å; R569-D661 IonicContact NH1-OD2 3.82Å; R569-D661 PolarHBondContact NH1-OD2 2.6Å; R569-D661 IonicContact NH2-OD1 3.97Å; R569-D661 PolarHBondContact NH2-OD1 2.86Å; R569-D661 IonicContact NH2-OD2 3.49Å; R569-D661 PolarHBondContact NH2-OD2 3.16Å; R575-D661 IonicContact NH2-OD1 2.68Å; R575-D661 PolarHBondContact NH2-OD1 3.22Å; D659-D661 PolarHBondContact O-N 3.48Å; D659-D661 VanDerWaalsContact O-N 3.13Å; D661-V768 PolarHBondContact O-N 3.09Å; D661-V768 VanDerWaalsContact O-N 3.08Å; D661-H770 VanDerWaalsContact CG-CD2 3.45Å; D661-H770 IonicContact OD1-CD2 3.63Å; D661-H770 IonicContact OD2-CD2 3.33Å; D661-H770 PolarHBondContact OD2-CD2 3.18Å; D661-H770 IonicContact OD2-CG 2.83Å; D661-H770 IonicContact OD2-NE2 2.69Å; D661-H770 PolarHBondContact OD2-NE2 3.09Å
662	M	97.2	Very high	96.4	Very high	1 Å²	1	21 Å²	21	1%	0.005	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	134.8	-178.3	-63.2	-44.9	94.4	0	0	110.2	F576 A658 D659 V660 F664 V687 L717 L765 I766 H767	F576-M662 WeakPolarHBondContact CD2-O 3.41Å; A658-M662 HydrophobicContact CB-CG 4.39Å; D659-M662 HydrophobicContact CB-CE 3.88Å; D659-M662 HydrophobicContact CB-CG 4.38Å; D659-M662 WeakPolarHBondContact O-CB 3.45Å; D659-M662 WeakPolarHBondContact O-CG 3.35Å; D659-M662 PolarHBondContact O-N 2.86Å; D659-M662 VanDerWaalsContact O-N 3.13Å; V660-M662 VanDerWaalsContact C-N 3.29Å; M662-F664 HydrophobicContact CB-CD1 4.31Å; M662-V687 HydrophobicContact SD-CG2 4.14Å; M662-L717 HydrophobicContact CG-CD1 4.36Å; M662-L717 HydrophobicContact CG-CD2 3.93Å; M662-L717 HydrophobicContact SD-CD1 3.69Å; M662-L717 HydrophobicContact SD-CD2 4.13Å; M662-L765 HydrophobicContact CB-CD1 4.11Å; M662-L765 HydrophobicContact CG-CD1 4.25Å; M662-L765 HydrophobicContact SD-CD1 4.4Å; M662-I766 CarbonylContact C-O 3.45Å; M662-I766 WeakPolarHBondContact CA-O 3.43Å; M662-H767 HydrophobicContact CE-CB 3.63Å; M662-H767 WeakPolarHBondContact CE-CD2 3.43Å; M662-H767 HydrophobicContact SD-CB 3.88Å
663	L	96.3	Very high	96.5	Very high	4 Å²	4	20.1 Å²	20.1	2%	0.021	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	135.4	164.5	-54.9	179.2	0	0	0	108.2	H579 H700 L765 I766 V768	H579-L663 HydrophobicContact CB-CD2 3.82Å; L663-H700 HydrophobicContact CD1-CB 4.03Å; L663-L765 WeakPolarHBondContact O-CA 3.29Å; L663-I766 HydrophobicContact CB-CB 4.34Å; L663-I766 PolarHBondContact N-O 3.27Å; L663-I766 PolarHBondContact O-N 3.47Å; L663-V768 HydrophobicContact CD1-CG2 3.41Å; L663-V768 VanDerWaalsContact CD1-CG2 3.41Å; L663-V768 HydrophobicContact CD2-CG2 4.34Å; L663-V768 HydrophobicContact CG-CG2 3.56Å
664	F	97.2	Very high	96.3	Very high	3 Å²	3	22.7 Å²	22.7	1%	0.013	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	154.8	178.3	56.7	-98.4	0	0	0	113.4	V562 F576 H579 F580 F656 M662 L668 L669 D764 L765	V562-F664 HydrophobicContact CG1-CZ 4.24Å; V562-F664 HydrophobicContact CG2-CZ 4.29Å; F576-F664 AromaticContact CE2-CE1 3.93Å; F576-F664 HydrophobicContact CE2-CE1 3.93Å; F576-F664 HydrophobicContact CE2-CZ 4.42Å; F576-F664 HydrophobicContact CZ-CE1 4.37Å; F576-F664 HydrophobicContact CZ-CZ 4.45Å; H579-F664 PolarHBondContact NE2-N 3.42Å; H579-F664 PolarHBondContact NE2-O 3Å; H579-F664 VanDerWaalsContact NE2-O 3.12Å; F580-F664 AromaticContact CD2-CE2 4Å; F580-F664 HydrophobicContact CD2-CE2 4Å; F580-F664 AromaticContact CD2-CZ 3.78Å; F580-F664 HydrophobicContact CD2-CZ 3.78Å; F580-F664 HydrophobicContact CE2-CE2 4.09Å; F580-F664 AromaticContact CE2-CZ 3.95Å; F580-F664 HydrophobicContact CE2-CZ 3.95Å; F656-F664 HydrophobicContact CE1-CE1 4.35Å; M662-F664 HydrophobicContact CB-CD1 4.31Å; F664-L668 HydrophobicContact CB-CB 4.12Å; F664-L668 HydrophobicContact CB-CD2 3.29Å; F664-L668 HydrophobicContact CB-CG 4.31Å; F664-L668 HydrophobicContact CD1-CD2 4.16Å; F664-L668 HydrophobicContact CD2-CD2 4.02Å; F664-L668 HydrophobicContact CG-CD2 3.58Å; F664-L669 HydrophobicContact CE2-CD2 4.23Å; F664-D764 WeakPolarHBondContact CA-O 3.14Å; F664-D764 VanDerWaalsContact CB-O 3.23Å; F664-D764 WeakPolarHBondContact CB-O 3.26Å; F664-L765 HydrophobicContact CB-CD1 4.08Å; F664-L765 HydrophobicContact CD1-CD1 4.23Å
665	T	95.1	Very high	96.2	Very high	11 Å²	11	24.2 Å²	24.2	7%	0.067	11%	0.109	C	C	.	.			trans	-105	176.1	-176.9	73.1	0	0	0	0	111.9	Q667 L668 F701 D764	T665-Q667 VanDerWaalsContact CB-OE1 3.29Å; T665-Q667 PolarHBondContact O-N 3.39Å; T665-Q667 PolarHBondContact OG1-N 3.05Å; T665-Q667 PolarHBondContact OG1-OE1 3.36Å; T665-L668 WeakPolarHBondContact O-CB 3.41Å; T665-L668 PolarHBondContact O-N 3.49Å; T665-F701 HydrophobicContact CG2-CE1 3.73Å; T665-F701 HydrophobicContact CG2-CE2 4.14Å; T665-F701 HydrophobicContact CG2-CZ 3.5Å; T665-F701 VanDerWaalsContact CG2-CZ 3.5Å; T665-D764 HydrophobicContact CG2-CB 4.4Å; T665-D764 WeakPolarHBondContact CG2-OD1 3.47Å; T665-D764 PolarHBondContact N-O 2.97Å; T665-D764 WeakPolarHBondContact OG1-CB 3.43Å; T665-D764 PolarHBondContact OG1-OD1 3.05Å
666	R	94.4	Very high	96	Very high	129 Å²	129	24.4 Å²	24.4	49%	0.487	11%	0.11	S	C	.	.	H	α-helix	trans	-58.4	-26.6	172.5	62.9	179.3	-177	-175.3	0.1	113.5	E589 L668 L669 H670	E589-R666 HydrophobicContact CG-CB 4.06Å; E589-R666 WeakPolarHBondContact OE1-CB 3.37Å; R666-L668 VanDerWaalsContact C-N 3.33Å; R666-L668 PolarHBondContact O-N 3.03Å; R666-L669 WeakPolarHBondContact O-CB 3.4Å; R666-L669 PolarHBondContact O-N 2.96Å; R666-H670 PolarHBondContact O-N 2.81Å
667	Q	95.2	Very high	95.8	Very high	73 Å²	73	26 Å²	26	34%	0.341	12%	0.119	S	C	.	.	H	α-helix	trans	-67.2	-35.6	178.8	-71.6	78.6	-2.9	0	0	111.4	T665 H670 R671 D764	T665-Q667 VanDerWaalsContact CB-OE1 3.29Å; T665-Q667 PolarHBondContact O-N 3.39Å; T665-Q667 PolarHBondContact OG1-N 3.05Å; T665-Q667 PolarHBondContact OG1-OE1 3.36Å; Q667-H670 PolarHBondContact O-N 3.03Å; Q667-R671 PolarHBondContact O-N 3.13Å; Q667-D764 HydrophobicContact CB-CB 4.27Å; Q667-D764 WeakPolarHBondContact CB-OD2 3.39Å
668	L	97.3	Very high	95.5	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-61.2	-47.3	170.5	174.6	65.8	0	0	0	110.7	F656 F664 T665 R666 H670 R671 I672 E762 D764 L765	F656-L668 HydrophobicContact CE1-CD2 4.01Å; F656-L668 HydrophobicContact CZ-CD2 4.03Å; F664-L668 HydrophobicContact CB-CB 4.12Å; F664-L668 HydrophobicContact CB-CD2 3.29Å; F664-L668 HydrophobicContact CB-CG 4.31Å; F664-L668 HydrophobicContact CD1-CD2 4.16Å; F664-L668 HydrophobicContact CD2-CD2 4.02Å; F664-L668 HydrophobicContact CG-CD2 3.58Å; T665-L668 WeakPolarHBondContact O-CB 3.41Å; T665-L668 PolarHBondContact O-N 3.49Å; R666-L668 VanDerWaalsContact C-N 3.33Å; R666-L668 PolarHBondContact O-N 3.03Å; L668-H670 VanDerWaalsContact C-N 3.29Å; L668-H670 PolarHBondContact O-N 3.38Å; L668-R671 CarbonylContact O-C 3.58Å; L668-R671 PolarHBondContact O-N 3.36Å; L668-R671 VanDerWaalsContact O-N 3.11Å; L668-I672 HydrophobicContact CD1-CD1 4.07Å; L668-I672 HydrophobicContact CD1-CG1 4.1Å; L668-I672 HydrophobicContact CD2-CD1 4.15Å; L668-I672 HydrophobicContact CG-CD1 3.74Å; L668-I672 HydrophobicContact CG-CG1 4.21Å; L668-I672 WeakPolarHBondContact O-CG1 3.34Å; L668-I672 PolarHBondContact O-N 2.76Å; L668-E762 HydrophobicContact CD1-CG 3.46Å; L668-E762 VanDerWaalsContact CD1-CG 3.46Å; L668-D764 HydrophobicContact CB-CB 4.31Å; L668-L765 HydrophobicContact CD1-CB 4.48Å; L668-L765 HydrophobicContact CD2-CB 4.22Å; L668-L765 HydrophobicContact CD2-CD1 3.87Å; L668-L765 HydrophobicContact CD2-CD2 4.37Å; L668-L765 HydrophobicContact CD2-CG 4.37Å
669	L	96.7	Very high	95.2	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-58.8	-43	-179.2	-61	176.2	0	0	0	111.5	V560 C584 E589 V591 F664 R666 I672 R673	V560-L669 HydrophobicContact CB-CD2 4.2Å; V560-L669 HydrophobicContact CG1-CD2 4.18Å; V560-L669 HydrophobicContact CG2-CD2 4.33Å; C584-L669 HydrophobicContact CB-CD1 4.36Å; E589-L669 HydrophobicContact CB-CD1 3.85Å; E589-L669 HydrophobicContact CG-CD1 3.86Å; V591-L669 HydrophobicContact CG1-CD1 3.46Å; V591-L669 VanDerWaalsContact CG1-CD1 3.46Å; V591-L669 HydrophobicContact CG1-CD2 3.98Å; V591-L669 HydrophobicContact CG1-CG 4.37Å; F664-L669 HydrophobicContact CE2-CD2 4.23Å; R666-L669 WeakPolarHBondContact O-CB 3.4Å; R666-L669 PolarHBondContact O-N 2.96Å; L669-I672 PolarHBondContact O-N 3.02Å; L669-R673 WeakPolarHBondContact O-CD 3.48Å; L669-R673 VanDerWaalsContact O-CG 3.28Å; L669-R673 WeakPolarHBondContact O-CG 3.01Å; L669-R673 PolarHBondContact O-N 3.11Å
670	H	94.6	Very high	94.9	Very high	77 Å²	77	39.2 Å²	39.2	36%	0.356	18%	0.176	S	C	.	.	H	α-helix	trans	-60.6	-45.7	174.4	-175.9	68.7	0	0	0	112.1	N556 R666 Q667 L668 I672 R673 L674	N556-H670 PolarHBondContact OD1-ND1 3.05Å; R666-H670 PolarHBondContact O-N 2.81Å; Q667-H670 PolarHBondContact O-N 3.03Å; L668-H670 VanDerWaalsContact C-N 3.29Å; L668-H670 PolarHBondContact O-N 3.38Å; H670-I672 PolarHBondContact O-N 2.86Å; H670-R673 PolarHBondContact O-N 3.26Å; H670-L674 VanDerWaalsContact NE2-CD1 3.31Å; H670-L674 WeakPolarHBondContact NE2-CD1 3.34Å; H670-L674 WeakPolarHBondContact O-CG 3.15Å; H670-L674 PolarHBondContact O-N 2.75Å
671	R	95.1	Very high	94.7	Very high	64 Å²	64	40.8 Å²	40.8	24%	0.242	18%	0.183	C	C	.	.	H	α-helix	trans	-68.2	-31.9	176.7	-77.1	-172	-66.8	-85.3	-8.1	113.5	Q667 L668 R673 L674 N675 E762 D764	Q667-R671 PolarHBondContact O-N 3.13Å; L668-R671 CarbonylContact O-C 3.58Å; L668-R671 PolarHBondContact O-N 3.36Å; L668-R671 VanDerWaalsContact O-N 3.11Å; R671-R673 VanDerWaalsContact C-N 3.34Å; R671-L674 PolarHBondContact O-N 2.73Å; R671-N675 WeakPolarHBondContact O-CB 3.42Å; R671-N675 PolarHBondContact O-N 3.11Å; R671-N675 PolarHBondContact O-ND2 3.09Å; R671-E762 IonicContact CZ-OE1 3.54Å; R671-E762 VanDerWaalsContact CZ-OE1 3.28Å; R671-E762 IonicContact CZ-OE2 3.9Å; R671-E762 IonicContact NE-OE1 3.56Å; R671-E762 PolarHBondContact NE-OE1 3.29Å; R671-E762 IonicContact NE-OE2 2.65Å; R671-E762 PolarHBondContact NE-OE2 2.92Å; R671-E762 IonicContact NH2-OE1 3.26Å; R671-E762 PolarHBondContact NH2-OE1 2.99Å; R671-E762 IonicContact NH2-OE2 3.43Å; R671-D764 IonicContact CZ-OD2 3.6Å; R671-D764 IonicContact NH1-OD2 3.49Å; R671-D764 VanDerWaalsContact NH2-CB 3.27Å; R671-D764 VanDerWaalsContact NH2-CG 3.33Å; R671-D764 IonicContact NH2-OD2 3.54Å; R671-D764 PolarHBondContact NH2-OD2 2.82Å
672	I	97.1	Very high	94.8	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-60.1	-47	171.2	-77.7	170.2	0	0	0	110.1	V560 L654 F656 L668 L669 H670 T676 F683	V560-I672 HydrophobicContact CG1-CG2 4.09Å; V560-I672 HydrophobicContact CG2-CG2 4.11Å; L654-I672 HydrophobicContact CD1-CG2 4.29Å; L654-I672 HydrophobicContact CD2-CG2 3.92Å; L654-I672 HydrophobicContact CG-CG2 4.16Å; F656-I672 HydrophobicContact CB-CD1 4.16Å; F656-I672 HydrophobicContact CD1-CD1 3.87Å; F656-I672 HydrophobicContact CD2-CD1 3.67Å; F656-I672 HydrophobicContact CD2-CG1 4.47Å; F656-I672 HydrophobicContact CE1-CD1 4.14Å; F656-I672 HydrophobicContact CE2-CD1 3.97Å; F656-I672 HydrophobicContact CG-CD1 3.63Å; F656-I672 HydrophobicContact CZ-CD1 4.2Å; L668-I672 HydrophobicContact CD1-CD1 4.07Å; L668-I672 HydrophobicContact CD1-CG1 4.1Å; L668-I672 HydrophobicContact CD2-CD1 4.15Å; L668-I672 HydrophobicContact CG-CD1 3.74Å; L668-I672 HydrophobicContact CG-CG1 4.21Å; L668-I672 WeakPolarHBondContact O-CG1 3.34Å; L668-I672 PolarHBondContact O-N 2.76Å; L669-I672 PolarHBondContact O-N 3.02Å; H670-I672 PolarHBondContact O-N 2.86Å; I672-T676 VanDerWaalsContact O-CB 3.26Å; I672-T676 WeakPolarHBondContact O-CB 3.19Å; I672-T676 PolarHBondContact O-N 3.44Å; I672-T676 VanDerWaalsContact O-N 3.11Å; I672-T676 PolarHBondContact O-OG1 2.73Å; I672-F683 HydrophobicContact CG1-CD1 4.17Å; I672-F683 HydrophobicContact CG1-CE1 4.24Å
673	R	95.2	Very high	94.8	Very high	12 Å²	12	40.8 Å²	40.8	5%	0.045	18%	0.183	C	C	.	.	H	α-helix	trans	-66.1	-40	179.5	-63.4	158.6	174.3	138.7	7.7	112.3	V555 V558 V560 E589 K590 L654 L669 H670 R671	V555-R673 HydrophobicContact CG1-CB 3.36Å; V555-R673 HydrophobicContact CG1-CG 4.37Å; V555-R673 VanDerWaalsContact O-CD 3.26Å; V555-R673 WeakPolarHBondContact O-CD 3.44Å; V558-R673 HydrophobicContact CB-CG 4.46Å; V558-R673 PolarHBondContact O-NE 3.44Å; V560-R673 HydrophobicContact CG2-CG 4Å; E589-R673 IonicContact OE2-CZ 3.85Å; E589-R673 IonicContact OE2-NH1 2.69Å; E589-R673 PolarHBondContact OE2-NH1 2.6Å; E589-R673 IonicContact OE2-NH2 2.77Å; E589-R673 PolarHBondContact OE2-NH2 2.9Å; E589-R673 VanDerWaalsContact OE2-NH2 3.09Å; K590-R673 PolarHBondContact O-NH2 3.33Å; K590-R673 VanDerWaalsContact O-NH2 3.1Å; L654-R673 HydrophobicContact CD2-CB 4.42Å; L654-R673 HydrophobicContact CD2-CG 4.01Å; L669-R673 WeakPolarHBondContact O-CD 3.48Å; L669-R673 VanDerWaalsContact O-CG 3.28Å; L669-R673 WeakPolarHBondContact O-CG 3.01Å; L669-R673 PolarHBondContact O-N 3.11Å; H670-R673 PolarHBondContact O-N 3.26Å; R671-R673 VanDerWaalsContact C-N 3.34Å
674	L	92.8	Very high	94.9	Very high	62 Å²	62	40.6 Å²	40.6	33%	0.325	18%	0.182	S	C	.	.	H	α-helix	trans	-71.1	-39.7	178.4	-72.5	179.5	0	0	0	113.4	V555 H670 R671	V555-L674 HydrophobicContact CG1-CD2 4.11Å; V555-L674 HydrophobicContact CG1-CG 4.5Å; V555-L674 HydrophobicContact CG2-CD2 4.45Å; H670-L674 VanDerWaalsContact NE2-CD1 3.31Å; H670-L674 WeakPolarHBondContact NE2-CD1 3.34Å; H670-L674 WeakPolarHBondContact O-CG 3.15Å; H670-L674 PolarHBondContact O-N 2.75Å; R671-L674 PolarHBondContact O-N 2.73Å
675	N	94.6	Very high	94.9	Very high	34 Å²	34	40.5 Å²	40.5	18%	0.182	18%	0.182	C	C	.	.	H	α-helix	trans	-97.2	-2	-169.4	-63.4	-55.3	0	0	0	113.9	R671 Q681 F683 F758	R671-N675 WeakPolarHBondContact O-CB 3.42Å; R671-N675 PolarHBondContact O-N 3.11Å; R671-N675 PolarHBondContact O-ND2 3.09Å; N675-Q681 PolarHBondContact O-NE2 3.23Å; N675-F683 HydrophobicContact CB-CB 4Å; N675-F683 HydrophobicContact CB-CD1 4.09Å; N675-F683 HydrophobicContact CB-CD2 4.15Å; N675-F683 HydrophobicContact CB-CG 3.84Å; N675-F758 HydrophobicContact CB-CD1 3.59Å; N675-F758 HydrophobicContact CB-CE1 3.93Å; N675-F758 VanDerWaalsContact CG-CE1 3.44Å; N675-F758 WeakPolarHBondContact OD1-CE1 3.39Å
676	T	95.6	Very high	94.9	Very high	3 Å²	3	40.1 Å²	40.1	2%	0.018	18%	0.179	C	C	.	.			trans	-107.6	116.7	173.2	-44.9	0	0	0	0	108.9	L654 I672 S719 Y721	L654-T676 HydrophobicContact CD1-CG2 3.5Å; I672-T676 VanDerWaalsContact O-CB 3.26Å; I672-T676 WeakPolarHBondContact O-CB 3.19Å; I672-T676 PolarHBondContact O-N 3.44Å; I672-T676 VanDerWaalsContact O-N 3.11Å; I672-T676 PolarHBondContact O-OG1 2.73Å; T676-S719 PolarHBondContact OG1-OG 2.9Å; T676-Y721 HydrophobicContact CG2-CD2 3.86Å; T676-Y721 HydrophobicContact CG2-CE2 3.96Å; T676-Y721 WeakPolarHBondContact O-CE2 3.4Å
677	I	93	Very high	95	Very high	35 Å²	35	34.2 Å²	34.2	18%	0.179	16%	0.158	C	C	.	.	B	Isolated β-bridge	trans	-122.1	116.7	-176	-52.6	175.5	0	0	0	108.5	N679 R680 Q681	I677-N679 PolarHBondContact O-N 2.75Å; I677-R680 HydrophobicContact CB-CB 4.33Å; I677-R680 HydrophobicContact CG2-CB 4.04Å; I677-R680 PolarHBondContact O-N 3.08Å; I677-Q681 HydrophobicContact CB-CB 3.93Å; I677-Q681 HydrophobicContact CD1-CB 4.33Å; I677-Q681 HydrophobicContact CG1-CB 4.17Å; I677-Q681 PolarHBondContact N-O 2.98Å; I677-Q681 PolarHBondContact O-N 3.48Å
678	K	92.6	Very high	94.9	Very high	79 Å²	79	31 Å²	31	34%	0.343	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53	135.8	-177.6	-167.1	176.7	-174.7	176.1	0	111.7	R680 Y721 E723	K678-R680 PolarHBondContact O-N 2.91Å; K678-R680 VanDerWaalsContact O-N 3.16Å; K678-Y721 VanDerWaalsContact CA-CD2 3.4Å; K678-Y721 HydrophobicContact CB-CD1 4.25Å; K678-Y721 HydrophobicContact CB-CD2 3.58Å; K678-Y721 HydrophobicContact CB-CE1 4.4Å; K678-Y721 HydrophobicContact CB-CE2 3.77Å; K678-Y721 HydrophobicContact CB-CG 3.83Å; K678-Y721 HydrophobicContact CD-CD1 4.26Å; K678-Y721 HydrophobicContact CD-CG 4.38Å; K678-Y721 HydrophobicContact CG-CD1 4.25Å; K678-Y721 HydrophobicContact CG-CD2 4.13Å; K678-Y721 HydrophobicContact CG-CG 3.88Å; K678-Y721 VanDerWaalsContact N-CE2 3.26Å; K678-E723 WeakPolarHBondContact CE-OE1 3.34Å; K678-E723 VanDerWaalsContact CE-OE2 3.31Å; K678-E723 WeakPolarHBondContact CE-OE2 3.36Å; K678-E723 IonicContact NZ-OE1 3.32Å; K678-E723 PolarHBondContact NZ-OE1 2.75Å; K678-E723 IonicContact NZ-OE2 3.88Å; K678-E723 PolarHBondContact NZ-OE2 2.92Å
679	N	91	Very high	94.7	Very high	104 Å²	104	31.3 Å²	31.3	56%	0.556	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	61	13.3	-179.1	-54.8	-44.7	0	0	0	115	I677 D724	I677-N679 PolarHBondContact O-N 2.75Å; N679-D724 WeakPolarHBondContact CA-OD1 3.35Å; N679-D724 PolarHBondContact N-OD1 3.32Å; N679-D724 PolarHBondContact N-OD2 3.07Å
680	R	89.1	Confident	94.5	Very high	126 Å²	126	31.6 Å²	31.6	48%	0.475	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-145.7	-40.5	-172.8	-176.5	175.6	173.2	171.3	-7	115.3	I677 K678 S756	I677-R680 HydrophobicContact CB-CB 4.33Å; I677-R680 HydrophobicContact CG2-CB 4.04Å; I677-R680 PolarHBondContact O-N 3.08Å; K678-R680 PolarHBondContact O-N 2.91Å; K678-R680 VanDerWaalsContact O-N 3.16Å; R680-S756 WeakPolarHBondContact O-CB 3.41Å; R680-S756 PolarHBondContact O-N 3.48Å; R680-S756 PolarHBondContact O-OG 3.17Å
681	Q	94	Very high	94.3	Very high	38 Å²	38	28.5 Å²	28.5	18%	0.178	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	128	-172.1	-168.7	174.3	-85.3	0	0	112.4	N675 I677 S756 F758	N675-Q681 PolarHBondContact O-NE2 3.23Å; I677-Q681 HydrophobicContact CB-CB 3.93Å; I677-Q681 HydrophobicContact CD1-CB 4.33Å; I677-Q681 HydrophobicContact CG1-CB 4.17Å; I677-Q681 PolarHBondContact N-O 2.98Å; I677-Q681 PolarHBondContact O-N 3.48Å; Q681-S756 VanDerWaalsContact CA-O 3.29Å; Q681-S756 WeakPolarHBondContact CA-O 3.49Å; Q681-F758 HydrophobicContact CG-CB 3.96Å
682	V	97	Very high	94	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	147.3	168.8	-62.9	0	0	0	0	110.1	F684 L720 D724 C749 I755 S756 I757 F758	V682-F684 HydrophobicContact CB-CE2 4.39Å; V682-F684 HydrophobicContact CG2-CD2 4.08Å; V682-F684 HydrophobicContact CG2-CE2 3.64Å; V682-L720 HydrophobicContact CB-CB 4.18Å; V682-L720 HydrophobicContact CG1-CB 3.57Å; V682-L720 HydrophobicContact CG1-CD1 4.5Å; V682-D724 HydrophobicContact CG1-CB 4.43Å; V682-C749 HydrophobicContact CG2-CB 4.15Å; V682-I755 HydrophobicContact CB-CG2 4.39Å; V682-I755 HydrophobicContact CG1-CG2 3.76Å; V682-I755 HydrophobicContact CG2-CG2 3.89Å; V682-S756 PolarHBondContact N-O 2.79Å; V682-I757 HydrophobicContact CG2-CG1 3.9Å; V682-F758 PolarHBondContact O-N 3.41Å
683	F	97.8	Very high	93.2	Very high	3 Å²	3	35 Å²	35	1%	0.013	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	120.9	-178.6	171.9	-136	0	0	0	111.4	I672 N675 P685 V718 S719 F758	I672-F683 HydrophobicContact CG1-CD1 4.17Å; I672-F683 HydrophobicContact CG1-CE1 4.24Å; N675-F683 HydrophobicContact CB-CB 4Å; N675-F683 HydrophobicContact CB-CD1 4.09Å; N675-F683 HydrophobicContact CB-CD2 4.15Å; N675-F683 HydrophobicContact CB-CG 3.84Å; F683-P685 HydrophobicContact CE1-CB 4.02Å; F683-P685 HydrophobicContact CE1-CG 4.35Å; F683-P685 HydrophobicContact CE2-CB 4.2Å; F683-P685 HydrophobicContact CZ-CB 3.73Å; F683-P685 HydrophobicContact CZ-CG 4.48Å; F683-P685 WeakPolarHBondContact O-CD 3.37Å; F683-V718 CarbonylContact O-C 3.52Å; F683-V718 WeakPolarHBondContact O-CA 3.43Å; F683-S719 WeakPolarHBondContact CB-OG 3.28Å; F683-S719 WeakPolarHBondContact CD1-OG 3.22Å; F683-S719 PolarHBondContact N-O 3.07Å; F683-S719 PolarHBondContact O-N 3.24Å; F683-F758 WeakPolarHBondContact CA-O 3.45Å; F683-F758 HydrophobicContact CD2-CB 4.49Å; F683-F758 AromaticContact CD2-CD1 3.37Å; F683-F758 HydrophobicContact CD2-CD1 3.37Å; F683-F758 HydrophobicContact CD2-CE1 4.01Å; F683-F758 HydrophobicContact CD2-CG 4.35Å; F683-F758 AromaticContact CE2-CD1 3.63Å; F683-F758 HydrophobicContact CE2-CD1 3.63Å; F683-F758 AromaticContact CE2-CE1 3.78Å; F683-F758 HydrophobicContact CE2-CE1 3.78Å; F683-F758 HydrophobicContact CG-CD1 4.24Å
684	F	97.6	Very high	92	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	92.7	173.6	-75.6	-98.3	0	0	0	109.5	V682 F715 V718 F746 C749 I757 F758 R759	V682-F684 HydrophobicContact CB-CE2 4.39Å; V682-F684 HydrophobicContact CG2-CD2 4.08Å; V682-F684 HydrophobicContact CG2-CE2 3.64Å; F684-F715 HydrophobicContact CD1-CB 4.47Å; F684-F715 HydrophobicContact CE1-CB 4.44Å; F684-V718 HydrophobicContact CD1-CB 3.75Å; F684-V718 HydrophobicContact CD1-CG2 3.81Å; F684-V718 HydrophobicContact CD2-CG2 3.81Å; F684-V718 HydrophobicContact CE1-CB 3.63Å; F684-V718 HydrophobicContact CE1-CG1 4.39Å; F684-V718 HydrophobicContact CE1-CG2 3.57Å; F684-V718 HydrophobicContact CE2-CG2 3.59Å; F684-V718 HydrophobicContact CG-CB 4.27Å; F684-V718 HydrophobicContact CG-CG2 3.94Å; F684-V718 HydrophobicContact CZ-CB 4.06Å; F684-V718 HydrophobicContact CZ-CG2 3.47Å; F684-V718 VanDerWaalsContact CZ-CG2 3.47Å; F684-F746 AromaticContact CD1-CD2 3.91Å; F684-F746 HydrophobicContact CD1-CD2 3.91Å; F684-F746 HydrophobicContact CD2-CD2 4.05Å; F684-F746 HydrophobicContact CD2-CE2 4.34Å; F684-F746 HydrophobicContact CE1-CB 4.1Å; F684-F746 AromaticContact CE1-CD2 3.76Å; F684-F746 HydrophobicContact CE1-CD2 3.76Å; F684-F746 HydrophobicContact CE1-CG 4.44Å; F684-F746 AromaticContact CE2-CD2 3.89Å; F684-F746 HydrophobicContact CE2-CD2 3.89Å; F684-F746 HydrophobicContact CG-CD2 4.04Å; F684-F746 HydrophobicContact CG-CE2 4.35Å; F684-F746 HydrophobicContact CZ-CB 4.11Å; F684-F746 AromaticContact CZ-CD2 3.74Å; F684-F746 HydrophobicContact CZ-CD2 3.74Å; F684-F746 HydrophobicContact CZ-CG 4.41Å; F684-C749 HydrophobicContact CE2-CB 4.47Å; F684-I757 HydrophobicContact CD2-CG2 3.81Å; F684-I757 HydrophobicContact CE2-CD1 4.26Å; F684-I757 HydrophobicContact CE2-CG1 4.48Å; F684-I757 HydrophobicContact CE2-CG2 4.39Å; F684-F758 PolarHBondContact N-O 2.92Å; F684-R759 HydrophobicContact CB-CB 4.36Å; F684-R759 HydrophobicContact CB-CG 4.38Å; F684-R759 WeakPolarHBondContact O-CA 3.15Å; F684-R759 VanDerWaalsContact O-CG 3.31Å; F684-R759 WeakPolarHBondContact O-CG 3.43Å
685	P	97.5	Very high	91	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.006	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	140.1	177.4	26	-34.1	0	0	0	111.5	F656 F683 L717 E762 L765	F656-P685 HydrophobicContact CE2-CG 4.07Å; F683-P685 HydrophobicContact CE1-CB 4.02Å; F683-P685 HydrophobicContact CE1-CG 4.35Å; F683-P685 HydrophobicContact CE2-CB 4.2Å; F683-P685 HydrophobicContact CZ-CB 3.73Å; F683-P685 HydrophobicContact CZ-CG 4.48Å; F683-P685 WeakPolarHBondContact O-CD 3.37Å; P685-L717 HydrophobicContact CG-CB 4.24Å; P685-E762 HydrophobicContact CB-CB 3.71Å; P685-E762 HydrophobicContact CB-CG 3.92Å; P685-L765 HydrophobicContact CB-CD2 3.81Å; P685-L765 HydrophobicContact CG-CD2 3.74Å
686	V	95.2	Very high	89.3	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.012	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	103.1	171.8	178.4	0	0	0	0	107.8	F710 Y712 R759 A760 E762	V686-F710 HydrophobicContact CG1-CB 3.89Å; V686-F710 HydrophobicContact CG1-CD1 4.32Å; V686-F710 WeakPolarHBondContact O-CD1 3.48Å; V686-Y712 HydrophobicContact CG1-CD1 4.02Å; V686-Y712 HydrophobicContact CG1-CE1 4.34Å; V686-Y712 HydrophobicContact CG1-CG 4.28Å; V686-Y712 HydrophobicContact CG2-CD1 4.44Å; V686-R759 HydrophobicContact CG2-CG 3.65Å; V686-A760 WeakPolarHBondContact CB-O 3.17Å; V686-A760 PolarHBondContact N-O 3.46Å; V686-E762 PolarHBondContact O-N 3.34Å
687	V	95.2	Very high	87.5	Confident	6 Å²	6	43 Å²	43	4%	0.036	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	144.6	-177.8	57.1	0	0	0	0	113	M662 F710 R711 L717 L765 H767	M662-V687 HydrophobicContact SD-CG2 4.14Å; V687-F710 WeakPolarHBondContact O-CA 3.5Å; V687-R711 HydrophobicContact CG1-CB 4.09Å; V687-R711 PolarHBondContact O-N 3.3Å; V687-L717 HydrophobicContact CB-CD1 3.62Å; V687-L717 HydrophobicContact CG1-CD1 3.72Å; V687-L717 HydrophobicContact CG2-CD1 4.03Å; V687-L765 HydrophobicContact CB-CD2 4.14Å; V687-L765 HydrophobicContact CB-CG 4.08Å; V687-L765 HydrophobicContact CG2-CD2 4.48Å; V687-L765 HydrophobicContact CG2-CG 3.9Å; V687-L765 WeakPolarHBondContact CG2-O 3.31Å; V687-H767 HydrophobicContact CG2-CB 3.68Å
688	F	93.9	Very high	86.4	Confident	4 Å²	4	47.8 Å²	47.8	2%	0.018	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	123.7	167.2	-171.3	-95.4	0	0	0	110	H703 H709 F710 L765 I766 H767	F688-H703 AromaticContact CD1-ND1 3.86Å; F688-H703 HydrophobicContact CD2-CB 4.41Å; F688-H703 AromaticContact CD2-ND1 3.51Å; F688-H703 HydrophobicContact CE2-CB 4.09Å; F688-H703 AromaticContact CE2-ND1 3.97Å; F688-H703 AromaticContact CG-ND1 3.43Å; F688-H703 WeakPolarHBondContact CG-ND1 3.18Å; F688-H703 HydrophobicContact CZ-CB 4.38Å; F688-H709 CarbonylContact C-O 3.57Å; F688-H709 WeakPolarHBondContact CA-O 3.43Å; F688-F710 HydrophobicContact CB-CD1 4.07Å; F688-F710 HydrophobicContact CB-CE1 3.82Å; F688-F710 HydrophobicContact CB-CZ 4.27Å; F688-F710 HydrophobicContact CD2-CD1 4.3Å; F688-F710 AromaticContact CD2-CD2 3.95Å; F688-F710 HydrophobicContact CD2-CD2 3.95Å; F688-F710 HydrophobicContact CD2-CE1 4.19Å; F688-F710 AromaticContact CD2-CE2 3.81Å; F688-F710 HydrophobicContact CD2-CE2 3.81Å; F688-F710 HydrophobicContact CD2-CG 4.2Å; F688-F710 AromaticContact CD2-CZ 3.94Å; F688-F710 HydrophobicContact CD2-CZ 3.94Å; F688-F710 HydrophobicContact CE2-CE2 4.43Å; F688-L765 PolarHBondContact N-O 3.29Å; F688-L765 VanDerWaalsContact N-O 3.1Å; F688-I766 HydrophobicContact CB-CD1 3.9Å; F688-I766 HydrophobicContact CD1-CD1 3.99Å; F688-I766 HydrophobicContact CG-CD1 4.31Å; F688-I766 CarbonylContact O-C 3.57Å; F688-I766 WeakPolarHBondContact O-CA 3.4Å; F688-H767 PolarHBondContact O-N 3.48Å
689	S	93	Very high	86	Confident	8 Å²	8	49 Å²	49	6%	0.056	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	127.5	179.2	-62.5	0	0	0	0	111.1	G708 H709 R711 H767	S689-G708 CarbonylContact O-C 3.57Å; S689-G708 WeakPolarHBondContact O-CA 3.46Å; S689-H709 PolarHBondContact N-O 3.49Å; S689-H709 PolarHBondContact O-N 2.68Å; S689-R711 WeakPolarHBondContact OG-CD 3.42Å; S689-R711 WeakPolarHBondContact OG-CG 3.32Å; S689-H767 WeakPolarHBondContact OG-CB 3.46Å
690	E	92.7	Very high	85.9	Confident	5 Å²	5	46.1 Å²	46.1	2%	0.023	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	148.4	178.7	-64.5	-175	137.2	0	0	112	S695 H700 N707 I766 H767 Y769	E690-S695 WeakPolarHBondContact OE1-CB 3.12Å; E690-S695 PolarHBondContact OE1-OG 2.65Å; E690-H700 IonicContact OE1-CE1 2.68Å; E690-H700 IonicContact OE1-CG 3.57Å; E690-H700 IonicContact OE1-ND1 3.6Å; E690-H700 PolarHBondContact OE1-ND1 2.79Å; E690-H700 IonicContact OE2-CE1 3.28Å; E690-H700 IonicContact OE2-ND1 3.26Å; E690-H700 PolarHBondContact OE2-ND1 3.48Å; E690-N707 CarbonylContact C-O 3.55Å; E690-N707 VanDerWaalsContact CA-O 3.28Å; E690-N707 WeakPolarHBondContact CA-O 3.48Å; E690-I766 HydrophobicContact CG-CG2 4.05Å; E690-H767 PolarHBondContact N-O 3.49Å; E690-H767 VanDerWaalsContact N-O 3.1Å; E690-Y769 PolarHBondContact OE2-N 3.34Å
691	Y	90.9	Very high	86	Confident	12 Å²	12	42.4 Å²	42.4	5%	0.047	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-80.4	172.7	168.4	-69	-53	0	0	0	111.5	E449 P693 A694 M706 N707 G708 H709 Y769 D792 G793 L795 S796	E449-Y691 PolarHBondContact OE1-OH 3.45Å; Y691-P693 CarbonylContact O-C 3.44Å; Y691-A694 PolarHBondContact O-N 3.3Å; Y691-M706 WeakPolarHBondContact CD2-O 3.14Å; Y691-N707 PolarHBondContact N-O 2.67Å; Y691-G708 VanDerWaalsContact CE2-C 3.47Å; Y691-G708 VanDerWaalsContact CE2-CA 3.45Å; Y691-G708 WeakPolarHBondContact CE2-O 3.44Å; Y691-H709 AromaticContact CE1-ND1 3.33Å; Y691-H709 VanDerWaalsContact CE1-ND1 3.33Å; Y691-H709 WeakPolarHBondContact CE1-ND1 3.42Å; Y691-H709 AromaticContact CZ-ND1 3.55Å; Y691-H709 PolarHBondContact OH-ND1 2.82Å; Y691-Y769 WeakPolarHBondContact O-CB 3.45Å; Y691-D792 WeakPolarHBondContact CD1-O 3.43Å; Y691-D792 WeakPolarHBondContact CE1-O 3.48Å; Y691-G793 CarbonylContact C-O 3.6Å; Y691-G793 WeakPolarHBondContact CA-O 3.47Å; Y691-L795 VanDerWaalsContact CE1-C 3.46Å; Y691-S796 WeakPolarHBondContact OH-CA 3.35Å
692	K	87	Confident	85.7	Confident	89 Å²	89	44 Å²	44	39%	0.387	25%	0.253	S	S	.	.	S	Bend	trans	-82.7	136.5	170.9	-167.3	178.9	-165.6	142.2	0	110.4	Y769 D771 G793 Y794	K692-Y769 HydrophobicContact CB-CD1 4.28Å; K692-Y769 HydrophobicContact CB-CD2 4.18Å; K692-Y769 HydrophobicContact CB-CE1 3.81Å; K692-Y769 HydrophobicContact CB-CE2 3.7Å; K692-Y769 HydrophobicContact CB-CG 4.45Å; K692-Y769 VanDerWaalsContact CB-CZ 3.49Å; K692-Y769 HydrophobicContact CD-CE1 4Å; K692-Y769 WeakPolarHBondContact CD-OH 3.37Å; K692-Y769 HydrophobicContact CG-CD1 4.23Å; K692-Y769 HydrophobicContact CG-CE1 3.56Å; K692-Y769 HydrophobicContact CG-CE2 4.35Å; K692-D771 IonicContact NZ-OD1 3.55Å; K692-D771 PolarHBondContact NZ-OD1 3.16Å; K692-D771 IonicContact NZ-OD2 3.31Å; K692-G793 PolarHBondContact N-O 3.26Å; K692-Y794 HydrophobicContact CB-CD1 4.48Å; K692-Y794 HydrophobicContact CD-CD1 4.36Å; K692-Y794 HydrophobicContact CD-CE1 4.45Å; K692-Y794 PolarHBondContact N-O 2.84Å
693	P	80.4	Confident	85.2	Confident	113 Å²	113	47 Å²	47	73%	0.734	27%	0.266	S	S	*	.	S	Bend	cis	-72.9	157.6	-12.6	32.3	-34.5	0	0	0	111.3	Y691	Y691-P693 CarbonylContact O-C 3.44Å
694	A	70.7	Confident	84.4	Confident	25 Å²	25	52 Å²	52	21%	0.207	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-54.1	156.3	167.8	0	0	0	0	0	110.3	Y691 D696 V768	Y691-A694 PolarHBondContact O-N 3.3Å; A694-D696 PolarHBondContact O-N 3.36Å; A694-V768 HydrophobicContact CB-CG1 4.17Å
695	S	71.7	Confident	83.5	Confident	14 Å²	14	56.9 Å²	56.9	10%	0.098	31%	0.307	C	S	.	.			trans	-66.9	73.7	173.7	-53.9	0	0	0	0	110.3	E690 G697 Q698 H700	E690-S695 WeakPolarHBondContact OE1-CB 3.12Å; E690-S695 PolarHBondContact OE1-OG 2.65Å; S695-G697 PolarHBondContact O-N 2.88Å; S695-Q698 PolarHBondContact O-N 3.25Å; S695-H700 PolarHBondContact O-CE1 3.45Å
696	D	58.8	Low	82.7	Confident	158 Å²	158	59.4 Å²	59.4	85%	0.845	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	103.8	-172.1	-148	16.2	0	0	0	109.9	A694 Q698	A694-D696 PolarHBondContact O-N 3.36Å; D696-Q698 VanDerWaalsContact C-N 3.29Å; D696-Q698 PolarHBondContact O-N 3.11Å
697	G	59.1	Low	82.3	Confident	81 Å²	81	61.3 Å²	61.3	84%	0.835	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.4	3.9	-176.6	0	0	0	0	0	116.4	S695	S695-G697 PolarHBondContact O-N 2.88Å
698	Q	68.7	Low	82.1	Confident	136 Å²	136	61 Å²	61	64%	0.636	33%	0.329	S	S	*	.	S	Bend	trans	-95.9	179.4	176.6	-65.2	-173.2	8.6	0	0	112.5	S695 D696 H700	S695-Q698 PolarHBondContact O-N 3.25Å; D696-Q698 VanDerWaalsContact C-N 3.29Å; D696-Q698 PolarHBondContact O-N 3.11Å; Q698-H700 PolarHBondContact O-N 3.49Å; Q698-H700 VanDerWaalsContact O-N 3.08Å
699	N	84.2	Confident	81.8	Confident	104 Å²	104	62 Å²	62	56%	0.556	33%	0.333	S	S	*	.			trans	-70	98.7	174.3	-179.4	17.8	0	0	0	111.4	F701 N702	N699-F701 PolarHBondContact O-N 3.06Å; N699-F701 VanDerWaalsContact O-N 3.11Å; N699-F701 WeakPolarHBondContact OD1-CB 3.44Å; N699-F701 PolarHBondContact OD1-N 2.74Å; N699-N702 VanDerWaalsContact O-CB 3.31Å; N699-N702 WeakPolarHBondContact O-CB 3.49Å; N699-N702 PolarHBondContact O-N 2.99Å; N699-N702 VanDerWaalsContact O-N 3.08Å
700	H	89.5	Confident	81.7	Confident	44 Å²	44	63.7 Å²	63.7	20%	0.204	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-23.7	173.3	-70	-67.1	0	0	0	114.2	L663 E690 S695 Q698 N702 I766	L663-H700 HydrophobicContact CD1-CB 4.03Å; E690-H700 IonicContact OE1-CE1 2.68Å; E690-H700 IonicContact OE1-CG 3.57Å; E690-H700 IonicContact OE1-ND1 3.6Å; E690-H700 PolarHBondContact OE1-ND1 2.79Å; E690-H700 IonicContact OE2-CE1 3.28Å; E690-H700 IonicContact OE2-ND1 3.26Å; E690-H700 PolarHBondContact OE2-ND1 3.48Å; S695-H700 PolarHBondContact O-CE1 3.45Å; Q698-H700 PolarHBondContact O-N 3.49Å; Q698-H700 VanDerWaalsContact O-N 3.08Å; H700-N702 PolarHBondContact O-N 3.17Å; H700-I766 HydrophobicContact CB-CG2 4.4Å; H700-I766 WeakPolarHBondContact O-CD1 3.34Å
701	F	90.5	Very high	81.5	Confident	48 Å²	48	65.9 Å²	65.9	21%	0.211	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	22.7	178	-60.1	-87.8	0	0	0	112.9	T665 N699 H703 I766	T665-F701 HydrophobicContact CG2-CE1 3.73Å; T665-F701 HydrophobicContact CG2-CE2 4.14Å; T665-F701 HydrophobicContact CG2-CZ 3.5Å; T665-F701 VanDerWaalsContact CG2-CZ 3.5Å; N699-F701 PolarHBondContact O-N 3.06Å; N699-F701 VanDerWaalsContact O-N 3.11Å; N699-F701 WeakPolarHBondContact OD1-CB 3.44Å; N699-F701 PolarHBondContact OD1-N 2.74Å; F701-H703 PolarHBondContact O-CD2 3.43Å; F701-H703 PolarHBondContact O-N 3.25Å; F701-I766 HydrophobicContact CD1-CD1 3.99Å; F701-I766 HydrophobicContact CD1-CG1 3.62Å; F701-I766 HydrophobicContact CE1-CD1 4.43Å; F701-I766 HydrophobicContact CE1-CG1 3.66Å; F701-I766 HydrophobicContact CG-CG1 4.22Å; F701-I766 HydrophobicContact CZ-CG1 4.3Å
702	N	87.9	Confident	81.3	Confident	72 Å²	72	70.8 Å²	70.8	39%	0.385	37%	0.367	S	S	.	.			trans	-89.9	96.7	171.5	-176.4	-0.4	0	0	0	110.9	N699 H700 F704 N707	N699-N702 VanDerWaalsContact O-CB 3.31Å; N699-N702 WeakPolarHBondContact O-CB 3.49Å; N699-N702 PolarHBondContact O-N 2.99Å; N699-N702 VanDerWaalsContact O-N 3.08Å; H700-N702 PolarHBondContact O-N 3.17Å; N702-F704 PolarHBondContact O-N 3.11Å; N702-F704 VanDerWaalsContact O-N 3.09Å; N702-F704 WeakPolarHBondContact OD1-CB 3.35Å; N702-F704 PolarHBondContact OD1-N 2.68Å; N702-N707 PolarHBondContact ND2-ND2 3.35Å; N702-N707 VanDerWaalsContact ND2-ND2 3.11Å; N702-N707 PolarHBondContact O-ND2 3.3Å; N702-N707 VanDerWaalsContact O-ND2 3.08Å
703	H	86.4	Confident	81.2	Confident	61 Å²	61	72.8 Å²	72.8	28%	0.282	38%	0.376	S	S	.	.			trans	-78.2	19.4	-177.5	-56.5	-75	0	0	0	115.3	F688 F701 Y705 F710 P763 I766	F688-H703 AromaticContact CD1-ND1 3.86Å; F688-H703 HydrophobicContact CD2-CB 4.41Å; F688-H703 AromaticContact CD2-ND1 3.51Å; F688-H703 HydrophobicContact CE2-CB 4.09Å; F688-H703 AromaticContact CE2-ND1 3.97Å; F688-H703 AromaticContact CG-ND1 3.43Å; F688-H703 WeakPolarHBondContact CG-ND1 3.18Å; F688-H703 HydrophobicContact CZ-CB 4.38Å; F701-H703 PolarHBondContact O-CD2 3.43Å; F701-H703 PolarHBondContact O-N 3.25Å; H703-Y705 PolarHBondContact O-N 3.33Å; H703-F710 AromaticContact ND1-CZ 3.92Å; H703-P763 PolarHBondContact CE1-O 3.03Å; H703-P763 PolarHBondContact NE2-O 3.08Å; H703-I766 VanDerWaalsContact CE1-CD1 3.48Å; H703-I766 WeakPolarHBondContact CE1-CD1 3.39Å
704	F	82.2	Confident	81.5	Confident	108 Å²	108	68 Å²	68	47%	0.474	35%	0.346	S	S	.	.			trans	-58.9	139.5	175.5	-164.5	-112.5	0	0	0	110.2	N702 M706 N707	N702-F704 PolarHBondContact O-N 3.11Å; N702-F704 VanDerWaalsContact O-N 3.09Å; N702-F704 WeakPolarHBondContact OD1-CB 3.35Å; N702-F704 PolarHBondContact OD1-N 2.68Å; F704-M706 HydrophobicContact CD1-CB 3.77Å; F704-M706 HydrophobicContact CD1-CG 3.74Å; F704-M706 HydrophobicContact CE1-CB 4.07Å; F704-M706 HydrophobicContact CE1-CG 3.52Å; F704-M706 PolarHBondContact O-N 3.34Å; F704-N707 WeakPolarHBondContact O-CB 3.26Å; F704-N707 PolarHBondContact O-N 3.08Å
705	Y	77.2	Confident	82.7	Confident	103 Å²	103	68.1 Å²	68.1	40%	0.404	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-12.1	-172.6	68.8	-90.8	0	0	0	114.6	H703	H703-Y705 PolarHBondContact O-N 3.33Å
706	M	82.1	Confident	83.7	Confident	54 Å²	54	68 Å²	68	27%	0.266	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-17.5	175.3	-60.9	-71.3	-79.4	0	0	113.3	Y691 F704 R799	Y691-M706 WeakPolarHBondContact CD2-O 3.14Å; F704-M706 HydrophobicContact CD1-CB 3.77Å; F704-M706 HydrophobicContact CD1-CG 3.74Å; F704-M706 HydrophobicContact CE1-CB 4.07Å; F704-M706 HydrophobicContact CE1-CG 3.52Å; F704-M706 PolarHBondContact O-N 3.34Å; M706-R799 HydrophobicContact CE-CB 4.2Å; M706-R799 HydrophobicContact CE-CG 4.09Å; M706-R799 HydrophobicContact SD-CB 4.34Å
707	N	87	Confident	85.5	Confident	42 Å²	42	61 Å²	61	23%	0.225	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-21.8	-173.8	-62.2	-7.8	0	0	0	112.4	E690 Y691 N702 F704	E690-N707 CarbonylContact C-O 3.55Å; E690-N707 VanDerWaalsContact CA-O 3.28Å; E690-N707 WeakPolarHBondContact CA-O 3.48Å; Y691-N707 PolarHBondContact N-O 2.67Å; N702-N707 PolarHBondContact ND2-ND2 3.35Å; N702-N707 VanDerWaalsContact ND2-ND2 3.11Å; N702-N707 PolarHBondContact O-ND2 3.3Å; N702-N707 VanDerWaalsContact O-ND2 3.08Å; F704-N707 WeakPolarHBondContact O-CB 3.26Å; F704-N707 PolarHBondContact O-N 3.08Å
708	G	89.7	Confident	87.4	Confident	1 Å²	1	57.2 Å²	57.2	1%	0.01	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.7	-169.9	-177.3	0	0	0	0	0	112.3	S689 Y691	S689-G708 CarbonylContact O-C 3.57Å; S689-G708 WeakPolarHBondContact O-CA 3.46Å; Y691-G708 VanDerWaalsContact CE2-C 3.47Å; Y691-G708 VanDerWaalsContact CE2-CA 3.45Å; Y691-G708 WeakPolarHBondContact CE2-O 3.44Å
709	H	88.1	Confident	88.8	Confident	24 Å²	24	50.7 Å²	50.7	11%	0.111	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	158.6	178.9	64.9	-81.9	0	0	0	112.4	E449 F688 S689 Y691 D792	E449-H709 WeakPolarHBondContact OE1-CB 3.49Å; E449-H709 WeakPolarHBondContact OE2-CB 3.33Å; F688-H709 CarbonylContact C-O 3.57Å; F688-H709 WeakPolarHBondContact CA-O 3.43Å; S689-H709 PolarHBondContact N-O 3.49Å; S689-H709 PolarHBondContact O-N 2.68Å; Y691-H709 AromaticContact CE1-ND1 3.33Å; Y691-H709 VanDerWaalsContact CE1-ND1 3.33Å; Y691-H709 WeakPolarHBondContact CE1-ND1 3.42Å; Y691-H709 AromaticContact CZ-ND1 3.55Å; Y691-H709 PolarHBondContact OH-ND1 2.82Å; H709-D792 PolarHBondContact CE1-O 2.93Å
710	F	90.8	Very high	89.5	Confident	43 Å²	43	45.8 Å²	45.8	19%	0.189	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	124.5	173	-77.1	-74.9	0	0	0	111.4	V686 V687 F688 H703 Y712 P761	V686-F710 HydrophobicContact CG1-CB 3.89Å; V686-F710 HydrophobicContact CG1-CD1 4.32Å; V686-F710 WeakPolarHBondContact O-CD1 3.48Å; V687-F710 WeakPolarHBondContact O-CA 3.5Å; F688-F710 HydrophobicContact CB-CD1 4.07Å; F688-F710 HydrophobicContact CB-CE1 3.82Å; F688-F710 HydrophobicContact CB-CZ 4.27Å; F688-F710 HydrophobicContact CD2-CD1 4.3Å; F688-F710 AromaticContact CD2-CD2 3.95Å; F688-F710 HydrophobicContact CD2-CD2 3.95Å; F688-F710 HydrophobicContact CD2-CE1 4.19Å; F688-F710 AromaticContact CD2-CE2 3.81Å; F688-F710 HydrophobicContact CD2-CE2 3.81Å; F688-F710 HydrophobicContact CD2-CG 4.2Å; F688-F710 AromaticContact CD2-CZ 3.94Å; F688-F710 HydrophobicContact CD2-CZ 3.94Å; F688-F710 HydrophobicContact CE2-CE2 4.43Å; H703-F710 AromaticContact ND1-CZ 3.92Å; F710-Y712 VanDerWaalsContact C-N 3.35Å; F710-Y712 HydrophobicContact CB-CD2 4.32Å; F710-Y712 HydrophobicContact CB-CE2 3.83Å; F710-Y712 VanDerWaalsContact O-CD2 3.25Å; F710-Y712 WeakPolarHBondContact O-CD2 3.49Å; F710-Y712 PolarHBondContact O-N 3.08Å; F710-P761 HydrophobicContact CD1-CB 3.94Å; F710-P761 HydrophobicContact CE1-CB 3.91Å; F710-P761 HydrophobicContact CG-CB 4.28Å; F710-P761 HydrophobicContact CZ-CB 4.22Å
711	R	88.5	Confident	89.9	Confident	51 Å²	51	45.2 Å²	45.2	19%	0.192	21%	0.206	C	C	.	.			trans	-81.6	73.4	-177.8	-73.2	-177.7	65.3	-165	-3.3	112.6	V687 S689 F713 G714	V687-R711 HydrophobicContact CG1-CB 4.09Å; V687-R711 PolarHBondContact O-N 3.3Å; S689-R711 WeakPolarHBondContact OG-CD 3.42Å; S689-R711 WeakPolarHBondContact OG-CG 3.32Å; R711-F713 PolarHBondContact O-N 3.25Å; R711-G714 PolarHBondContact O-N 2.86Å
712	Y	86	Confident	90.2	Very high	115 Å²	115	44.8 Å²	44.8	45%	0.451	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-23.7	-178.1	-70.9	-77	0	0	0	115	V686 F710 R759 P761	V686-Y712 HydrophobicContact CG1-CD1 4.02Å; V686-Y712 HydrophobicContact CG1-CE1 4.34Å; V686-Y712 HydrophobicContact CG1-CG 4.28Å; V686-Y712 HydrophobicContact CG2-CD1 4.44Å; F710-Y712 VanDerWaalsContact C-N 3.35Å; F710-Y712 HydrophobicContact CB-CD2 4.32Å; F710-Y712 HydrophobicContact CB-CE2 3.83Å; F710-Y712 VanDerWaalsContact O-CD2 3.25Å; F710-Y712 WeakPolarHBondContact O-CD2 3.49Å; F710-Y712 PolarHBondContact O-N 3.08Å; Y712-R759 VanDerWaalsContact C-NH2 3.35Å; Y712-R759 PolarHBondContact O-NE 3.42Å; Y712-R759 PolarHBondContact O-NH2 2.95Å; Y712-P761 HydrophobicContact CE1-CG 3.99Å
713	F	84.8	Confident	90.6	Very high	132 Å²	132	43.7 Å²	43.7	58%	0.579	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108.8	14	179	-54.6	-80	0	0	0	114.1	P451 R711 F715	P451-F713 HydrophobicContact CG-CE2 3.37Å; P451-F713 HydrophobicContact CG-CZ 3.59Å; R711-F713 PolarHBondContact O-N 3.25Å; F713-F715 WeakPolarHBondContact O-CD2 3.23Å; F713-F715 VanDerWaalsContact O-CE2 3.27Å; F713-F715 WeakPolarHBondContact O-CE2 3.13Å
714	G	88.6	Confident	91.1	Very high	11 Å²	11	40.8 Å²	40.8	11%	0.113	18%	0.182	C	C	.	.			trans	-94.2	121.7	172.1	0	0	0	0	0	111.6	R711 R759	R711-G714 PolarHBondContact O-N 2.86Å; G714-R759 PolarHBondContact O-NH1 3.29Å; G714-R759 PolarHBondContact O-NH2 2.97Å
715	F	94.2	Very high	91.8	Very high	29 Å²	29	35.9 Å²	35.9	13%	0.127	16%	0.161	C	C	.	.			trans	-111.4	-0.9	-174.9	-56.1	-78.4	0	0	0	113.3	F684 F713 L717 D742 V743 F746 R759	F684-F715 HydrophobicContact CD1-CB 4.47Å; F684-F715 HydrophobicContact CE1-CB 4.44Å; F713-F715 WeakPolarHBondContact O-CD2 3.23Å; F713-F715 VanDerWaalsContact O-CE2 3.27Å; F713-F715 WeakPolarHBondContact O-CE2 3.13Å; F715-L717 PolarHBondContact O-N 3.49Å; F715-D742 HydrophobicContact CB-CB 4.08Å; F715-D742 PolarHBondContact N-OD2 2.9Å; F715-V743 HydrophobicContact CD2-CG2 3.94Å; F715-V743 HydrophobicContact CE2-CG2 4.46Å; F715-F746 HydrophobicContact CB-CB 4.15Å; F715-F746 HydrophobicContact CD1-CB 4.12Å; F715-F746 AromaticContact CD1-CD1 3.99Å; F715-F746 HydrophobicContact CD1-CD1 3.99Å; F715-F746 AromaticContact CD1-CD2 3.39Å; F715-F746 HydrophobicContact CD1-CD2 3.39Å; F715-F746 HydrophobicContact CD1-CE1 4.21Å; F715-F746 AromaticContact CD1-CE2 3.66Å; F715-F746 HydrophobicContact CD1-CE2 3.66Å; F715-F746 AromaticContact CD1-CG 3.57Å; F715-F746 HydrophobicContact CD1-CG 3.57Å; F715-F746 HydrophobicContact CD1-CZ 4.08Å; F715-F746 AromaticContact CE1-CD1 3.9Å; F715-F746 HydrophobicContact CE1-CD1 3.9Å; F715-F746 AromaticContact CE1-CD2 3.84Å; F715-F746 HydrophobicContact CE1-CD2 3.84Å; F715-F746 AromaticContact CE1-CE1 3.72Å; F715-F746 HydrophobicContact CE1-CE1 3.72Å; F715-F746 AromaticContact CE1-CE2 3.66Å; F715-F746 HydrophobicContact CE1-CE2 3.66Å; F715-F746 AromaticContact CE1-CG 3.95Å; F715-F746 HydrophobicContact CE1-CG 3.95Å; F715-F746 AromaticContact CE1-CZ 3.62Å; F715-F746 HydrophobicContact CE1-CZ 3.62Å; F715-F746 HydrophobicContact CG-CB 4.16Å; F715-F746 HydrophobicContact CG-CD2 4.26Å; F715-F746 HydrophobicContact CG-CG 4.09Å; F715-F746 HydrophobicContact CZ-CD1 4.39Å; F715-F746 HydrophobicContact CZ-CE1 4.24Å; F715-F746 HydrophobicContact CZ-CZ 4.49Å; F715-R759 VanDerWaalsContact CE1-CZ 3.5Å
716	G	93.6	Very high	92.7	Very high	12 Å²	12	34.7 Å²	34.7	12%	0.124	16%	0.162	C	C	.	.	S	Bend	trans	-63.3	-22.3	-175.1	0	0	0	0	0	115.6	R638 D742	R638-G716 PolarHBondContact NH2-O 3.4Å; G716-D742 PolarHBondContact N-OD2 3.14Å
717	L	97.5	Very high	93.3	Very high	10 Å²	10	35 Å²	35	5%	0.052	17%	0.173	C	C	.	.			trans	-101	121.2	179.2	-52.9	172.4	0	0	0	109	F656 F657 A658 M662 P685 V687 F715 L765	F656-L717 HydrophobicContact CE2-CB 4.47Å; F657-L717 WeakPolarHBondContact O-CA 3.46Å; A658-L717 HydrophobicContact CB-CD2 4.44Å; M662-L717 HydrophobicContact CG-CD1 4.36Å; M662-L717 HydrophobicContact CG-CD2 3.93Å; M662-L717 HydrophobicContact SD-CD1 3.69Å; M662-L717 HydrophobicContact SD-CD2 4.13Å; P685-L717 HydrophobicContact CG-CB 4.24Å; V687-L717 HydrophobicContact CB-CD1 3.62Å; V687-L717 HydrophobicContact CG1-CD1 3.72Å; V687-L717 HydrophobicContact CG2-CD1 4.03Å; F715-L717 PolarHBondContact O-N 3.49Å; L717-L765 HydrophobicContact CD1-CD2 3.76Å; L717-L765 HydrophobicContact CD1-CG 4.27Å
718	V	98.1	Very high	93.7	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.006	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	140.3	-175.7	60.5	0	0	0	0	110.6	F656 F657 F683 F684 L720 L745	F656-V718 WeakPolarHBondContact CA-O 3.45Å; F656-V718 WeakPolarHBondContact CD2-O 3.31Å; F657-V718 HydrophobicContact CB-CG1 4.07Å; F657-V718 HydrophobicContact CD2-CG1 3.62Å; F657-V718 HydrophobicContact CE2-CG1 4.4Å; F657-V718 HydrophobicContact CG-CG1 4.11Å; F657-V718 PolarHBondContact N-O 2.96Å; F683-V718 CarbonylContact O-C 3.52Å; F683-V718 WeakPolarHBondContact O-CA 3.43Å; F684-V718 HydrophobicContact CD1-CB 3.75Å; F684-V718 HydrophobicContact CD1-CG2 3.81Å; F684-V718 HydrophobicContact CD2-CG2 3.81Å; F684-V718 HydrophobicContact CE1-CB 3.63Å; F684-V718 HydrophobicContact CE1-CG1 4.39Å; F684-V718 HydrophobicContact CE1-CG2 3.57Å; F684-V718 HydrophobicContact CE2-CG2 3.59Å; F684-V718 HydrophobicContact CG-CB 4.27Å; F684-V718 HydrophobicContact CG-CG2 3.94Å; F684-V718 HydrophobicContact CZ-CB 4.06Å; F684-V718 HydrophobicContact CZ-CG2 3.47Å; F684-V718 VanDerWaalsContact CZ-CG2 3.47Å; V718-L720 HydrophobicContact CG1-CD2 4.01Å; V718-L720 HydrophobicContact CG2-CD2 4.13Å; V718-L745 HydrophobicContact CG1-CD2 3.97Å
719	S	98.4	Very high	94	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	134.1	164.4	61.5	0	0	0	0	111.9	M655 T676 F683	M655-S719 WeakPolarHBondContact O-CA 3.47Å; M655-S719 WeakPolarHBondContact O-CB 3.49Å; T676-S719 PolarHBondContact OG1-OG 2.9Å; F683-S719 WeakPolarHBondContact CB-OG 3.28Å; F683-S719 WeakPolarHBondContact CD1-OG 3.22Å; F683-S719 PolarHBondContact N-O 3.07Å; F683-S719 PolarHBondContact O-N 3.24Å
720	L	98	Very high	94.4	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	154.2	-175.2	67.5	179.5	0	0	0	110.2	M655 F657 V682 V718 F725	M655-L720 WeakPolarHBondContact CB-O 3.36Å; M655-L720 HydrophobicContact CE-CD2 4.38Å; M655-L720 HydrophobicContact CE-CG 4.36Å; M655-L720 PolarHBondContact N-O 3.5Å; M655-L720 PolarHBondContact O-N 3.34Å; M655-L720 VanDerWaalsContact O-N 3.11Å; F657-L720 HydrophobicContact CE2-CD2 4.46Å; V682-L720 HydrophobicContact CB-CB 4.18Å; V682-L720 HydrophobicContact CG1-CB 3.57Å; V682-L720 HydrophobicContact CG1-CD1 4.5Å; V718-L720 HydrophobicContact CG1-CD2 4.01Å; V718-L720 HydrophobicContact CG2-CD2 4.13Å; L720-F725 HydrophobicContact CD1-CB 3.71Å; L720-F725 HydrophobicContact CD1-CD2 4Å; L720-F725 HydrophobicContact CD1-CG 4.35Å; L720-F725 HydrophobicContact CG-CB 4.07Å
721	Y	98	Very high	94.6	Very high	33 Å²	33	34.1 Å²	34.1	13%	0.129	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	152.2	173	-75.2	-89.7	0	0	0	111.2	G652 S653 L654 T676 K678 E723 D724 F725	G652-Y721 WeakPolarHBondContact O-CD1 3.42Å; S653-Y721 CarbonylContact O-C 3.52Å; S653-Y721 WeakPolarHBondContact O-CA 3.36Å; L654-Y721 HydrophobicContact CB-CD1 4.4Å; L654-Y721 HydrophobicContact CB-CE1 4.04Å; L654-Y721 HydrophobicContact CD1-CD2 4.46Å; L654-Y721 HydrophobicContact CD1-CE2 4.25Å; T676-Y721 HydrophobicContact CG2-CD2 3.86Å; T676-Y721 HydrophobicContact CG2-CE2 3.96Å; T676-Y721 WeakPolarHBondContact O-CE2 3.4Å; K678-Y721 VanDerWaalsContact CA-CD2 3.4Å; K678-Y721 HydrophobicContact CB-CD1 4.25Å; K678-Y721 HydrophobicContact CB-CD2 3.58Å; K678-Y721 HydrophobicContact CB-CE1 4.4Å; K678-Y721 HydrophobicContact CB-CE2 3.77Å; K678-Y721 HydrophobicContact CB-CG 3.83Å; K678-Y721 HydrophobicContact CD-CD1 4.26Å; K678-Y721 HydrophobicContact CD-CG 4.38Å; K678-Y721 HydrophobicContact CG-CD1 4.25Å; K678-Y721 HydrophobicContact CG-CD2 4.13Å; K678-Y721 HydrophobicContact CG-CG 3.88Å; K678-Y721 VanDerWaalsContact N-CE2 3.26Å; Y721-E723 VanDerWaalsContact C-N 3.25Å; Y721-E723 PolarHBondContact O-N 3.28Å; Y721-D724 PolarHBondContact O-N 2.93Å; Y721-F725 PolarHBondContact O-N 2.91Å
722	R	97.5	Very high	95	Very high	38 Å²	38	33.9 Å²	33.9	14%	0.143	19%	0.188	C	C	.	.	H	α-helix	trans	-50.9	-45.8	176.7	179.5	60.5	177.1	131.9	10.4	112.1	A646 S653 M655 F725 D726	A646-R722 WeakPolarHBondContact O-CD 3.29Å; A646-R722 PolarHBondContact O-NE 3.49Å; S653-R722 PolarHBondContact O-N 3.02Å; M655-R722 HydrophobicContact CE-CB 4.41Å; M655-R722 HydrophobicContact SD-CB 4.34Å; R722-F725 VanDerWaalsContact NH1-CD1 3.32Å; R722-F725 WeakPolarHBondContact O-CB 3.31Å; R722-F725 PolarHBondContact O-N 2.79Å; R722-D726 IonicContact CZ-OD1 3.48Å; R722-D726 VanDerWaalsContact CZ-OD1 3.26Å; R722-D726 IonicContact CZ-OD2 3.68Å; R722-D726 VanDerWaalsContact CZ-OD2 3.31Å; R722-D726 IonicContact NE-OD2 2.81Å; R722-D726 IonicContact NH1-OD1 2.96Å; R722-D726 PolarHBondContact NH1-OD1 2.91Å; R722-D726 IonicContact NH1-OD2 2.72Å; R722-D726 PolarHBondContact NH1-OD2 3.13Å; R722-D726 IonicContact NH2-OD1 2.71Å; R722-D726 IonicContact NH2-OD2 2.91Å; R722-D726 PolarHBondContact O-N 3.35Å
723	E	95.5	Very high	95.3	Very high	49 Å²	49	31.1 Å²	31.1	23%	0.229	18%	0.183	C	C	.	.	H	α-helix	trans	-67.4	-35.7	178.7	-64.4	91.7	149.7	0	0	113	G652 K678 Y721 D726 A727	G652-E723 WeakPolarHBondContact CA-OE1 3.46Å; G652-E723 WeakPolarHBondContact CA-OE2 3.4Å; G652-E723 PolarHBondContact N-OE1 2.71Å; G652-E723 PolarHBondContact N-OE2 3.23Å; K678-E723 WeakPolarHBondContact CE-OE1 3.34Å; K678-E723 VanDerWaalsContact CE-OE2 3.31Å; K678-E723 WeakPolarHBondContact CE-OE2 3.36Å; K678-E723 IonicContact NZ-OE1 3.32Å; K678-E723 PolarHBondContact NZ-OE1 2.75Å; K678-E723 IonicContact NZ-OE2 3.88Å; K678-E723 PolarHBondContact NZ-OE2 2.92Å; Y721-E723 VanDerWaalsContact C-N 3.25Å; Y721-E723 PolarHBondContact O-N 3.28Å; E723-D726 PolarHBondContact O-N 2.84Å; E723-A727 WeakPolarHBondContact O-CB 3.33Å; E723-A727 PolarHBondContact O-N 3.13Å
724	D	97.1	Very high	95.7	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-67.7	-40.8	176.6	-66.3	-32	0	0	0	110.6	N679 V682 Y721 D726 A727 V728 I755	N679-D724 WeakPolarHBondContact CA-OD1 3.35Å; N679-D724 PolarHBondContact N-OD1 3.32Å; N679-D724 PolarHBondContact N-OD2 3.07Å; V682-D724 HydrophobicContact CG1-CB 4.43Å; Y721-D724 PolarHBondContact O-N 2.93Å; D724-D726 VanDerWaalsContact C-N 3.35Å; D724-A727 PolarHBondContact O-N 2.99Å; D724-V728 WeakPolarHBondContact O-CG1 3.32Å; D724-V728 WeakPolarHBondContact O-CG2 3.31Å; D724-V728 PolarHBondContact O-N 3.18Å; D724-I755 HydrophobicContact CB-CD1 4.04Å
725	F	97.8	Very high	95.7	Very high	5 Å²	5	34.6 Å²	34.6	2%	0.022	20%	0.196	C	C	.	.	H	α-helix	trans	-60.3	-43.9	173.8	175.6	-99.7	0	0	0	111.9	A646 M655 F657 L720 Y721 R722 V728 G729 G730 M731 L745	A646-F725 HydrophobicContact CB-CD1 4.27Å; A646-F725 HydrophobicContact CB-CE1 3.92Å; A646-F725 HydrophobicContact CB-CZ 4.37Å; M655-F725 HydrophobicContact CE-CB 3.67Å; M655-F725 HydrophobicContact CE-CD1 4.37Å; M655-F725 HydrophobicContact CE-CG 4Å; F657-F725 HydrophobicContact CE2-CD2 4.08Å; F657-F725 AromaticContact CE2-CE2 3.75Å; F657-F725 HydrophobicContact CE2-CE2 3.75Å; F657-F725 AromaticContact CZ-CD2 3.97Å; F657-F725 HydrophobicContact CZ-CD2 3.97Å; F657-F725 AromaticContact CZ-CE2 3.73Å; F657-F725 HydrophobicContact CZ-CE2 3.73Å; F657-F725 HydrophobicContact CZ-CZ 4.23Å; L720-F725 HydrophobicContact CD1-CB 3.71Å; L720-F725 HydrophobicContact CD1-CD2 4Å; L720-F725 HydrophobicContact CD1-CG 4.35Å; L720-F725 HydrophobicContact CG-CB 4.07Å; Y721-F725 PolarHBondContact O-N 2.91Å; R722-F725 VanDerWaalsContact NH1-CD1 3.32Å; R722-F725 WeakPolarHBondContact O-CB 3.31Å; R722-F725 PolarHBondContact O-N 2.79Å; F725-V728 VanDerWaalsContact O-CG2 3.26Å; F725-V728 WeakPolarHBondContact O-CG2 3.18Å; F725-G729 PolarHBondContact O-N 3.42Å; F725-G730 VanDerWaalsContact CZ-CA 3.42Å; F725-G730 WeakPolarHBondContact O-CA 3.5Å; F725-G730 PolarHBondContact O-N 2.85Å; F725-M731 HydrophobicContact CE2-CG 3.75Å; F725-M731 HydrophobicContact CE2-SD 4.14Å; F725-M731 HydrophobicContact CZ-CB 4.43Å; F725-M731 HydrophobicContact CZ-CG 3.86Å; F725-M731 VanDerWaalsContact CZ-N 3.33Å; F725-L745 HydrophobicContact CD2-CD1 4.27Å; F725-L745 HydrophobicContact CE2-CD1 4.41Å
726	D	96	Very high	95.4	Very high	78 Å²	78	42.6 Å²	42.6	42%	0.417	23%	0.226	S	C	.	.	H	α-helix	trans	-69.3	-39.7	177.4	-67.5	-27.8	0	0	0	111.5	R722 E723 D724 V728 G729	R722-D726 IonicContact CZ-OD1 3.48Å; R722-D726 VanDerWaalsContact CZ-OD1 3.26Å; R722-D726 IonicContact CZ-OD2 3.68Å; R722-D726 VanDerWaalsContact CZ-OD2 3.31Å; R722-D726 IonicContact NE-OD2 2.81Å; R722-D726 IonicContact NH1-OD1 2.96Å; R722-D726 PolarHBondContact NH1-OD1 2.91Å; R722-D726 IonicContact NH1-OD2 2.72Å; R722-D726 PolarHBondContact NH1-OD2 3.13Å; R722-D726 IonicContact NH2-OD1 2.71Å; R722-D726 IonicContact NH2-OD2 2.91Å; R722-D726 PolarHBondContact O-N 3.35Å; E723-D726 PolarHBondContact O-N 2.84Å; D724-D726 VanDerWaalsContact C-N 3.35Å; D726-V728 VanDerWaalsContact C-N 3.33Å; D726-V728 PolarHBondContact O-N 3.26Å; D726-G729 PolarHBondContact O-N 3.22Å
727	A	94.6	Very high	95	Very high	61 Å²	61	44.1 Å²	44.1	50%	0.504	24%	0.241	S	C	.	.	H	α-helix	trans	-64.9	-31.4	179.1	0	0	0	0	0	113.5	E723 D724 G729	E723-A727 WeakPolarHBondContact O-CB 3.33Å; E723-A727 PolarHBondContact O-N 3.13Å; D724-A727 PolarHBondContact O-N 2.99Å; A727-G729 VanDerWaalsContact C-N 3.3Å
728	V	95.8	Very high	94.3	Very high	16 Å²	16	47.4 Å²	47.4	10%	0.097	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-5.8	172.7	-58.2	0	0	0	0	113.3	D724 F725 D726 L745 K748 N752 I755	D724-V728 WeakPolarHBondContact O-CG1 3.32Å; D724-V728 WeakPolarHBondContact O-CG2 3.31Å; D724-V728 PolarHBondContact O-N 3.18Å; F725-V728 VanDerWaalsContact O-CG2 3.26Å; F725-V728 WeakPolarHBondContact O-CG2 3.18Å; D726-V728 VanDerWaalsContact C-N 3.33Å; D726-V728 PolarHBondContact O-N 3.26Å; V728-L745 HydrophobicContact CG2-CD1 3.82Å; V728-K748 HydrophobicContact CB-CB 4.13Å; V728-N752 HydrophobicContact CG1-CB 4.24Å; V728-I755 HydrophobicContact CG1-CD1 3.5Å
729	G	95.3	Very high	93.8	Very high	56 Å²	56	47.6 Å²	47.6	58%	0.577	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.7	15.5	178.9	0	0	0	0	0	115.3	F725 D726 A727	F725-G729 PolarHBondContact O-N 3.42Å; D726-G729 PolarHBondContact O-N 3.22Å; A727-G729 VanDerWaalsContact C-N 3.3Å
730	G	96	Very high	93.5	Very high	6 Å²	6	50 Å²	50	6%	0.062	27%	0.268	C	S	.	.			trans	63.8	-167.7	173.3	0	0	0	0	0	116	F725 K748	F725-G730 VanDerWaalsContact CZ-CA 3.42Å; F725-G730 WeakPolarHBondContact O-CA 3.5Å; F725-G730 PolarHBondContact O-N 2.85Å; G730-K748 PolarHBondContact O-NZ 2.9Å
731	M	96.3	Very high	93.3	Very high	13 Å²	13	50.5 Å²	50.5	6%	0.064	27%	0.27	C	S	.	.			trans	-72.3	140.8	177.1	-59.2	-61.5	-69.7	0	0	111.7	A639 L642 S643 F657 F725 T733 E741 L745	A639-M731 HydrophobicContact CB-CB 3.97Å; A639-M731 HydrophobicContact CB-CE 4.06Å; L642-M731 HydrophobicContact CB-CG 4.21Å; L642-M731 HydrophobicContact CD1-CE 4.14Å; S643-M731 WeakPolarHBondContact OG-CB 3.42Å; F657-M731 HydrophobicContact CD2-SD 4.48Å; F657-M731 HydrophobicContact CE2-CG 4.42Å; F657-M731 HydrophobicContact CE2-SD 4Å; F725-M731 HydrophobicContact CE2-CG 3.75Å; F725-M731 HydrophobicContact CE2-SD 4.14Å; F725-M731 HydrophobicContact CZ-CB 4.43Å; F725-M731 HydrophobicContact CZ-CG 3.86Å; F725-M731 VanDerWaalsContact CZ-N 3.33Å; M731-T733 PolarHBondContact O-N 3.12Å; M731-T733 VanDerWaalsContact O-N 3.16Å; M731-E741 HydrophobicContact CE-CB 4.06Å; M731-E741 HydrophobicContact CE-CG 3.65Å; M731-E741 WeakPolarHBondContact CE-O 3.4Å; M731-L745 HydrophobicContact SD-CB 4.09Å; M731-L745 HydrophobicContact SD-CD2 3.64Å; M731-L745 HydrophobicContact SD-CG 4.3Å
732	N	94.9	Very high	93.1	Very high	45 Å²	45	50 Å²	50	24%	0.241	27%	0.27	C	S	.	.			trans	-79.6	94.4	168.9	-175.1	-7.5	0	0	0	111.2	K734 I735 D744	N732-K734 PolarHBondContact O-N 3.03Å; N732-K734 WeakPolarHBondContact OD1-CB 3.4Å; N732-K734 PolarHBondContact OD1-N 3.21Å; N732-I735 HydrophobicContact CB-CD1 4.09Å; N732-I735 HydrophobicContact CB-CG1 4.43Å; N732-I735 PolarHBondContact O-N 2.81Å; N732-D744 HydrophobicContact CB-CB 4.43Å; N732-D744 WeakPolarHBondContact CB-OD2 3.42Å; N732-D744 PolarHBondContact ND2-OD1 3.18Å
733	T	93	Very high	92.9	Very high	58 Å²	58	49.8 Å²	49.8	36%	0.356	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-8.6	-177.7	61.2	0	0	0	0	114.4	N637 F640 M731 I735	N637-T733 PolarHBondContact ND2-O 3.2Å; N637-T733 VanDerWaalsContact ND2-O 3.09Å; F640-T733 HydrophobicContact CB-CG2 4.42Å; F640-T733 HydrophobicContact CD2-CG2 4.31Å; M731-T733 PolarHBondContact O-N 3.12Å; M731-T733 VanDerWaalsContact O-N 3.16Å; T733-I735 VanDerWaalsContact C-N 3.32Å
734	K	93.2	Very high	92.9	Very high	183 Å²	183	49 Å²	49	80%	0.796	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-23.3	176.3	-59.5	179.5	179.6	177.2	0	112.2	N732 R736	N732-K734 PolarHBondContact O-N 3.03Å; N732-K734 WeakPolarHBondContact OD1-CB 3.4Å; N732-K734 PolarHBondContact OD1-N 3.21Å; K734-R736 PolarHBondContact O-N 3.22Å
735	I	89.3	Confident	92.9	Very high	33 Å²	33	49.1 Å²	49.1	17%	0.169	27%	0.27	C	S	.	.			trans	-70.2	119	174.4	-61.4	172.1	0	0	0	107.7	N637 N732 T733 G739 L740 E741 D744	N637-I735 PolarHBondContact ND2-O 3.25Å; N732-I735 HydrophobicContact CB-CD1 4.09Å; N732-I735 HydrophobicContact CB-CG1 4.43Å; N732-I735 PolarHBondContact O-N 2.81Å; T733-I735 VanDerWaalsContact C-N 3.32Å; I735-G739 WeakPolarHBondContact CG2-O 3.34Å; I735-L740 HydrophobicContact CD1-CB 4.33Å; I735-L740 HydrophobicContact CG2-CB 4.18Å; I735-E741 HydrophobicContact CB-CB 4.31Å; I735-E741 HydrophobicContact CD1-CB 4.45Å; I735-E741 HydrophobicContact CG2-CB 4.23Å; I735-D744 HydrophobicContact CD1-CB 3.96Å
736	R	86.9	Confident	92.8	Very high	197 Å²	197	50.3 Å²	50.3	74%	0.743	28%	0.275	S	S	*	.			trans	-110.5	158.4	177.4	-64.9	-174.4	177.9	-173.3	-0.8	109.7	K734 Q782	K734-R736 PolarHBondContact O-N 3.22Å; R736-Q782 PolarHBondContact O-NE2 3.41Å
737	G	84.7	Confident	92.8	Very high	44 Å²	44	51.5 Å²	51.5	45%	0.454	28%	0.279	S	S	.	.	S	Bend	trans	79.5	-162.8	-177.9	0	0	0	0	0	112.6
738	W	82.9	Confident	92.8	Very high	79 Å²	79	51.1 Å²	51.1	30%	0.299	27%	0.266	S	S	.	.	S	Bend	trans	-89.8	125.4	-174.2	-175.8	88.7	0	0	0	111.7	L778 Q782 M785 C786 R789	W738-L778 HydrophobicContact CB-CD1 4.36Å; W738-Q782 WeakPolarHBondContact O-CB 3.25Å; W738-Q782 WeakPolarHBondContact O-CG 3.21Å; W738-Q782 PolarHBondContact O-NE2 3.27Å; W738-M785 HydrophobicContact CE3-CB 4.47Å; W738-M785 HydrophobicContact CH2-CB 4.35Å; W738-M785 HydrophobicContact CZ3-CB 3.56Å; W738-C786 HydrophobicContact CD2-CB 4.28Å; W738-C786 HydrophobicContact CE3-CB 3.72Å; W738-C786 HydrophobicContact CZ3-CB 4.1Å; W738-C786 VanDerWaalsContact CZ3-N 3.3Å; W738-R789 HydrophobicContact CH2-CB 4.03Å; W738-R789 HydrophobicContact CZ2-CB 4.23Å; W738-R789 HydrophobicContact CZ2-CG 4.34Å
739	G	88	Confident	92.8	Very high	5 Å²	5	50.4 Å²	50.4	5%	0.052	26%	0.261	C	S	.	.	S	Bend	trans	83.7	171.4	169.6	0	0	0	0	0	115	I735 E741 Q782	I735-G739 WeakPolarHBondContact CG2-O 3.34Å; G739-E741 WeakPolarHBondContact CA-OE2 3.45Å; G739-E741 PolarHBondContact N-OE2 2.68Å; G739-E741 PolarHBondContact O-N 3.48Å; G739-Q782 PolarHBondContact O-NE2 2.89Å
740	L	91.6	Very high	92.5	Very high	50 Å²	50	52.5 Å²	52.5	26%	0.262	26%	0.259	S	S	.	.	S	Bend	trans	78.1	-24.9	-174.6	-57	174.8	0	0	0	115	I735 D742 V743 D744 L781 Q782 M785	I735-L740 HydrophobicContact CD1-CB 4.33Å; I735-L740 HydrophobicContact CG2-CB 4.18Å; L740-D742 PolarHBondContact N-OD1 2.84Å; L740-D742 PolarHBondContact O-N 3.28Å; L740-V743 PolarHBondContact O-N 3.25Å; L740-D744 WeakPolarHBondContact O-CB 3.26Å; L740-D744 PolarHBondContact O-N 3.05Å; L740-L781 HydrophobicContact CD1-CD2 4.35Å; L740-L781 HydrophobicContact CD2-CD2 4.15Å; L740-Q782 HydrophobicContact CD1-CG 3.63Å; L740-Q782 HydrophobicContact CG-CG 3.97Å; L740-M785 HydrophobicContact CD2-CE 4.17Å; L740-M785 HydrophobicContact CD2-SD 3.75Å; L740-M785 HydrophobicContact CG-SD 4.33Å
741	E	94.6	Very high	92.2	Very high	11 Å²	11	58.6 Å²	58.6	5%	0.051	29%	0.29	C	S	.	.	H	α-helix	trans	-67.8	-31.1	178.1	82.2	-69.3	173	0	0	112.6	R638 A639 M731 I735 G739 L745	R638-E741 WeakPolarHBondContact CD-OE1 3.38Å; R638-E741 IonicContact CZ-OE1 3.93Å; R638-E741 IonicContact NE-OE1 2.75Å; R638-E741 IonicContact NH1-OE1 2.73Å; R638-E741 PolarHBondContact NH1-OE1 3.32Å; A639-E741 HydrophobicContact CB-CB 3.89Å; A639-E741 HydrophobicContact CB-CG 3.96Å; M731-E741 HydrophobicContact CE-CB 4.06Å; M731-E741 HydrophobicContact CE-CG 3.65Å; M731-E741 WeakPolarHBondContact CE-O 3.4Å; I735-E741 HydrophobicContact CB-CB 4.31Å; I735-E741 HydrophobicContact CD1-CB 4.45Å; I735-E741 HydrophobicContact CG2-CB 4.23Å; G739-E741 WeakPolarHBondContact CA-OE2 3.45Å; G739-E741 PolarHBondContact N-OE2 2.68Å; G739-E741 PolarHBondContact O-N 3.48Å; E741-L745 PolarHBondContact O-N 2.72Å
742	D	94.1	Very high	91.9	Very high	22 Å²	22	59.2 Å²	59.2	12%	0.118	29%	0.293	C	S	.	.	H	α-helix	trans	-76.2	-39.2	175.5	63.4	-26.3	0	0	0	112.4	F715 G716 L740 L745 F746	F715-D742 HydrophobicContact CB-CB 4.08Å; F715-D742 PolarHBondContact N-OD2 2.9Å; G716-D742 PolarHBondContact N-OD2 3.14Å; L740-D742 PolarHBondContact N-OD1 2.84Å; L740-D742 PolarHBondContact O-N 3.28Å; D742-L745 PolarHBondContact O-N 3.04Å; D742-F746 WeakPolarHBondContact O-CB 3.28Å; D742-F746 PolarHBondContact O-N 3.09Å
743	V	93.6	Very high	91.3	Very high	33 Å²	33	63.2 Å²	63.2	20%	0.2	32%	0.322	C	S	.	.	H	α-helix	trans	-62.6	-43.2	172.8	-179	0	0	0	0	110.6	F715 L740 L745 F746 E747	F715-V743 HydrophobicContact CD2-CG2 3.94Å; F715-V743 HydrophobicContact CE2-CG2 4.46Å; L740-V743 PolarHBondContact O-N 3.25Å; V743-L745 PolarHBondContact O-N 3.4Å; V743-F746 PolarHBondContact O-N 3.02Å; V743-E747 HydrophobicContact CG1-CG 4.34Å; V743-E747 WeakPolarHBondContact O-CB 3.44Å; V743-E747 WeakPolarHBondContact O-CG 3.41Å; V743-E747 PolarHBondContact O-N 3.44Å
744	D	95.9	Very high	91	Very high	33 Å²	33	67.1 Å²	67.1	18%	0.176	34%	0.338	C	S	.	.	H	α-helix	trans	-58.6	-47.1	176.2	175.4	106.7	0	0	0	111.6	N732 I735 L740 F746 E747 K748	N732-D744 HydrophobicContact CB-CB 4.43Å; N732-D744 WeakPolarHBondContact CB-OD2 3.42Å; N732-D744 PolarHBondContact ND2-OD1 3.18Å; I735-D744 HydrophobicContact CD1-CB 3.96Å; L740-D744 WeakPolarHBondContact O-CB 3.26Å; L740-D744 PolarHBondContact O-N 3.05Å; D744-F746 PolarHBondContact O-N 3.21Å; D744-E747 PolarHBondContact O-N 2.65Å; D744-K748 WeakPolarHBondContact O-CG 3.47Å; D744-K748 PolarHBondContact O-N 3.42Å; D744-K748 WeakPolarHBondContact OD2-CD 3.46Å; D744-K748 WeakPolarHBondContact OD2-CE 3.35Å; D744-K748 IonicContact OD2-NZ 3.76Å; D744-K748 PolarHBondContact OD2-NZ 2.88Å
745	L	96.8	Very high	90.7	Very high	3 Å²	3	59.1 Å²	59.1	2%	0.016	30%	0.303	C	S	.	.	H	α-helix	trans	-62.8	-43.2	175.4	-179	64.8	0	0	0	111.7	F657 V718 F725 V728 M731 E741 D742 V743 E747 K748 C749	F657-L745 HydrophobicContact CD2-CD2 4.46Å; F657-L745 HydrophobicContact CE2-CD2 4.21Å; V718-L745 HydrophobicContact CG1-CD2 3.97Å; F725-L745 HydrophobicContact CD2-CD1 4.27Å; F725-L745 HydrophobicContact CE2-CD1 4.41Å; V728-L745 HydrophobicContact CG2-CD1 3.82Å; M731-L745 HydrophobicContact SD-CB 4.09Å; M731-L745 HydrophobicContact SD-CD2 3.64Å; M731-L745 HydrophobicContact SD-CG 4.3Å; E741-L745 PolarHBondContact O-N 2.72Å; D742-L745 PolarHBondContact O-N 3.04Å; V743-L745 PolarHBondContact O-N 3.4Å; L745-E747 VanDerWaalsContact C-N 3.35Å; L745-E747 PolarHBondContact O-N 3.13Å; L745-K748 WeakPolarHBondContact O-CB 3.46Å; L745-K748 PolarHBondContact O-N 3.05Å; L745-C749 PolarHBondContact O-N 2.93Å; L745-C749 PolarHBondContact O-SG 2.84Å; L745-C749 VanDerWaalsContact O-SG 3.36Å
746	F	96.1	Very high	90.7	Very high	30 Å²	30	59.9 Å²	59.9	13%	0.132	31%	0.312	C	S	.	.	H	α-helix	trans	-61	-42.8	177.5	-178.4	-97.4	0	0	0	112.1	F684 F715 D742 V743 D744 C749 L750 I757	F684-F746 AromaticContact CD1-CD2 3.91Å; F684-F746 HydrophobicContact CD1-CD2 3.91Å; F684-F746 HydrophobicContact CD2-CD2 4.05Å; F684-F746 HydrophobicContact CD2-CE2 4.34Å; F684-F746 HydrophobicContact CE1-CB 4.1Å; F684-F746 AromaticContact CE1-CD2 3.76Å; F684-F746 HydrophobicContact CE1-CD2 3.76Å; F684-F746 HydrophobicContact CE1-CG 4.44Å; F684-F746 AromaticContact CE2-CD2 3.89Å; F684-F746 HydrophobicContact CE2-CD2 3.89Å; F684-F746 HydrophobicContact CG-CD2 4.04Å; F684-F746 HydrophobicContact CG-CE2 4.35Å; F684-F746 HydrophobicContact CZ-CB 4.11Å; F684-F746 AromaticContact CZ-CD2 3.74Å; F684-F746 HydrophobicContact CZ-CD2 3.74Å; F684-F746 HydrophobicContact CZ-CG 4.41Å; F715-F746 HydrophobicContact CB-CB 4.15Å; F715-F746 HydrophobicContact CD1-CB 4.12Å; F715-F746 AromaticContact CD1-CD1 3.99Å; F715-F746 HydrophobicContact CD1-CD1 3.99Å; F715-F746 AromaticContact CD1-CD2 3.39Å; F715-F746 HydrophobicContact CD1-CD2 3.39Å; F715-F746 HydrophobicContact CD1-CE1 4.21Å; F715-F746 AromaticContact CD1-CE2 3.66Å; F715-F746 HydrophobicContact CD1-CE2 3.66Å; F715-F746 AromaticContact CD1-CG 3.57Å; F715-F746 HydrophobicContact CD1-CG 3.57Å; F715-F746 HydrophobicContact CD1-CZ 4.08Å; F715-F746 AromaticContact CE1-CD1 3.9Å; F715-F746 HydrophobicContact CE1-CD1 3.9Å; F715-F746 AromaticContact CE1-CD2 3.84Å; F715-F746 HydrophobicContact CE1-CD2 3.84Å; F715-F746 AromaticContact CE1-CE1 3.72Å; F715-F746 HydrophobicContact CE1-CE1 3.72Å; F715-F746 AromaticContact CE1-CE2 3.66Å; F715-F746 HydrophobicContact CE1-CE2 3.66Å; F715-F746 AromaticContact CE1-CG 3.95Å; F715-F746 HydrophobicContact CE1-CG 3.95Å; F715-F746 AromaticContact CE1-CZ 3.62Å; F715-F746 HydrophobicContact CE1-CZ 3.62Å; F715-F746 HydrophobicContact CG-CB 4.16Å; F715-F746 HydrophobicContact CG-CD2 4.26Å; F715-F746 HydrophobicContact CG-CG 4.09Å; F715-F746 HydrophobicContact CZ-CD1 4.39Å; F715-F746 HydrophobicContact CZ-CE1 4.24Å; F715-F746 HydrophobicContact CZ-CZ 4.49Å; D742-F746 WeakPolarHBondContact O-CB 3.28Å; D742-F746 PolarHBondContact O-N 3.09Å; V743-F746 PolarHBondContact O-N 3.02Å; D744-F746 PolarHBondContact O-N 3.21Å; F746-C749 PolarHBondContact O-N 3.29Å; F746-L750 HydrophobicContact CD1-CD1 3.74Å; F746-L750 HydrophobicContact CD1-CG 4.21Å; F746-L750 HydrophobicContact CE1-CD1 3.35Å; F746-L750 HydrophobicContact CE1-CD2 4.48Å; F746-L750 HydrophobicContact CE1-CG 3.92Å; F746-L750 HydrophobicContact CZ-CD1 4.13Å; F746-L750 HydrophobicContact CZ-CD2 4.49Å; F746-L750 HydrophobicContact CZ-CG 4.31Å; F746-L750 WeakPolarHBondContact O-CG 3.5Å; F746-L750 PolarHBondContact O-N 2.77Å; F746-I757 HydrophobicContact CD2-CD1 3.86Å; F746-I757 HydrophobicContact CE2-CD1 3.66Å; F746-I757 HydrophobicContact CE2-CG2 3.86Å; F746-I757 HydrophobicContact CG-CD1 4.44Å; F746-I757 HydrophobicContact CZ-CD1 4.06Å
747	E	94.4	Very high	91.1	Very high	103 Å²	103	52.5 Å²	52.5	48%	0.481	29%	0.287	S	S	.	.	H	α-helix	trans	-65.9	-39.3	175.9	-74.4	-177.1	175.7	0	0	112.4	V743 D744 L745 C749 L750 N751	V743-E747 HydrophobicContact CG1-CG 4.34Å; V743-E747 WeakPolarHBondContact O-CB 3.44Å; V743-E747 WeakPolarHBondContact O-CG 3.41Å; V743-E747 PolarHBondContact O-N 3.44Å; D744-E747 PolarHBondContact O-N 2.65Å; L745-E747 VanDerWaalsContact C-N 3.35Å; L745-E747 PolarHBondContact O-N 3.13Å; E747-C749 VanDerWaalsContact C-N 3.33Å; E747-C749 PolarHBondContact O-N 2.87Å; E747-L750 PolarHBondContact O-N 3.48Å; E747-N751 WeakPolarHBondContact O-CB 3.25Å; E747-N751 VanDerWaalsContact O-CG 3.3Å; E747-N751 PolarHBondContact O-N 3.39Å; E747-N751 PolarHBondContact O-ND2 3.42Å; E747-N751 VanDerWaalsContact O-ND2 3.09Å
748	K	96	Very high	91.5	Very high	54 Å²	54	53.8 Å²	53.8	24%	0.235	28%	0.28	C	S	.	.	H	α-helix	trans	-59.6	-43.4	172.6	-75.9	166.1	168.3	164.3	0	111.9	V728 G730 D744 L745 N751 N752	V728-K748 HydrophobicContact CB-CB 4.13Å; G730-K748 PolarHBondContact O-NZ 2.9Å; D744-K748 WeakPolarHBondContact O-CG 3.47Å; D744-K748 PolarHBondContact O-N 3.42Å; D744-K748 WeakPolarHBondContact OD2-CD 3.46Å; D744-K748 WeakPolarHBondContact OD2-CE 3.35Å; D744-K748 IonicContact OD2-NZ 3.76Å; D744-K748 PolarHBondContact OD2-NZ 2.88Å; L745-K748 WeakPolarHBondContact O-CB 3.46Å; L745-K748 PolarHBondContact O-N 3.05Å; K748-N751 PolarHBondContact O-N 2.89Å; K748-N752 PolarHBondContact O-N 3.45Å
749	C	94.6	Very high	92	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-63.4	-43.2	174	-67.5	0	0	0	0	111.8	V682 F684 L745 F746 E747 N751 N752 I757	V682-C749 HydrophobicContact CG2-CB 4.15Å; F684-C749 HydrophobicContact CE2-CB 4.47Å; L745-C749 PolarHBondContact O-N 2.93Å; L745-C749 PolarHBondContact O-SG 2.84Å; L745-C749 VanDerWaalsContact O-SG 3.36Å; F746-C749 PolarHBondContact O-N 3.29Å; E747-C749 VanDerWaalsContact C-N 3.33Å; E747-C749 PolarHBondContact O-N 2.87Å; C749-N751 VanDerWaalsContact C-N 3.31Å; C749-N751 PolarHBondContact O-N 2.89Å; C749-N752 PolarHBondContact O-N 3.13Å; C749-I757 HydrophobicContact CB-CD1 3.76Å; C749-I757 HydrophobicContact CB-CG1 4.07Å
750	L	90.2	Very high	92.1	Very high	101 Å²	101	54 Å²	54	53%	0.529	29%	0.285	S	S	.	.	H	α-helix	trans	-62.5	-36.5	178.4	-81.3	178.2	0	0	0	113.2	F746 E747 N752 I757	F746-L750 HydrophobicContact CD1-CD1 3.74Å; F746-L750 HydrophobicContact CD1-CG 4.21Å; F746-L750 HydrophobicContact CE1-CD1 3.35Å; F746-L750 HydrophobicContact CE1-CD2 4.48Å; F746-L750 HydrophobicContact CE1-CG 3.92Å; F746-L750 HydrophobicContact CZ-CD1 4.13Å; F746-L750 HydrophobicContact CZ-CD2 4.49Å; F746-L750 HydrophobicContact CZ-CG 4.31Å; F746-L750 WeakPolarHBondContact O-CG 3.5Å; F746-L750 PolarHBondContact O-N 2.77Å; E747-L750 PolarHBondContact O-N 3.48Å; L750-N752 VanDerWaalsContact C-N 3.33Å; L750-I757 HydrophobicContact CB-CD1 4.39Å; L750-I757 HydrophobicContact CD2-CD1 3.57Å; L750-I757 HydrophobicContact CD2-CG1 4.38Å; L750-I757 HydrophobicContact CG-CD1 3.57Å
751	N	89.7	Confident	92.1	Very high	133 Å²	133	54.5 Å²	54.5	71%	0.711	29%	0.291	S	S	*	.	H	α-helix	trans	-86.1	-5.2	-177.3	-67.9	-35.9	0	0	0	113	E747 K748 C749	E747-N751 WeakPolarHBondContact O-CB 3.25Å; E747-N751 VanDerWaalsContact O-CG 3.3Å; E747-N751 PolarHBondContact O-N 3.39Å; E747-N751 PolarHBondContact O-ND2 3.42Å; E747-N751 VanDerWaalsContact O-ND2 3.09Å; K748-N751 PolarHBondContact O-N 2.89Å; C749-N751 VanDerWaalsContact C-N 3.31Å; C749-N751 PolarHBondContact O-N 2.89Å
752	N	89.3	Confident	92.2	Very high	26 Å²	26	54.1 Å²	54.1	14%	0.139	29%	0.289	C	S	.	.			trans	-80.5	127.5	176.2	-171.9	-62.5	0	0	0	110.3	V728 K748 C749 L750 M754 I755	V728-N752 HydrophobicContact CG1-CB 4.24Å; K748-N752 PolarHBondContact O-N 3.45Å; C749-N752 PolarHBondContact O-N 3.13Å; L750-N752 VanDerWaalsContact C-N 3.33Å; N752-M754 VanDerWaalsContact C-N 3.3Å; N752-M754 PolarHBondContact O-N 2.96Å; N752-M754 PolarHBondContact OD1-N 3.41Å; N752-I755 HydrophobicContact CB-CB 4.21Å; N752-I755 PolarHBondContact OD1-N 3.39Å
753	P	83.2	Confident	92.2	Very high	129 Å²	129	55.5 Å²	55.5	84%	0.838	30%	0.3	S	S	*	.	S	Bend	trans	-73.2	-17.9	-174.9	29.1	-35.6	0	0	0	114.4
754	M	85.1	Confident	92.3	Very high	141 Å²	141	55.5 Å²	55.5	70%	0.695	30%	0.299	S	S	*	.	S	Bend	trans	-100.1	-25.8	-176.8	-63.3	-173.5	-71.3	0	0	112.8	N752	N752-M754 VanDerWaalsContact C-N 3.3Å; N752-M754 PolarHBondContact O-N 2.96Å; N752-M754 PolarHBondContact OD1-N 3.41Å
755	I	88.4	Confident	92.4	Very high	14 Å²	14	53.9 Å²	53.9	7%	0.072	29%	0.29	C	S	.	.			trans	-98.6	125.8	-174.4	-63.1	171.8	0	0	0	110.3	V682 D724 V728 N752	V682-I755 HydrophobicContact CB-CG2 4.39Å; V682-I755 HydrophobicContact CG1-CG2 3.76Å; V682-I755 HydrophobicContact CG2-CG2 3.89Å; D724-I755 HydrophobicContact CB-CD1 4.04Å; V728-I755 HydrophobicContact CG1-CD1 3.5Å; N752-I755 HydrophobicContact CB-CB 4.21Å; N752-I755 PolarHBondContact OD1-N 3.39Å
756	S	89.7	Confident	92.3	Very high	49 Å²	49	53.8 Å²	53.8	34%	0.343	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	154.8	170.5	64.3	0	0	0	0	111.2	R680 Q681 V682	R680-S756 WeakPolarHBondContact O-CB 3.41Å; R680-S756 PolarHBondContact O-N 3.48Å; R680-S756 PolarHBondContact O-OG 3.17Å; Q681-S756 VanDerWaalsContact CA-O 3.29Å; Q681-S756 WeakPolarHBondContact CA-O 3.49Å; V682-S756 PolarHBondContact N-O 2.79Å
757	I	93.3	Very high	92.3	Very high	43 Å²	43	52.9 Å²	52.9	22%	0.221	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	123.9	177.8	-63.1	-174.3	0	0	0	109.4	V682 F684 F746 C749 L750 R759	V682-I757 HydrophobicContact CG2-CG1 3.9Å; F684-I757 HydrophobicContact CD2-CG2 3.81Å; F684-I757 HydrophobicContact CE2-CD1 4.26Å; F684-I757 HydrophobicContact CE2-CG1 4.48Å; F684-I757 HydrophobicContact CE2-CG2 4.39Å; F746-I757 HydrophobicContact CD2-CD1 3.86Å; F746-I757 HydrophobicContact CE2-CD1 3.66Å; F746-I757 HydrophobicContact CE2-CG2 3.86Å; F746-I757 HydrophobicContact CG-CD1 4.44Å; F746-I757 HydrophobicContact CZ-CD1 4.06Å; C749-I757 HydrophobicContact CB-CD1 3.76Å; C749-I757 HydrophobicContact CB-CG1 4.07Å; L750-I757 HydrophobicContact CB-CD1 4.39Å; L750-I757 HydrophobicContact CD2-CD1 3.57Å; L750-I757 HydrophobicContact CD2-CG1 4.38Å; L750-I757 HydrophobicContact CG-CD1 3.57Å; I757-R759 HydrophobicContact CG2-CB 4.35Å
758	F	94	Very high	92.3	Very high	71 Å²	71	48 Å²	48	31%	0.311	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	130.5	163.6	-174.8	-109.3	0	0	0	109.8	N675 Q681 V682 F683 F684 A760	N675-F758 HydrophobicContact CB-CD1 3.59Å; N675-F758 HydrophobicContact CB-CE1 3.93Å; N675-F758 VanDerWaalsContact CG-CE1 3.44Å; N675-F758 WeakPolarHBondContact OD1-CE1 3.39Å; Q681-F758 HydrophobicContact CG-CB 3.96Å; V682-F758 PolarHBondContact O-N 3.41Å; F683-F758 WeakPolarHBondContact CA-O 3.45Å; F683-F758 HydrophobicContact CD2-CB 4.49Å; F683-F758 AromaticContact CD2-CD1 3.37Å; F683-F758 HydrophobicContact CD2-CD1 3.37Å; F683-F758 HydrophobicContact CD2-CE1 4.01Å; F683-F758 HydrophobicContact CD2-CG 4.35Å; F683-F758 AromaticContact CE2-CD1 3.63Å; F683-F758 HydrophobicContact CE2-CD1 3.63Å; F683-F758 AromaticContact CE2-CE1 3.78Å; F683-F758 HydrophobicContact CE2-CE1 3.78Å; F683-F758 HydrophobicContact CG-CD1 4.24Å; F684-F758 PolarHBondContact N-O 2.92Å; F758-A760 HydrophobicContact CE1-CB 4.13Å; F758-A760 HydrophobicContact CZ-CB 4.05Å
759	R	92.8	Very high	92.1	Very high	60 Å²	60	47 Å²	47	23%	0.226	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	122	-177.8	178.7	165.8	-174.7	92.3	-1.7	110.3	F684 V686 Y712 G714 F715 I757	F684-R759 HydrophobicContact CB-CB 4.36Å; F684-R759 HydrophobicContact CB-CG 4.38Å; F684-R759 WeakPolarHBondContact O-CA 3.15Å; F684-R759 VanDerWaalsContact O-CG 3.31Å; F684-R759 WeakPolarHBondContact O-CG 3.43Å; V686-R759 HydrophobicContact CG2-CG 3.65Å; Y712-R759 VanDerWaalsContact C-NH2 3.35Å; Y712-R759 PolarHBondContact O-NE 3.42Å; Y712-R759 PolarHBondContact O-NH2 2.95Å; G714-R759 PolarHBondContact O-NH1 3.29Å; G714-R759 PolarHBondContact O-NH2 2.97Å; F715-R759 VanDerWaalsContact CE1-CZ 3.5Å; I757-R759 HydrophobicContact CG2-CB 4.35Å
760	A	89.8	Confident	91.9	Very high	28 Å²	28	48.9 Å²	48.9	23%	0.231	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	150	-175.6	0	0	0	0	0	111.6	V686 F758 E762	V686-A760 WeakPolarHBondContact CB-O 3.17Å; V686-A760 PolarHBondContact N-O 3.46Å; F758-A760 HydrophobicContact CE1-CB 4.13Å; F758-A760 HydrophobicContact CZ-CB 4.05Å; A760-E762 PolarHBondContact O-N 3.06Å
761	P	93.3	Very high	91.9	Very high	61 Å²	61	48.9 Å²	48.9	40%	0.396	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-49.2	128.5	164.7	-27.1	37	0	0	0	111.5	F710 Y712	F710-P761 HydrophobicContact CD1-CB 3.94Å; F710-P761 HydrophobicContact CE1-CB 3.91Å; F710-P761 HydrophobicContact CG-CB 4.28Å; F710-P761 HydrophobicContact CZ-CB 4.22Å; Y712-P761 HydrophobicContact CE1-CG 3.99Å
762	E	95.3	Very high	91.9	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.009	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	96.9	-175	178.7	45.1	-94.3	0	0	109.3	L668 R671 P685 V686 A760 D764 L765	L668-E762 HydrophobicContact CD1-CG 3.46Å; L668-E762 VanDerWaalsContact CD1-CG 3.46Å; R671-E762 IonicContact CZ-OE1 3.54Å; R671-E762 VanDerWaalsContact CZ-OE1 3.28Å; R671-E762 IonicContact CZ-OE2 3.9Å; R671-E762 IonicContact NE-OE1 3.56Å; R671-E762 PolarHBondContact NE-OE1 3.29Å; R671-E762 IonicContact NE-OE2 2.65Å; R671-E762 PolarHBondContact NE-OE2 2.92Å; R671-E762 IonicContact NH2-OE1 3.26Å; R671-E762 PolarHBondContact NH2-OE1 2.99Å; R671-E762 IonicContact NH2-OE2 3.43Å; P685-E762 HydrophobicContact CB-CB 3.71Å; P685-E762 HydrophobicContact CB-CG 3.92Å; V686-E762 PolarHBondContact O-N 3.34Å; A760-E762 PolarHBondContact O-N 3.06Å; E762-D764 VanDerWaalsContact C-N 3.29Å; E762-D764 PolarHBondContact O-N 3.1Å; E762-D764 PolarHBondContact OE1-N 3.26Å; E762-L765 HydrophobicContact CB-CB 4.19Å; E762-L765 HydrophobicContact CG-CB 3.53Å; E762-L765 HydrophobicContact CG-CD2 4.22Å; E762-L765 PolarHBondContact O-N 3.49Å
763	P	94	Very high	91.9	Very high	52 Å²	52	48.6 Å²	48.6	34%	0.338	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	-28.1	-174.7	27.2	-34.8	0	0	0	112.9	H703 L765	H703-P763 PolarHBondContact CE1-O 3.03Å; H703-P763 PolarHBondContact NE2-O 3.08Å; P763-L765 PolarHBondContact O-N 2.8Å
764	D	96.4	Very high	92.3	Very high	32 Å²	32	43.9 Å²	43.9	17%	0.171	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	21.6	178.9	-68.9	-88	0	0	0	112.8	F664 T665 Q667 L668 R671 E762	F664-D764 WeakPolarHBondContact CA-O 3.14Å; F664-D764 VanDerWaalsContact CB-O 3.23Å; F664-D764 WeakPolarHBondContact CB-O 3.26Å; T665-D764 HydrophobicContact CG2-CB 4.4Å; T665-D764 WeakPolarHBondContact CG2-OD1 3.47Å; T665-D764 PolarHBondContact N-O 2.97Å; T665-D764 WeakPolarHBondContact OG1-CB 3.43Å; T665-D764 PolarHBondContact OG1-OD1 3.05Å; Q667-D764 HydrophobicContact CB-CB 4.27Å; Q667-D764 WeakPolarHBondContact CB-OD2 3.39Å; L668-D764 HydrophobicContact CB-CB 4.31Å; R671-D764 IonicContact CZ-OD2 3.6Å; R671-D764 IonicContact NH1-OD2 3.49Å; R671-D764 VanDerWaalsContact NH2-CB 3.27Å; R671-D764 VanDerWaalsContact NH2-CG 3.33Å; R671-D764 IonicContact NH2-OD2 3.54Å; R671-D764 PolarHBondContact NH2-OD2 2.82Å; E762-D764 VanDerWaalsContact C-N 3.29Å; E762-D764 PolarHBondContact O-N 3.1Å; E762-D764 PolarHBondContact OE1-N 3.26Å
765	L	97.5	Very high	92.5	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	111.2	175.4	-177.7	58.4	0	0	0	109.9	F656 M662 L663 F664 L668 P685 V687 F688 L717 E762 P763	F656-L765 HydrophobicContact CZ-CD1 4.48Å; F656-L765 HydrophobicContact CZ-CD2 4.3Å; M662-L765 HydrophobicContact CB-CD1 4.11Å; M662-L765 HydrophobicContact CG-CD1 4.25Å; M662-L765 HydrophobicContact SD-CD1 4.4Å; L663-L765 WeakPolarHBondContact O-CA 3.29Å; F664-L765 HydrophobicContact CB-CD1 4.08Å; F664-L765 HydrophobicContact CD1-CD1 4.23Å; L668-L765 HydrophobicContact CD1-CB 4.48Å; L668-L765 HydrophobicContact CD2-CB 4.22Å; L668-L765 HydrophobicContact CD2-CD1 3.87Å; L668-L765 HydrophobicContact CD2-CD2 4.37Å; L668-L765 HydrophobicContact CD2-CG 4.37Å; P685-L765 HydrophobicContact CB-CD2 3.81Å; P685-L765 HydrophobicContact CG-CD2 3.74Å; V687-L765 HydrophobicContact CB-CD2 4.14Å; V687-L765 HydrophobicContact CB-CG 4.08Å; V687-L765 HydrophobicContact CG2-CD2 4.48Å; V687-L765 HydrophobicContact CG2-CG 3.9Å; V687-L765 WeakPolarHBondContact CG2-O 3.31Å; F688-L765 PolarHBondContact N-O 3.29Å; F688-L765 VanDerWaalsContact N-O 3.1Å; L717-L765 HydrophobicContact CD1-CD2 3.76Å; L717-L765 HydrophobicContact CD1-CG 4.27Å; E762-L765 HydrophobicContact CB-CB 4.19Å; E762-L765 HydrophobicContact CG-CB 3.53Å; E762-L765 HydrophobicContact CG-CD2 4.22Å; E762-L765 PolarHBondContact O-N 3.49Å; P763-L765 PolarHBondContact O-N 2.8Å
766	I	95.7	Very high	92.6	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	132.5	-177.4	-49.9	-59.8	0	0	0	109.5	M662 L663 F688 E690 H700 F701 H703	M662-I766 CarbonylContact C-O 3.45Å; M662-I766 WeakPolarHBondContact CA-O 3.43Å; L663-I766 HydrophobicContact CB-CB 4.34Å; L663-I766 PolarHBondContact N-O 3.27Å; L663-I766 PolarHBondContact O-N 3.47Å; F688-I766 HydrophobicContact CB-CD1 3.9Å; F688-I766 HydrophobicContact CD1-CD1 3.99Å; F688-I766 HydrophobicContact CG-CD1 4.31Å; F688-I766 CarbonylContact O-C 3.57Å; F688-I766 WeakPolarHBondContact O-CA 3.4Å; E690-I766 HydrophobicContact CG-CG2 4.05Å; H700-I766 HydrophobicContact CB-CG2 4.4Å; H700-I766 WeakPolarHBondContact O-CD1 3.34Å; F701-I766 HydrophobicContact CD1-CD1 3.99Å; F701-I766 HydrophobicContact CD1-CG1 3.62Å; F701-I766 HydrophobicContact CE1-CD1 4.43Å; F701-I766 HydrophobicContact CE1-CG1 3.66Å; F701-I766 HydrophobicContact CG-CG1 4.22Å; F701-I766 HydrophobicContact CZ-CG1 4.3Å; H703-I766 VanDerWaalsContact CE1-CD1 3.48Å; H703-I766 WeakPolarHBondContact CE1-CD1 3.39Å
767	H	95.1	Very high	92.7	Very high	11 Å²	11	49.2 Å²	49.2	5%	0.051	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	106.4	165.8	-179.8	-53	0	0	0	108.2	M662 V687 F688 S689 E690 H770 R789	M662-H767 HydrophobicContact CE-CB 3.63Å; M662-H767 WeakPolarHBondContact CE-CD2 3.43Å; M662-H767 HydrophobicContact SD-CB 3.88Å; V687-H767 HydrophobicContact CG2-CB 3.68Å; F688-H767 PolarHBondContact O-N 3.48Å; S689-H767 WeakPolarHBondContact OG-CB 3.46Å; E690-H767 PolarHBondContact N-O 3.49Å; E690-H767 VanDerWaalsContact N-O 3.1Å; H767-H770 AromaticContact CE1-CD2 3.49Å; H767-H770 PolarHBondContact CE1-CD2 2.93Å; H767-H770 VanDerWaalsContact CE1-CD2 3.49Å; H767-H770 AromaticContact CE1-NE2 3.4Å; H767-H770 PolarHBondContact CE1-NE2 3.25Å; H767-H770 AromaticContact NE2-NE2 3.84Å; H767-R789 PolarHBondContact CE1-NH2 3.22Å; H767-R789 PolarHBondContact NE2-NH2 3.4Å
768	V	94.1	Very high	92.6	Very high	2 Å²	2	48 Å²	48	1%	0.012	27%	0.27	C	S	.	.			trans	-63.1	139.6	179.4	-175.3	0	0	0	0	109.4	D661 L663 A694 H770	D661-V768 PolarHBondContact O-N 3.09Å; D661-V768 VanDerWaalsContact O-N 3.08Å; L663-V768 HydrophobicContact CD1-CG2 3.41Å; L663-V768 VanDerWaalsContact CD1-CG2 3.41Å; L663-V768 HydrophobicContact CD2-CG2 4.34Å; L663-V768 HydrophobicContact CG-CG2 3.56Å; A694-V768 HydrophobicContact CB-CG1 4.17Å; V768-H770 PolarHBondContact O-N 2.87Å
769	Y	92.1	Very high	92.5	Very high	31 Å²	31	48 Å²	48	12%	0.122	28%	0.277	C	S	.	.			trans	-62.3	137	177.3	176.7	-89.3	0	0	0	110.8	E690 Y691 K692 D771 G793	E690-Y769 PolarHBondContact OE2-N 3.34Å; Y691-Y769 WeakPolarHBondContact O-CB 3.45Å; K692-Y769 HydrophobicContact CB-CD1 4.28Å; K692-Y769 HydrophobicContact CB-CD2 4.18Å; K692-Y769 HydrophobicContact CB-CE1 3.81Å; K692-Y769 HydrophobicContact CB-CE2 3.7Å; K692-Y769 HydrophobicContact CB-CG 4.45Å; K692-Y769 VanDerWaalsContact CB-CZ 3.49Å; K692-Y769 HydrophobicContact CD-CE1 4Å; K692-Y769 WeakPolarHBondContact CD-OH 3.37Å; K692-Y769 HydrophobicContact CG-CD1 4.23Å; K692-Y769 HydrophobicContact CG-CE1 3.56Å; K692-Y769 HydrophobicContact CG-CE2 4.35Å; Y769-D771 PolarHBondContact OH-OD1 2.87Å; Y769-G793 WeakPolarHBondContact CD2-O 3.33Å; Y769-G793 WeakPolarHBondContact CE2-O 3.45Å
770	H	90.6	Very high	92.5	Very high	41 Å²	41	50.2 Å²	50.2	19%	0.19	30%	0.299	C	S	.	.			trans	-146.2	150.9	168	68.7	83.6	0	0	0	108.8	D661 H767 V768 V772 R789	D661-H770 VanDerWaalsContact CG-CD2 3.45Å; D661-H770 IonicContact OD1-CD2 3.63Å; D661-H770 IonicContact OD2-CD2 3.33Å; D661-H770 PolarHBondContact OD2-CD2 3.18Å; D661-H770 IonicContact OD2-CG 2.83Å; D661-H770 IonicContact OD2-NE2 2.69Å; D661-H770 PolarHBondContact OD2-NE2 3.09Å; H767-H770 AromaticContact CE1-CD2 3.49Å; H767-H770 PolarHBondContact CE1-CD2 2.93Å; H767-H770 VanDerWaalsContact CE1-CD2 3.49Å; H767-H770 AromaticContact CE1-NE2 3.4Å; H767-H770 PolarHBondContact CE1-NE2 3.25Å; H767-H770 AromaticContact NE2-NE2 3.84Å; V768-H770 PolarHBondContact O-N 2.87Å; H770-V772 PolarHBondContact O-N 3.17Å; H770-R789 PolarHBondContact NE2-NH2 2.98Å
771	D	90.3	Very high	92.5	Very high	101 Å²	101	53.2 Å²	53.2	54%	0.54	31%	0.311	S	S	.	.			trans	-63.2	138.6	178	-76.1	-53	0	0	0	110.7	K692 Y769	K692-D771 IonicContact NZ-OD1 3.55Å; K692-D771 PolarHBondContact NZ-OD1 3.16Å; K692-D771 IonicContact NZ-OD2 3.31Å; Y769-D771 PolarHBondContact OH-OD1 2.87Å
772	V	89.7	Confident	92.5	Very high	20 Å²	20	50.8 Å²	50.8	12%	0.121	29%	0.294	C	S	.	.			trans	-108.3	123.5	-179	-179.4	0	0	0	0	109.7	H770 K790	H770-V772 PolarHBondContact O-N 3.17Å; V772-K790 HydrophobicContact CB-CB 4.21Å; V772-K790 HydrophobicContact CB-CG 4.32Å; V772-K790 HydrophobicContact CG1-CB 4.38Å; V772-K790 WeakPolarHBondContact O-CD 3.12Å; V772-K790 WeakPolarHBondContact O-CE 3.24Å; V772-K790 PolarHBondContact O-NZ 3.25Å
773	T	90	Very high	92.4	Very high	132 Å²	132	52.4 Å²	52.4	81%	0.81	30%	0.303	S	S	*	.			trans	-106.2	119.2	172.6	-55.5	0	0	0	0	108.9
774	C	91	Very high	92.2	Very high	30 Å²	30	58.5 Å²	58.5	20%	0.203	32%	0.319	C	S	.	.			trans	-97.5	118.5	178.8	-60.9	0	0	0	0	109.9	S776 L783 C786	C774-S776 PolarHBondContact O-N 3.18Å; C774-L783 HydrophobicContact CB-CD1 4.05Å; C774-C786 WeakPolarHBondContact CA-SG 3.48Å; C774-C786 HydrophobicContact CB-CB 3.9Å; C774-C786 WeakPolarHBondContact CB-SG 3.38Å; C774-C786 WeakPolarHBondContact SG-CB 3.42Å; C774-C786 PolarHBondContact SG-O 3.49Å; C774-C786 CovalentContact SG-SG 2.04Å; C774-C786 PolarHBondContact SG-SG 2.83Å
775	D	90	Very high	91.9	Very high	84 Å²	84	59.8 Å²	59.8	45%	0.449	33%	0.325	S	S	.	.			trans	-63.4	126.8	174.3	179.2	2.4	0	0	0	110.4	N777 L778	D775-N777 PolarHBondContact O-N 3.43Å; D775-N777 WeakPolarHBondContact OD1-CB 3.35Å; D775-N777 PolarHBondContact OD1-N 2.75Å; D775-N777 PolarHBondContact OD1-ND2 2.76Å; D775-L778 HydrophobicContact CB-CD1 4.43Å; D775-L778 HydrophobicContact CB-CG 4.13Å; D775-L778 WeakPolarHBondContact O-CB 3.37Å; D775-L778 WeakPolarHBondContact O-CG 3.23Å; D775-L778 PolarHBondContact O-N 3.11Å
776	S	89.9	Confident	91.6	Very high	97 Å²	97	59.9 Å²	59.9	68%	0.678	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-19.8	179.1	51.2	0	0	0	0	113.2	C774 L778	C774-S776 PolarHBondContact O-N 3.18Å; S776-L778 VanDerWaalsContact C-N 3.3Å
777	N	91.9	Very high	91.4	Very high	135 Å²	135	66 Å²	66	72%	0.722	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-0.9	179	-58.7	-43.4	0	0	0	113.4	D775	D775-N777 PolarHBondContact O-N 3.43Å; D775-N777 WeakPolarHBondContact OD1-CB 3.35Å; D775-N777 PolarHBondContact OD1-N 2.75Å; D775-N777 PolarHBondContact OD1-ND2 2.76Å
778	L	90.7	Very high	91.1	Very high	18 Å²	18	66.9 Å²	66.9	9%	0.094	36%	0.364	C	S	.	.	S	Bend	trans	-63.3	141	175.4	-73.1	171.9	0	0	0	110.9	W738 D775 S776 Q782 L783 C786	W738-L778 HydrophobicContact CB-CD1 4.36Å; D775-L778 HydrophobicContact CB-CD1 4.43Å; D775-L778 HydrophobicContact CB-CG 4.13Å; D775-L778 WeakPolarHBondContact O-CB 3.37Å; D775-L778 WeakPolarHBondContact O-CG 3.23Å; D775-L778 PolarHBondContact O-N 3.11Å; S776-L778 VanDerWaalsContact C-N 3.3Å; L778-Q782 HydrophobicContact CB-CB 4.21Å; L778-Q782 HydrophobicContact CD2-CB 4.35Å; L778-L783 HydrophobicContact CB-CB 4.01Å; L778-C786 HydrophobicContact CD1-CB 4.38Å
779	P	92.7	Very high	90.7	Very high	70 Å²	70	68.7 Å²	68.7	46%	0.455	37%	0.371	S	S	.	.			trans	-46	145.1	166.7	-30.5	34.9	0	0	0	112.3	L781 Q782 L783	P779-L781 PolarHBondContact O-N 3.14Å; P779-Q782 PolarHBondContact O-N 2.86Å; P779-L783 PolarHBondContact O-N 2.99Å
780	P	92.3	Very high	90.7	Very high	107 Å²	107	70.6 Å²	70.6	70%	0.695	38%	0.38	S	S	*	.	H	α-helix	trans	-52.3	-35.8	-170.8	-30.3	34.8	0	0	0	115	R784	P780-R784 WeakPolarHBondContact O-CB 3.33Å; P780-R784 PolarHBondContact O-N 3.28Å; P780-R784 VanDerWaalsContact O-N 3.08Å
781	L	90.5	Very high	90.5	Very high	92 Å²	92	71.2 Å²	71.2	48%	0.482	39%	0.392	S	S	.	.	H	α-helix	trans	-68.6	-50.8	176.8	-179.2	60	0	0	0	112	L740 P779 L783 R784 M785	L740-L781 HydrophobicContact CD1-CD2 4.35Å; L740-L781 HydrophobicContact CD2-CD2 4.15Å; P779-L781 PolarHBondContact O-N 3.14Å; L781-L783 VanDerWaalsContact C-N 3.33Å; L781-L783 PolarHBondContact O-N 2.8Å; L781-R784 PolarHBondContact O-N 3.21Å; L781-M785 HydrophobicContact CD1-CG 4.37Å; L781-M785 HydrophobicContact CD1-SD 4.31Å; L781-M785 HydrophobicContact CG-SD 4.07Å; L781-M785 VanDerWaalsContact O-CG 3.29Å; L781-M785 WeakPolarHBondContact O-CG 3.41Å; L781-M785 PolarHBondContact O-N 3.47Å
782	Q	92.2	Very high	90.3	Very high	9 Å²	9	70.7 Å²	70.7	4%	0.042	39%	0.389	C	S	.	.	H	α-helix	trans	-62.5	-40	178.2	-74.8	176.7	-54.7	0	0	111.5	R736 W738 G739 L740 L778 P779 R784 M785 C786	R736-Q782 PolarHBondContact O-NE2 3.41Å; W738-Q782 WeakPolarHBondContact O-CB 3.25Å; W738-Q782 WeakPolarHBondContact O-CG 3.21Å; W738-Q782 PolarHBondContact O-NE2 3.27Å; G739-Q782 PolarHBondContact O-NE2 2.89Å; L740-Q782 HydrophobicContact CD1-CG 3.63Å; L740-Q782 HydrophobicContact CG-CG 3.97Å; L778-Q782 HydrophobicContact CB-CB 4.21Å; L778-Q782 HydrophobicContact CD2-CB 4.35Å; P779-Q782 PolarHBondContact O-N 2.86Å; Q782-R784 PolarHBondContact O-N 3.39Å; Q782-M785 PolarHBondContact O-N 3.38Å; Q782-C786 WeakPolarHBondContact O-CB 3.38Å; Q782-C786 PolarHBondContact O-N 3.49Å
783	L	93.4	Very high	90.3	Very high	36 Å²	36	70.3 Å²	70.3	19%	0.188	39%	0.389	C	S	.	.	H	α-helix	trans	-61.1	-44.7	174.8	-178.3	58.4	0	0	0	111.6	C774 L778 P779 L781 C786 K787	C774-L783 HydrophobicContact CB-CD1 4.05Å; L778-L783 HydrophobicContact CB-CB 4.01Å; P779-L783 PolarHBondContact O-N 2.99Å; L781-L783 VanDerWaalsContact C-N 3.33Å; L781-L783 PolarHBondContact O-N 2.8Å; L783-C786 PolarHBondContact O-N 3.42Å; L783-K787 HydrophobicContact CD1-CG 4.44Å; L783-K787 WeakPolarHBondContact O-CG 3.35Å; L783-K787 PolarHBondContact O-N 2.84Å
784	R	91.1	Very high	90.2	Very high	180 Å²	180	68.6 Å²	68.6	68%	0.679	37%	0.369	S	S	*	.	H	α-helix	trans	-62.8	-44	176.5	-173.7	-174.6	-61.3	160.2	1.3	111.4	P780 L781 Q782 C786 K787 G788	P780-R784 WeakPolarHBondContact O-CB 3.33Å; P780-R784 PolarHBondContact O-N 3.28Å; P780-R784 VanDerWaalsContact O-N 3.08Å; L781-R784 PolarHBondContact O-N 3.21Å; Q782-R784 PolarHBondContact O-N 3.39Å; R784-C786 VanDerWaalsContact C-N 3.34Å; R784-K787 PolarHBondContact O-N 2.96Å; R784-G788 PolarHBondContact O-N 3.44Å
785	M	88.6	Confident	89.8	Confident	59 Å²	59	70.4 Å²	70.4	29%	0.291	38%	0.376	S	S	.	.	H	α-helix	trans	-64.3	-39.8	177.7	-65.8	170.8	62.8	0	0	111.4	W738 L740 L781 Q782 G788 R789	W738-M785 HydrophobicContact CE3-CB 4.47Å; W738-M785 HydrophobicContact CH2-CB 4.35Å; W738-M785 HydrophobicContact CZ3-CB 3.56Å; L740-M785 HydrophobicContact CD2-CE 4.17Å; L740-M785 HydrophobicContact CD2-SD 3.75Å; L740-M785 HydrophobicContact CG-SD 4.33Å; L781-M785 HydrophobicContact CD1-CG 4.37Å; L781-M785 HydrophobicContact CD1-SD 4.31Å; L781-M785 HydrophobicContact CG-SD 4.07Å; L781-M785 VanDerWaalsContact O-CG 3.29Å; L781-M785 WeakPolarHBondContact O-CG 3.41Å; L781-M785 PolarHBondContact O-N 3.47Å; Q782-M785 PolarHBondContact O-N 3.38Å; M785-G788 PolarHBondContact O-N 3.18Å; M785-R789 PolarHBondContact O-N 3.34Å
786	C	91.8	Very high	89.4	Confident	2 Å²	2	66.5 Å²	66.5	1%	0.014	36%	0.356	C	S	.	.	H	α-helix	trans	-64.5	-46.9	176.4	-178.1	0	0	0	0	111.6	W738 C774 L778 Q782 L783 R784 G788 R789 K790	W738-C786 HydrophobicContact CD2-CB 4.28Å; W738-C786 HydrophobicContact CE3-CB 3.72Å; W738-C786 HydrophobicContact CZ3-CB 4.1Å; W738-C786 VanDerWaalsContact CZ3-N 3.3Å; C774-C786 WeakPolarHBondContact CA-SG 3.48Å; C774-C786 HydrophobicContact CB-CB 3.9Å; C774-C786 WeakPolarHBondContact CB-SG 3.38Å; C774-C786 WeakPolarHBondContact SG-CB 3.42Å; C774-C786 PolarHBondContact SG-O 3.49Å; C774-C786 CovalentContact SG-SG 2.04Å; C774-C786 PolarHBondContact SG-SG 2.83Å; L778-C786 HydrophobicContact CD1-CB 4.38Å; Q782-C786 WeakPolarHBondContact O-CB 3.38Å; Q782-C786 PolarHBondContact O-N 3.49Å; L783-C786 PolarHBondContact O-N 3.42Å; R784-C786 VanDerWaalsContact C-N 3.34Å; C786-G788 VanDerWaalsContact C-N 3.3Å; C786-G788 PolarHBondContact O-N 2.72Å; C786-R789 PolarHBondContact O-N 3.38Å; C786-K790 PolarHBondContact O-N 3.14Å
787	K	91.8	Very high	88.7	Confident	128 Å²	128	67.1 Å²	67.1	56%	0.557	35%	0.346	S	S	*	.	H	α-helix	trans	-61.3	-39.1	175.1	-73.7	-176.6	177.7	-175	0	111.8	L783 R784 K790 A791	L783-K787 HydrophobicContact CD1-CG 4.44Å; L783-K787 WeakPolarHBondContact O-CG 3.35Å; L783-K787 PolarHBondContact O-N 2.84Å; R784-K787 PolarHBondContact O-N 2.96Å; K787-K790 PolarHBondContact O-N 2.87Å; K787-A791 WeakPolarHBondContact O-CB 3.34Å; K787-A791 PolarHBondContact O-N 3.23Å
788	G	88	Confident	87.8	Confident	30 Å²	30	64.6 Å²	64.6	31%	0.309	33%	0.33	S	S	.	.	H	α-helix	trans	-59	-52.5	173.2	0	0	0	0	0	111.7	R784 M785 C786 K790 A791 D792	R784-G788 PolarHBondContact O-N 3.44Å; M785-G788 PolarHBondContact O-N 3.18Å; C786-G788 VanDerWaalsContact C-N 3.3Å; C786-G788 PolarHBondContact O-N 2.72Å; G788-K790 VanDerWaalsContact C-N 3.27Å; G788-K790 PolarHBondContact O-N 3.3Å; G788-A791 WeakPolarHBondContact O-CB 3.11Å; G788-A791 PolarHBondContact O-N 2.95Å; G788-A791 VanDerWaalsContact O-N 3.08Å; G788-D792 VanDerWaalsContact O-CG 3.28Å; G788-D792 PolarHBondContact O-N 2.82Å
789	R	87.2	Confident	87.2	Confident	40 Å²	40	68.8 Å²	68.8	15%	0.151	34%	0.344	C	S	.	.	H	α-helix	trans	-55.3	-42.7	174.6	169.9	176.3	173.1	161.3	1.3	112.3	W738 H767 H770 M785 C786 A791 D792 G793	W738-R789 HydrophobicContact CH2-CB 4.03Å; W738-R789 HydrophobicContact CZ2-CB 4.23Å; W738-R789 HydrophobicContact CZ2-CG 4.34Å; H767-R789 PolarHBondContact CE1-NH2 3.22Å; H767-R789 PolarHBondContact NE2-NH2 3.4Å; H770-R789 PolarHBondContact NE2-NH2 2.98Å; M785-R789 PolarHBondContact O-N 3.34Å; C786-R789 PolarHBondContact O-N 3.38Å; R789-A791 VanDerWaalsContact C-N 3.35Å; R789-D792 PolarHBondContact O-N 3.25Å; R789-G793 PolarHBondContact O-N 2.89Å; R789-G793 VanDerWaalsContact O-N 3.14Å
790	K	90.6	Very high	86.6	Confident	72 Å²	72	69.7 Å²	69.7	31%	0.313	35%	0.345	S	S	.	.	H	α-helix	trans	-62.3	-44.3	178	-177	173.9	-176.1	152.4	0	111.2	V772 C786 K787 G788 G793 Y794	V772-K790 HydrophobicContact CB-CB 4.21Å; V772-K790 HydrophobicContact CB-CG 4.32Å; V772-K790 HydrophobicContact CG1-CB 4.38Å; V772-K790 WeakPolarHBondContact O-CD 3.12Å; V772-K790 WeakPolarHBondContact O-CE 3.24Å; V772-K790 PolarHBondContact O-NZ 3.25Å; C786-K790 PolarHBondContact O-N 3.14Å; K787-K790 PolarHBondContact O-N 2.87Å; G788-K790 VanDerWaalsContact C-N 3.27Å; G788-K790 PolarHBondContact O-N 3.3Å; K790-G793 PolarHBondContact O-N 3.41Å; K790-Y794 WeakPolarHBondContact CE-OH 3.44Å; K790-Y794 HydrophobicContact CG-CE2 4.12Å; K790-Y794 WeakPolarHBondContact O-CD2 3.4Å; K790-Y794 WeakPolarHBondContact O-CE2 3.27Å
791	A	88	Confident	85.9	Confident	54 Å²	54	67.5 Å²	67.5	45%	0.446	34%	0.336	S	S	.	.	H	α-helix	trans	-64.7	-44.3	177.6	0	0	0	0	0	112.2	K787 G788 R789 G793 Y794	K787-A791 WeakPolarHBondContact O-CB 3.34Å; K787-A791 PolarHBondContact O-N 3.23Å; G788-A791 WeakPolarHBondContact O-CB 3.11Å; G788-A791 PolarHBondContact O-N 2.95Å; G788-A791 VanDerWaalsContact O-N 3.08Å; R789-A791 VanDerWaalsContact C-N 3.35Å; A791-G793 PolarHBondContact O-N 2.94Å; A791-Y794 PolarHBondContact O-N 2.9Å; A791-Y794 VanDerWaalsContact O-N 3.16Å
792	D	85.8	Confident	85.4	Confident	89 Å²	89	67.1 Å²	67.1	48%	0.476	33%	0.332	S	S	.	.	H	α-helix	trans	-63.5	-20.8	177.2	-66.9	-22.4	0	0	0	112.3	Y691 H709 G788 R789	Y691-D792 WeakPolarHBondContact CD1-O 3.43Å; Y691-D792 WeakPolarHBondContact CE1-O 3.48Å; H709-D792 PolarHBondContact CE1-O 2.93Å; G788-D792 VanDerWaalsContact O-CG 3.28Å; G788-D792 PolarHBondContact O-N 2.82Å; R789-D792 PolarHBondContact O-N 3.25Å
793	G	88.1	Confident	84.9	Confident	12 Å²	12	70.3 Å²	70.3	12%	0.124	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-7.2	177.1	0	0	0	0	0	114.8	Y691 K692 Y769 R789 K790 A791	Y691-G793 CarbonylContact C-O 3.6Å; Y691-G793 WeakPolarHBondContact CA-O 3.47Å; K692-G793 PolarHBondContact N-O 3.26Å; Y769-G793 WeakPolarHBondContact CD2-O 3.33Å; Y769-G793 WeakPolarHBondContact CE2-O 3.45Å; R789-G793 PolarHBondContact O-N 2.89Å; R789-G793 VanDerWaalsContact O-N 3.14Å; K790-G793 PolarHBondContact O-N 3.41Å; A791-G793 PolarHBondContact O-N 2.94Å
794	Y	87.8	Confident	84.3	Confident	96 Å²	96	70.8 Å²	70.8	38%	0.376	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-61.6	-173.8	-71.3	-56	0	0	0	113.6	K692 K790 A791	K692-Y794 HydrophobicContact CB-CD1 4.48Å; K692-Y794 HydrophobicContact CD-CD1 4.36Å; K692-Y794 HydrophobicContact CD-CE1 4.45Å; K692-Y794 PolarHBondContact N-O 2.84Å; K790-Y794 WeakPolarHBondContact CE-OH 3.44Å; K790-Y794 HydrophobicContact CG-CE2 4.12Å; K790-Y794 WeakPolarHBondContact O-CD2 3.4Å; K790-Y794 WeakPolarHBondContact O-CE2 3.27Å; A791-Y794 PolarHBondContact O-N 2.9Å; A791-Y794 VanDerWaalsContact O-N 3.16Å
795	L	83.9	Confident	83.7	Confident	69 Å²	69	63.1 Å²	63.1	36%	0.361	33%	0.329	S	S	.	.			trans	-154.7	157.1	-172.6	-71.6	174.3	0	0	0	110.4	Y691 R799 I803	Y691-L795 VanDerWaalsContact CE1-C 3.46Å; L795-R799 HydrophobicContact CD1-CG 4.33Å; L795-R799 HydrophobicContact CD2-CG 4.15Å; L795-I803 HydrophobicContact CD1-CD1 3.61Å
796	S	81.5	Confident	83.3	Confident	2 Å²	2	63.4 Å²	63.4	1%	0.014	34%	0.336	C	S	.	.			trans	-61.7	148.5	167.8	79	0	0	0	0	110.7	Y691 Q798 R799 L800	Y691-S796 WeakPolarHBondContact OH-CA 3.35Å; S796-Q798 PolarHBondContact O-N 2.84Å; S796-R799 PolarHBondContact O-N 3.16Å; S796-R799 VanDerWaalsContact O-N 3.09Å; S796-R799 WeakPolarHBondContact OG-CB 3.3Å; S796-R799 PolarHBondContact OG-N 3Å; S796-R799 VanDerWaalsContact OG-N 3.13Å; S796-L800 PolarHBondContact O-N 2.87Å
797	K	74.4	Confident	82.8	Confident	109 Å²	109	67.4 Å²	67.4	47%	0.474	36%	0.355	S	S	.	.	H	α-helix	trans	-59.9	-31.8	176.5	-72	173.1	-174.8	177.6	0	112.6	S448 A801	S448-K797 WeakPolarHBondContact O-CD 3.27Å; S448-K797 WeakPolarHBondContact O-CE 3.27Å; S448-K797 PolarHBondContact O-NZ 2.92Å; K797-A801 VanDerWaalsContact O-CB 3.31Å; K797-A801 WeakPolarHBondContact O-CB 3.46Å; K797-A801 PolarHBondContact O-N 3.37Å
798	Q	73.2	Confident	82	Confident	83 Å²	83	67 Å²	67	39%	0.388	36%	0.358	S	S	.	.	H	α-helix	trans	-64.7	-47.3	174.9	-178.6	179.1	-19.4	0	0	110.5	S796 L800 A801 E802	S796-Q798 PolarHBondContact O-N 2.84Å; Q798-L800 VanDerWaalsContact C-N 3.33Å; Q798-L800 PolarHBondContact O-N 3.38Å; Q798-A801 CarbonylContact O-C 3.53Å; Q798-A801 WeakPolarHBondContact O-CB 3.27Å; Q798-A801 PolarHBondContact O-N 2.91Å; Q798-A801 VanDerWaalsContact O-N 3.14Å; Q798-E802 PolarHBondContact NE2-OE1 3.47Å; Q798-E802 WeakPolarHBondContact O-CG 3.41Å; Q798-E802 PolarHBondContact O-N 3.43Å
799	R	78.7	Confident	81.3	Confident	105 Å²	105	75.9 Å²	75.9	40%	0.396	38%	0.383	S	S	.	.	H	α-helix	trans	-65.7	-38.6	177.6	-170.3	50.7	158.8	-158.2	1.9	111.8	M706 L795 S796 A801 E802 I803	M706-R799 HydrophobicContact CE-CB 4.2Å; M706-R799 HydrophobicContact CE-CG 4.09Å; M706-R799 HydrophobicContact SD-CB 4.34Å; L795-R799 HydrophobicContact CD1-CG 4.33Å; L795-R799 HydrophobicContact CD2-CG 4.15Å; S796-R799 PolarHBondContact O-N 3.16Å; S796-R799 VanDerWaalsContact O-N 3.09Å; S796-R799 WeakPolarHBondContact OG-CB 3.3Å; S796-R799 PolarHBondContact OG-N 3Å; S796-R799 VanDerWaalsContact OG-N 3.13Å; R799-A801 VanDerWaalsContact C-N 3.32Å; R799-A801 PolarHBondContact O-N 2.9Å; R799-E802 VanDerWaalsContact CD-OE2 3.23Å; R799-E802 WeakPolarHBondContact CD-OE2 3.35Å; R799-E802 IonicContact CZ-OE2 3.63Å; R799-E802 IonicContact NE-OE2 3.09Å; R799-E802 IonicContact NH1-OE2 3.23Å; R799-E802 PolarHBondContact NH1-OE2 3.38Å; R799-E802 WeakPolarHBondContact O-CB 3.42Å; R799-E802 PolarHBondContact O-N 3.31Å; R799-I803 HydrophobicContact CG-CD1 4.12Å; R799-I803 WeakPolarHBondContact O-CD1 3.25Å; R799-I803 VanDerWaalsContact O-CG1 3.25Å; R799-I803 WeakPolarHBondContact O-CG1 3.44Å; R799-I803 PolarHBondContact O-N 2.86Å
800	L	79.5	Confident	80.5	Confident	90 Å²	90	80.2 Å²	80.2	47%	0.471	41%	0.409	S	S	.	.	H	α-helix	trans	-60.7	-42.7	171.9	-172	67.7	0	0	0	111.2	S796 Q798 I803 V804	S796-L800 PolarHBondContact O-N 2.87Å; Q798-L800 VanDerWaalsContact C-N 3.33Å; Q798-L800 PolarHBondContact O-N 3.38Å; L800-I803 PolarHBondContact O-N 3.23Å; L800-V804 HydrophobicContact CD1-CG2 3.8Å; L800-V804 HydrophobicContact CG-CG2 4.05Å; L800-V804 VanDerWaalsContact O-CB 3.26Å; L800-V804 WeakPolarHBondContact O-CB 3.29Å; L800-V804 VanDerWaalsContact O-CG2 3.27Å; L800-V804 WeakPolarHBondContact O-CG2 3.48Å; L800-V804 PolarHBondContact O-N 3.38Å
801	A	78.5	Confident	79	Confident	61 Å²	61	79.7 Å²	79.7	50%	0.504	42%	0.424	S	S	.	.	H	α-helix	trans	-67.4	-33.8	176.2	0	0	0	0	0	112.9	K797 Q798 R799 I803 G805	K797-A801 VanDerWaalsContact O-CB 3.31Å; K797-A801 WeakPolarHBondContact O-CB 3.46Å; K797-A801 PolarHBondContact O-N 3.37Å; Q798-A801 CarbonylContact O-C 3.53Å; Q798-A801 WeakPolarHBondContact O-CB 3.27Å; Q798-A801 PolarHBondContact O-N 2.91Å; Q798-A801 VanDerWaalsContact O-N 3.14Å; R799-A801 VanDerWaalsContact C-N 3.32Å; R799-A801 PolarHBondContact O-N 2.9Å; A801-I803 VanDerWaalsContact C-N 3.32Å; A801-G805 WeakPolarHBondContact O-CA 3.42Å; A801-G805 PolarHBondContact O-N 3.06Å
802	E	79.6	Confident	77.4	Confident	83 Å²	83	80.6 Å²	80.6	39%	0.388	42%	0.424	S	S	.	.	H	α-helix	trans	-65	-35.6	171.9	-73.5	168.8	-169.1	0	0	112	Q798 R799 P806	Q798-E802 PolarHBondContact NE2-OE1 3.47Å; Q798-E802 WeakPolarHBondContact O-CG 3.41Å; Q798-E802 PolarHBondContact O-N 3.43Å; R799-E802 VanDerWaalsContact CD-OE2 3.23Å; R799-E802 WeakPolarHBondContact CD-OE2 3.35Å; R799-E802 IonicContact CZ-OE2 3.63Å; R799-E802 IonicContact NE-OE2 3.09Å; R799-E802 IonicContact NH1-OE2 3.23Å; R799-E802 PolarHBondContact NH1-OE2 3.38Å; R799-E802 WeakPolarHBondContact O-CB 3.42Å; R799-E802 PolarHBondContact O-N 3.31Å; E802-P806 WeakPolarHBondContact O-CD 3.46Å; E802-P806 WeakPolarHBondContact O-CG 3.37Å
803	I	82.7	Confident	75.8	Confident	76 Å²	76	85.2 Å²	85.2	39%	0.39	44%	0.44	S	S	.	.	H	α-helix	trans	-79.4	-49.1	179.1	-66	164.1	0	0	0	111	L795 R799 L800 A801	L795-I803 HydrophobicContact CD1-CD1 3.61Å; R799-I803 HydrophobicContact CG-CD1 4.12Å; R799-I803 WeakPolarHBondContact O-CD1 3.25Å; R799-I803 VanDerWaalsContact O-CG1 3.25Å; R799-I803 WeakPolarHBondContact O-CG1 3.44Å; R799-I803 PolarHBondContact O-N 2.86Å; L800-I803 PolarHBondContact O-N 3.23Å; A801-I803 VanDerWaalsContact C-N 3.32Å
804	V	79.9	Confident	74.1	Confident	47 Å²	47	91.6 Å²	91.6	29%	0.285	47%	0.471	S	S	.	.	H	α-helix	trans	-83	-30.8	-173.4	178	0	0	0	0	111.8	L800 M807 L808	L800-V804 HydrophobicContact CD1-CG2 3.8Å; L800-V804 HydrophobicContact CG-CG2 4.05Å; L800-V804 VanDerWaalsContact O-CB 3.26Å; L800-V804 WeakPolarHBondContact O-CB 3.29Å; L800-V804 VanDerWaalsContact O-CG2 3.27Å; L800-V804 WeakPolarHBondContact O-CG2 3.48Å; L800-V804 PolarHBondContact O-N 3.38Å; V804-M807 WeakPolarHBondContact O-CA 3.48Å; V804-M807 WeakPolarHBondContact O-CB 3.37Å; V804-M807 PolarHBondContact O-N 3.25Å; V804-L808 HydrophobicContact CG1-CD1 3.82Å; V804-L808 HydrophobicContact CG1-CG 3.85Å; V804-L808 WeakPolarHBondContact O-CG 3.28Å; V804-L808 PolarHBondContact O-N 3.38Å
805	G	78.3	Confident	72.3	Confident	18 Å²	18	89 Å²	89	19%	0.186	47%	0.47	C	S	.	.	H	α-helix	trans	-55.1	-48.4	-179	0	0	0	0	0	113.6	A801 L808 R809	A801-G805 WeakPolarHBondContact O-CA 3.42Å; A801-G805 PolarHBondContact O-N 3.06Å; G805-L808 PolarHBondContact O-N 3Å; G805-R809 WeakPolarHBondContact O-CG 3.3Å; G805-R809 PolarHBondContact O-N 2.84Å; G805-R809 VanDerWaalsContact O-N 3.08Å
806	P	80.3	Confident	70.3	Confident	66 Å²	66	89.2 Å²	89.2	43%	0.429	48%	0.481	S	S	.	.	H	α-helix	trans	-61.5	-38.4	171.8	-25.1	35.3	0	0	0	113.6	E802 L808 R809 N810	E802-P806 WeakPolarHBondContact O-CD 3.46Å; E802-P806 WeakPolarHBondContact O-CG 3.37Å; P806-L808 VanDerWaalsContact C-N 3.33Å; P806-L808 PolarHBondContact O-N 3.03Å; P806-R809 PolarHBondContact O-N 2.76Å; P806-N810 WeakPolarHBondContact O-CB 3.27Å; P806-N810 PolarHBondContact O-N 3.25Å
807	M	80.3	Confident	68.2	Low	85 Å²	85	99.3 Å²	99.3	42%	0.419	53%	0.534	S	S	.	.	H	α-helix	trans	-63.4	-39.5	177.3	-63.8	174.8	157.5	0	0	111.8	V804	V804-M807 WeakPolarHBondContact O-CA 3.48Å; V804-M807 WeakPolarHBondContact O-CB 3.37Å; V804-M807 PolarHBondContact O-N 3.25Å
808	L	76.3	Confident	67.9	Low	120 Å²	120	98.8 Å²	98.8	63%	0.628	54%	0.537	S	S	*	.	H	α-helix	trans	-69.7	-37.7	176	-67.4	173	0	0	0	112.3	V804 G805 P806	V804-L808 HydrophobicContact CG1-CD1 3.82Å; V804-L808 HydrophobicContact CG1-CG 3.85Å; V804-L808 WeakPolarHBondContact O-CG 3.28Å; V804-L808 PolarHBondContact O-N 3.38Å; G805-L808 PolarHBondContact O-N 3Å; P806-L808 VanDerWaalsContact C-N 3.33Å; P806-L808 PolarHBondContact O-N 3.03Å
809	R	73.3	Confident	67.7	Low	216 Å²	216	99.6 Å²	99.6	82%	0.815	55%	0.545	S	S	*	.	H	α-helix	trans	-69.9	-36	178.5	-72.5	-175.5	-139.9	-163.8	4.7	113	G805 P806 G811	G805-R809 WeakPolarHBondContact O-CG 3.3Å; G805-R809 PolarHBondContact O-N 2.84Å; G805-R809 VanDerWaalsContact O-N 3.08Å; P806-R809 PolarHBondContact O-N 2.76Å; R809-G811 PolarHBondContact O-N 3.26Å
810	N	70.8	Confident	67.1	Low	131 Å²	131	99.3 Å²	99.3	70%	0.701	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	5.9	-177	-74.9	-2.7	0	0	0	114.1	P806 T812	P806-N810 WeakPolarHBondContact O-CB 3.27Å; P806-N810 PolarHBondContact O-N 3.25Å; N810-T812 PolarHBondContact O-N 3.34Å
811	G	57.7	Low	66.3	Low	61 Å²	61	99.9 Å²	99.9	63%	0.629	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	66.4	6.9	168.8	0	0	0	0	0	115.6	R809 K813	R809-G811 PolarHBondContact O-N 3.26Å; G811-K813 VanDerWaalsContact C-N 3.29Å; G811-K813 PolarHBondContact O-N 2.93Å
812	T	55	Low	65.6	Low	74 Å²	74	102.3 Å²	102.3	45%	0.454	56%	0.561	S	S	.	*			trans	-72.9	86.8	171.5	45	0	0	0	0	108.6	N810 D814 A815	N810-T812 PolarHBondContact O-N 3.34Å; T812-D814 PolarHBondContact O-N 2.81Å; T812-D814 VanDerWaalsContact O-N 3.07Å; T812-A815 PolarHBondContact O-N 3.27Å; T812-A815 VanDerWaalsContact O-N 3.08Å
813	K	51.7	Low	64.6	Low	186 Å²	186	103.6 Å²	103.6	81%	0.809	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-51.1	-26.1	171.9	-80.5	-176.7	174.3	178.9	0	112.8	G811	G811-K813 VanDerWaalsContact C-N 3.29Å; G811-K813 PolarHBondContact O-N 2.93Å
814	D	52.8	Low	63.3	Low	146 Å²	146	105.6 Å²	105.6	78%	0.781	59%	0.586	S	S	*	*	G	3₁₀ helix	trans	-82.1	-12.7	-178.6	-63.1	-28.3	0	0	0	114.6	T812	T812-D814 PolarHBondContact O-N 2.81Å; T812-D814 VanDerWaalsContact O-N 3.07Å
815	A	49.5	Very low	62.1	Low	42 Å²	42	110.1 Å²	110.1	35%	0.347	61%	0.609	S	S	.	*	G	3₁₀ helix	trans	-93.2	-6.3	178.2	0	0	0	0	0	113.8	T812	T812-A815 PolarHBondContact O-N 3.27Å; T812-A815 VanDerWaalsContact O-N 3.08Å
816	A	43.7	Very low	60.7	Low	73 Å²	73	117.8 Å²	117.8	60%	0.603	64%	0.644	S	S	*	*			trans	-86.4	-11.1	179.4	0	0	0	0	0	113.6
817	L	37.4	Very low	58.9	Low	213 Å²	213	122.5 Å²	122.5	100%	1.115	66%	0.664	S	S	*	*			trans	-88.5	0	170.7	-91.6	153.2	0	0	0	109.7

Retrieved 817 of 817 residues in 161 ms (Link to these results)

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