A0A096MKW3_PAPAN Loading...

exo-alpha-sialidase

AlphaFold DB , UniProt , Accession A0A096MKW3, Species PAPAN (Papio anubis, Olive baboon), Gene n/a, Length 461 aa.

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(Predicted Aligned Error values between residue pairs)

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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	35.1	Very low	43.8	Very low	250 Å²	250	162.8 Å²	162.8	100%	1.232	86%	0.863	S	S	*	*				0	154.8	0	-77	164.7	168.2	0	0	108.5
2	R	36.7	Very low	43.2	Very low	238 Å²	238	166 Å²	166	90%	0.898	87%	0.869	S	S	*	*			trans	-69.7	178.1	171.6	-81.8	-172.3	-172.5	-177	3.3	111.4
3	P	51.7	Low	42.5	Very low	121 Å²	121	166.8 Å²	166.8	79%	0.786	87%	0.866	S	S	*	*			cis	-137.5	-177.2	-34.6	36	-18.2	0	0	0	113.7
4	G	37	Very low	43.4	Very low	61 Å²	61	162.4 Å²	162.4	63%	0.629	85%	0.852	S	S	*	*			trans	91	115.2	139.1	0	0	0	0	0	119.2
5	D	42.3	Very low	43.7	Very low	172 Å²	172	160.3 Å²	160.3	92%	0.92	85%	0.852	S	S	*	*				163.3	149.2	107.2	-79.6	-13.8	0	0	0	113.5
6	L	43.3	Very low	43.1	Very low	167 Å²	167	156.4 Å²	156.4	87%	0.874	85%	0.85	S	S	*	*			trans	-116	172.9	169.9	-85.2	163.6	0	0	0	107.4
7	P	54.3	Low	42.4	Very low	112 Å²	112	154.4 Å²	154.4	73%	0.727	85%	0.85	S	S	*	*			cis	-129.9	-139.6	5.3	36.9	-12.4	0	0	0	109.7
8	P	51.9	Low	41.8	Very low	121 Å²	121	152.1 Å²	152.1	79%	0.786	85%	0.847	S	S	*	*			cis	-133.8	-171.7	-12.7	37.6	-15.3	0	0	0	116.6
9	R	42.6	Very low	41.4	Very low	236 Å²	236	150.5 Å²	150.5	89%	0.891	85%	0.847	S	S	*	*			trans	-81.9	166.6	176.3	-59.9	178.8	173.8	179.3	-3.7	113.3
10	P	48.2	Very low	40.9	Very low	132 Å²	132	147.6 Å²	147.6	86%	0.857	84%	0.843	S	S	*	*				-145.2	-162.2	97.5	37.5	-18.6	0	0	0	115.8
11	M	38.6	Very low	41.2	Very low	181 Å²	181	145.8 Å²	145.8	89%	0.892	84%	0.836	S	S	*	*			trans	-96.2	161.5	-162.5	-52.1	176.4	-67.9	0	0	115.5
12	E	37.4	Very low	40.9	Very low	201 Å²	201	139.7 Å²	139.7	94%	0.939	81%	0.814	S	S	*	*			trans	-164.9	158.3	147.1	-117.4	168.6	-170.7	0	0	113.7
13	E	33.9	Very low	40.6	Very low	177 Å²	177	137.9 Å²	137.9	83%	0.827	82%	0.815	S	S	*	*			trans	-150.4	172.4	-178.2	-126.3	-167.2	-161.6	0	0	107.3
14	P	54.8	Low	39.6	Very low	104 Å²	104	138.3 Å²	138.3	68%	0.675	82%	0.816	S	S	*	*			cis	-118	-152.7	-35.7	34.8	-13.6	0	0	0	109.7
15	P	47.9	Very low	39.3	Very low	131 Å²	131	144.7 Å²	144.7	85%	0.851	83%	0.83	S	S	*	*				-152.1	-172.2	74.8	39.9	-17.5	0	0	0	115.8
16	A	33.5	Very low	39	Very low	99 Å²	99	145.6 Å²	145.6	82%	0.818	83%	0.828	S	S	*	*			trans	-124.4	155.3	-171.1	0	0	0	0	0	116
17	S	31.4	Very low	38.7	Very low	121 Å²	121	143.6 Å²	143.6	85%	0.846	83%	0.825	S	S	*	*			trans	-178.7	158.4	161.5	53.8	0	0	0	0	109.9
18	S	31.5	Very low	37.4	Very low	114 Å²	114	141 Å²	141	80%	0.797	82%	0.819	S	S	*	*			cis	-167.8	178.7	-25.4	-170.5	0	0	0	0	110
19	S	34	Very low	36.7	Very low	122 Å²	122	141 Å²	141	85%	0.853	82%	0.822	S	S	*	*			trans	88.3	146.9	162.6	77	0	0	0	0	121.6
20	A	32.9	Very low	36.2	Very low	92 Å²	92	134.8 Å²	134.8	76%	0.76	81%	0.814	S	S	*	*			trans	-144.3	-173.4	-176.3	0	0	0	0	0	107.2
21	P	46.7	Very low	35.5	Very low	109 Å²	109	133 Å²	133	71%	0.708	81%	0.81	S	S	*	*			cis	-144.4	-176.9	9.9	39.8	-17.4	0	0	0	118
22	T	29.4	Very low	35.2	Very low	123 Å²	123	132.2 Å²	132.2	76%	0.755	81%	0.805	S	S	*	*			trans	55	125.3	151	41.5	0	0	0	0	122.4
23	E	30.2	Very low	35.1	Very low	199 Å²	199	129.1 Å²	129.1	93%	0.93	80%	0.799	S	S	*	*				-152.2	156.7	115.2	-118.3	170	-161.7	0	0	110.8
24	T	30.5	Very low	35	Very low	130 Å²	130	128.5 Å²	128.5	80%	0.798	80%	0.798	S	S	*	*			trans	-126.4	127.7	-171.5	45.3	0	0	0	0	111.7
25	E	30.6	Very low	34.2	Very low	196 Å²	196	131.8 Å²	131.8	92%	0.916	81%	0.805	S	S	*	*			trans	-138.1	126.3	158.3	-73.6	-164.4	140.4	0	0	110.2
26	E	36.6	Very low	33.7	Very low	191 Å²	191	134.2 Å²	134.2	89%	0.893	81%	0.805	S	S	*	*			trans	-89.7	153.3	158.1	-79.8	-160.5	164.3	0	0	109.6
27	P	35.9	Very low	33.9	Very low	124 Å²	124	134.8 Å²	134.8	81%	0.805	80%	0.798	S	S	*	*			trans	-132.1	124.1	140.6	33.3	-20.5	0	0	0	113.8
28	G	27.2	Very low	34.4	Very low	58 Å²	58	132.1 Å²	132.1	60%	0.598	78%	0.777	S	S	*	*				76.7	87.4	116.5	0	0	0	0	0	117.7	S30	G28-S30 PolarHBondContact O-N 2.87Å
29	S	36.7	Very low	35.1	Very low	122 Å²	122	130.1 Å²	130.1	85%	0.853	76%	0.76	S	S	*	*			trans	-45.4	104	159.6	158.1	0	0	0	0	112.5
30	S	31.6	Very low	36.1	Very low	104 Å²	104	124.4 Å²	124.4	73%	0.727	72%	0.72	S	S	*	*			trans	-116.9	99.5	161.7	-57.7	0	0	0	0	107.3	G28 E32	G28-S30 PolarHBondContact O-N 2.87Å; S30-E32 PolarHBondContact O-N 3.42Å
31	A	35.2	Very low	37.4	Very low	94 Å²	94	122.5 Å²	122.5	78%	0.777	70%	0.7	S	S	*	*			trans	-74.9	78.2	176.8	0	0	0	0	0	109.7	V33	A31-V33 PolarHBondContact O-N 2.87Å
32	E	32.5	Very low	38.9	Very low	166 Å²	166	124.8 Å²	124.8	78%	0.776	70%	0.7	S	S	*	*			trans	-63.5	113.6	161.1	-69.6	-168.1	153.5	0	0	107.7	S30 M34	S30-E32 PolarHBondContact O-N 3.42Å; E32-M34 PolarHBondContact O-N 3.45Å
33	V	35.2	Very low	41.7	Very low	136 Å²	136	121.4 Å²	121.4	82%	0.824	68%	0.677	S	S	*	*			trans	-69.5	85.9	166.5	-179.9	0	0	0	0	106.5	A31 E35	A31-V33 PolarHBondContact O-N 2.87Å; V33-E35 PolarHBondContact O-N 3.45Å
34	M	30.6	Very low	44.7	Very low	163 Å²	163	114.3 Å²	114.3	80%	0.803	65%	0.649	S	S	*	*			trans	-62.3	103.9	165.8	-74.1	-178.3	63	0	0	107.3	E32 E36	E32-M34 PolarHBondContact O-N 3.45Å; M34-E36 PolarHBondContact O-N 2.91Å
35	E	38	Very low	47.8	Very low	174 Å²	174	110 Å²	110	81%	0.813	62%	0.624	S	S	*	*			trans	-50.6	125	159	-88	-175	141.3	0	0	107.8	V33 V37	V33-E35 PolarHBondContact O-N 3.45Å; E35-V37 PolarHBondContact O-N 2.99Å
36	E	37.1	Very low	51	Low	181 Å²	181	101 Å²	101	85%	0.846	58%	0.582	S	S	*	*			trans	-70.6	84.5	-179.8	-171.4	176.6	-152.3	0	0	108.8	M34 T38	M34-E36 PolarHBondContact O-N 2.91Å; E36-T38 VanDerWaalsContact C-N 3.34Å; E36-T38 PolarHBondContact O-N 3.04Å; E36-T38 PolarHBondContact O-OG1 3.12Å; E36-T38 VanDerWaalsContact O-OG1 3.13Å
37	V	37.9	Very low	53.9	Low	111 Å²	111	92 Å²	92	67%	0.673	54%	0.54	S	S	*	.			trans	-57	97.9	179.3	177.9	0	0	0	0	108.5	E35 T39	E35-V37 PolarHBondContact O-N 2.99Å; V37-T39 PolarHBondContact O-N 2.92Å; V37-T39 VanDerWaalsContact O-N 3.1Å
38	T	41.9	Very low	56.8	Low	66 Å²	66	93.7 Å²	93.7	41%	0.405	53%	0.53	S	S	.	.			trans	-67.2	116.3	-165.3	-38.5	0	0	0	0	109.1	E36 C40 S41	E36-T38 VanDerWaalsContact C-N 3.34Å; E36-T38 PolarHBondContact O-N 3.04Å; E36-T38 PolarHBondContact O-OG1 3.12Å; E36-T38 VanDerWaalsContact O-OG1 3.13Å; T38-C40 PolarHBondContact O-N 2.83Å; T38-S41 PolarHBondContact O-N 3.16Å; T38-S41 PolarHBondContact O-OG 2.97Å
39	T	45.7	Very low	60.1	Low	72 Å²	72	92.2 Å²	92.2	44%	0.442	51%	0.508	S	S	.	.	G	3₁₀ helix	trans	-67.8	-4.4	-166.8	48.7	0	0	0	0	114.5	V37 S41 L100	V37-T39 PolarHBondContact O-N 2.92Å; V37-T39 VanDerWaalsContact O-N 3.1Å; T39-S41 PolarHBondContact O-N 3.05Å; T39-L100 HydrophobicContact CG2-CD2 4.4Å
40	C	56.1	Low	62.7	Low	2 Å²	2	92.7 Å²	92.7	1%	0.014	50%	0.496	C	S	.	.	G	3₁₀ helix	trans	-60.1	-20.4	167.5	-63.6	0	0	0	0	114.4	T38 F42 H99 R433 L434	T38-C40 PolarHBondContact O-N 2.83Å; C40-F42 VanDerWaalsContact C-N 3.26Å; C40-F42 PolarHBondContact O-N 3.48Å; C40-H99 PolarHBondContact SG-ND1 2.78Å; C40-R433 PolarHBondContact O-NE 3.08Å; C40-L434 CarbonylContact C-O 3.52Å; C40-L434 HydrophobicContact CB-CB 4.32Å; C40-L434 WeakPolarHBondContact CB-O 3.38Å
41	S	60.4	Low	65.3	Low	51 Å²	51	92.1 Å²	92.1	36%	0.357	49%	0.485	S	S	.	.	G	3₁₀ helix	trans	-68.7	-9.8	-163.9	-60.9	0	0	0	0	116.8	T38 T39	T38-S41 PolarHBondContact O-N 3.16Å; T38-S41 PolarHBondContact O-OG 2.97Å; T39-S41 PolarHBondContact O-N 3.05Å
42	F	78.3	Confident	67.2	Low	158 Å²	158	92.5 Å²	92.5	69%	0.693	47%	0.474	S	S	*	.	S	Bend	trans	-117	138.4	-170	-61.4	-74.3	0	0	0	114.7	C40 S44	C40-F42 VanDerWaalsContact C-N 3.26Å; C40-F42 PolarHBondContact O-N 3.48Å; F42-S44 PolarHBondContact O-N 3.04Å
43	N	87.8	Confident	69.6	Low	51 Å²	51	94 Å²	94	27%	0.273	47%	0.473	S	S	.	.			trans	-73.6	119.6	173.6	-65.8	-12.4	0	0	0	110.6	P45 H397 A431 R433	N43-P45 WeakPolarHBondContact O-CD 3.08Å; N43-H397 PolarHBondContact ND2-ND1 3.21Å; N43-A431 HydrophobicContact CB-CB 4.22Å; N43-R433 WeakPolarHBondContact OD1-CD 3.49Å
44	S	92.3	Very high	72.3	Confident	50 Å²	50	88.2 Å²	88.2	35%	0.35	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	108.8	173.1	-173.7	0	0	0	0	110.6	F42 L46 A431 F432	F42-S44 PolarHBondContact O-N 3.04Å; S44-L46 PolarHBondContact O-N 3.24Å; S44-A431 CarbonylContact O-C 3.55Å; S44-A431 WeakPolarHBondContact O-CA 3.27Å; S44-F432 PolarHBondContact N-O 2.84Å; S44-F432 PolarHBondContact O-N 3.26Å
45	P	95.9	Very high	75.4	Confident	40 Å²	40	81.8 Å²	81.8	26%	0.26	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	113.2	179.5	29.6	-35.1	0	0	0	111.2	N43 R48	N43-P45 WeakPolarHBondContact O-CD 3.08Å; P45-R48 HydrophobicContact CB-CG 4.32Å
46	L	97.6	Very high	78.3	Confident	7 Å²	7	73.6 Å²	73.6	4%	0.037	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	-39.7	-174.4	-59.7	-163.7	0	0	0	112.8	S44 A73 R92 W103 L418 I430 F432	S44-L46 PolarHBondContact O-N 3.24Å; L46-A73 HydrophobicContact CD1-CB 3.95Å; L46-R92 PolarHBondContact O-NE 3.26Å; L46-R92 PolarHBondContact O-NH2 3.24Å; L46-R92 VanDerWaalsContact O-NH2 3.08Å; L46-W103 HydrophobicContact CD1-CD2 3.74Å; L46-W103 HydrophobicContact CD1-CE3 3.92Å; L46-W103 HydrophobicContact CD1-CG 4.47Å; L46-W103 HydrophobicContact CD1-CH2 3.77Å; L46-W103 HydrophobicContact CD1-CZ2 3.6Å; L46-W103 HydrophobicContact CD1-CZ3 3.93Å; L46-W103 HydrophobicContact CD2-CB 4.41Å; L46-W103 HydrophobicContact CD2-CD2 3.81Å; L46-W103 HydrophobicContact CD2-CG 3.65Å; L46-W103 HydrophobicContact CG-CD2 4.46Å; L46-L418 HydrophobicContact CD1-CD1 3.75Å; L46-L418 HydrophobicContact CG-CD1 4.44Å; L46-I430 PolarHBondContact N-O 3.49Å; L46-F432 HydrophobicContact CD1-CB 3.64Å; L46-F432 HydrophobicContact CD1-CG 4.37Å; L46-F432 HydrophobicContact CD2-CB 4.3Å; L46-F432 HydrophobicContact CG-CB 3.81Å
47	F	98.1	Very high	81.2	Confident	2 Å²	2	66.1 Å²	66.1	1%	0.009	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	127.9	178.4	-51.9	-90.8	0	0	0	107.5	Y57 A73 A75 V90 R92 L106 Q429 I430	F47-Y57 HydrophobicContact CB-CD1 4.29Å; F47-Y57 HydrophobicContact CB-CD2 3.92Å; F47-Y57 HydrophobicContact CB-CG 3.68Å; F47-Y57 AromaticContact CD1-CD1 3.96Å; F47-Y57 HydrophobicContact CD1-CD1 3.96Å; F47-Y57 HydrophobicContact CD1-CE1 4.31Å; F47-Y57 HydrophobicContact CD1-CG 4.23Å; F47-Y57 HydrophobicContact CG-CD1 4.48Å; F47-Y57 HydrophobicContact CG-CG 4.33Å; F47-A73 HydrophobicContact CE2-CB 4.29Å; F47-A75 HydrophobicContact CD1-CB 4.42Å; F47-A75 HydrophobicContact CD2-CB 4.33Å; F47-A75 HydrophobicContact CE1-CB 4.41Å; F47-A75 HydrophobicContact CE2-CB 4.3Å; F47-A75 HydrophobicContact CG-CB 4.39Å; F47-A75 HydrophobicContact CZ-CB 4.35Å; F47-V90 HydrophobicContact CD1-CG2 3.95Å; F47-V90 HydrophobicContact CE1-CB 4.34Å; F47-V90 HydrophobicContact CE1-CG2 3.57Å; F47-V90 HydrophobicContact CZ-CG2 4.44Å; F47-R92 HydrophobicContact CE1-CG 4.09Å; F47-R92 HydrophobicContact CZ-CB 4.24Å; F47-R92 HydrophobicContact CZ-CG 3.95Å; F47-L106 HydrophobicContact CD1-CD1 3.66Å; F47-L106 HydrophobicContact CE1-CD1 3.79Å; F47-L106 HydrophobicContact CE1-CG 4.31Å; F47-Q429 CarbonylContact O-C 3.5Å; F47-Q429 WeakPolarHBondContact O-CA 3.36Å; F47-Q429 VanDerWaalsContact O-CB 3.24Å; F47-Q429 WeakPolarHBondContact O-CB 3.16Å; F47-I430 HydrophobicContact CB-CB 4.17Å; F47-I430 HydrophobicContact CD2-CB 3.98Å; F47-I430 HydrophobicContact CD2-CD1 4.45Å; F47-I430 HydrophobicContact CD2-CG2 4.16Å; F47-I430 PolarHBondContact N-O 2.67Å; F47-I430 PolarHBondContact O-N 3Å
48	R	97.1	Very high	84.1	Confident	159 Å²	159	61.9 Å²	61.9	60%	0.6	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.2	139.4	179.9	-65.8	-177.3	-177	163.6	0.1	109.2	P45 Y57 Q429	P45-R48 HydrophobicContact CB-CG 4.32Å; R48-Y57 WeakPolarHBondContact O-CD2 3.36Å; R48-Y57 WeakPolarHBondContact O-CE2 3.47Å; R48-Q429 HydrophobicContact CG-CB 4.25Å
49	Q	95.8	Very high	86.8	Confident	28 Å²	28	58.8 Å²	58.8	13%	0.131	29%	0.288	C	S	.	.			trans	-62.4	145.9	166.2	176.7	169.1	66.6	0	0	109.6	D51 I55 T56 E428	Q49-D51 WeakPolarHBondContact CG-O 3.42Å; Q49-I55 WeakPolarHBondContact CA-O 3.3Å; Q49-T56 PolarHBondContact NE2-OG1 3.18Å; Q49-E428 WeakPolarHBondContact CB-O 3.44Å; Q49-E428 PolarHBondContact N-O 3.04Å
50	E	91.3	Very high	89.3	Confident	132 Å²	132	55.4 Å²	55.4	62%	0.617	27%	0.267	S	S	*	.			trans	-74.4	-67.9	176.6	-69.1	169.2	169.6	0	0	111	I55	E50-I55 VanDerWaalsContact CD-CB 3.48Å; E50-I55 HydrophobicContact CG-CB 4.12Å; E50-I55 PolarHBondContact N-O 3.32Å; E50-I55 VanDerWaalsContact N-O 3.16Å; E50-I55 WeakPolarHBondContact OE1-CG1 3.34Å; E50-I55 WeakPolarHBondContact OE2-CB 3.41Å; E50-I55 WeakPolarHBondContact OE2-CG1 3.24Å; E50-I55 PolarHBondContact OE2-N 2.75Å
51	D	86.3	Confident	91.3	Very high	92 Å²	92	55.3 Å²	55.3	49%	0.492	27%	0.267	S	S	.	.	S	Bend	trans	-141	-170	172.7	69	35.1	0	0	0	110.6	Q49 R53 G54	Q49-D51 WeakPolarHBondContact CG-O 3.42Å; D51-R53 PolarHBondContact O-N 2.88Å; D51-R53 VanDerWaalsContact O-N 3.11Å; D51-R53 WeakPolarHBondContact OD1-CA 3.46Å; D51-R53 PolarHBondContact OD1-N 2.95Å; D51-G54 PolarHBondContact OD1-N 2.73Å
52	D	75.9	Confident	93.2	Very high	102 Å²	102	53 Å²	53	55%	0.545	25%	0.25	S	S	.	.	S	Bend	trans	-67.7	-11.5	-174.4	77.6	-45.3	0	0	0	115.2
53	R	82.6	Confident	94.1	Very high	198 Å²	198	46.1 Å²	46.1	75%	0.747	22%	0.221	S	C	*	.	S	Bend	trans	-128.1	-12.9	-177.3	-62	175.2	-169.7	-132	0	114.2	D51	D51-R53 PolarHBondContact O-N 2.88Å; D51-R53 VanDerWaalsContact O-N 3.11Å; D51-R53 WeakPolarHBondContact OD1-CA 3.46Å; D51-R53 PolarHBondContact OD1-N 2.95Å
54	G	90.8	Very high	94.6	Very high	14 Å²	14	44.6 Å²	44.6	14%	0.144	21%	0.211	C	C	.	.	S	Bend	trans	-80.4	-166.4	180	0	0	0	0	0	114.3	D51 T56	D51-G54 PolarHBondContact OD1-N 2.73Å; G54-T56 PolarHBondContact O-N 2.84Å; G54-T56 PolarHBondContact O-OG1 2.97Å; G54-T56 VanDerWaalsContact O-OG1 3.12Å
55	I	96.9	Very high	94.9	Very high	28 Å²	28	42.5 Å²	42.5	14%	0.144	20%	0.196	C	C	.	.			trans	-54.7	129.1	-176.6	-62.4	-57	0	0	0	110.2	Q49 E50 Y57 K77 R78	Q49-I55 WeakPolarHBondContact CA-O 3.3Å; E50-I55 VanDerWaalsContact CD-CB 3.48Å; E50-I55 HydrophobicContact CG-CB 4.12Å; E50-I55 PolarHBondContact N-O 3.32Å; E50-I55 VanDerWaalsContact N-O 3.16Å; E50-I55 WeakPolarHBondContact OE1-CG1 3.34Å; E50-I55 WeakPolarHBondContact OE2-CB 3.41Å; E50-I55 WeakPolarHBondContact OE2-CG1 3.24Å; E50-I55 PolarHBondContact OE2-N 2.75Å; I55-Y57 HydrophobicContact CG2-CD2 4.32Å; I55-Y57 HydrophobicContact CG2-CE1 4.3Å; I55-Y57 HydrophobicContact CG2-CE2 3.7Å; I55-K77 HydrophobicContact CG2-CD 4.29Å; I55-K77 HydrophobicContact CG2-CG 3.72Å; I55-R78 WeakPolarHBondContact CA-O 3.32Å
56	T	97.8	Very high	94.8	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.006	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	135.3	179.1	-53.6	0	0	0	0	108.9	Q49 G54 R58 R78 C427	Q49-T56 PolarHBondContact NE2-OG1 3.18Å; G54-T56 PolarHBondContact O-N 2.84Å; G54-T56 PolarHBondContact O-OG1 2.97Å; G54-T56 VanDerWaalsContact O-OG1 3.12Å; T56-R58 HydrophobicContact CG2-CG 4.04Å; T56-R78 PolarHBondContact N-O 3.47Å; T56-R78 WeakPolarHBondContact O-CB 3.42Å; T56-R78 PolarHBondContact O-N 3.03Å; T56-C427 HydrophobicContact CG2-CB 4.04Å
57	Y	98.6	Very high	94.7	Very high	25 Å²	25	47.3 Å²	47.3	10%	0.098	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	130.2	175.6	-61.9	-85.4	0	0	0	109.5	F47 R48 I55 E76 K77 V90 L106	F47-Y57 HydrophobicContact CB-CD1 4.29Å; F47-Y57 HydrophobicContact CB-CD2 3.92Å; F47-Y57 HydrophobicContact CB-CG 3.68Å; F47-Y57 AromaticContact CD1-CD1 3.96Å; F47-Y57 HydrophobicContact CD1-CD1 3.96Å; F47-Y57 HydrophobicContact CD1-CE1 4.31Å; F47-Y57 HydrophobicContact CD1-CG 4.23Å; F47-Y57 HydrophobicContact CG-CD1 4.48Å; F47-Y57 HydrophobicContact CG-CG 4.33Å; R48-Y57 WeakPolarHBondContact O-CD2 3.36Å; R48-Y57 WeakPolarHBondContact O-CE2 3.47Å; I55-Y57 HydrophobicContact CG2-CD2 4.32Å; I55-Y57 HydrophobicContact CG2-CE1 4.3Å; I55-Y57 HydrophobicContact CG2-CE2 3.7Å; Y57-E76 VanDerWaalsContact CA-O 3.31Å; Y57-E76 WeakPolarHBondContact CA-O 3.31Å; Y57-K77 HydrophobicContact CD1-CB 4.2Å; Y57-K77 HydrophobicContact CD1-CG 4.34Å; Y57-K77 HydrophobicContact CE1-CB 3.89Å; Y57-K77 HydrophobicContact CE1-CD 4.25Å; Y57-K77 HydrophobicContact CE1-CG 3.72Å; Y57-V90 HydrophobicContact CD1-CG2 3.75Å; Y57-V90 HydrophobicContact CE1-CG1 4.28Å; Y57-V90 HydrophobicContact CE1-CG2 3.79Å; Y57-L106 HydrophobicContact CE1-CD1 3.94Å
58	R	98.4	Very high	94.6	Very high	21 Å²	21	50 Å²	50	8%	0.079	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	170.1	-176.5	-71.8	-146.1	64.9	-128.4	-11.6	111.5	T56 E76 Y403 E420 C427	T56-R58 HydrophobicContact CG2-CG 4.04Å; R58-E76 PolarHBondContact N-O 3.13Å; R58-E76 VanDerWaalsContact N-O 3.15Å; R58-E76 PolarHBondContact O-N 2.97Å; R58-Y403 VanDerWaalsContact NH2-CE2 3.28Å; R58-E420 VanDerWaalsContact CA-OE1 3.28Å; R58-E420 WeakPolarHBondContact CA-OE1 3.49Å; R58-E420 WeakPolarHBondContact CB-OE1 3.45Å; R58-E420 IonicContact CZ-OE1 3.79Å; R58-E420 IonicContact CZ-OE2 3.66Å; R58-E420 IonicContact NE-OE1 3.18Å; R58-E420 PolarHBondContact NE-OE1 3.11Å; R58-E420 IonicContact NE-OE2 3.8Å; R58-E420 IonicContact NH2-OE1 3.19Å; R58-E420 PolarHBondContact NH2-OE1 3.3Å; R58-E420 IonicContact NH2-OE2 3.81Å; R58-E420 PolarHBondContact NH2-OE2 3.39Å; R58-C427 HydrophobicContact CG-CB 4.16Å
59	I	98.5	Very high	94.6	Very high	2 Å²	2	46.7 Å²	46.7	1%	0.01	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	60.9	70.2	172.3	-43.1	-53.6	0	0	0	111.3	E76 P122 P196 Y403 E420	I59-E76 HydrophobicContact CB-CG 4.16Å; I59-E76 HydrophobicContact CG1-CG 4.31Å; I59-E76 WeakPolarHBondContact CG1-OE1 3.4Å; I59-P122 WeakPolarHBondContact O-CG 3.41Å; I59-P196 HydrophobicContact CG2-CB 3.23Å; I59-P196 HydrophobicContact CG2-CG 3.49Å; I59-P196 VanDerWaalsContact CG2-CG 3.49Å; I59-Y403 HydrophobicContact CD1-CD1 3.69Å; I59-Y403 HydrophobicContact CD1-CD2 4.41Å; I59-Y403 HydrophobicContact CD1-CE1 3.63Å; I59-Y403 HydrophobicContact CD1-CE2 4.35Å; I59-Y403 HydrophobicContact CD1-CG 4.13Å; I59-Y403 HydrophobicContact CG2-CD1 4.44Å; I59-E420 PolarHBondContact N-OE1 2.96Å
60	P	98.8	Very high	94.7	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.006	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	142.9	177.2	28	-34.2	0	0	0	111.4	F74 L418 E420 I430	P60-F74 WeakPolarHBondContact CA-O 3.49Å; P60-L418 HydrophobicContact CB-CB 4.33Å; P60-L418 HydrophobicContact CB-CD2 3.66Å; P60-L418 HydrophobicContact CB-CG 3.69Å; P60-E420 HydrophobicContact CG-CG 4.33Å; P60-I430 HydrophobicContact CB-CD1 4.39Å; P60-I430 HydrophobicContact CB-CG2 3.96Å
61	A	98.9	Very high	95	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	138.1	165.7	0	0	0	0	0	109.3	F74 P122 P124 G197 D405 L418	A61-F74 HydrophobicContact CB-CB 4.25Å; A61-F74 PolarHBondContact N-O 3.44Å; A61-F74 VanDerWaalsContact N-O 3.08Å; A61-F74 PolarHBondContact O-N 3Å; A61-P122 HydrophobicContact CB-CB 3.87Å; A61-P122 HydrophobicContact CB-CG 3.8Å; A61-P124 HydrophobicContact CB-CG 4.35Å; A61-G197 WeakPolarHBondContact CB-O 3.36Å; A61-D405 WeakPolarHBondContact CA-OD2 3.44Å; A61-L418 WeakPolarHBondContact O-CD2 3.32Å
62	L	98.9	Very high	95.6	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.01	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	124.9	-170.9	-175.5	67.9	0	0	0	110.5	F71 A73 D405 A407 L418 F432	L62-F71 HydrophobicContact CD1-CB 4.35Å; L62-F71 HydrophobicContact CD1-CD1 3.85Å; L62-F71 HydrophobicContact CD1-CG 4.48Å; L62-F71 HydrophobicContact CD2-CD1 4.43Å; L62-F71 HydrophobicContact CD2-CE1 4.5Å; L62-F71 HydrophobicContact CG-CD1 4.25Å; L62-A73 HydrophobicContact CD1-CB 4.25Å; L62-D405 HydrophobicContact CB-CB 4.2Å; L62-D405 PolarHBondContact N-OD2 2.89Å; L62-A407 HydrophobicContact CD2-CB 3.75Å; L62-A407 HydrophobicContact CG-CB 3.97Å; L62-L418 HydrophobicContact CB-CB 3.96Å; L62-L418 HydrophobicContact CB-CD2 4.27Å; L62-L418 HydrophobicContact CD1-CB 4.28Å; L62-L418 HydrophobicContact CD1-CD2 4.47Å; L62-L418 HydrophobicContact CD2-CB 4.08Å; L62-L418 HydrophobicContact CG-CB 4.33Å; L62-F432 HydrophobicContact CD1-CD2 4.33Å; L62-F432 HydrophobicContact CD1-CE2 4.19Å; L62-F432 HydrophobicContact CD2-CD2 4.3Å; L62-F432 HydrophobicContact CD2-CE2 3.98Å
63	L	98.6	Very high	96.7	Very high	14 Å²	14	30.2 Å²	30.2	7%	0.073	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	137.6	172.1	-174.6	71.7	0	0	0	109.4	I65 F71 L72 P124 W126 V133	L63-I65 HydrophobicContact CD2-CG1 4.31Å; L63-F71 CarbonylContact O-C 3.59Å; L63-F71 WeakPolarHBondContact O-CA 3.46Å; L63-L72 HydrophobicContact CB-CB 4.41Å; L63-L72 HydrophobicContact CD2-CD1 4.4Å; L63-L72 PolarHBondContact N-O 3.43Å; L63-L72 PolarHBondContact O-N 3.2Å; L63-P124 HydrophobicContact CB-CB 4.13Å; L63-P124 HydrophobicContact CB-CG 3.91Å; L63-P124 HydrophobicContact CD2-CB 4.1Å; L63-W126 HydrophobicContact CD1-CB 4.06Å; L63-W126 HydrophobicContact CD2-CB 4.05Å; L63-W126 HydrophobicContact CG-CB 4.43Å; L63-V133 HydrophobicContact CD2-CB 4.41Å; L63-V133 HydrophobicContact CD2-CG1 3.59Å; L63-V133 HydrophobicContact CD2-CG2 3.98Å
64	Y	98.2	Very high	97.5	Very high	19 Å²	19	20.8 Å²	20.8	8%	0.075	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	139.1	167.3	-178	-108.7	0	0	0	110.3	P66 H69 F71 R96 L409	Y64-P66 HydrophobicContact CD1-CB 4.47Å; Y64-P66 HydrophobicContact CD1-CG 3.87Å; Y64-P66 HydrophobicContact CE1-CB 3.96Å; Y64-P66 HydrophobicContact CE1-CG 3.86Å; Y64-H69 PolarHBondContact OH-ND1 2.84Å; Y64-F71 AromaticContact CD2-CD1 3.75Å; Y64-F71 HydrophobicContact CD2-CD1 3.75Å; Y64-F71 AromaticContact CD2-CD2 3.92Å; Y64-F71 HydrophobicContact CD2-CD2 3.92Å; Y64-F71 AromaticContact CD2-CE1 3.65Å; Y64-F71 HydrophobicContact CD2-CE1 3.65Å; Y64-F71 AromaticContact CD2-CE2 3.81Å; Y64-F71 HydrophobicContact CD2-CE2 3.81Å; Y64-F71 AromaticContact CD2-CG 3.9Å; Y64-F71 HydrophobicContact CD2-CG 3.9Å; Y64-F71 AromaticContact CD2-CZ 3.68Å; Y64-F71 HydrophobicContact CD2-CZ 3.68Å; Y64-F71 HydrophobicContact CE2-CD2 4.27Å; Y64-F71 HydrophobicContact CE2-CE2 4.01Å; Y64-F71 HydrophobicContact CE2-CZ 4.17Å; Y64-F71 HydrophobicContact CG-CD1 4.29Å; Y64-F71 HydrophobicContact CG-CE1 4.05Å; Y64-F71 HydrophobicContact CG-CZ 4.36Å; Y64-R96 HydrophobicContact CE2-CB 4.39Å; Y64-R96 PolarHBondContact OH-NE 3.46Å; Y64-R96 PolarHBondContact OH-NH2 3.44Å; Y64-R96 VanDerWaalsContact OH-NH2 3.15Å; Y64-L409 HydrophobicContact CD1-CD1 4.16Å; Y64-L409 HydrophobicContact CD1-CD2 3.97Å; Y64-L409 HydrophobicContact CD1-CG 3.58Å; Y64-L409 HydrophobicContact CD2-CD2 4.18Å; Y64-L409 HydrophobicContact CD2-CG 4.43Å; Y64-L409 HydrophobicContact CE1-CB 4.5Å; Y64-L409 HydrophobicContact CE1-CD2 3.52Å; Y64-L409 HydrophobicContact CE1-CG 3.55Å; Y64-L409 HydrophobicContact CE2-CD2 3.77Å; Y64-L409 HydrophobicContact CE2-CG 4.42Å; Y64-L409 HydrophobicContact CG-CD1 4.13Å; Y64-L409 HydrophobicContact CG-CD2 4.25Å; Y64-L409 HydrophobicContact CG-CG 4.01Å
65	I	97.4	Very high	97.9	Very high	6 Å²	6	20.1 Å²	20.1	3%	0.031	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	97.5	179.7	-57.3	172.4	0	0	0	107.3	L63 T68 H69 T70 L72 V133 A167	L63-I65 HydrophobicContact CD2-CG1 4.31Å; I65-T68 WeakPolarHBondContact CG2-OG1 3.45Å; I65-T68 PolarHBondContact O-N 3.01Å; I65-H69 PolarHBondContact O-N 3.08Å; I65-H69 VanDerWaalsContact O-N 3.11Å; I65-T70 PolarHBondContact N-O 2.92Å; I65-T70 PolarHBondContact O-N 3.26Å; I65-T70 VanDerWaalsContact O-N 3.16Å; I65-L72 HydrophobicContact CD1-CD1 3.75Å; I65-L72 HydrophobicContact CD1-CG 3.97Å; I65-V133 HydrophobicContact CD1-CG2 3.61Å; I65-V133 HydrophobicContact CG1-CG2 4.37Å; I65-A167 HydrophobicContact CD1-CB 3.9Å
66	P	95.3	Very high	98	Very high	53 Å²	53	18.8 Å²	18.8	34%	0.344	10%	0.103	S	C	.	.	G	3₁₀ helix	trans	-55.4	-47.3	-175.5	-22.3	29.4	0	0	0	115	Y64 T68 H69 W126	Y64-P66 HydrophobicContact CD1-CB 4.47Å; Y64-P66 HydrophobicContact CD1-CG 3.87Å; Y64-P66 HydrophobicContact CE1-CB 3.96Å; Y64-P66 HydrophobicContact CE1-CG 3.86Å; P66-T68 PolarHBondContact O-N 3.21Å; P66-H69 PolarHBondContact O-N 2.9Å; P66-W126 VanDerWaalsContact CD-CZ3 3.41Å; P66-W126 HydrophobicContact CG-CH2 4.41Å; P66-W126 HydrophobicContact CG-CZ3 3.89Å
67	P	95.1	Very high	98	Very high	94 Å²	94	21 Å²	21	61%	0.61	11%	0.113	S	C	*	.	G	3₁₀ helix	trans	-62.6	-17.4	-175	-25.8	36.2	0	0	0	115.4	W126	P67-W126 VanDerWaalsContact CD-CH2 3.46Å; P67-W126 HydrophobicContact CG-CH2 3.73Å; P67-W126 HydrophobicContact CG-CZ2 3.71Å
68	T	95.8	Very high	98	Very high	59 Å²	59	19.9 Å²	19.9	36%	0.362	11%	0.108	S	C	.	.	G	3₁₀ helix	trans	-119.8	9.2	178.6	59.3	0	0	0	0	112.4	I65 P66 T70 A167	I65-T68 WeakPolarHBondContact CG2-OG1 3.45Å; I65-T68 PolarHBondContact O-N 3.01Å; P66-T68 PolarHBondContact O-N 3.21Å; T68-T70 PolarHBondContact O-N 3.45Å; T68-T70 PolarHBondContact O-OG1 3.13Å; T68-T70 WeakPolarHBondContact OG1-CB 3.37Å; T68-T70 PolarHBondContact OG1-OG1 3.1Å; T68-A167 HydrophobicContact CG2-CB 4.15Å
69	H	96.3	Very high	97.9	Very high	90 Å²	90	21.1 Å²	21.1	42%	0.417	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	42.8	35.6	-173.2	-57.9	-80.3	0	0	0	113.8	Y64 I65 P66 L95 R96	Y64-H69 PolarHBondContact OH-ND1 2.84Å; I65-H69 PolarHBondContact O-N 3.08Å; I65-H69 VanDerWaalsContact O-N 3.11Å; P66-H69 PolarHBondContact O-N 2.9Å; H69-L95 HydrophobicContact CB-CD1 4.49Å; H69-R96 HydrophobicContact CB-CB 4.42Å; H69-R96 PolarHBondContact ND1-NH2 2.98Å; H69-R96 VanDerWaalsContact ND1-NH2 3.14Å; H69-R96 WeakPolarHBondContact O-CB 3.37Å; H69-R96 PolarHBondContact O-N 2.91Å
70	T	97.9	Very high	97.7	Very high	8 Å²	8	23 Å²	23	5%	0.049	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	125.1	-168.2	-67.8	0	0	0	0	111.3	I65 T68 L72 G94	I65-T70 PolarHBondContact N-O 2.92Å; I65-T70 PolarHBondContact O-N 3.26Å; I65-T70 VanDerWaalsContact O-N 3.16Å; T68-T70 PolarHBondContact O-N 3.45Å; T68-T70 PolarHBondContact O-OG1 3.13Å; T68-T70 WeakPolarHBondContact OG1-CB 3.37Å; T68-T70 PolarHBondContact OG1-OG1 3.1Å; T70-L72 HydrophobicContact CG2-CD2 3.91Å; T70-G94 CarbonylContact C-O 3.6Å; T70-G94 WeakPolarHBondContact CA-O 3.3Å
71	F	98.6	Very high	97.4	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	138.5	162.6	-70.4	-81.2	0	0	0	111.1	L62 L63 Y64 R93 G94 R96 V101 W103 A407 L409 F432 L434	L62-F71 HydrophobicContact CD1-CB 4.35Å; L62-F71 HydrophobicContact CD1-CD1 3.85Å; L62-F71 HydrophobicContact CD1-CG 4.48Å; L62-F71 HydrophobicContact CD2-CD1 4.43Å; L62-F71 HydrophobicContact CD2-CE1 4.5Å; L62-F71 HydrophobicContact CG-CD1 4.25Å; L63-F71 CarbonylContact O-C 3.59Å; L63-F71 WeakPolarHBondContact O-CA 3.46Å; Y64-F71 AromaticContact CD2-CD1 3.75Å; Y64-F71 HydrophobicContact CD2-CD1 3.75Å; Y64-F71 AromaticContact CD2-CD2 3.92Å; Y64-F71 HydrophobicContact CD2-CD2 3.92Å; Y64-F71 AromaticContact CD2-CE1 3.65Å; Y64-F71 HydrophobicContact CD2-CE1 3.65Å; Y64-F71 AromaticContact CD2-CE2 3.81Å; Y64-F71 HydrophobicContact CD2-CE2 3.81Å; Y64-F71 AromaticContact CD2-CG 3.9Å; Y64-F71 HydrophobicContact CD2-CG 3.9Å; Y64-F71 AromaticContact CD2-CZ 3.68Å; Y64-F71 HydrophobicContact CD2-CZ 3.68Å; Y64-F71 HydrophobicContact CE2-CD2 4.27Å; Y64-F71 HydrophobicContact CE2-CE2 4.01Å; Y64-F71 HydrophobicContact CE2-CZ 4.17Å; Y64-F71 HydrophobicContact CG-CD1 4.29Å; Y64-F71 HydrophobicContact CG-CE1 4.05Å; Y64-F71 HydrophobicContact CG-CZ 4.36Å; F71-R93 CarbonylContact O-C 3.56Å; F71-R93 WeakPolarHBondContact O-CA 3.41Å; F71-G94 PolarHBondContact N-O 2.86Å; F71-G94 PolarHBondContact O-N 3.39Å; F71-R96 HydrophobicContact CD2-CB 4.38Å; F71-R96 HydrophobicContact CE2-CB 4.08Å; F71-R96 HydrophobicContact CE2-CG 4.28Å; F71-V101 HydrophobicContact CD2-CG1 3.97Å; F71-V101 HydrophobicContact CD2-CG2 3.78Å; F71-V101 HydrophobicContact CE2-CG2 3.64Å; F71-W103 HydrophobicContact CB-CH2 3.55Å; F71-W103 HydrophobicContact CB-CZ2 4.28Å; F71-W103 HydrophobicContact CB-CZ3 4.11Å; F71-W103 HydrophobicContact CG-CH2 4.32Å; F71-A407 HydrophobicContact CE1-CB 4.18Å; F71-L409 HydrophobicContact CE1-CD1 4.09Å; F71-L409 HydrophobicContact CZ-CD1 3.86Å; F71-L409 HydrophobicContact CZ-CD2 4.28Å; F71-F432 HydrophobicContact CD1-CE2 4.25Å; F71-F432 HydrophobicContact CD1-CZ 4.47Å; F71-F432 HydrophobicContact CD2-CZ 4.22Å; F71-F432 HydrophobicContact CE1-CE2 4.21Å; F71-F432 HydrophobicContact CE1-CZ 4.25Å; F71-F432 AromaticContact CE2-CZ 3.98Å; F71-F432 HydrophobicContact CE2-CZ 3.98Å; F71-F432 HydrophobicContact CG-CE2 4.49Å; F71-F432 HydrophobicContact CG-CZ 4.45Å; F71-F432 HydrophobicContact CZ-CE2 4.42Å; F71-F432 AromaticContact CZ-CZ 4Å; F71-F432 HydrophobicContact CZ-CZ 4Å; F71-L434 HydrophobicContact CE2-CD2 4.21Å; F71-L434 HydrophobicContact CZ-CD2 3.86Å
72	L	98.9	Very high	97.2	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	110.5	164.4	-54.7	-174.3	0	0	0	108	L63 I65 T70 F74 L91 R93 V133 W171	L63-L72 HydrophobicContact CB-CB 4.41Å; L63-L72 HydrophobicContact CD2-CD1 4.4Å; L63-L72 PolarHBondContact N-O 3.43Å; L63-L72 PolarHBondContact O-N 3.2Å; I65-L72 HydrophobicContact CD1-CD1 3.75Å; I65-L72 HydrophobicContact CD1-CG 3.97Å; T70-L72 HydrophobicContact CG2-CD2 3.91Å; L72-F74 HydrophobicContact CB-CD2 4.32Å; L72-F74 HydrophobicContact CB-CE2 3.46Å; L72-F74 VanDerWaalsContact CB-CE2 3.46Å; L72-F74 HydrophobicContact CB-CZ 3.72Å; L72-F74 HydrophobicContact CD1-CE2 4.31Å; L72-F74 HydrophobicContact CD1-CZ 3.92Å; L72-F74 HydrophobicContact CG-CZ 4.46Å; L72-L91 HydrophobicContact CB-CD1 3.82Å; L72-L91 HydrophobicContact CD2-CD1 4.12Å; L72-L91 HydrophobicContact CG-CD1 4.49Å; L72-R93 HydrophobicContact CD2-CB 4.4Å; L72-R93 HydrophobicContact CD2-CG 3.79Å; L72-V133 HydrophobicContact CD1-CG1 4.17Å; L72-V133 HydrophobicContact CD1-CG2 4.29Å; L72-W171 HydrophobicContact CD1-CH2 4.5Å; L72-W171 HydrophobicContact CD1-CZ2 4.41Å
73	A	98.9	Very high	97	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	114.9	175.4	0	0	0	0	0	109.3	L46 F47 L62 L91 R92 W103 L418	L46-A73 HydrophobicContact CD1-CB 3.95Å; F47-A73 HydrophobicContact CE2-CB 4.29Å; L62-A73 HydrophobicContact CD1-CB 4.25Å; A73-L91 CarbonylContact O-C 3.49Å; A73-L91 WeakPolarHBondContact O-CA 3.38Å; A73-R92 PolarHBondContact N-O 2.79Å; A73-R92 PolarHBondContact O-N 2.79Å; A73-W103 HydrophobicContact CB-CH2 3.68Å; A73-W103 HydrophobicContact CB-CZ3 3.54Å; A73-L418 HydrophobicContact CB-CD1 4.12Å; A73-L418 HydrophobicContact CB-CD2 3.77Å
74	F	98.9	Very high	96.9	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	152.6	178.7	-53.6	-93.2	0	0	0	111.1	P60 A61 L72 V90 L91 L109 P122 P124 L135 W171	P60-F74 WeakPolarHBondContact CA-O 3.49Å; A61-F74 HydrophobicContact CB-CB 4.25Å; A61-F74 PolarHBondContact N-O 3.44Å; A61-F74 VanDerWaalsContact N-O 3.08Å; A61-F74 PolarHBondContact O-N 3Å; L72-F74 HydrophobicContact CB-CD2 4.32Å; L72-F74 HydrophobicContact CB-CE2 3.46Å; L72-F74 VanDerWaalsContact CB-CE2 3.46Å; L72-F74 HydrophobicContact CB-CZ 3.72Å; L72-F74 HydrophobicContact CD1-CE2 4.31Å; L72-F74 HydrophobicContact CD1-CZ 3.92Å; L72-F74 HydrophobicContact CG-CZ 4.46Å; F74-V90 VanDerWaalsContact CA-O 3.28Å; F74-V90 WeakPolarHBondContact CA-O 3.35Å; F74-L91 HydrophobicContact CD1-CB 4.21Å; F74-L91 HydrophobicContact CD1-CD1 3.97Å; F74-L91 HydrophobicContact CE1-CB 4.31Å; F74-L91 HydrophobicContact CE1-CD1 3.72Å; F74-L91 HydrophobicContact CE1-CD2 4.37Å; F74-L91 HydrophobicContact CE1-CG 4.35Å; F74-L91 HydrophobicContact CE2-CD1 4.42Å; F74-L91 HydrophobicContact CG-CD1 4.43Å; F74-L91 HydrophobicContact CZ-CD1 3.96Å; F74-L109 HydrophobicContact CD1-CD1 3.8Å; F74-L109 HydrophobicContact CE1-CD1 3.85Å; F74-P122 HydrophobicContact CB-CB 3.93Å; F74-P122 HydrophobicContact CB-CG 4.23Å; F74-P124 HydrophobicContact CD2-CB 4.32Å; F74-P124 HydrophobicContact CD2-CG 3.87Å; F74-P124 HydrophobicContact CE2-CB 3.74Å; F74-P124 HydrophobicContact CE2-CG 3.72Å; F74-P124 HydrophobicContact CZ-CB 4.34Å; F74-L135 HydrophobicContact CD1-CD1 3.94Å; F74-L135 HydrophobicContact CD1-CD2 3.8Å; F74-L135 HydrophobicContact CD2-CD1 4.24Å; F74-L135 HydrophobicContact CE1-CD1 3.92Å; F74-L135 HydrophobicContact CE1-CD2 3.62Å; F74-L135 HydrophobicContact CE1-CG 4.29Å; F74-L135 HydrophobicContact CE2-CD1 4.23Å; F74-L135 HydrophobicContact CG-CD1 4.09Å; F74-L135 HydrophobicContact CZ-CD1 4.07Å; F74-L135 HydrophobicContact CZ-CD2 4.41Å; F74-W171 AromaticContact CE1-CH2 3.95Å; F74-W171 HydrophobicContact CE1-CH2 3.95Å; F74-W171 AromaticContact CE1-CZ2 3.78Å; F74-W171 HydrophobicContact CE1-CZ2 3.78Å; F74-W171 AromaticContact CZ-CH2 3.78Å; F74-W171 HydrophobicContact CZ-CH2 3.78Å; F74-W171 AromaticContact CZ-CZ2 3.88Å; F74-W171 HydrophobicContact CZ-CZ2 3.88Å
75	A	98.9	Very high	96.8	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	158.9	169.1	0	0	0	0	0	110.5	F47 L89 V90 I430	F47-A75 HydrophobicContact CD1-CB 4.42Å; F47-A75 HydrophobicContact CD2-CB 4.33Å; F47-A75 HydrophobicContact CE1-CB 4.41Å; F47-A75 HydrophobicContact CE2-CB 4.3Å; F47-A75 HydrophobicContact CG-CB 4.39Å; F47-A75 HydrophobicContact CZ-CB 4.35Å; A75-L89 WeakPolarHBondContact O-CA 3.47Å; A75-V90 HydrophobicContact CB-CG2 4.04Å; A75-V90 PolarHBondContact N-O 2.82Å; A75-V90 WeakPolarHBondContact O-CG2 3.31Å; A75-V90 PolarHBondContact O-N 2.84Å; A75-I430 HydrophobicContact CB-CD1 3.6Å
76	E	98.8	Very high	96.8	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	133	161.6	-67.6	178.8	-162.9	0	0	110.3	Y57 R58 I59 R78 L89 M120 N121	Y57-E76 VanDerWaalsContact CA-O 3.31Å; Y57-E76 WeakPolarHBondContact CA-O 3.31Å; R58-E76 PolarHBondContact N-O 3.13Å; R58-E76 VanDerWaalsContact N-O 3.15Å; R58-E76 PolarHBondContact O-N 2.97Å; I59-E76 HydrophobicContact CB-CG 4.16Å; I59-E76 HydrophobicContact CG1-CG 4.31Å; I59-E76 WeakPolarHBondContact CG1-OE1 3.4Å; E76-R78 HydrophobicContact CB-CG 4.16Å; E76-R78 IonicContact OE1-NH2 2.67Å; E76-R78 IonicContact OE2-CZ 3.64Å; E76-R78 IonicContact OE2-NE 3.09Å; E76-R78 PolarHBondContact OE2-NE 3.34Å; E76-R78 IonicContact OE2-NH2 3.04Å; E76-R78 PolarHBondContact OE2-NH2 2.89Å; E76-L89 HydrophobicContact CG-CD2 3.94Å; E76-M120 VanDerWaalsContact OE1-CA 3.23Å; E76-M120 WeakPolarHBondContact OE1-CA 3.4Å; E76-M120 VanDerWaalsContact OE1-CB 3.28Å; E76-M120 WeakPolarHBondContact OE1-CB 3.45Å; E76-N121 PolarHBondContact OE1-N 3.21Å; E76-N121 PolarHBondContact OE1-OD1 2.9Å
77	K	98.6	Very high	96.9	Very high	48 Å²	48	38.1 Å²	38.1	21%	0.209	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	124.2	161.3	-172.5	-177.4	-173.8	-179.2	0	108.9	I55 Y57 L87 H88 V90	I55-K77 HydrophobicContact CG2-CD 4.29Å; I55-K77 HydrophobicContact CG2-CG 3.72Å; Y57-K77 HydrophobicContact CD1-CB 4.2Å; Y57-K77 HydrophobicContact CD1-CG 4.34Å; Y57-K77 HydrophobicContact CE1-CB 3.89Å; Y57-K77 HydrophobicContact CE1-CD 4.25Å; Y57-K77 HydrophobicContact CE1-CG 3.72Å; K77-L87 WeakPolarHBondContact O-CB 3.5Å; K77-L87 PolarHBondContact O-N 2.89Å; K77-H88 WeakPolarHBondContact CB-O 3.46Å; K77-H88 WeakPolarHBondContact CD-NE2 3.37Å; K77-H88 PolarHBondContact N-O 3.28Å; K77-V90 HydrophobicContact CB-CG1 3.88Å; K77-V90 HydrophobicContact CD-CG1 4.34Å
78	R	97.9	Very high	97	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	148.5	-178.9	-48.6	-178	165.2	-163	-7.4	110.9	I55 T56 E76 T80 S81 R82 D83 D85 A86	I55-R78 WeakPolarHBondContact CA-O 3.32Å; T56-R78 PolarHBondContact N-O 3.47Å; T56-R78 WeakPolarHBondContact O-CB 3.42Å; T56-R78 PolarHBondContact O-N 3.03Å; E76-R78 HydrophobicContact CB-CG 4.16Å; E76-R78 IonicContact OE1-NH2 2.67Å; E76-R78 IonicContact OE2-CZ 3.64Å; E76-R78 IonicContact OE2-NE 3.09Å; E76-R78 PolarHBondContact OE2-NE 3.34Å; E76-R78 IonicContact OE2-NH2 3.04Å; E76-R78 PolarHBondContact OE2-NH2 2.89Å; R78-T80 WeakPolarHBondContact CB-O 2.97Å; R78-S81 PolarHBondContact NH1-O 2.8Å; R78-R82 WeakPolarHBondContact CD-O 3.48Å; R78-R82 PolarHBondContact NH1-O 3.37Å; R78-D83 IonicContact CZ-OD1 3.79Å; R78-D83 IonicContact NH1-OD1 3.93Å; R78-D83 PolarHBondContact NH1-OD1 3.22Å; R78-D83 IonicContact NH2-OD1 2.73Å; R78-D83 PolarHBondContact NH2-OD1 2.94Å; R78-D85 CarbonylContact C-O 3.42Å; R78-D85 VanDerWaalsContact CA-O 3.27Å; R78-D85 WeakPolarHBondContact CA-O 3.46Å; R78-A86 HydrophobicContact CG-CB 4.18Å
79	S	96.5	Very high	97.2	Very high	47 Å²	47	32.2 Å²	32.2	33%	0.329	16%	0.164	S	C	.	.	S	Bend	trans	-75.6	-24	174	57.3	0	0	0	0	113.2	D85	S79-D85 PolarHBondContact N-O 2.75Å; S79-D85 WeakPolarHBondContact OG-CB 3.38Å; S79-D85 PolarHBondContact OG-O 2.98Å
80	T	95	Very high	97.3	Very high	43 Å²	43	27.9 Å²	27.9	26%	0.264	14%	0.144	S	C	.	.	S	Bend	trans	-140.4	-178.5	165.5	89.6	0	0	0	0	109.7	R78 R82 D85	R78-T80 WeakPolarHBondContact CB-O 2.97Å; T80-R82 PolarHBondContact O-N 3.29Å; T80-R82 WeakPolarHBondContact OG1-CG 3.29Å; T80-R82 PolarHBondContact OG1-N 3.4Å; T80-D85 WeakPolarHBondContact CB-OD2 3.25Å; T80-D85 VanDerWaalsContact CG2-OD2 3.29Å; T80-D85 WeakPolarHBondContact CG2-OD2 3.25Å; T80-D85 PolarHBondContact OG1-OD2 3.41Å
81	S	92.9	Very high	97.4	Very high	50 Å²	50	27.6 Å²	27.6	35%	0.35	14%	0.142	S	C	.	.	S	Bend	trans	-66.6	-13.2	176.1	60.4	0	0	0	0	115.2	R78	R78-S81 PolarHBondContact NH1-O 2.8Å
82	R	94.1	Very high	97.4	Very high	142 Å²	142	30.4 Å²	30.4	54%	0.536	15%	0.153	S	C	.	.	S	Bend	trans	-71.2	155.4	-176.6	-60.3	175	73	166.2	4.5	112.7	R78 T80 E84 D85	R78-R82 WeakPolarHBondContact CD-O 3.48Å; R78-R82 PolarHBondContact NH1-O 3.37Å; T80-R82 PolarHBondContact O-N 3.29Å; T80-R82 WeakPolarHBondContact OG1-CG 3.29Å; T80-R82 PolarHBondContact OG1-N 3.4Å; R82-E84 HydrophobicContact CB-CG 4.34Å; R82-E84 IonicContact CZ-OE1 3.71Å; R82-E84 IonicContact NE-OE1 3.92Å; R82-E84 PolarHBondContact NE-OE1 2.99Å; R82-E84 IonicContact NE-OE2 3.59Å; R82-E84 IonicContact NH2-OE1 3.86Å; R82-E84 PolarHBondContact NH2-OE1 3.41Å; R82-D85 HydrophobicContact CB-CB 4.27Å
83	D	95.1	Very high	97.4	Very high	76 Å²	76	34.5 Å²	34.5	41%	0.406	17%	0.168	S	C	.	.	G	3₁₀ helix	trans	-71.2	-42.1	-179.1	-66.6	-25.9	0	0	0	111.6	R78 D85 A86 R118 M120	R78-D83 IonicContact CZ-OD1 3.79Å; R78-D83 IonicContact NH1-OD1 3.93Å; R78-D83 PolarHBondContact NH1-OD1 3.22Å; R78-D83 IonicContact NH2-OD1 2.73Å; R78-D83 PolarHBondContact NH2-OD1 2.94Å; D83-D85 PolarHBondContact O-N 3.08Å; D83-D85 VanDerWaalsContact O-N 3.11Å; D83-A86 WeakPolarHBondContact O-CB 3.46Å; D83-A86 PolarHBondContact O-N 3.28Å; D83-A86 VanDerWaalsContact O-N 3.14Å; D83-R118 PolarHBondContact O-NH1 2.88Å; D83-M120 HydrophobicContact CB-CE 3.8Å
84	E	95.4	Very high	97.3	Very high	39 Å²	39	34.5 Å²	34.5	18%	0.182	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-65.5	-8.9	178.8	60	-96.2	-125.6	0	0	115.1	R82 H143 T145	R82-E84 HydrophobicContact CB-CG 4.34Å; R82-E84 IonicContact CZ-OE1 3.71Å; R82-E84 IonicContact NE-OE1 3.92Å; R82-E84 PolarHBondContact NE-OE1 2.99Å; R82-E84 IonicContact NE-OE2 3.59Å; R82-E84 IonicContact NH2-OE1 3.86Å; R82-E84 PolarHBondContact NH2-OE1 3.41Å; E84-H143 PolarHBondContact O-ND1 2.9Å; E84-T145 HydrophobicContact CB-CG2 4.47Å
85	D	95.8	Very high	97.3	Very high	29 Å²	29	38.3 Å²	38.3	16%	0.155	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-101.8	5.9	179.4	-70.2	-19.9	0	0	0	112.3	R78 S79 T80 R82 D83	R78-D85 CarbonylContact C-O 3.42Å; R78-D85 VanDerWaalsContact CA-O 3.27Å; R78-D85 WeakPolarHBondContact CA-O 3.46Å; S79-D85 PolarHBondContact N-O 2.75Å; S79-D85 WeakPolarHBondContact OG-CB 3.38Å; S79-D85 PolarHBondContact OG-O 2.98Å; T80-D85 WeakPolarHBondContact CB-OD2 3.25Å; T80-D85 VanDerWaalsContact CG2-OD2 3.29Å; T80-D85 WeakPolarHBondContact CG2-OD2 3.25Å; T80-D85 PolarHBondContact OG1-OD2 3.41Å; R82-D85 HydrophobicContact CB-CB 4.27Å; D83-D85 PolarHBondContact O-N 3.08Å; D83-D85 VanDerWaalsContact O-N 3.11Å
86	A	97.5	Very high	97.1	Very high	5 Å²	5	39.3 Å²	39.3	4%	0.041	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	142.7	169.3	0	0	0	0	0	111.9	R78 D83 R118 M120	R78-A86 HydrophobicContact CG-CB 4.18Å; D83-A86 WeakPolarHBondContact O-CB 3.46Å; D83-A86 PolarHBondContact O-N 3.28Å; D83-A86 VanDerWaalsContact O-N 3.14Å; A86-R118 HydrophobicContact CB-CB 4.41Å; A86-R118 WeakPolarHBondContact O-CB 3.31Å; A86-M120 HydrophobicContact CB-CE 4.47Å; A86-M120 HydrophobicContact CB-CG 3.66Å; A86-M120 HydrophobicContact CB-SD 4.24Å
87	L	97.8	Very high	96.8	Very high	71 Å²	71	44 Å²	44	37%	0.372	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	-69.3	-176.3	-55	175.9	0	0	0	110.2	K77 T119	K77-L87 WeakPolarHBondContact O-CB 3.5Å; K77-L87 PolarHBondContact O-N 2.89Å; L87-T119 PolarHBondContact O-N 2.83Å
88	H	98.6	Very high	96.4	Very high	28 Å²	28	43.5 Å²	43.5	13%	0.13	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	167.2	-177.4	50.4	-106.5	0	0	0	110.2	K77 M110 T113	K77-H88 WeakPolarHBondContact CB-O 3.46Å; K77-H88 WeakPolarHBondContact CD-NE2 3.37Å; K77-H88 PolarHBondContact N-O 3.28Å; H88-M110 HydrophobicContact CB-SD 4.38Å; H88-T113 HydrophobicContact CB-CG2 3.92Å
89	L	98.8	Very high	96	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	150.4	173.5	-57.1	178.7	0	0	0	111	A75 E76 L109 A112 T119 P122 L135 F137	A75-L89 WeakPolarHBondContact O-CA 3.47Å; E76-L89 HydrophobicContact CG-CD2 3.94Å; L89-L109 HydrophobicContact CB-CB 4.33Å; L89-L109 HydrophobicContact CB-CD1 4.19Å; L89-L109 PolarHBondContact O-N 2.97Å; L89-A112 HydrophobicContact CD1-CB 4.31Å; L89-T119 HydrophobicContact CD1-CG2 3.99Å; L89-T119 HydrophobicContact CD2-CG2 4.4Å; L89-T119 HydrophobicContact CG-CG2 3.77Å; L89-P122 HydrophobicContact CD1-CB 4.19Å; L89-P122 HydrophobicContact CD2-CB 4.21Å; L89-P122 HydrophobicContact CD2-CG 4.19Å; L89-L135 HydrophobicContact CD1-CD2 3.93Å; L89-L135 HydrophobicContact CD1-CG 4.46Å; L89-F137 HydrophobicContact CD1-CB 3.87Å; L89-F137 HydrophobicContact CD1-CD1 4.06Å; L89-F137 HydrophobicContact CD1-CG 4.04Å
90	V	98.9	Very high	95.8	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	150.1	171.7	-67.8	0	0	0	0	110	F47 Y57 F74 A75 K77 L106 K107	F47-V90 HydrophobicContact CD1-CG2 3.95Å; F47-V90 HydrophobicContact CE1-CB 4.34Å; F47-V90 HydrophobicContact CE1-CG2 3.57Å; F47-V90 HydrophobicContact CZ-CG2 4.44Å; Y57-V90 HydrophobicContact CD1-CG2 3.75Å; Y57-V90 HydrophobicContact CE1-CG1 4.28Å; Y57-V90 HydrophobicContact CE1-CG2 3.79Å; F74-V90 VanDerWaalsContact CA-O 3.28Å; F74-V90 WeakPolarHBondContact CA-O 3.35Å; A75-V90 HydrophobicContact CB-CG2 4.04Å; A75-V90 PolarHBondContact N-O 2.82Å; A75-V90 WeakPolarHBondContact O-CG2 3.31Å; A75-V90 PolarHBondContact O-N 2.84Å; K77-V90 HydrophobicContact CB-CG1 3.88Å; K77-V90 HydrophobicContact CD-CG1 4.34Å; V90-L106 HydrophobicContact CB-CD1 4.41Å; V90-L106 HydrophobicContact CB-CD2 4.13Å; V90-L106 HydrophobicContact CB-CG 4.17Å; V90-L106 HydrophobicContact CG1-CD2 3.85Å; V90-L106 HydrophobicContact CG1-CG 4.41Å; V90-L106 HydrophobicContact CG2-CD1 4.41Å; V90-K107 WeakPolarHBondContact CA-O 3.27Å
91	L	98.8	Very high	95.8	Very high	1 Å²	1	49 Å²	49	1%	0.005	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	141.8	179.1	169.7	63.4	0	0	0	110.1	L72 A73 F74 R93 K107 L109 G168 W171	L72-L91 HydrophobicContact CB-CD1 3.82Å; L72-L91 HydrophobicContact CD2-CD1 4.12Å; L72-L91 HydrophobicContact CG-CD1 4.49Å; A73-L91 CarbonylContact O-C 3.49Å; A73-L91 WeakPolarHBondContact O-CA 3.38Å; F74-L91 HydrophobicContact CD1-CB 4.21Å; F74-L91 HydrophobicContact CD1-CD1 3.97Å; F74-L91 HydrophobicContact CE1-CB 4.31Å; F74-L91 HydrophobicContact CE1-CD1 3.72Å; F74-L91 HydrophobicContact CE1-CD2 4.37Å; F74-L91 HydrophobicContact CE1-CG 4.35Å; F74-L91 HydrophobicContact CE2-CD1 4.42Å; F74-L91 HydrophobicContact CG-CD1 4.43Å; F74-L91 HydrophobicContact CZ-CD1 3.96Å; L91-R93 HydrophobicContact CD1-CG 4.39Å; L91-R93 HydrophobicContact CD2-CG 4Å; L91-R93 HydrophobicContact CG-CG 4.14Å; L91-K107 PolarHBondContact N-O 2.88Å; L91-K107 PolarHBondContact O-N 2.9Å; L91-L109 HydrophobicContact CB-CD1 4.09Å; L91-L109 HydrophobicContact CB-CD2 4.06Å; L91-L109 HydrophobicContact CB-CG 4.11Å; L91-L109 HydrophobicContact CD2-CD2 4.28Å; L91-G168 WeakPolarHBondContact CD2-O 3.44Å; L91-W171 HydrophobicContact CD2-CZ2 4.07Å
92	R	98.8	Very high	96	Very high	60 Å²	60	53.3 Å²	53.3	23%	0.226	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	137.3	151.5	-73.1	-174.2	-177.9	-93.7	11.9	109.7	L46 F47 A73 W103 G104 L106	L46-R92 PolarHBondContact O-NE 3.26Å; L46-R92 PolarHBondContact O-NH2 3.24Å; L46-R92 VanDerWaalsContact O-NH2 3.08Å; F47-R92 HydrophobicContact CE1-CG 4.09Å; F47-R92 HydrophobicContact CZ-CB 4.24Å; F47-R92 HydrophobicContact CZ-CG 3.95Å; A73-R92 PolarHBondContact N-O 2.79Å; A73-R92 PolarHBondContact O-N 2.79Å; R92-W103 HydrophobicContact CB-CE3 3.85Å; R92-W103 HydrophobicContact CB-CZ3 4.28Å; R92-G104 PolarHBondContact NH1-O 2.89Å; R92-L106 HydrophobicContact CG-CB 4.32Å
93	R	98.6	Very high	96.2	Very high	85 Å²	85	48.6 Å²	48.6	32%	0.321	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	133.6	171.7	-58.3	177.5	65.3	-116.4	-3.7	108.4	F71 L72 L91 G104 A167 G168 C169	F71-R93 CarbonylContact O-C 3.56Å; F71-R93 WeakPolarHBondContact O-CA 3.41Å; L72-R93 HydrophobicContact CD2-CB 4.4Å; L72-R93 HydrophobicContact CD2-CG 3.79Å; L91-R93 HydrophobicContact CD1-CG 4.39Å; L91-R93 HydrophobicContact CD2-CG 4Å; L91-R93 HydrophobicContact CG-CG 4.14Å; R93-G104 PolarHBondContact O-N 3.45Å; R93-A167 PolarHBondContact NE-O 3.2Å; R93-A167 PolarHBondContact NH2-O 3.22Å; R93-G168 WeakPolarHBondContact CD-O 3.45Å; R93-C169 PolarHBondContact NH1-SG 3.12Å; R93-C169 VanDerWaalsContact NH1-SG 3.42Å; R93-C169 PolarHBondContact NH2-SG 3.24Å
94	G	98.1	Very high	96.4	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	115.1	-179.9	0	0	0	0	0	111	T70 F71 Q102 W103	T70-G94 CarbonylContact C-O 3.6Å; T70-G94 WeakPolarHBondContact CA-O 3.3Å; F71-G94 PolarHBondContact N-O 2.86Å; F71-G94 PolarHBondContact O-N 3.39Å; G94-Q102 WeakPolarHBondContact CA-O 3.32Å; G94-W103 VanDerWaalsContact CA-CE3 3.45Å
95	L	97.8	Very high	96.5	Very high	81 Å²	81	49.6 Å²	49.6	42%	0.424	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	120.3	173.6	-179.4	63.5	0	0	0	108.8	H69 I97 V101 Q102	H69-L95 HydrophobicContact CB-CD1 4.49Å; L95-I97 HydrophobicContact CG-CG1 4.35Å; L95-V101 WeakPolarHBondContact O-CA 3.34Å; L95-Q102 PolarHBondContact N-O 3.34Å; L95-Q102 PolarHBondContact O-N 2.85Å
96	R	94.9	Very high	96.6	Very high	20 Å²	20	50.7 Å²	50.7	8%	0.075	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	131.8	174.7	-170.8	-178.1	64.8	83.2	1.7	110	Y64 H69 F71 G98 L100 V101 E412	Y64-R96 HydrophobicContact CE2-CB 4.39Å; Y64-R96 PolarHBondContact OH-NE 3.46Å; Y64-R96 PolarHBondContact OH-NH2 3.44Å; Y64-R96 VanDerWaalsContact OH-NH2 3.15Å; H69-R96 HydrophobicContact CB-CB 4.42Å; H69-R96 PolarHBondContact ND1-NH2 2.98Å; H69-R96 VanDerWaalsContact ND1-NH2 3.14Å; H69-R96 WeakPolarHBondContact O-CB 3.37Å; H69-R96 PolarHBondContact O-N 2.91Å; F71-R96 HydrophobicContact CD2-CB 4.38Å; F71-R96 HydrophobicContact CE2-CB 4.08Å; F71-R96 HydrophobicContact CE2-CG 4.28Å; R96-G98 WeakPolarHBondContact CD-O 3.4Å; R96-G98 VanDerWaalsContact CG-O 3.26Å; R96-G98 WeakPolarHBondContact CG-O 3.21Å; R96-G98 PolarHBondContact NH1-O 2.96Å; R96-L100 CarbonylContact C-O 3.6Å; R96-L100 WeakPolarHBondContact CA-O 3.29Å; R96-V101 HydrophobicContact CB-CG2 4.35Å; R96-V101 HydrophobicContact CG-CG2 4.29Å; R96-E412 IonicContact CZ-OE1 3.42Å; R96-E412 VanDerWaalsContact CZ-OE1 3.27Å; R96-E412 IonicContact CZ-OE2 2.84Å; R96-E412 IonicContact NE-OE1 3.39Å; R96-E412 IonicContact NH1-OE1 3.53Å; R96-E412 IonicContact NH1-OE2 3.83Å; R96-E412 PolarHBondContact NH1-OE2 3.29Å; R96-E412 IonicContact NH2-OE1 2.85Å; R96-E412 PolarHBondContact NH2-OE1 2.92Å; R96-E412 IonicContact NH2-OE2 3.71Å; R96-E412 PolarHBondContact NH2-OE2 3.19Å
97	I	93.3	Very high	96.6	Very high	99 Å²	99	53.7 Å²	53.7	51%	0.508	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	95.1	174.6	-55	177	0	0	0	106.1	L95 H99 L100	L95-I97 HydrophobicContact CG-CG1 4.35Å; I97-H99 PolarHBondContact O-N 3.13Å; I97-L100 PolarHBondContact N-O 3.23Å; I97-L100 PolarHBondContact O-N 2.79Å; I97-L100 VanDerWaalsContact O-N 3.11Å
98	G	89.6	Confident	96.7	Very high	38 Å²	38	53 Å²	53	39%	0.392	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.3	-118.3	-171	0	0	0	0	0	111.9	R96	R96-G98 WeakPolarHBondContact CD-O 3.4Å; R96-G98 VanDerWaalsContact CG-O 3.26Å; R96-G98 WeakPolarHBondContact CG-O 3.21Å; R96-G98 PolarHBondContact NH1-O 2.96Å
99	H	90.1	Very high	96.7	Very high	81 Å²	81	51.6 Å²	51.6	38%	0.375	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	7.4	-178.8	-71.2	-121.8	0	0	0	113.6	C40 I97 L434	C40-H99 PolarHBondContact SG-ND1 2.78Å; I97-H99 PolarHBondContact O-N 3.13Å; H99-L434 VanDerWaalsContact O-CD1 3.25Å; H99-L434 WeakPolarHBondContact O-CD1 3.44Å
100	L	92	Very high	96.7	Very high	100 Å²	100	56.4 Å²	56.4	52%	0.524	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	155.4	178.6	-67.5	171.9	0	0	0	111.2	T39 R96 I97	T39-L100 HydrophobicContact CG2-CD2 4.4Å; R96-L100 CarbonylContact C-O 3.6Å; R96-L100 WeakPolarHBondContact CA-O 3.29Å; I97-L100 PolarHBondContact N-O 3.23Å; I97-L100 PolarHBondContact O-N 2.79Å; I97-L100 VanDerWaalsContact O-N 3.11Å
101	V	96	Very high	96.6	Very high	25 Å²	25	59.4 Å²	59.4	15%	0.152	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	118.1	172.5	-173.8	0	0	0	0	110.3	F71 L95 R96 W103 F432 L434	F71-V101 HydrophobicContact CD2-CG1 3.97Å; F71-V101 HydrophobicContact CD2-CG2 3.78Å; F71-V101 HydrophobicContact CE2-CG2 3.64Å; L95-V101 WeakPolarHBondContact O-CA 3.34Å; R96-V101 HydrophobicContact CB-CG2 4.35Å; R96-V101 HydrophobicContact CG-CG2 4.29Å; V101-W103 HydrophobicContact CB-CZ2 4.35Å; V101-W103 HydrophobicContact CG1-CD2 4.01Å; V101-W103 VanDerWaalsContact CG1-CE2 3.46Å; V101-W103 HydrophobicContact CG1-CG 4.38Å; V101-W103 HydrophobicContact CG1-CH2 4.38Å; V101-W103 HydrophobicContact CG1-CZ2 3.68Å; V101-W103 VanDerWaalsContact O-CD1 3.28Å; V101-W103 PolarHBondContact O-N 3.04Å; V101-F432 HydrophobicContact CB-CE1 4.07Å; V101-F432 HydrophobicContact CG2-CE1 3.6Å; V101-F432 HydrophobicContact CG2-CZ 3.9Å; V101-L434 HydrophobicContact CG2-CD1 3.78Å; V101-L434 HydrophobicContact CG2-CG 4.31Å
102	Q	96.9	Very high	96.6	Very high	139 Å²	139	59.4 Å²	59.4	65%	0.65	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.8	103	175.2	-176.8	175.4	-22.2	0	0	109.8	G94 L95	G94-Q102 WeakPolarHBondContact CA-O 3.32Å; L95-Q102 PolarHBondContact N-O 3.34Å; L95-Q102 PolarHBondContact O-N 2.85Å
103	W	98.1	Very high	96.6	Very high	43 Å²	43	58.5 Å²	58.5	16%	0.163	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	126.9	-178.6	-66.1	95.6	0	0	0	112.7	L46 F71 A73 R92 G94 V101 F432	L46-W103 HydrophobicContact CD1-CD2 3.74Å; L46-W103 HydrophobicContact CD1-CE3 3.92Å; L46-W103 HydrophobicContact CD1-CG 4.47Å; L46-W103 HydrophobicContact CD1-CH2 3.77Å; L46-W103 HydrophobicContact CD1-CZ2 3.6Å; L46-W103 HydrophobicContact CD1-CZ3 3.93Å; L46-W103 HydrophobicContact CD2-CB 4.41Å; L46-W103 HydrophobicContact CD2-CD2 3.81Å; L46-W103 HydrophobicContact CD2-CG 3.65Å; L46-W103 HydrophobicContact CG-CD2 4.46Å; F71-W103 HydrophobicContact CB-CH2 3.55Å; F71-W103 HydrophobicContact CB-CZ2 4.28Å; F71-W103 HydrophobicContact CB-CZ3 4.11Å; F71-W103 HydrophobicContact CG-CH2 4.32Å; A73-W103 HydrophobicContact CB-CH2 3.68Å; A73-W103 HydrophobicContact CB-CZ3 3.54Å; R92-W103 HydrophobicContact CB-CE3 3.85Å; R92-W103 HydrophobicContact CB-CZ3 4.28Å; G94-W103 VanDerWaalsContact CA-CE3 3.45Å; V101-W103 HydrophobicContact CB-CZ2 4.35Å; V101-W103 HydrophobicContact CG1-CD2 4.01Å; V101-W103 VanDerWaalsContact CG1-CE2 3.46Å; V101-W103 HydrophobicContact CG1-CG 4.38Å; V101-W103 HydrophobicContact CG1-CH2 4.38Å; V101-W103 HydrophobicContact CG1-CZ2 3.68Å; V101-W103 VanDerWaalsContact O-CD1 3.28Å; V101-W103 PolarHBondContact O-N 3.04Å; W103-F432 HydrophobicContact CH2-CD2 4.36Å; W103-F432 HydrophobicContact CH2-CE2 4.49Å; W103-F432 HydrophobicContact CZ2-CB 4.23Å; W103-F432 AromaticContact CZ2-CD1 3.68Å; W103-F432 HydrophobicContact CZ2-CD1 3.68Å; W103-F432 AromaticContact CZ2-CD2 3.77Å; W103-F432 HydrophobicContact CZ2-CD2 3.77Å; W103-F432 AromaticContact CZ2-CE1 3.87Å; W103-F432 HydrophobicContact CZ2-CE1 3.87Å; W103-F432 AromaticContact CZ2-CE2 3.96Å; W103-F432 HydrophobicContact CZ2-CE2 3.96Å; W103-F432 AromaticContact CZ2-CG 3.62Å; W103-F432 HydrophobicContact CZ2-CG 3.62Å; W103-F432 AromaticContact CZ2-CZ 4Å; W103-F432 HydrophobicContact CZ2-CZ 4Å; W103-F432 AromaticContact NE1-CD1 3.79Å
104	G	97.8	Very high	96.6	Very high	25 Å²	25	56 Å²	56	26%	0.258	30%	0.304	S	S	.	.			trans	-74	179.3	171.1	0	0	0	0	0	113.8	R92 R93	R92-G104 PolarHBondContact NH1-O 2.89Å; R93-G104 PolarHBondContact O-N 3.45Å
105	P	97.9	Very high	96.5	Very high	112 Å²	112	61.8 Å²	61.8	73%	0.727	34%	0.342	S	S	*	.			trans	-62.6	158.1	177.9	28.4	-35.6	0	0	0	112.1	K107	P105-K107 PolarHBondContact O-N 2.66Å
106	L	98.4	Very high	96.5	Very high	52 Å²	52	61 Å²	61	27%	0.272	35%	0.353	S	S	.	.			trans	-72.6	124.8	172.4	-178.9	153.3	0	0	0	109.5	F47 Y57 V90 R92	F47-L106 HydrophobicContact CD1-CD1 3.66Å; F47-L106 HydrophobicContact CE1-CD1 3.79Å; F47-L106 HydrophobicContact CE1-CG 4.31Å; Y57-L106 HydrophobicContact CE1-CD1 3.94Å; V90-L106 HydrophobicContact CB-CD1 4.41Å; V90-L106 HydrophobicContact CB-CD2 4.13Å; V90-L106 HydrophobicContact CB-CG 4.17Å; V90-L106 HydrophobicContact CG1-CD2 3.85Å; V90-L106 HydrophobicContact CG1-CG 4.41Å; V90-L106 HydrophobicContact CG2-CD1 4.41Å; R92-L106 HydrophobicContact CG-CB 4.32Å
107	K	98.5	Very high	96.7	Very high	67 Å²	67	62.3 Å²	62.3	29%	0.291	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	120.8	175.8	-179.5	178.4	176.2	-172.3	0	109.8	V90 L91 P105 E111 C169	V90-K107 WeakPolarHBondContact CA-O 3.27Å; L91-K107 PolarHBondContact N-O 2.88Å; L91-K107 PolarHBondContact O-N 2.9Å; P105-K107 PolarHBondContact O-N 2.66Å; K107-E111 IonicContact NZ-OE1 3.44Å; K107-C169 PolarHBondContact NZ-O 2.92Å
108	P	98.6	Very high	96.9	Very high	56 Å²	56	58.4 Å²	58.4	36%	0.364	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	136.4	164.1	-18.6	32.6	0	0	0	110.7	M110	P108-M110 HydrophobicContact CB-CG 4.35Å; P108-M110 HydrophobicContact CB-SD 4.35Å
109	L	98.6	Very high	97.3	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	79.4	173.6	-59.8	179.5	0	0	0	108.6	F74 L89 L91 E111 A112 L135 I162 W171	F74-L109 HydrophobicContact CD1-CD1 3.8Å; F74-L109 HydrophobicContact CE1-CD1 3.85Å; L89-L109 HydrophobicContact CB-CB 4.33Å; L89-L109 HydrophobicContact CB-CD1 4.19Å; L89-L109 PolarHBondContact O-N 2.97Å; L91-L109 HydrophobicContact CB-CD1 4.09Å; L91-L109 HydrophobicContact CB-CD2 4.06Å; L91-L109 HydrophobicContact CB-CG 4.11Å; L91-L109 HydrophobicContact CD2-CD2 4.28Å; L109-E111 WeakPolarHBondContact CA-OE2 3.38Å; L109-A112 HydrophobicContact CB-CB 4.11Å; L109-A112 PolarHBondContact O-N 3.37Å; L109-L135 HydrophobicContact CD1-CD2 3.61Å; L109-I162 HydrophobicContact CD1-CD1 4.46Å; L109-W171 HydrophobicContact CD2-CG 4.42Å
110	M	98.4	Very high	97.7	Very high	100 Å²	100	53.3 Å²	53.3	49%	0.493	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-73.3	-23.8	178.6	-63.6	-53.1	-52.3	0	0	111.7	H88 P108 A112 T113	H88-M110 HydrophobicContact CB-SD 4.38Å; P108-M110 HydrophobicContact CB-CG 4.35Å; P108-M110 HydrophobicContact CB-SD 4.35Å; M110-A112 PolarHBondContact O-N 3.26Å; M110-T113 HydrophobicContact CE-CG2 4.24Å; M110-T113 PolarHBondContact O-N 2.87Å; M110-T113 PolarHBondContact O-OG1 2.76Å
111	E	98.4	Very high	98	Very high	64 Å²	64	49 Å²	49	30%	0.299	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-58.5	-31.4	170.7	-54.1	90.6	151.5	0	0	111.3	K107 L109 T113 I162 W171 V174	K107-E111 IonicContact NZ-OE1 3.44Å; L109-E111 WeakPolarHBondContact CA-OE2 3.38Å; E111-T113 VanDerWaalsContact C-N 3.26Å; E111-T113 PolarHBondContact O-N 3.29Å; E111-I162 HydrophobicContact CB-CD1 4.42Å; E111-I162 HydrophobicContact CB-CG2 4.42Å; E111-I162 WeakPolarHBondContact O-CG2 3.2Å; E111-W171 HydrophobicContact CB-CB 4.32Å; E111-W171 HydrophobicContact CG-CB 4.35Å; E111-V174 WeakPolarHBondContact O-CB 3.49Å
112	A	98.4	Very high	98.1	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-84.4	42.2	175.9	0	0	0	0	0	113	L89 L109 M110 T119 F137 I162	L89-A112 HydrophobicContact CD1-CB 4.31Å; L109-A112 HydrophobicContact CB-CB 4.11Å; L109-A112 PolarHBondContact O-N 3.37Å; M110-A112 PolarHBondContact O-N 3.26Å; A112-T119 WeakPolarHBondContact O-CG2 3.45Å; A112-T119 PolarHBondContact O-OG1 3.46Å; A112-F137 HydrophobicContact CB-CD1 4.28Å; A112-F137 HydrophobicContact CB-CE1 3.68Å; A112-F137 HydrophobicContact CB-CE2 4.24Å; A112-F137 HydrophobicContact CB-CZ 3.64Å; A112-I162 HydrophobicContact CB-CD1 3.75Å; A112-I162 HydrophobicContact CB-CG1 4.27Å; A112-I162 HydrophobicContact CB-CG2 4.47Å
113	T	98.2	Very high	98.2	Very high	41 Å²	41	41.1 Å²	41.1	25%	0.252	24%	0.244	S	C	.	.			trans	-135.1	147.9	-178.7	68	0	0	0	0	113.2	H88 M110 E111 V174	H88-T113 HydrophobicContact CB-CG2 3.92Å; M110-T113 HydrophobicContact CE-CG2 4.24Å; M110-T113 PolarHBondContact O-N 2.87Å; M110-T113 PolarHBondContact O-OG1 2.76Å; E111-T113 VanDerWaalsContact C-N 3.26Å; E111-T113 PolarHBondContact O-N 3.29Å; T113-V174 WeakPolarHBondContact O-CG1 3.22Å
114	L	98.1	Very high	98.2	Very high	32 Å²	32	39.1 Å²	39.1	17%	0.168	24%	0.237	C	C	.	.			trans	-112.4	140.7	168.8	-70.6	179.9	0	0	0	110.5	G116 H117 C139 R158 V174	L114-G116 PolarHBondContact O-N 2.88Å; L114-H117 HydrophobicContact CB-CB 4.04Å; L114-H117 WeakPolarHBondContact O-CB 3.4Å; L114-H117 PolarHBondContact O-N 3.02Å; L114-C139 HydrophobicContact CB-CB 4.27Å; L114-C139 HydrophobicContact CD1-CB 3.8Å; L114-C139 HydrophobicContact CG-CB 4.18Å; L114-R158 HydrophobicContact CD1-CB 4.11Å; L114-R158 HydrophobicContact CD1-CG 4.16Å; L114-V174 HydrophobicContact CD2-CG1 3.78Å; L114-V174 HydrophobicContact CD2-CG2 4.36Å
115	P	97.2	Very high	98.3	Very high	122 Å²	122	38 Å²	38	79%	0.792	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53	127.4	178.3	-28.2	35.5	0	0	0	112.6	H117	P115-H117 VanDerWaalsContact C-N 3.28Å; P115-H117 PolarHBondContact O-N 2.72Å; P115-H117 PolarHBondContact O-ND1 3.03Å
116	G	97.1	Very high	98.3	Very high	64 Å²	64	34.5 Å²	34.5	66%	0.66	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.8	17.2	-179.1	0	0	0	0	0	115.3	L114 G142	L114-G116 PolarHBondContact O-N 2.88Å; G116-G142 PolarHBondContact O-N 3.31Å
117	H	98.4	Very high	98.3	Very high	48 Å²	48	32 Å²	32	22%	0.222	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	151.9	175.2	-60.8	67.7	0	0	0	111.3	L114 P115 C139 V140 R141	L114-H117 HydrophobicContact CB-CB 4.04Å; L114-H117 WeakPolarHBondContact O-CB 3.4Å; L114-H117 PolarHBondContact O-N 3.02Å; P115-H117 VanDerWaalsContact C-N 3.28Å; P115-H117 PolarHBondContact O-N 2.72Å; P115-H117 PolarHBondContact O-ND1 3.03Å; H117-C139 HydrophobicContact CB-CB 3.91Å; H117-V140 CarbonylContact C-O 3.53Å; H117-V140 WeakPolarHBondContact CA-O 3.14Å; H117-V140 WeakPolarHBondContact CB-O 3.17Å; H117-R141 VanDerWaalsContact CD2-CA 3.43Å; H117-R141 WeakPolarHBondContact CD2-CA 3.07Å; H117-R141 PolarHBondContact CD2-N 3.12Å; H117-R141 VanDerWaalsContact CD2-N 3.33Å
118	R	97.8	Very high	98.2	Very high	17 Å²	17	34.8 Å²	34.8	6%	0.064	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	143.2	165.7	55.1	-179.4	172.4	113.2	11.8	110.1	D83 A86 M120 C139 V140 G142 V144	D83-R118 PolarHBondContact O-NH1 2.88Å; A86-R118 HydrophobicContact CB-CB 4.41Å; A86-R118 WeakPolarHBondContact O-CB 3.31Å; R118-M120 PolarHBondContact NH1-SD 3.32Å; R118-C139 CarbonylContact O-C 3.52Å; R118-C139 WeakPolarHBondContact O-CA 3.3Å; R118-V140 HydrophobicContact CG-CB 4.06Å; R118-V140 WeakPolarHBondContact CG-O 3.14Å; R118-V140 PolarHBondContact N-O 3.16Å; R118-V140 PolarHBondContact O-N 2.83Å; R118-G142 PolarHBondContact NE-O 2.81Å; R118-V144 PolarHBondContact NH2-O 3.03Å
119	T	98.4	Very high	98	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	133.8	-177.2	-43.1	0	0	0	0	111.2	L87 L89 A112 F137 I138	L87-T119 PolarHBondContact O-N 2.83Å; L89-T119 HydrophobicContact CD1-CG2 3.99Å; L89-T119 HydrophobicContact CD2-CG2 4.4Å; L89-T119 HydrophobicContact CG-CG2 3.77Å; A112-T119 WeakPolarHBondContact O-CG2 3.45Å; A112-T119 PolarHBondContact O-OG1 3.46Å; T119-F137 HydrophobicContact CG2-CB 4.17Å; T119-F137 HydrophobicContact CG2-CD2 3.3Å; T119-F137 HydrophobicContact CG2-CE2 3.77Å; T119-F137 HydrophobicContact CG2-CG 3.85Å; T119-I138 WeakPolarHBondContact CA-O 3.24Å
120	M	98.1	Very high	97.9	Very high	12 Å²	12	43.8 Å²	43.8	6%	0.059	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	166	-170.8	-66	-171.4	78.7	0	0	113.9	E76 D83 A86 R118 F137 I138	E76-M120 VanDerWaalsContact OE1-CA 3.23Å; E76-M120 WeakPolarHBondContact OE1-CA 3.4Å; E76-M120 VanDerWaalsContact OE1-CB 3.28Å; E76-M120 WeakPolarHBondContact OE1-CB 3.45Å; D83-M120 HydrophobicContact CB-CE 3.8Å; A86-M120 HydrophobicContact CB-CE 4.47Å; A86-M120 HydrophobicContact CB-CG 3.66Å; A86-M120 HydrophobicContact CB-SD 4.24Å; R118-M120 PolarHBondContact NH1-SD 3.32Å; M120-F137 WeakPolarHBondContact O-CB 3.36Å; M120-I138 HydrophobicContact CB-CD1 4.43Å; M120-I138 HydrophobicContact CB-CG1 3.91Å; M120-I138 PolarHBondContact N-O 2.8Å; M120-I138 PolarHBondContact O-N 2.94Å
121	N	98.4	Very high	97.8	Very high	9 Å²	9	40.3 Å²	40.3	5%	0.048	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	50.4	70.2	174.8	-70.7	15.1	0	0	0	113.6	E76 C123 F137 A193 V194 P196	E76-N121 PolarHBondContact OE1-N 3.21Å; E76-N121 PolarHBondContact OE1-OD1 2.9Å; N121-C123 PolarHBondContact O-N 3.29Å; N121-F137 WeakPolarHBondContact O-CA 3.48Å; N121-A193 WeakPolarHBondContact ND2-CB 3.19Å; N121-V194 WeakPolarHBondContact CB-O 3.43Å; N121-V194 PolarHBondContact ND2-O 3.43Å; N121-V194 WeakPolarHBondContact O-CG2 3.35Å; N121-P196 HydrophobicContact CB-CB 4.11Å
122	P	98.8	Very high	97.8	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	138.2	171.1	27	-34	0	0	0	111	I59 A61 F74 L89 L135 F136 G197	I59-P122 WeakPolarHBondContact O-CG 3.41Å; A61-P122 HydrophobicContact CB-CB 3.87Å; A61-P122 HydrophobicContact CB-CG 3.8Å; F74-P122 HydrophobicContact CB-CB 3.93Å; F74-P122 HydrophobicContact CB-CG 4.23Å; L89-P122 HydrophobicContact CD1-CB 4.19Å; L89-P122 HydrophobicContact CD2-CB 4.21Å; L89-P122 HydrophobicContact CD2-CG 4.19Å; P122-L135 HydrophobicContact CB-CD1 4Å; P122-F136 CarbonylContact C-O 3.54Å; P122-G197 PolarHBondContact O-N 3.35Å
123	C	98.9	Very high	97.8	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	80.9	178.2	-165.3	0	0	0	0	109.8	N121 F136 V194 G197 H198 I209	N121-C123 PolarHBondContact O-N 3.29Å; C123-F136 HydrophobicContact CB-CB 4.23Å; C123-F136 PolarHBondContact N-O 3.49Å; C123-F136 WeakPolarHBondContact O-CB 3.43Å; C123-F136 PolarHBondContact O-N 2.86Å; C123-V194 HydrophobicContact CB-CB 4.18Å; C123-V194 HydrophobicContact CB-CG2 3.92Å; C123-G197 WeakPolarHBondContact CA-O 3.41Å; C123-H198 VanDerWaalsContact SG-C 3.56Å; C123-I209 HydrophobicContact CB-CG2 4.48Å
124	P	98.9	Very high	97.8	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	146.8	-179.4	33.3	-36.1	0	0	0	112.6	A61 L63 F74 F134 L135 G197 G199	A61-P124 HydrophobicContact CB-CG 4.35Å; L63-P124 HydrophobicContact CB-CB 4.13Å; L63-P124 HydrophobicContact CB-CG 3.91Å; L63-P124 HydrophobicContact CD2-CB 4.1Å; F74-P124 HydrophobicContact CD2-CB 4.32Å; F74-P124 HydrophobicContact CD2-CG 3.87Å; F74-P124 HydrophobicContact CE2-CB 3.74Å; F74-P124 HydrophobicContact CE2-CG 3.72Å; F74-P124 HydrophobicContact CZ-CB 4.34Å; P124-F134 CarbonylContact C-O 3.6Å; P124-F134 VanDerWaalsContact CA-O 3.3Å; P124-F134 WeakPolarHBondContact CA-O 3.14Å; P124-L135 HydrophobicContact CB-CD1 3.91Å; P124-L135 HydrophobicContact CG-CD1 4.39Å; P124-G197 VanDerWaalsContact CD-O 3.29Å; P124-G197 WeakPolarHBondContact CD-O 3.43Å; P124-G199 PolarHBondContact O-N 2.91Å
125	V	98.8	Very high	97.9	Very high	1 Å²	1	35 Å²	35	1%	0.006	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	148.6	166.1	67.2	0	0	0	0	109.9	V133 F134 L207 I209	V125-V133 WeakPolarHBondContact O-CA 3.46Å; V125-F134 HydrophobicContact CG1-CB 3.93Å; V125-F134 HydrophobicContact CG1-CD2 4.43Å; V125-F134 PolarHBondContact N-O 3.48Å; V125-F134 PolarHBondContact O-N 2.89Å; V125-L207 HydrophobicContact CG1-CD2 4.39Å; V125-L207 HydrophobicContact CG2-CD2 3.83Å; V125-I209 HydrophobicContact CB-CD1 3.8Å; V125-I209 HydrophobicContact CG1-CD1 3.55Å
126	W	98.4	Very high	98	Very high	39 Å²	39	29.2 Å²	29.2	15%	0.148	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	125.4	173.8	-177.9	47.8	0	0	0	110.8	L63 P66 P67 R128 G131	L63-W126 HydrophobicContact CD1-CB 4.06Å; L63-W126 HydrophobicContact CD2-CB 4.05Å; L63-W126 HydrophobicContact CG-CB 4.43Å; P66-W126 VanDerWaalsContact CD-CZ3 3.41Å; P66-W126 HydrophobicContact CG-CH2 4.41Å; P66-W126 HydrophobicContact CG-CZ3 3.89Å; P67-W126 VanDerWaalsContact CD-CH2 3.46Å; P67-W126 HydrophobicContact CG-CH2 3.73Å; P67-W126 HydrophobicContact CG-CZ2 3.71Å; W126-R128 HydrophobicContact CD2-CG 4.33Å; W126-R128 HydrophobicContact CE3-CG 3.77Å; W126-R128 HydrophobicContact CH2-CB 4.32Å; W126-R128 HydrophobicContact CH2-CG 3.89Å; W126-R128 HydrophobicContact CZ2-CG 4.45Å; W126-R128 HydrophobicContact CZ3-CB 4.45Å; W126-R128 HydrophobicContact CZ3-CG 3.54Å; W126-G131 PolarHBondContact NE1-O 2.87Å
127	E	98.1	Very high	98.1	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.005	13%	0.129	C	C	.	.			trans	-92.5	109.8	173.1	-162.2	-63.9	104.4	0	0	108.7	K129 S130 G131 C132 F134 Q201 L207 L241	E127-K129 VanDerWaalsContact C-N 3.32Å; E127-K129 PolarHBondContact O-N 3.35Å; E127-K129 VanDerWaalsContact OE1-CB 3.29Å; E127-K129 WeakPolarHBondContact OE1-CB 3.46Å; E127-K129 PolarHBondContact OE1-N 3.29Å; E127-K129 PolarHBondContact OE2-N 2.88Å; E127-S130 WeakPolarHBondContact OE2-CB 3.32Å; E127-S130 PolarHBondContact OE2-N 3.04Å; E127-S130 PolarHBondContact OE2-OG 3.26Å; E127-G131 CarbonylContact O-C 3.4Å; E127-G131 VanDerWaalsContact O-CA 3.31Å; E127-G131 WeakPolarHBondContact O-CA 3.4Å; E127-G131 PolarHBondContact O-N 3.45Å; E127-C132 HydrophobicContact CB-CB 4.5Å; E127-C132 PolarHBondContact N-O 3.06Å; E127-C132 PolarHBondContact O-N 2.91Å; E127-F134 HydrophobicContact CB-CE2 4.09Å; E127-Q201 PolarHBondContact OE1-NE2 3.23Å; E127-L207 HydrophobicContact CB-CD1 4.24Å; E127-L207 HydrophobicContact CB-CD2 4.04Å; E127-L207 HydrophobicContact CG-CD1 3.95Å; E127-L207 HydrophobicContact CG-CD2 4.06Å; E127-L207 HydrophobicContact CG-CG 4.33Å; E127-L241 HydrophobicContact CG-CB 4.31Å; E127-L241 HydrophobicContact CG-CD2 4.46Å
128	R	96	Very high	98.1	Very high	124 Å²	124	24.3 Å²	24.3	47%	0.468	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-29.1	-168.7	-69.1	-175.1	-75.9	-100.4	0.1	114.4	W126 Q201 L202	W126-R128 HydrophobicContact CD2-CG 4.33Å; W126-R128 HydrophobicContact CE3-CG 3.77Å; W126-R128 HydrophobicContact CH2-CB 4.32Å; W126-R128 HydrophobicContact CH2-CG 3.89Å; W126-R128 HydrophobicContact CZ2-CG 4.45Å; W126-R128 HydrophobicContact CZ3-CB 4.45Å; W126-R128 HydrophobicContact CZ3-CG 3.54Å; R128-Q201 VanDerWaalsContact CB-OE1 3.25Å; R128-Q201 VanDerWaalsContact CG-OE1 3.26Å; R128-Q201 PolarHBondContact NH1-O 3.06Å; R128-Q201 PolarHBondContact NH2-O 3.37Å; R128-L202 PolarHBondContact NH2-O 3.34Å
129	K	95.6	Very high	98.1	Very high	171 Å²	171	23.5 Å²	23.5	74%	0.743	12%	0.118	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-41.5	-171.1	-172.5	178.4	177.1	-177.5	0	112.9	E127 L241	E127-K129 VanDerWaalsContact C-N 3.32Å; E127-K129 PolarHBondContact O-N 3.35Å; E127-K129 VanDerWaalsContact OE1-CB 3.29Å; E127-K129 WeakPolarHBondContact OE1-CB 3.46Å; E127-K129 PolarHBondContact OE1-N 3.29Å; E127-K129 PolarHBondContact OE2-N 2.88Å; K129-L241 HydrophobicContact CB-CD2 4.41Å; K129-L241 HydrophobicContact CD-CD1 3.98Å; K129-L241 HydrophobicContact CD-CD2 4.12Å
130	S	95.5	Very high	98.1	Very high	75 Å²	75	23.7 Å²	23.7	52%	0.524	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-18.5	175.7	61.9	0	0	0	0	113	E127 C132	E127-S130 WeakPolarHBondContact OE2-CB 3.32Å; E127-S130 PolarHBondContact OE2-N 3.04Å; E127-S130 PolarHBondContact OE2-OG 3.26Å; S130-C132 PolarHBondContact O-N 3.25Å; S130-C132 WeakPolarHBondContact OG-CB 3.47Å; S130-C132 PolarHBondContact OG-N 3.2Å
131	G	96.5	Very high	98.1	Very high	27 Å²	27	30.1 Å²	30.1	28%	0.278	14%	0.142	S	C	.	.			trans	77.5	2	-170.4	0	0	0	0	0	113.7	W126 E127	W126-G131 PolarHBondContact NE1-O 2.87Å; E127-G131 CarbonylContact O-C 3.4Å; E127-G131 VanDerWaalsContact O-CA 3.31Å; E127-G131 WeakPolarHBondContact O-CA 3.4Å; E127-G131 PolarHBondContact O-N 3.45Å
132	C	98.2	Very high	97.8	Very high	13 Å²	13	31.2 Å²	31.2	9%	0.088	16%	0.155	C	C	.	.	P	Polyproline II helix	trans	-66.8	133.9	-176.9	-170.5	0	0	0	0	111.7	E127 S130 F134 S164	E127-C132 HydrophobicContact CB-CB 4.5Å; E127-C132 PolarHBondContact N-O 3.06Å; E127-C132 PolarHBondContact O-N 2.91Å; S130-C132 PolarHBondContact O-N 3.25Å; S130-C132 WeakPolarHBondContact OG-CB 3.47Å; S130-C132 PolarHBondContact OG-N 3.2Å; C132-F134 HydrophobicContact CB-CE2 3.98Å; C132-F134 HydrophobicContact CB-CZ 4.44Å; C132-S164 WeakPolarHBondContact CA-O 3.41Å
133	V	98.8	Very high	97.4	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	125.2	167.1	178.4	0	0	0	0	108.5	L63 I65 L72 V125 C163 S164 W171	L63-V133 HydrophobicContact CD2-CB 4.41Å; L63-V133 HydrophobicContact CD2-CG1 3.59Å; L63-V133 HydrophobicContact CD2-CG2 3.98Å; I65-V133 HydrophobicContact CD1-CG2 3.61Å; I65-V133 HydrophobicContact CG1-CG2 4.37Å; L72-V133 HydrophobicContact CD1-CG1 4.17Å; L72-V133 HydrophobicContact CD1-CG2 4.29Å; V125-V133 WeakPolarHBondContact O-CA 3.46Å; V133-C163 CarbonylContact O-C 3.51Å; V133-C163 WeakPolarHBondContact O-CA 3.43Å; V133-S164 PolarHBondContact N-O 2.83Å; V133-S164 PolarHBondContact O-N 2.98Å; V133-W171 HydrophobicContact CB-CH2 4.47Å; V133-W171 HydrophobicContact CG1-CH2 3.85Å; V133-W171 HydrophobicContact CG1-CZ3 4.22Å
134	F	98.9	Very high	97.3	Very high	13 Å²	13	39.8 Å²	39.8	6%	0.057	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	119.8	169	-61.8	-96.1	0	0	0	108.6	P124 V125 E127 C132 F136 F161 C163 L207 W245	P124-F134 CarbonylContact C-O 3.6Å; P124-F134 VanDerWaalsContact CA-O 3.3Å; P124-F134 WeakPolarHBondContact CA-O 3.14Å; V125-F134 HydrophobicContact CG1-CB 3.93Å; V125-F134 HydrophobicContact CG1-CD2 4.43Å; V125-F134 PolarHBondContact N-O 3.48Å; V125-F134 PolarHBondContact O-N 2.89Å; E127-F134 HydrophobicContact CB-CE2 4.09Å; C132-F134 HydrophobicContact CB-CE2 3.98Å; C132-F134 HydrophobicContact CB-CZ 4.44Å; F134-F136 HydrophobicContact CB-CD2 4.2Å; F134-F136 HydrophobicContact CB-CE2 3.82Å; F134-F161 AromaticContact CD1-CD2 3.92Å; F134-F161 HydrophobicContact CD1-CD2 3.92Å; F134-F161 HydrophobicContact CD1-CE1 4.48Å; F134-F161 AromaticContact CD1-CE2 3.69Å; F134-F161 HydrophobicContact CD1-CE2 3.69Å; F134-F161 HydrophobicContact CD1-CG 4.45Å; F134-F161 AromaticContact CD1-CZ 3.98Å; F134-F161 HydrophobicContact CD1-CZ 3.98Å; F134-F161 AromaticContact CE1-CE2 3.99Å; F134-F161 HydrophobicContact CE1-CE2 3.99Å; F134-F161 HydrophobicContact CE1-CZ 4.03Å; F134-C163 HydrophobicContact CD1-CB 4.12Å; F134-C163 HydrophobicContact CE1-CB 4.35Å; F134-L207 HydrophobicContact CD2-CD1 4.33Å; F134-L207 HydrophobicContact CE2-CD1 4.13Å; F134-W245 HydrophobicContact CD1-CZ2 4.22Å; F134-W245 HydrophobicContact CE1-CZ2 4.4Å; F134-W245 HydrophobicContact CG-CZ2 4.29Å
135	L	98.9	Very high	97.2	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	103.2	171.9	177	68.3	0	0	0	108.9	F74 L89 L109 P122 P124 F137 F161 I162 W171	F74-L135 HydrophobicContact CD1-CD1 3.94Å; F74-L135 HydrophobicContact CD1-CD2 3.8Å; F74-L135 HydrophobicContact CD2-CD1 4.24Å; F74-L135 HydrophobicContact CE1-CD1 3.92Å; F74-L135 HydrophobicContact CE1-CD2 3.62Å; F74-L135 HydrophobicContact CE1-CG 4.29Å; F74-L135 HydrophobicContact CE2-CD1 4.23Å; F74-L135 HydrophobicContact CG-CD1 4.09Å; F74-L135 HydrophobicContact CZ-CD1 4.07Å; F74-L135 HydrophobicContact CZ-CD2 4.41Å; L89-L135 HydrophobicContact CD1-CD2 3.93Å; L89-L135 HydrophobicContact CD1-CG 4.46Å; L109-L135 HydrophobicContact CD1-CD2 3.61Å; P122-L135 HydrophobicContact CB-CD1 4Å; P124-L135 HydrophobicContact CB-CD1 3.91Å; P124-L135 HydrophobicContact CG-CD1 4.39Å; L135-F137 HydrophobicContact CG-CD1 4.34Å; L135-F137 VanDerWaalsContact O-CD1 3.28Å; L135-F137 WeakPolarHBondContact O-CD1 3.3Å; L135-F137 WeakPolarHBondContact O-CE1 3.23Å; L135-F161 WeakPolarHBondContact O-CA 3.27Å; L135-F161 WeakPolarHBondContact O-CB 3.33Å; L135-I162 HydrophobicContact CB-CG1 4.08Å; L135-I162 HydrophobicContact CD2-CD1 4.13Å; L135-I162 HydrophobicContact CD2-CG1 4.15Å; L135-I162 PolarHBondContact N-O 3.24Å; L135-I162 PolarHBondContact O-N 2.86Å; L135-W171 HydrophobicContact CB-CH2 3.99Å; L135-W171 HydrophobicContact CB-CZ3 3.69Å
136	F	98.9	Very high	97.1	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	149.8	171.5	-76.5	-100.6	0	0	0	111.3	P122 C123 F134 L159 C160 F161 L177 V194 I209 W245	P122-F136 CarbonylContact C-O 3.54Å; C123-F136 HydrophobicContact CB-CB 4.23Å; C123-F136 PolarHBondContact N-O 3.49Å; C123-F136 WeakPolarHBondContact O-CB 3.43Å; C123-F136 PolarHBondContact O-N 2.86Å; F134-F136 HydrophobicContact CB-CD2 4.2Å; F134-F136 HydrophobicContact CB-CE2 3.82Å; F136-L159 HydrophobicContact CD1-CD1 4.17Å; F136-C160 WeakPolarHBondContact CA-O 3.43Å; F136-F161 HydrophobicContact CD1-CB 4.19Å; F136-F161 HydrophobicContact CD2-CB 4.29Å; F136-F161 HydrophobicContact CE1-CB 4.31Å; F136-F161 HydrophobicContact CE1-CD1 4.01Å; F136-F161 HydrophobicContact CE2-CB 4.38Å; F136-F161 HydrophobicContact CE2-CD1 4.49Å; F136-F161 HydrophobicContact CG-CB 4.19Å; F136-F161 HydrophobicContact CZ-CB 4.38Å; F136-F161 AromaticContact CZ-CD1 3.88Å; F136-F161 HydrophobicContact CZ-CD1 3.88Å; F136-F161 HydrophobicContact CZ-CG 4.43Å; F136-L177 HydrophobicContact CE1-CD1 3.9Å; F136-L177 HydrophobicContact CZ-CD1 4.41Å; F136-V194 HydrophobicContact CB-CG1 4.44Å; F136-V194 HydrophobicContact CB-CG2 4.19Å; F136-I209 HydrophobicContact CB-CG2 4.21Å; F136-I209 HydrophobicContact CD1-CG1 4.48Å; F136-I209 HydrophobicContact CD2-CD1 3.55Å; F136-I209 HydrophobicContact CD2-CG1 3.73Å; F136-I209 HydrophobicContact CE1-CG1 4.47Å; F136-I209 HydrophobicContact CE2-CD1 3.78Å; F136-I209 HydrophobicContact CE2-CG1 3.74Å; F136-I209 HydrophobicContact CG-CD1 4.26Å; F136-I209 HydrophobicContact CG-CG1 4.12Å; F136-I209 HydrophobicContact CG-CG2 4.17Å; F136-I209 HydrophobicContact CZ-CG1 4.12Å; F136-W245 HydrophobicContact CE1-CD2 4.47Å; F136-W245 HydrophobicContact CE1-CE3 4.47Å; F136-W245 HydrophobicContact CE2-CE3 4.49Å; F136-W245 AromaticContact CE2-CH2 3.56Å; F136-W245 HydrophobicContact CE2-CH2 3.56Å; F136-W245 AromaticContact CE2-CZ2 3.76Å; F136-W245 HydrophobicContact CE2-CZ2 3.76Å; F136-W245 AromaticContact CE2-CZ3 3.98Å; F136-W245 HydrophobicContact CE2-CZ3 3.98Å; F136-W245 AromaticContact CZ-CD2 3.72Å; F136-W245 HydrophobicContact CZ-CD2 3.72Å; F136-W245 AromaticContact CZ-CE2 3.64Å; F136-W245 AromaticContact CZ-CE3 3.75Å; F136-W245 HydrophobicContact CZ-CE3 3.75Å; F136-W245 AromaticContact CZ-CH2 3.59Å; F136-W245 HydrophobicContact CZ-CH2 3.59Å; F136-W245 AromaticContact CZ-CZ2 3.58Å; F136-W245 HydrophobicContact CZ-CZ2 3.58Å; F136-W245 AromaticContact CZ-CZ3 3.69Å; F136-W245 HydrophobicContact CZ-CZ3 3.69Å
137	F	98.9	Very high	97	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.7	175	176.2	52.7	-90.3	0	0	0	110.7	L89 A112 T119 M120 N121 L135 C160 I162 V174	L89-F137 HydrophobicContact CD1-CB 3.87Å; L89-F137 HydrophobicContact CD1-CD1 4.06Å; L89-F137 HydrophobicContact CD1-CG 4.04Å; A112-F137 HydrophobicContact CB-CD1 4.28Å; A112-F137 HydrophobicContact CB-CE1 3.68Å; A112-F137 HydrophobicContact CB-CE2 4.24Å; A112-F137 HydrophobicContact CB-CZ 3.64Å; T119-F137 HydrophobicContact CG2-CB 4.17Å; T119-F137 HydrophobicContact CG2-CD2 3.3Å; T119-F137 HydrophobicContact CG2-CE2 3.77Å; T119-F137 HydrophobicContact CG2-CG 3.85Å; M120-F137 WeakPolarHBondContact O-CB 3.36Å; N121-F137 WeakPolarHBondContact O-CA 3.48Å; L135-F137 HydrophobicContact CG-CD1 4.34Å; L135-F137 VanDerWaalsContact O-CD1 3.28Å; L135-F137 WeakPolarHBondContact O-CD1 3.3Å; L135-F137 WeakPolarHBondContact O-CE1 3.23Å; F137-C160 HydrophobicContact CD2-CB 3.67Å; F137-C160 HydrophobicContact CE1-CB 4.35Å; F137-C160 HydrophobicContact CE2-CB 3.22Å; F137-C160 HydrophobicContact CG-CB 4.43Å; F137-C160 HydrophobicContact CZ-CB 3.6Å; F137-C160 PolarHBondContact N-O 2.88Å; F137-C160 PolarHBondContact O-N 3.41Å; F137-C160 VanDerWaalsContact O-O 3.13Å; F137-I162 HydrophobicContact CE1-CG1 4.11Å; F137-I162 HydrophobicContact CE1-CG2 4.31Å; F137-I162 HydrophobicContact CZ-CG2 4.38Å; F137-V174 HydrophobicContact CE2-CG2 4.22Å; F137-V174 HydrophobicContact CZ-CB 4.49Å; F137-V174 HydrophobicContact CZ-CG2 3.79Å
138	I	98.8	Very high	96.8	Very high	9 Å²	9	57.9 Å²	57.9	5%	0.046	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	145.3	165.4	62.4	172.8	0	0	0	112.8	T119 M120 V140 R158 F192 A193	T119-I138 WeakPolarHBondContact CA-O 3.24Å; M120-I138 HydrophobicContact CB-CD1 4.43Å; M120-I138 HydrophobicContact CB-CG1 3.91Å; M120-I138 PolarHBondContact N-O 2.8Å; M120-I138 PolarHBondContact O-N 2.94Å; I138-V140 HydrophobicContact CD1-CG2 3.89Å; I138-V140 HydrophobicContact CG1-CG2 4.3Å; I138-R158 WeakPolarHBondContact CA-O 3.46Å; I138-F192 HydrophobicContact CG2-CD2 4.25Å; I138-F192 HydrophobicContact CG2-CE2 4.01Å; I138-A193 HydrophobicContact CD1-CB 3.79Å; I138-A193 HydrophobicContact CG2-CB 4.37Å
139	C	98.7	Very high	96.8	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	117.7	168.4	-85.3	0	0	0	0	109.4	L114 H117 R118 A157 R158	L114-C139 HydrophobicContact CB-CB 4.27Å; L114-C139 HydrophobicContact CD1-CB 3.8Å; L114-C139 HydrophobicContact CG-CB 4.18Å; H117-C139 HydrophobicContact CB-CB 3.91Å; R118-C139 CarbonylContact O-C 3.52Å; R118-C139 WeakPolarHBondContact O-CA 3.3Å; C139-A157 CarbonylContact O-C 3.55Å; C139-A157 WeakPolarHBondContact O-CA 3.43Å; C139-R158 HydrophobicContact CB-CB 4.13Å; C139-R158 PolarHBondContact N-O 3.01Å; C139-R158 PolarHBondContact O-N 3.21Å
140	V	98.5	Very high	96.7	Very high	3 Å²	3	45.3 Å²	45.3	2%	0.018	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	130	180	-173.1	0	0	0	0	110.5	H117 R118 I138 G142 V144 A156 A157	H117-V140 CarbonylContact C-O 3.53Å; H117-V140 WeakPolarHBondContact CA-O 3.14Å; H117-V140 WeakPolarHBondContact CB-O 3.17Å; R118-V140 HydrophobicContact CG-CB 4.06Å; R118-V140 WeakPolarHBondContact CG-O 3.14Å; R118-V140 PolarHBondContact N-O 3.16Å; R118-V140 PolarHBondContact O-N 2.83Å; I138-V140 HydrophobicContact CD1-CG2 3.89Å; I138-V140 HydrophobicContact CG1-CG2 4.3Å; V140-G142 PolarHBondContact O-N 3.31Å; V140-V144 WeakPolarHBondContact CG1-O 2.98Å; V140-A156 CarbonylContact C-O 3.54Å; V140-A156 WeakPolarHBondContact CA-O 3.34Å; V140-A157 HydrophobicContact CG2-CB 4.3Å
141	R	97.9	Very high	96.6	Very high	148 Å²	148	45.9 Å²	45.9	56%	0.558	23%	0.228	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-66.5	116.4	-173.6	-171.6	177.7	61.2	-177.5	-5.7	112	H117 V144 A156	H117-R141 VanDerWaalsContact CD2-CA 3.43Å; H117-R141 WeakPolarHBondContact CD2-CA 3.07Å; H117-R141 PolarHBondContact CD2-N 3.12Å; H117-R141 VanDerWaalsContact CD2-N 3.33Å; R141-V144 WeakPolarHBondContact O-CB 3.27Å; R141-V144 VanDerWaalsContact O-CG2 3.27Å; R141-V144 WeakPolarHBondContact O-CG2 3.37Å; R141-V144 PolarHBondContact O-N 3.04Å; R141-A156 HydrophobicContact CB-CB 4.27Å; R141-A156 PolarHBondContact N-O 2.84Å
142	G	92.5	Very high	96.3	Very high	31 Å²	31	47.4 Å²	47.4	32%	0.32	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	49	-144.4	-178.5	0	0	0	0	0	113.4	G116 R118 V140 V144	G116-G142 PolarHBondContact O-N 3.31Å; R118-G142 PolarHBondContact NE-O 2.81Å; V140-G142 PolarHBondContact O-N 3.31Å; G142-V144 PolarHBondContact O-N 3.17Å
143	H	90.8	Very high	95.9	Very high	140 Å²	140	47.7 Å²	47.7	65%	0.648	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.8	26.6	177.6	-53.6	-72.9	0	0	0	113.3	E84 T145	E84-H143 PolarHBondContact O-ND1 2.9Å; H143-T145 PolarHBondContact O-N 3.28Å; H143-T145 VanDerWaalsContact O-N 3.17Å
144	V	96.3	Very high	95.6	Very high	41 Å²	41	56.9 Å²	56.9	25%	0.248	28%	0.275	C	S	.	.			trans	-66.7	116.9	174.5	176.9	0	0	0	0	108.9	R118 V140 R141 G142 Q148 Q149 A156	R118-V144 PolarHBondContact NH2-O 3.03Å; V140-V144 WeakPolarHBondContact CG1-O 2.98Å; R141-V144 WeakPolarHBondContact O-CB 3.27Å; R141-V144 VanDerWaalsContact O-CG2 3.27Å; R141-V144 WeakPolarHBondContact O-CG2 3.37Å; R141-V144 PolarHBondContact O-N 3.04Å; G142-V144 PolarHBondContact O-N 3.17Å; V144-Q148 HydrophobicContact CG1-CB 4.46Å; V144-Q149 HydrophobicContact CG1-CG 3.64Å; V144-A156 HydrophobicContact CB-CB 4.1Å; V144-A156 HydrophobicContact CG1-CB 3.79Å; V144-A156 HydrophobicContact CG2-CB 4.42Å
145	T	96.7	Very high	95.5	Very high	37 Å²	37	58.2 Å²	58.2	23%	0.227	28%	0.282	C	S	.	.			trans	-77.6	154.4	-177.7	61.7	0	0	0	0	112.1	E84 H143 R147 Q148 Q149	E84-T145 HydrophobicContact CB-CG2 4.47Å; H143-T145 PolarHBondContact O-N 3.28Å; H143-T145 VanDerWaalsContact O-N 3.17Å; T145-R147 VanDerWaalsContact C-N 3.28Å; T145-R147 PolarHBondContact O-N 2.84Å; T145-Q148 PolarHBondContact O-N 3.12Å; T145-Q148 WeakPolarHBondContact OG1-CB 3.23Å; T145-Q148 VanDerWaalsContact OG1-CD 3.25Å; T145-Q148 VanDerWaalsContact OG1-CG 3.23Å; T145-Q148 WeakPolarHBondContact OG1-CG 3.18Å; T145-Q148 PolarHBondContact OG1-N 2.91Å; T145-Q148 PolarHBondContact OG1-OE1 3.1Å; T145-Q149 WeakPolarHBondContact O-CG 3.47Å; T145-Q149 PolarHBondContact O-N 3.22Å
146	E	96.1	Very high	95.4	Very high	81 Å²	81	58.7 Å²	58.7	38%	0.379	29%	0.286	S	S	.	.	H	α-helix	trans	-53.4	-46.5	171.5	-169.2	-150.3	-135.4	0	0	110.9	Q148 Q149 I150 T191 Y214	E146-Q148 PolarHBondContact O-N 3.1Å; E146-Q149 WeakPolarHBondContact O-CB 3.21Å; E146-Q149 PolarHBondContact O-N 3.22Å; E146-Q149 VanDerWaalsContact O-N 3.13Å; E146-I150 HydrophobicContact CG-CD1 3.71Å; E146-I150 HydrophobicContact CG-CG1 4.4Å; E146-I150 VanDerWaalsContact O-CG1 3.31Å; E146-I150 WeakPolarHBondContact O-CG1 3.28Å; E146-I150 PolarHBondContact O-N 2.83Å; E146-T191 HydrophobicContact CG-CG2 3.79Å; E146-Y214 VanDerWaalsContact CD-OH 3.31Å; E146-Y214 HydrophobicContact CG-CE2 4.17Å; E146-Y214 WeakPolarHBondContact OE1-CE2 3.35Å; E146-Y214 PolarHBondContact OE1-OH 3.19Å
147	R	95.6	Very high	95.4	Very high	196 Å²	196	58.7 Å²	58.7	74%	0.74	29%	0.286	S	S	*	.	H	α-helix	trans	-58.8	-40	178.3	-173	177.7	178.9	-172.2	-0.4	113.5	T145 V151	T145-R147 VanDerWaalsContact C-N 3.28Å; T145-R147 PolarHBondContact O-N 2.84Å; R147-V151 HydrophobicContact CG-CG2 4.33Å; R147-V151 WeakPolarHBondContact O-CB 3.39Å; R147-V151 VanDerWaalsContact O-CG2 3.28Å; R147-V151 WeakPolarHBondContact O-CG2 3.24Å; R147-V151 PolarHBondContact O-N 2.84Å
148	Q	95.2	Very high	95.4	Very high	106 Å²	106	62.4 Å²	62.4	50%	0.495	30%	0.3	S	S	.	.	H	α-helix	trans	-64.8	-42.2	176.3	-79.5	161.9	-38.5	0	0	111.6	V144 T145 E146 S152	V144-Q148 HydrophobicContact CG1-CB 4.46Å; T145-Q148 PolarHBondContact O-N 3.12Å; T145-Q148 WeakPolarHBondContact OG1-CB 3.23Å; T145-Q148 VanDerWaalsContact OG1-CD 3.25Å; T145-Q148 VanDerWaalsContact OG1-CG 3.23Å; T145-Q148 WeakPolarHBondContact OG1-CG 3.18Å; T145-Q148 PolarHBondContact OG1-N 2.91Å; T145-Q148 PolarHBondContact OG1-OE1 3.1Å; E146-Q148 PolarHBondContact O-N 3.1Å; Q148-S152 VanDerWaalsContact O-CB 3.29Å; Q148-S152 WeakPolarHBondContact O-CB 3.3Å; Q148-S152 PolarHBondContact O-N 2.88Å; Q148-S152 PolarHBondContact O-OG 2.97Å
149	Q	96	Very high	95.4	Very high	2 Å²	2	62 Å²	62	1%	0.009	30%	0.298	C	S	.	.	H	α-helix	trans	-63.4	-49	177.1	-65.2	-179.4	85.9	0	0	111.1	V144 T145 E146 V151 S152 G153 R154 A156 A190 T191	V144-Q149 HydrophobicContact CG1-CG 3.64Å; T145-Q149 WeakPolarHBondContact O-CG 3.47Å; T145-Q149 PolarHBondContact O-N 3.22Å; E146-Q149 WeakPolarHBondContact O-CB 3.21Å; E146-Q149 PolarHBondContact O-N 3.22Å; E146-Q149 VanDerWaalsContact O-N 3.13Å; Q149-V151 PolarHBondContact O-N 3.01Å; Q149-S152 PolarHBondContact O-N 2.84Å; Q149-G153 WeakPolarHBondContact O-CA 3.2Å; Q149-G153 PolarHBondContact O-N 3.02Å; Q149-R154 WeakPolarHBondContact CG-O 3.4Å; Q149-R154 PolarHBondContact O-N 2.68Å; Q149-A156 HydrophobicContact CG-CB 4.2Å; Q149-A190 WeakPolarHBondContact CB-O 3.45Å; Q149-T191 HydrophobicContact CB-CG2 4.31Å; Q149-T191 PolarHBondContact NE2-OG1 3.44Å; Q149-T191 PolarHBondContact OE1-OG1 2.84Å
150	I	93.9	Very high	95.4	Very high	29 Å²	29	62 Å²	62	15%	0.149	30%	0.298	C	S	.	.	H	α-helix	trans	-55	-52.4	176.1	-70.9	168.7	0	0	0	111.7	E146 T191 Y214 T229	E146-I150 HydrophobicContact CG-CD1 3.71Å; E146-I150 HydrophobicContact CG-CG1 4.4Å; E146-I150 VanDerWaalsContact O-CG1 3.31Å; E146-I150 WeakPolarHBondContact O-CG1 3.28Å; E146-I150 PolarHBondContact O-N 2.83Å; I150-T191 HydrophobicContact CG1-CG2 4.19Å; I150-Y214 HydrophobicContact CD1-CD1 3.67Å; I150-Y214 HydrophobicContact CD1-CD2 4.19Å; I150-Y214 HydrophobicContact CD1-CE1 3.44Å; I150-Y214 VanDerWaalsContact CD1-CE1 3.44Å; I150-Y214 HydrophobicContact CD1-CE2 3.96Å; I150-Y214 HydrophobicContact CD1-CG 4.03Å; I150-Y214 HydrophobicContact CG1-CD1 3.82Å; I150-Y214 HydrophobicContact CG1-CD2 4.27Å; I150-Y214 HydrophobicContact CG1-CE1 4.15Å; I150-Y214 HydrophobicContact CG1-CG 3.88Å; I150-T229 HydrophobicContact CG2-CG2 4.32Å; I150-T229 WeakPolarHBondContact CG2-OG1 3.46Å; I150-T229 WeakPolarHBondContact O-CG2 3.36Å
151	V	91.6	Very high	95.4	Very high	88 Å²	88	62.1 Å²	62.1	53%	0.533	30%	0.298	S	S	.	.	H	α-helix	trans	-69.2	-38.2	-175.3	170.9	0	0	0	0	112.2	R147 Q149	R147-V151 HydrophobicContact CG-CG2 4.33Å; R147-V151 WeakPolarHBondContact O-CB 3.39Å; R147-V151 VanDerWaalsContact O-CG2 3.28Å; R147-V151 WeakPolarHBondContact O-CG2 3.24Å; R147-V151 PolarHBondContact O-N 2.84Å; Q149-V151 PolarHBondContact O-N 3.01Å
152	S	91	Very high	95.5	Very high	59 Å²	59	55 Å²	55	41%	0.413	27%	0.271	S	S	.	.	H	α-helix	trans	-87.5	-15.4	-177.4	66.2	0	0	0	0	114.5	Q148 Q149 R154	Q148-S152 VanDerWaalsContact O-CB 3.29Å; Q148-S152 WeakPolarHBondContact O-CB 3.3Å; Q148-S152 PolarHBondContact O-N 2.88Å; Q148-S152 PolarHBondContact O-OG 2.97Å; Q149-S152 PolarHBondContact O-N 2.84Å; S152-R154 PolarHBondContact O-N 3.41Å; S152-R154 WeakPolarHBondContact OG-CB 3.33Å; S152-R154 PolarHBondContact OG-N 2.87Å
153	G	90.8	Very high	95.8	Very high	19 Å²	19	54.9 Å²	54.9	20%	0.196	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.5	12	-168.9	0	0	0	0	0	114.1	Q149	Q149-G153 WeakPolarHBondContact O-CA 3.2Å; Q149-G153 PolarHBondContact O-N 3.02Å
154	R	92	Very high	96.2	Very high	193 Å²	193	48.3 Å²	48.3	73%	0.728	24%	0.235	S	C	*	.			trans	-101.3	106.5	-175.6	-63.6	179.4	177.5	-178.9	-2.5	110.8	Q149 S152	Q149-R154 WeakPolarHBondContact CG-O 3.4Å; Q149-R154 PolarHBondContact O-N 2.68Å; S152-R154 PolarHBondContact O-N 3.41Å; S152-R154 WeakPolarHBondContact OG-CB 3.33Å; S152-R154 PolarHBondContact OG-N 2.87Å
155	N	96.6	Very high	96.2	Very high	40 Å²	40	54.4 Å²	54.4	21%	0.214	26%	0.261	C	S	.	.			trans	-64	139.5	176.6	-162.2	-58.5	0	0	0	112.4	A157 W189 A190 F192	N155-A157 PolarHBondContact OD1-N 2.85Å; N155-A157 PolarHBondContact OD1-O 3.46Å; N155-A157 VanDerWaalsContact OD1-O 3.08Å; N155-W189 WeakPolarHBondContact CB-O 3.46Å; N155-W189 PolarHBondContact ND2-O 2.8Å; N155-A190 WeakPolarHBondContact CA-O 3.3Å; N155-A190 PolarHBondContact N-O 3.25Å; N155-F192 WeakPolarHBondContact ND2-CD1 3.38Å
156	A	97.7	Very high	96.3	Very high	10 Å²	10	55.5 Å²	55.5	8%	0.083	27%	0.265	C	S	.	.			trans	-137.2	12.7	174.6	0	0	0	0	0	112.7	V140 R141 V144 Q149	V140-A156 CarbonylContact C-O 3.54Å; V140-A156 WeakPolarHBondContact CA-O 3.34Å; R141-A156 HydrophobicContact CB-CB 4.27Å; R141-A156 PolarHBondContact N-O 2.84Å; V144-A156 HydrophobicContact CB-CB 4.1Å; V144-A156 HydrophobicContact CG1-CB 3.79Å; V144-A156 HydrophobicContact CG2-CB 4.42Å; Q149-A156 HydrophobicContact CG-CB 4.2Å
157	A	98.4	Very high	96.3	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	149.6	179	0	0	0	0	0	111.4	C139 V140 N155 F192	C139-A157 CarbonylContact O-C 3.55Å; C139-A157 WeakPolarHBondContact O-CA 3.43Å; V140-A157 HydrophobicContact CG2-CB 4.3Å; N155-A157 PolarHBondContact OD1-N 2.85Å; N155-A157 PolarHBondContact OD1-O 3.46Å; N155-A157 VanDerWaalsContact OD1-O 3.08Å; A157-F192 HydrophobicContact CB-CD1 4.33Å; A157-F192 HydrophobicContact CB-CE1 3.97Å; A157-F192 HydrophobicContact CB-CZ 4.09Å
158	R	98.7	Very high	96.4	Very high	79 Å²	79	42.8 Å²	42.8	30%	0.298	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	137.5	174.7	-60.5	-64.9	173.3	166.4	-16.7	109.7	L114 I138 C139 D176 T178 E179	L114-R158 HydrophobicContact CD1-CB 4.11Å; L114-R158 HydrophobicContact CD1-CG 4.16Å; I138-R158 WeakPolarHBondContact CA-O 3.46Å; C139-R158 HydrophobicContact CB-CB 4.13Å; C139-R158 PolarHBondContact N-O 3.01Å; C139-R158 PolarHBondContact O-N 3.21Å; R158-D176 WeakPolarHBondContact CD-OD2 3.26Å; R158-D176 IonicContact NH1-OD2 3.18Å; R158-T178 VanDerWaalsContact CA-OG1 3.24Å; R158-T178 WeakPolarHBondContact CA-OG1 3.25Å; R158-T178 WeakPolarHBondContact CD-OG1 3.2Å; R158-E179 IonicContact NH1-OE1 3.9Å; R158-E179 PolarHBondContact NH1-OE1 2.96Å
159	L	98.8	Very high	96.5	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	121.8	172	178.1	65.5	0	0	0	107.9	F136 L177 T178 V181 I182 F192 V194 I236	F136-L159 HydrophobicContact CD1-CD1 4.17Å; L159-L177 HydrophobicContact CD2-CB 3.95Å; L159-L177 HydrophobicContact CD2-CD1 4.49Å; L159-L177 HydrophobicContact CG-CB 4.11Å; L159-L177 PolarHBondContact O-N 2.88Å; L159-T178 PolarHBondContact N-OG1 2.92Å; L159-V181 HydrophobicContact CD2-CB 3.86Å; L159-V181 HydrophobicContact CD2-CG1 3.92Å; L159-V181 HydrophobicContact CD2-CG2 4.04Å; L159-I182 HydrophobicContact CB-CD1 4.38Å; L159-F192 HydrophobicContact CB-CE2 3.8Å; L159-F192 HydrophobicContact CB-CZ 4.13Å; L159-V194 HydrophobicContact CD1-CG1 3.52Å; L159-I236 HydrophobicContact CD1-CD1 3.91Å; L159-I236 HydrophobicContact CD2-CD1 3.78Å
160	C	98.8	Very high	96.6	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	155	-175.1	-63.1	0	0	0	0	111.9	F136 F137 V174 R175	F136-C160 WeakPolarHBondContact CA-O 3.43Å; F137-C160 HydrophobicContact CD2-CB 3.67Å; F137-C160 HydrophobicContact CE1-CB 4.35Å; F137-C160 HydrophobicContact CE2-CB 3.22Å; F137-C160 HydrophobicContact CG-CB 4.43Å; F137-C160 HydrophobicContact CZ-CB 3.6Å; F137-C160 PolarHBondContact N-O 2.88Å; F137-C160 PolarHBondContact O-N 3.41Å; F137-C160 VanDerWaalsContact O-O 3.13Å; C160-V174 HydrophobicContact CB-CG2 3.78Å; C160-R175 VanDerWaalsContact CA-O 3.24Å; C160-R175 WeakPolarHBondContact CA-O 3.36Å
161	F	98.8	Very high	96.9	Very high	5 Å²	5	43.1 Å²	43.1	2%	0.022	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	160	162.5	76.3	-109.3	0	0	0	112.8	F134 L135 F136 C163 R175 L177 W245	F134-F161 AromaticContact CD1-CD2 3.92Å; F134-F161 HydrophobicContact CD1-CD2 3.92Å; F134-F161 HydrophobicContact CD1-CE1 4.48Å; F134-F161 AromaticContact CD1-CE2 3.69Å; F134-F161 HydrophobicContact CD1-CE2 3.69Å; F134-F161 HydrophobicContact CD1-CG 4.45Å; F134-F161 AromaticContact CD1-CZ 3.98Å; F134-F161 HydrophobicContact CD1-CZ 3.98Å; F134-F161 AromaticContact CE1-CE2 3.99Å; F134-F161 HydrophobicContact CE1-CE2 3.99Å; F134-F161 HydrophobicContact CE1-CZ 4.03Å; L135-F161 WeakPolarHBondContact O-CA 3.27Å; L135-F161 WeakPolarHBondContact O-CB 3.33Å; F136-F161 HydrophobicContact CD1-CB 4.19Å; F136-F161 HydrophobicContact CD2-CB 4.29Å; F136-F161 HydrophobicContact CE1-CB 4.31Å; F136-F161 HydrophobicContact CE1-CD1 4.01Å; F136-F161 HydrophobicContact CE2-CB 4.38Å; F136-F161 HydrophobicContact CE2-CD1 4.49Å; F136-F161 HydrophobicContact CG-CB 4.19Å; F136-F161 HydrophobicContact CZ-CB 4.38Å; F136-F161 AromaticContact CZ-CD1 3.88Å; F136-F161 HydrophobicContact CZ-CD1 3.88Å; F136-F161 HydrophobicContact CZ-CG 4.43Å; F161-C163 HydrophobicContact CD2-CB 4.49Å; F161-C163 HydrophobicContact CE2-CB 4.29Å; F161-R175 HydrophobicContact CE1-CB 4.38Å; F161-R175 HydrophobicContact CE2-CB 4.44Å; F161-R175 HydrophobicContact CE2-CG 4.4Å; F161-R175 HydrophobicContact CZ-CB 4.31Å; F161-R175 HydrophobicContact CZ-CG 4.38Å; F161-R175 PolarHBondContact N-O 3.31Å; F161-R175 VanDerWaalsContact N-O 3.08Å; F161-R175 PolarHBondContact O-N 2.86Å; F161-L177 HydrophobicContact CD1-CD1 3.61Å; F161-L177 HydrophobicContact CD1-CD2 4.32Å; F161-L177 HydrophobicContact CD1-CG 3.88Å; F161-L177 HydrophobicContact CE1-CD1 3.72Å; F161-L177 HydrophobicContact CE1-CD2 3.9Å; F161-L177 HydrophobicContact CE1-CG 3.96Å; F161-W245 AromaticContact CE1-NE1 3.87Å
162	I	98.9	Very high	97.2	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	151.1	158.6	54.4	171.1	0	0	0	108.7	L109 E111 A112 L135 F137 W171 S172 V174	L109-I162 HydrophobicContact CD1-CD1 4.46Å; E111-I162 HydrophobicContact CB-CD1 4.42Å; E111-I162 HydrophobicContact CB-CG2 4.42Å; E111-I162 WeakPolarHBondContact O-CG2 3.2Å; A112-I162 HydrophobicContact CB-CD1 3.75Å; A112-I162 HydrophobicContact CB-CG1 4.27Å; A112-I162 HydrophobicContact CB-CG2 4.47Å; L135-I162 HydrophobicContact CB-CG1 4.08Å; L135-I162 HydrophobicContact CD2-CD1 4.13Å; L135-I162 HydrophobicContact CD2-CG1 4.15Å; L135-I162 PolarHBondContact N-O 3.24Å; L135-I162 PolarHBondContact O-N 2.86Å; F137-I162 HydrophobicContact CE1-CG1 4.11Å; F137-I162 HydrophobicContact CE1-CG2 4.31Å; F137-I162 HydrophobicContact CZ-CG2 4.38Å; I162-W171 HydrophobicContact CB-CE3 4.14Å; I162-W171 HydrophobicContact CD1-CB 3.84Å; I162-W171 HydrophobicContact CD1-CD2 3.63Å; I162-W171 HydrophobicContact CD1-CE3 3.53Å; I162-W171 HydrophobicContact CD1-CG 3.77Å; I162-W171 HydrophobicContact CD1-CZ3 4.3Å; I162-W171 HydrophobicContact CG1-CD2 4.18Å; I162-W171 HydrophobicContact CG1-CE3 3.53Å; I162-W171 HydrophobicContact CG1-CZ3 4.08Å; I162-S172 WeakPolarHBondContact CG2-O 3.4Å; I162-V174 HydrophobicContact CG2-CB 4.1Å
163	C	98.6	Very high	97.5	Very high	27 Å²	27	46.3 Å²	46.3	18%	0.182	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	152.5	177.7	69.1	0	0	0	0	113.2	V133 F134 F161 W171 S172	V133-C163 CarbonylContact O-C 3.51Å; V133-C163 WeakPolarHBondContact O-CA 3.43Å; F134-C163 HydrophobicContact CD1-CB 4.12Å; F134-C163 HydrophobicContact CE1-CB 4.35Å; F161-C163 HydrophobicContact CD2-CB 4.49Å; F161-C163 HydrophobicContact CE2-CB 4.29Å; C163-W171 CarbonylContact O-C 3.47Å; C163-W171 VanDerWaalsContact O-CA 3.31Å; C163-W171 WeakPolarHBondContact O-CA 3.23Å; C163-S172 PolarHBondContact N-OG 3.14Å; C163-S172 PolarHBondContact O-N 2.96Å
164	S	98.8	Very high	97.9	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.014	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	132.9	176.7	172.6	0	0	0	0	109.9	C132 V133 D166 G168 S170	C132-S164 WeakPolarHBondContact CA-O 3.41Å; V133-S164 PolarHBondContact N-O 2.83Å; V133-S164 PolarHBondContact O-N 2.98Å; S164-D166 PolarHBondContact OG-N 2.8Å; S164-D166 PolarHBondContact OG-OD1 2.89Å; S164-G168 VanDerWaalsContact OG-CA 3.28Å; S164-G168 WeakPolarHBondContact OG-CA 3.25Å; S164-G168 PolarHBondContact OG-N 3.41Å; S164-S170 WeakPolarHBondContact CB-O 3.19Å; S164-S170 PolarHBondContact OG-O 2.78Å
165	Q	97.9	Very high	98.2	Very high	170 Å²	170	42.8 Å²	42.8	79%	0.794	22%	0.22	S	C	*	.	S	Bend	trans	-103.5	1.8	177.9	-61.2	178.6	25.3	0	0	112.4
166	D	97.6	Very high	98.3	Very high	60 Å²	60	44 Å²	44	32%	0.321	23%	0.227	S	C	.	.	S	Bend	trans	-130.9	34.2	-167.7	64	7.6	0	0	0	112.8	S164 G168 C169 S170	S164-D166 PolarHBondContact OG-N 2.8Å; S164-D166 PolarHBondContact OG-OD1 2.89Å; D166-G168 VanDerWaalsContact C-N 3.33Å; D166-G168 PolarHBondContact O-N 3.24Å; D166-C169 HydrophobicContact CB-CB 4.35Å; D166-C169 PolarHBondContact O-N 3.27Å; D166-C169 PolarHBondContact O-SG 2.96Å; D166-C169 WeakPolarHBondContact OD1-CA 3.33Å; D166-C169 PolarHBondContact OD1-N 3.11Å; D166-C169 WeakPolarHBondContact OD2-CB 3.31Å; D166-S170 VanDerWaalsContact CG-N 3.33Å; D166-S170 PolarHBondContact OD1-N 3.31Å; D166-S170 VanDerWaalsContact OD2-CB 3.26Å; D166-S170 WeakPolarHBondContact OD2-CB 3.2Å; D166-S170 PolarHBondContact OD2-N 3.48Å; D166-S170 PolarHBondContact OD2-OG 2.91Å
167	A	96.6	Very high	98.4	Very high	10 Å²	10	43.6 Å²	43.6	8%	0.083	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.6	47.8	-177.8	0	0	0	0	0	112.9	I65 T68 R93	I65-A167 HydrophobicContact CD1-CB 3.9Å; T68-A167 HydrophobicContact CG2-CB 4.15Å; R93-A167 PolarHBondContact NE-O 3.2Å; R93-A167 PolarHBondContact NH2-O 3.22Å
168	G	97.8	Very high	98.4	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.3	10.1	172.4	0	0	0	0	0	115.9	L91 R93 S164 D166 W171	L91-G168 WeakPolarHBondContact CD2-O 3.44Å; R93-G168 WeakPolarHBondContact CD-O 3.45Å; S164-G168 VanDerWaalsContact OG-CA 3.28Å; S164-G168 WeakPolarHBondContact OG-CA 3.25Å; S164-G168 PolarHBondContact OG-N 3.41Å; D166-G168 VanDerWaalsContact C-N 3.33Å; D166-G168 PolarHBondContact O-N 3.24Å; G168-W171 PolarHBondContact O-NE1 3.29Å
169	C	97.8	Very high	98.3	Very high	58 Å²	58	45.3 Å²	45.3	39%	0.392	23%	0.234	S	C	.	.	S	Bend	trans	-69.9	-50.9	177.9	-60.1	0	0	0	0	111.1	R93 K107 D166	R93-C169 PolarHBondContact NH1-SG 3.12Å; R93-C169 VanDerWaalsContact NH1-SG 3.42Å; R93-C169 PolarHBondContact NH2-SG 3.24Å; K107-C169 PolarHBondContact NZ-O 2.92Å; D166-C169 HydrophobicContact CB-CB 4.35Å; D166-C169 PolarHBondContact O-N 3.27Å; D166-C169 PolarHBondContact O-SG 2.96Å; D166-C169 WeakPolarHBondContact OD1-CA 3.33Å; D166-C169 PolarHBondContact OD1-N 3.11Å; D166-C169 WeakPolarHBondContact OD2-CB 3.31Å
170	S	98.3	Very high	98.2	Very high	63 Å²	63	49.4 Å²	49.4	44%	0.441	25%	0.254	S	S	.	.	S	Bend	trans	-121.2	162.4	174.9	72.5	0	0	0	0	111.2	S164 D166	S164-S170 WeakPolarHBondContact CB-O 3.19Å; S164-S170 PolarHBondContact OG-O 2.78Å; D166-S170 VanDerWaalsContact CG-N 3.33Å; D166-S170 PolarHBondContact OD1-N 3.31Å; D166-S170 VanDerWaalsContact OD2-CB 3.26Å; D166-S170 WeakPolarHBondContact OD2-CB 3.2Å; D166-S170 PolarHBondContact OD2-N 3.48Å; D166-S170 PolarHBondContact OD2-OG 2.91Å
171	W	98.8	Very high	98.2	Very high	23 Å²	23	50 Å²	50	9%	0.087	26%	0.257	C	S	.	.			trans	-140.3	148.4	-175	-66	90.1	0	0	0	110.3	L72 F74 L91 L109 E111 V133 L135 I162 C163 G168	L72-W171 HydrophobicContact CD1-CH2 4.5Å; L72-W171 HydrophobicContact CD1-CZ2 4.41Å; F74-W171 AromaticContact CE1-CH2 3.95Å; F74-W171 HydrophobicContact CE1-CH2 3.95Å; F74-W171 AromaticContact CE1-CZ2 3.78Å; F74-W171 HydrophobicContact CE1-CZ2 3.78Å; F74-W171 AromaticContact CZ-CH2 3.78Å; F74-W171 HydrophobicContact CZ-CH2 3.78Å; F74-W171 AromaticContact CZ-CZ2 3.88Å; F74-W171 HydrophobicContact CZ-CZ2 3.88Å; L91-W171 HydrophobicContact CD2-CZ2 4.07Å; L109-W171 HydrophobicContact CD2-CG 4.42Å; E111-W171 HydrophobicContact CB-CB 4.32Å; E111-W171 HydrophobicContact CG-CB 4.35Å; V133-W171 HydrophobicContact CB-CH2 4.47Å; V133-W171 HydrophobicContact CG1-CH2 3.85Å; V133-W171 HydrophobicContact CG1-CZ3 4.22Å; L135-W171 HydrophobicContact CB-CH2 3.99Å; L135-W171 HydrophobicContact CB-CZ3 3.69Å; I162-W171 HydrophobicContact CB-CE3 4.14Å; I162-W171 HydrophobicContact CD1-CB 3.84Å; I162-W171 HydrophobicContact CD1-CD2 3.63Å; I162-W171 HydrophobicContact CD1-CE3 3.53Å; I162-W171 HydrophobicContact CD1-CG 3.77Å; I162-W171 HydrophobicContact CD1-CZ3 4.3Å; I162-W171 HydrophobicContact CG1-CD2 4.18Å; I162-W171 HydrophobicContact CG1-CE3 3.53Å; I162-W171 HydrophobicContact CG1-CZ3 4.08Å; C163-W171 CarbonylContact O-C 3.47Å; C163-W171 VanDerWaalsContact O-CA 3.31Å; C163-W171 WeakPolarHBondContact O-CA 3.23Å; G168-W171 PolarHBondContact O-NE1 3.29Å
172	S	98.7	Very high	98.1	Very high	37 Å²	37	50.1 Å²	50.1	26%	0.259	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-67.2	167.3	172.8	73.2	0	0	0	0	112.2	I162 C163	I162-S172 WeakPolarHBondContact CG2-O 3.4Å; C163-S172 PolarHBondContact N-OG 3.14Å; C163-S172 PolarHBondContact O-N 2.96Å
173	E	98.3	Very high	98	Very high	176 Å²	176	51 Å²	51	82%	0.822	27%	0.267	S	S	*	.	P	Polyproline II helix	trans	-59	154.8	158.1	-60.1	-171.3	127.5	0	0	110.8
174	V	98.7	Very high	97.8	Very high	38 Å²	38	54 Å²	54	23%	0.23	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-66.7	132.3	177.8	55.1	0	0	0	0	112	E111 T113 L114 F137 C160 I162	E111-V174 WeakPolarHBondContact O-CB 3.49Å; T113-V174 WeakPolarHBondContact O-CG1 3.22Å; L114-V174 HydrophobicContact CD2-CG1 3.78Å; L114-V174 HydrophobicContact CD2-CG2 4.36Å; F137-V174 HydrophobicContact CE2-CG2 4.22Å; F137-V174 HydrophobicContact CZ-CB 4.49Å; F137-V174 HydrophobicContact CZ-CG2 3.79Å; C160-V174 HydrophobicContact CB-CG2 3.78Å; I162-V174 HydrophobicContact CG2-CB 4.1Å
175	R	98.6	Very high	97.5	Very high	101 Å²	101	57 Å²	57	38%	0.381	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	124	163.4	-66.5	-166.2	66.1	-144.4	-12.9	109.6	C160 F161 L177 E180	C160-R175 VanDerWaalsContact CA-O 3.24Å; C160-R175 WeakPolarHBondContact CA-O 3.36Å; F161-R175 HydrophobicContact CE1-CB 4.38Å; F161-R175 HydrophobicContact CE2-CB 4.44Å; F161-R175 HydrophobicContact CE2-CG 4.4Å; F161-R175 HydrophobicContact CZ-CB 4.31Å; F161-R175 HydrophobicContact CZ-CG 4.38Å; F161-R175 PolarHBondContact N-O 3.31Å; F161-R175 VanDerWaalsContact N-O 3.08Å; F161-R175 PolarHBondContact O-N 2.86Å; R175-L177 HydrophobicContact CB-CD2 4.46Å; R175-E180 IonicContact CZ-OE2 2.76Å; R175-E180 IonicContact NH2-OE2 3.77Å; R175-E180 PolarHBondContact NH2-OE2 2.99Å
176	D	98.6	Very high	97.3	Very high	66 Å²	66	50.1 Å²	50.1	35%	0.353	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	114.6	165.1	-176	-7.7	0	0	0	108.7	R158 T178	R158-D176 WeakPolarHBondContact CD-OD2 3.26Å; R158-D176 IonicContact NH1-OD2 3.18Å; D176-T178 WeakPolarHBondContact OD1-CB 3.44Å; D176-T178 PolarHBondContact OD1-N 3.06Å; D176-T178 PolarHBondContact OD1-OG1 2.86Å
177	L	98.4	Very high	97	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.28	C	S	.	.			trans	-97.3	2.6	179.4	-67.1	-166	0	0	0	113.2	F136 L159 F161 R175 E179 E180 V181 W245	F136-L177 HydrophobicContact CE1-CD1 3.9Å; F136-L177 HydrophobicContact CZ-CD1 4.41Å; L159-L177 HydrophobicContact CD2-CB 3.95Å; L159-L177 HydrophobicContact CD2-CD1 4.49Å; L159-L177 HydrophobicContact CG-CB 4.11Å; L159-L177 PolarHBondContact O-N 2.88Å; F161-L177 HydrophobicContact CD1-CD1 3.61Å; F161-L177 HydrophobicContact CD1-CD2 4.32Å; F161-L177 HydrophobicContact CD1-CG 3.88Å; F161-L177 HydrophobicContact CE1-CD1 3.72Å; F161-L177 HydrophobicContact CE1-CD2 3.9Å; F161-L177 HydrophobicContact CE1-CG 3.96Å; R175-L177 HydrophobicContact CB-CD2 4.46Å; L177-E179 VanDerWaalsContact C-N 3.32Å; L177-E179 PolarHBondContact O-N 2.95Å; L177-E180 PolarHBondContact O-N 2.61Å; L177-E180 VanDerWaalsContact O-N 3.09Å; L177-V181 HydrophobicContact CB-CG2 3.9Å; L177-V181 HydrophobicContact CD1-CG2 3.91Å; L177-V181 PolarHBondContact O-N 3.33Å; L177-W245 HydrophobicContact CD1-CB 4.08Å; L177-W245 HydrophobicContact CD1-CG 3.94Å
178	T	98.4	Very high	96.9	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.287	C	S	.	.	I	π-helix	trans	-55.2	-46.3	-169.4	-52.5	0	0	0	0	112.2	R158 L159 D176 I182 G183 L186 F192	R158-T178 VanDerWaalsContact CA-OG1 3.24Å; R158-T178 WeakPolarHBondContact CA-OG1 3.25Å; R158-T178 WeakPolarHBondContact CD-OG1 3.2Å; L159-T178 PolarHBondContact N-OG1 2.92Å; D176-T178 WeakPolarHBondContact OD1-CB 3.44Å; D176-T178 PolarHBondContact OD1-N 3.06Å; D176-T178 PolarHBondContact OD1-OG1 2.86Å; T178-I182 HydrophobicContact CG2-CD1 4.39Å; T178-I182 WeakPolarHBondContact O-CA 3.29Å; T178-I182 VanDerWaalsContact O-CB 3.3Å; T178-I182 WeakPolarHBondContact O-CB 3.27Å; T178-I182 PolarHBondContact O-N 2.73Å; T178-G183 PolarHBondContact O-N 3.36Å; T178-L186 HydrophobicContact CG2-CD1 3.87Å; T178-L186 HydrophobicContact CG2-CD2 3.81Å; T178-L186 HydrophobicContact CG2-CG 4.47Å; T178-F192 HydrophobicContact CG2-CZ 4.47Å
179	E	97.7	Very high	96.8	Very high	116 Å²	116	55.1 Å²	55.1	54%	0.542	29%	0.288	S	S	.	.	I	π-helix	trans	-80.1	-27.1	179.7	-53.1	-57.4	155.9	0	0	113	R158 L177 G183	R158-E179 IonicContact NH1-OE1 3.9Å; R158-E179 PolarHBondContact NH1-OE1 2.96Å; L177-E179 VanDerWaalsContact C-N 3.32Å; L177-E179 PolarHBondContact O-N 2.95Å; E179-G183 VanDerWaalsContact O-CA 3.32Å; E179-G183 WeakPolarHBondContact O-CA 3.36Å; E179-G183 PolarHBondContact O-N 2.79Å
180	E	97.3	Very high	96.8	Very high	86 Å²	86	52.4 Å²	52.4	40%	0.402	27%	0.269	S	S	.	.	I	π-helix	trans	-71.1	-46.3	178.7	-171.3	-175.6	126.7	0	0	111.3	R175 L177	R175-E180 IonicContact CZ-OE2 2.76Å; R175-E180 IonicContact NH2-OE2 3.77Å; R175-E180 PolarHBondContact NH2-OE2 2.99Å; L177-E180 PolarHBondContact O-N 2.61Å; L177-E180 VanDerWaalsContact O-N 3.09Å
181	V	97.8	Very high	96.7	Very high	11 Å²	11	49.8 Å²	49.8	7%	0.067	25%	0.251	C	S	.	.	I	π-helix	trans	-93.1	-43.8	-173.3	176.1	0	0	0	0	112.5	L159 L177 I236 W245 H247	L159-V181 HydrophobicContact CD2-CB 3.86Å; L159-V181 HydrophobicContact CD2-CG1 3.92Å; L159-V181 HydrophobicContact CD2-CG2 4.04Å; L177-V181 HydrophobicContact CB-CG2 3.9Å; L177-V181 HydrophobicContact CD1-CG2 3.91Å; L177-V181 PolarHBondContact O-N 3.33Å; V181-I236 HydrophobicContact CG1-CG1 4.27Å; V181-I236 HydrophobicContact CG1-CG2 4.33Å; V181-W245 HydrophobicContact CG2-CB 3.54Å; V181-H247 HydrophobicContact CG1-CB 4.17Å; V181-H247 PolarHBondContact O-CD2 3.29Å
182	I	97.4	Very high	96.7	Very high	8 Å²	8	49 Å²	49	4%	0.041	25%	0.248	C	C	.	.	I	π-helix	trans	-101.5	-44.2	-172.2	-47.9	168.9	0	0	0	110.5	L159 T178 S184 E185 L186 W189 F192	L159-I182 HydrophobicContact CB-CD1 4.38Å; T178-I182 HydrophobicContact CG2-CD1 4.39Å; T178-I182 WeakPolarHBondContact O-CA 3.29Å; T178-I182 VanDerWaalsContact O-CB 3.3Å; T178-I182 WeakPolarHBondContact O-CB 3.27Å; T178-I182 PolarHBondContact O-N 2.73Å; I182-S184 PolarHBondContact O-N 2.94Å; I182-E185 HydrophobicContact CG2-CB 4.29Å; I182-E185 PolarHBondContact O-N 3.14Å; I182-L186 HydrophobicContact CD1-CD1 4.46Å; I182-L186 HydrophobicContact CG2-CB 4.08Å; I182-L186 HydrophobicContact CG2-CD1 4.2Å; I182-W189 HydrophobicContact CD1-CE3 3.89Å; I182-W189 HydrophobicContact CD1-CH2 4.38Å; I182-W189 HydrophobicContact CD1-CZ3 3.58Å; I182-W189 HydrophobicContact CG1-CE3 4.32Å; I182-W189 HydrophobicContact CG1-CH2 4.1Å; I182-W189 HydrophobicContact CG1-CZ3 3.79Å; I182-W189 HydrophobicContact CG2-CD2 3.79Å; I182-W189 HydrophobicContact CG2-CE3 3.75Å; I182-W189 HydrophobicContact CG2-CG 4.44Å; I182-W189 HydrophobicContact CG2-CH2 4.07Å; I182-W189 HydrophobicContact CG2-CZ2 4.08Å; I182-W189 HydrophobicContact CG2-CZ3 3.91Å; I182-F192 HydrophobicContact CD1-CD1 4.05Å; I182-F192 HydrophobicContact CD1-CD2 4.21Å; I182-F192 HydrophobicContact CD1-CE1 3.65Å; I182-F192 HydrophobicContact CD1-CE2 3.84Å; I182-F192 HydrophobicContact CD1-CG 4.32Å; I182-F192 HydrophobicContact CD1-CZ 3.53Å
183	G	95.8	Very high	96.7	Very high	18 Å²	18	47.3 Å²	47.3	19%	0.186	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	45.4	-120.6	174.1	0	0	0	0	0	113.5	T178 E179 E185 L186	T178-G183 PolarHBondContact O-N 3.36Å; E179-G183 VanDerWaalsContact O-CA 3.32Å; E179-G183 WeakPolarHBondContact O-CA 3.36Å; E179-G183 PolarHBondContact O-N 2.79Å; G183-E185 PolarHBondContact O-N 2.74Å; G183-E185 VanDerWaalsContact O-N 3.11Å; G183-L186 WeakPolarHBondContact O-CB 3.35Å; G183-L186 PolarHBondContact O-N 2.76Å
184	S	93.7	Very high	96.7	Very high	91 Å²	91	38.9 Å²	38.9	64%	0.636	20%	0.197	S	C	*	.	G	3₁₀ helix	trans	-65.7	-16.2	-173.6	85.1	0	0	0	0	115.4	I182 L186 K187	I182-S184 PolarHBondContact O-N 2.94Å; S184-L186 VanDerWaalsContact C-N 3.32Å; S184-K187 VanDerWaalsContact O-CD 3.25Å; S184-K187 WeakPolarHBondContact O-CD 3.35Å; S184-K187 WeakPolarHBondContact O-CE 3.33Å; S184-K187 WeakPolarHBondContact O-CG 3.49Å; S184-K187 PolarHBondContact O-NZ 2.86Å
185	E	93.6	Very high	96.2	Very high	64 Å²	64	37.1 Å²	37.1	30%	0.299	19%	0.186	S	C	.	.	G	3₁₀ helix	trans	-78.8	-14.3	175	-74.7	-61.6	104	0	0	112.9	I182 G183 K187 H188	I182-E185 HydrophobicContact CG2-CB 4.29Å; I182-E185 PolarHBondContact O-N 3.14Å; G183-E185 PolarHBondContact O-N 2.74Å; G183-E185 VanDerWaalsContact O-N 3.11Å; E185-K187 PolarHBondContact O-N 3.44Å; E185-K187 VanDerWaalsContact O-N 3.09Å; E185-H188 WeakPolarHBondContact O-CA 3.33Å; E185-H188 WeakPolarHBondContact O-CB 3.48Å; E185-H188 PolarHBondContact O-N 3.11Å; E185-H188 IonicContact OE1-CD2 3.83Å; E185-H188 IonicContact OE2-CD2 2.62Å
186	L	94.5	Very high	96.1	Very high	27 Å²	27	32.3 Å²	32.3	14%	0.141	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-57	-31.4	-178.2	-171.8	68.8	0	0	0	112.6	T178 I182 G183 S184 H188 W189 F192	T178-L186 HydrophobicContact CG2-CD1 3.87Å; T178-L186 HydrophobicContact CG2-CD2 3.81Å; T178-L186 HydrophobicContact CG2-CG 4.47Å; I182-L186 HydrophobicContact CD1-CD1 4.46Å; I182-L186 HydrophobicContact CG2-CB 4.08Å; I182-L186 HydrophobicContact CG2-CD1 4.2Å; G183-L186 WeakPolarHBondContact O-CB 3.35Å; G183-L186 PolarHBondContact O-N 2.76Å; S184-L186 VanDerWaalsContact C-N 3.32Å; L186-H188 PolarHBondContact O-N 3.21Å; L186-W189 PolarHBondContact O-N 3.17Å; L186-F192 HydrophobicContact CD1-CD1 4.37Å; L186-F192 HydrophobicContact CD1-CE1 3.77Å
187	K	91.4	Very high	96.1	Very high	120 Å²	120	29.1 Å²	29.1	52%	0.522	15%	0.151	S	C	.	.	G	3₁₀ helix	trans	-62.6	-21.9	173.7	75.2	-161.9	175.5	-154.7	0	114	S184 E185	S184-K187 VanDerWaalsContact O-CD 3.25Å; S184-K187 WeakPolarHBondContact O-CD 3.35Å; S184-K187 WeakPolarHBondContact O-CE 3.33Å; S184-K187 WeakPolarHBondContact O-CG 3.49Å; S184-K187 PolarHBondContact O-NZ 2.86Å; E185-K187 PolarHBondContact O-N 3.44Å; E185-K187 VanDerWaalsContact O-N 3.09Å
188	H	93.3	Very high	96.1	Very high	48 Å²	48	29.9 Å²	29.9	22%	0.222	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-95.4	-1.9	175.6	-66.9	-71.4	0	0	0	112.5	E185 L186 Y215 I216	E185-H188 WeakPolarHBondContact O-CA 3.33Å; E185-H188 WeakPolarHBondContact O-CB 3.48Å; E185-H188 PolarHBondContact O-N 3.11Å; E185-H188 IonicContact OE1-CD2 3.83Å; E185-H188 IonicContact OE2-CD2 2.62Å; L186-H188 PolarHBondContact O-N 3.21Å; H188-Y215 HydrophobicContact CB-CD2 4.1Å; H188-Y215 HydrophobicContact CB-CE2 3.62Å; H188-Y215 CarbonylContact O-C 3.53Å; H188-Y215 WeakPolarHBondContact O-CA 3.3Å; H188-I216 PolarHBondContact ND1-O 3.49Å; H188-I216 PolarHBondContact O-N 2.8Å
189	W	96.1	Very high	96.1	Very high	7 Å²	7	30 Å²	30	3%	0.027	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	100.2	-174	-70.2	31.1	0	0	0	108.3	N155 I182 L186 T191 F192 T213 L234 H247	N155-W189 WeakPolarHBondContact CB-O 3.46Å; N155-W189 PolarHBondContact ND2-O 2.8Å; I182-W189 HydrophobicContact CD1-CE3 3.89Å; I182-W189 HydrophobicContact CD1-CH2 4.38Å; I182-W189 HydrophobicContact CD1-CZ3 3.58Å; I182-W189 HydrophobicContact CG1-CE3 4.32Å; I182-W189 HydrophobicContact CG1-CH2 4.1Å; I182-W189 HydrophobicContact CG1-CZ3 3.79Å; I182-W189 HydrophobicContact CG2-CD2 3.79Å; I182-W189 HydrophobicContact CG2-CE3 3.75Å; I182-W189 HydrophobicContact CG2-CG 4.44Å; I182-W189 HydrophobicContact CG2-CH2 4.07Å; I182-W189 HydrophobicContact CG2-CZ2 4.08Å; I182-W189 HydrophobicContact CG2-CZ3 3.91Å; L186-W189 PolarHBondContact O-N 3.17Å; W189-T191 VanDerWaalsContact C-N 3.28Å; W189-T191 PolarHBondContact O-N 2.93Å; W189-F192 HydrophobicContact CE3-CB 3.65Å; W189-F192 AromaticContact CE3-CD1 3.72Å; W189-F192 HydrophobicContact CE3-CD1 3.72Å; W189-F192 AromaticContact CE3-CG 3.76Å; W189-F192 HydrophobicContact CE3-CG 3.76Å; W189-F192 HydrophobicContact CZ3-CB 3.97Å; W189-F192 HydrophobicContact CZ3-CD1 4.34Å; W189-F192 HydrophobicContact CZ3-CG 4.03Å; W189-T213 VanDerWaalsContact CB-OG1 3.3Å; W189-T213 WeakPolarHBondContact CB-OG1 3.38Å; W189-T213 HydrophobicContact CD2-CG2 3.92Å; W189-T213 HydrophobicContact CE3-CG2 4.29Å; W189-T213 HydrophobicContact CG-CG2 4.32Å; W189-T213 HydrophobicContact CH2-CG2 4.49Å; W189-T213 HydrophobicContact CZ2-CG2 4.15Å; W189-L234 HydrophobicContact CH2-CD1 3.92Å; W189-L234 HydrophobicContact CH2-CD2 4.05Å; W189-L234 HydrophobicContact CZ2-CD2 4.47Å; W189-H247 AromaticContact CZ2-NE2 3.96Å
190	A	96.6	Very high	96.2	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	-43.1	-178.8	0	0	0	0	0	111.2	Q149 N155 Y214 I216 T229	Q149-A190 WeakPolarHBondContact CB-O 3.45Å; N155-A190 WeakPolarHBondContact CA-O 3.3Å; N155-A190 PolarHBondContact N-O 3.25Å; A190-Y214 WeakPolarHBondContact CB-O 3.28Å; A190-Y214 PolarHBondContact N-O 2.79Å; A190-I216 HydrophobicContact CB-CD1 3.92Å; A190-I216 HydrophobicContact CB-CG1 4Å; A190-T229 HydrophobicContact CB-CG2 3.77Å
191	T	97.9	Very high	96.2	Very high	8 Å²	8	22.6 Å²	22.6	5%	0.049	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	163.5	166	-171.6	0	0	0	0	108.3	E146 Q149 I150 W189 T213 Y214	E146-T191 HydrophobicContact CG-CG2 3.79Å; Q149-T191 HydrophobicContact CB-CG2 4.31Å; Q149-T191 PolarHBondContact NE2-OG1 3.44Å; Q149-T191 PolarHBondContact OE1-OG1 2.84Å; I150-T191 HydrophobicContact CG1-CG2 4.19Å; W189-T191 VanDerWaalsContact C-N 3.28Å; W189-T191 PolarHBondContact O-N 2.93Å; T191-T213 PolarHBondContact O-OG1 2.83Å; T191-Y214 HydrophobicContact CG2-CD2 3.5Å; T191-Y214 HydrophobicContact CG2-CE2 4.06Å; T191-Y214 HydrophobicContact CG2-CG 4.23Å; T191-Y214 PolarHBondContact O-N 2.92Å
192	F	98.6	Very high	96.2	Very high	6 Å²	6	22 Å²	22	3%	0.026	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	167.4	178.7	63.1	-91	0	0	0	111.2	I138 N155 A157 L159 T178 I182 L186 W189 Y212	I138-F192 HydrophobicContact CG2-CD2 4.25Å; I138-F192 HydrophobicContact CG2-CE2 4.01Å; N155-F192 WeakPolarHBondContact ND2-CD1 3.38Å; A157-F192 HydrophobicContact CB-CD1 4.33Å; A157-F192 HydrophobicContact CB-CE1 3.97Å; A157-F192 HydrophobicContact CB-CZ 4.09Å; L159-F192 HydrophobicContact CB-CE2 3.8Å; L159-F192 HydrophobicContact CB-CZ 4.13Å; T178-F192 HydrophobicContact CG2-CZ 4.47Å; I182-F192 HydrophobicContact CD1-CD1 4.05Å; I182-F192 HydrophobicContact CD1-CD2 4.21Å; I182-F192 HydrophobicContact CD1-CE1 3.65Å; I182-F192 HydrophobicContact CD1-CE2 3.84Å; I182-F192 HydrophobicContact CD1-CG 4.32Å; I182-F192 HydrophobicContact CD1-CZ 3.53Å; L186-F192 HydrophobicContact CD1-CD1 4.37Å; L186-F192 HydrophobicContact CD1-CE1 3.77Å; W189-F192 HydrophobicContact CE3-CB 3.65Å; W189-F192 AromaticContact CE3-CD1 3.72Å; W189-F192 HydrophobicContact CE3-CD1 3.72Å; W189-F192 AromaticContact CE3-CG 3.76Å; W189-F192 HydrophobicContact CE3-CG 3.76Å; W189-F192 HydrophobicContact CZ3-CB 3.97Å; W189-F192 HydrophobicContact CZ3-CD1 4.34Å; W189-F192 HydrophobicContact CZ3-CG 4.03Å; F192-Y212 CarbonylContact C-O 3.59Å; F192-Y212 WeakPolarHBondContact CA-O 3.39Å; F192-Y212 VanDerWaalsContact CB-O 3.25Å; F192-Y212 WeakPolarHBondContact CB-O 3.37Å
193	A	98.4	Very high	96	Very high	2 Å²	2	26.7 Å²	26.7	2%	0.017	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	161.8	167.6	0	0	0	0	0	112.5	N121 I138 A211 Y212	N121-A193 WeakPolarHBondContact ND2-CB 3.19Å; I138-A193 HydrophobicContact CD1-CB 3.79Å; I138-A193 HydrophobicContact CG2-CB 4.37Å; A193-A211 CarbonylContact O-C 3.58Å; A193-A211 VanDerWaalsContact O-CA 3.27Å; A193-A211 WeakPolarHBondContact O-CA 3.24Å; A193-A211 WeakPolarHBondContact O-CB 3.16Å; A193-Y212 HydrophobicContact CB-CD1 4.46Å; A193-Y212 HydrophobicContact CB-CE1 3.74Å; A193-Y212 HydrophobicContact CB-CE2 4.37Å; A193-Y212 PolarHBondContact N-O 3.05Å; A193-Y212 PolarHBondContact O-N 3.43Å
194	V	97.8	Very high	96	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	156.8	163.8	-65.6	0	0	0	0	110.3	N121 C123 F136 L159 I209 P210 A211 I236	N121-V194 WeakPolarHBondContact CB-O 3.43Å; N121-V194 PolarHBondContact ND2-O 3.43Å; N121-V194 WeakPolarHBondContact O-CG2 3.35Å; C123-V194 HydrophobicContact CB-CB 4.18Å; C123-V194 HydrophobicContact CB-CG2 3.92Å; F136-V194 HydrophobicContact CB-CG1 4.44Å; F136-V194 HydrophobicContact CB-CG2 4.19Å; L159-V194 HydrophobicContact CD1-CG1 3.52Å; V194-I209 HydrophobicContact CB-CG2 4.08Å; V194-I209 HydrophobicContact CG1-CG2 3.94Å; V194-P210 CarbonylContact C-O 3.5Å; V194-P210 WeakPolarHBondContact CA-O 3.24Å; V194-A211 HydrophobicContact CG1-CB 4.41Å; V194-I236 HydrophobicContact CG1-CD1 4.12Å
195	G	88.7	Confident	96.1	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.138	C	C	.	.			trans	38.7	-118.9	179	0	0	0	0	0	113.6	P210	G195-P210 PolarHBondContact N-O 2.67Å
196	P	96.6	Very high	96.3	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.127	C	C	.	.	S	Bend	cis	-79.8	160.9	-5.1	32.5	-33.2	0	0	0	112.2	I59 N121 Q313 Y403	I59-P196 HydrophobicContact CG2-CB 3.23Å; I59-P196 HydrophobicContact CG2-CG 3.49Å; I59-P196 VanDerWaalsContact CG2-CG 3.49Å; N121-P196 HydrophobicContact CB-CB 4.11Å; P196-Q313 HydrophobicContact CG-CG 4.24Å; P196-Q313 WeakPolarHBondContact O-CG 3.36Å; P196-Q313 PolarHBondContact O-NE2 3.32Å; P196-Y403 HydrophobicContact CG-CD1 3.89Å; P196-Y403 HydrophobicContact CG-CE1 3.75Å
197	G	98.4	Very high	96.5	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.12	C	C	.	.	S	Bend	trans	135.9	-127.3	-170.3	0	0	0	0	0	108.3	A61 P122 C123 P124 E260 D405	A61-G197 WeakPolarHBondContact CB-O 3.36Å; P122-G197 PolarHBondContact O-N 3.35Å; C123-G197 WeakPolarHBondContact CA-O 3.41Å; P124-G197 VanDerWaalsContact CD-O 3.29Å; P124-G197 WeakPolarHBondContact CD-O 3.43Å; G197-E260 VanDerWaalsContact CA-OE1 3.27Å; G197-E260 WeakPolarHBondContact CA-OE1 3.38Å; G197-D405 WeakPolarHBondContact CA-OD2 3.37Å
198	H	98.8	Very high	96.9	Very high	15 Å²	15	17 Å²	17	7%	0.069	10%	0.096	C	C	.	.			trans	-128.1	167.6	177.9	62.5	-78.6	0	0	0	113.1	C123 P210 E260 S315 V316 D405 L406	C123-H198 VanDerWaalsContact SG-C 3.56Å; H198-P210 VanDerWaalsContact O-CD 3.3Å; H198-P210 WeakPolarHBondContact O-CD 3.34Å; H198-P210 WeakPolarHBondContact O-CG 3.25Å; H198-E260 IonicContact CE1-OE1 2.76Å; H198-E260 IonicContact CE1-OE2 2.73Å; H198-E260 IonicContact CG-OE1 3.49Å; H198-E260 PolarHBondContact N-OE1 3.23Å; H198-E260 IonicContact ND1-OE1 3.28Å; H198-E260 PolarHBondContact ND1-OE1 2.92Å; H198-S315 PolarHBondContact CE1-OG 2.8Å; H198-V316 PolarHBondContact CE1-O 3.29Å; H198-D405 IonicContact CE1-OD1 2.61Å; H198-D405 IonicContact CG-OD1 3.03Å; H198-D405 PolarHBondContact N-OD2 2.92Å; H198-D405 IonicContact ND1-OD1 3.91Å; H198-D405 PolarHBondContact ND1-OD1 3.07Å; H198-D405 IonicContact ND1-OD2 3.82Å; H198-L406 PolarHBondContact CE1-O 2.7Å
199	G	98.6	Very high	97.1	Very high	4 Å²	4	14.7 Å²	14.7	4%	0.041	9%	0.085	C	C	.	.			trans	-108.5	164.6	163.6	0	0	0	0	0	110.5	P124 V208	P124-G199 PolarHBondContact O-N 2.91Å; G199-V208 CarbonylContact C-O 3.53Å; G199-V208 WeakPolarHBondContact CA-O 3.22Å
200	I	98.3	Very high	97.3	Very high	27 Å²	27	14.3 Å²	14.3	14%	0.138	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	155.8	-177.4	66	174.5	0	0	0	111.8	L202 V208 V261 E263 L273	I200-L202 HydrophobicContact CD1-CD2 3.62Å; I200-L202 HydrophobicContact CG1-CD2 4.04Å; I200-V208 HydrophobicContact CG1-CB 4.16Å; I200-V208 PolarHBondContact N-O 3.11Å; I200-V208 PolarHBondContact O-N 3.03Å; I200-V261 HydrophobicContact CD1-CG2 4.1Å; I200-V261 HydrophobicContact CG1-CG2 4.17Å; I200-E263 HydrophobicContact CD1-CB 4.48Å; I200-L273 HydrophobicContact CD1-CD1 3.73Å
201	Q	98.2	Very high	97.4	Very high	18 Å²	18	14.5 Å²	14.5	8%	0.084	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	122.8	162.8	-168.2	179.4	31.4	0	0	109.1	E127 R128 G205 R206 L207	E127-Q201 PolarHBondContact OE1-NE2 3.23Å; R128-Q201 VanDerWaalsContact CB-OE1 3.25Å; R128-Q201 VanDerWaalsContact CG-OE1 3.26Å; R128-Q201 PolarHBondContact NH1-O 3.06Å; R128-Q201 PolarHBondContact NH2-O 3.37Å; Q201-G205 WeakPolarHBondContact CG-O 3.24Å; Q201-G205 PolarHBondContact NE2-O 2.85Å; Q201-R206 WeakPolarHBondContact CA-O 3.47Å; Q201-L207 HydrophobicContact CB-CD2 3.78Å; Q201-L207 HydrophobicContact CG-CD2 3.76Å
202	L	97.3	Very high	97.4	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	9%	0.087	C	C	.	.			trans	-70.1	164.1	-179.6	-58.2	-170.7	0	0	0	112.3	R128 I200 S204 G205 R206 V208 E263 L273 H292	R128-L202 PolarHBondContact NH2-O 3.34Å; I200-L202 HydrophobicContact CD1-CD2 3.62Å; I200-L202 HydrophobicContact CG1-CD2 4.04Å; L202-S204 PolarHBondContact O-N 2.84Å; L202-G205 PolarHBondContact O-N 3.15Å; L202-R206 HydrophobicContact CD1-CB 4.21Å; L202-R206 HydrophobicContact CG-CB 4.46Å; L202-R206 PolarHBondContact N-O 3.07Å; L202-V208 HydrophobicContact CD1-CG2 3.92Å; L202-V208 HydrophobicContact CD2-CG2 4.2Å; L202-V208 HydrophobicContact CG-CG2 3.88Å; L202-E263 WeakPolarHBondContact CB-OE1 3.38Å; L202-E263 HydrophobicContact CD2-CB 3.98Å; L202-E263 HydrophobicContact CD2-CG 4.27Å; L202-L273 HydrophobicContact CD2-CD1 4.02Å; L202-H292 HydrophobicContact CD1-CB 3.7Å
203	Q	94.1	Very high	97.4	Very high	106 Å²	106	14.8 Å²	14.8	50%	0.495	9%	0.086	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-27.9	170.1	-81.8	162	79.2	0	0	112.7	G205 E263	Q203-G205 PolarHBondContact O-N 2.74Å; Q203-E263 WeakPolarHBondContact CB-OE2 3.44Å; Q203-E263 WeakPolarHBondContact CG-OE2 3.31Å; Q203-E263 PolarHBondContact N-OE1 2.82Å; Q203-E263 PolarHBondContact N-OE2 2.88Å; Q203-E263 PolarHBondContact NE2-OE2 3.47Å
204	S	94.9	Very high	97.3	Very high	69 Å²	69	16.3 Å²	16.3	48%	0.483	9%	0.091	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-10.3	173.2	62.4	0	0	0	0	114.4	L202 R206	L202-S204 PolarHBondContact O-N 2.84Å; S204-R206 VanDerWaalsContact C-N 3.34Å
205	G	96.7	Very high	97.2	Very high	28 Å²	28	18.4 Å²	18.4	29%	0.289	10%	0.099	S	C	.	.	S	Bend	trans	90.4	-13.6	-173.8	0	0	0	0	0	114.6	Q201 L202 Q203 L207	Q201-G205 WeakPolarHBondContact CG-O 3.24Å; Q201-G205 PolarHBondContact NE2-O 2.85Å; L202-G205 PolarHBondContact O-N 3.15Å; Q203-G205 PolarHBondContact O-N 2.74Å; G205-L207 PolarHBondContact O-N 2.89Å
206	R	98	Very high	97.4	Very high	18 Å²	18	18.9 Å²	18.9	7%	0.068	10%	0.102	C	C	.	.			trans	-58.7	130.6	175.2	178.9	178.6	-79.5	-168.1	-8.7	110.7	Q201 L202 S204 V208 Y237 S238 D239 D291 H292 E294	Q201-R206 WeakPolarHBondContact CA-O 3.47Å; L202-R206 HydrophobicContact CD1-CB 4.21Å; L202-R206 HydrophobicContact CG-CB 4.46Å; L202-R206 PolarHBondContact N-O 3.07Å; S204-R206 VanDerWaalsContact C-N 3.34Å; R206-V208 HydrophobicContact CG-CG2 4.11Å; R206-Y237 HydrophobicContact CG-CD2 4.37Å; R206-S238 CarbonylContact C-O 3.57Å; R206-S238 WeakPolarHBondContact CA-O 3.25Å; R206-D239 WeakPolarHBondContact CB-OD1 3.29Å; R206-D239 WeakPolarHBondContact CG-OD1 3.47Å; R206-D239 IonicContact CZ-OD1 3.93Å; R206-D239 IonicContact CZ-OD2 3.59Å; R206-D239 IonicContact NE-OD1 2.8Å; R206-D239 PolarHBondContact NE-OD1 2.85Å; R206-D239 IonicContact NE-OD2 2.71Å; R206-D239 PolarHBondContact NE-OD2 2.84Å; R206-D239 IonicContact NH2-OD1 3.65Å; R206-D239 PolarHBondContact NH2-OD1 2.97Å; R206-D239 IonicContact NH2-OD2 3.11Å; R206-D239 PolarHBondContact NH2-OD2 3.43Å; R206-D291 PolarHBondContact NH1-O 2.73Å; R206-H292 WeakPolarHBondContact CD-O 3.28Å; R206-H292 PolarHBondContact NH1-O 2.89Å; R206-E294 IonicContact CZ-OE1 2.83Å; R206-E294 IonicContact NH1-OE1 2.74Å; R206-E294 PolarHBondContact NH1-OE1 2.8Å; R206-E294 IonicContact NH2-OE1 2.7Å; R206-E294 PolarHBondContact NH2-OE1 2.88Å
207	L	98.7	Very high	96.7	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	138.4	168.5	-63.1	171	0	0	0	109.4	V125 E127 F134 Q201 G205 Y237 S238 W245	V125-L207 HydrophobicContact CG1-CD2 4.39Å; V125-L207 HydrophobicContact CG2-CD2 3.83Å; E127-L207 HydrophobicContact CB-CD1 4.24Å; E127-L207 HydrophobicContact CB-CD2 4.04Å; E127-L207 HydrophobicContact CG-CD1 3.95Å; E127-L207 HydrophobicContact CG-CD2 4.06Å; E127-L207 HydrophobicContact CG-CG 4.33Å; F134-L207 HydrophobicContact CD2-CD1 4.33Å; F134-L207 HydrophobicContact CE2-CD1 4.13Å; Q201-L207 HydrophobicContact CB-CD2 3.78Å; Q201-L207 HydrophobicContact CG-CD2 3.76Å; G205-L207 PolarHBondContact O-N 2.89Å; L207-Y237 CarbonylContact O-C 3.52Å; L207-Y237 WeakPolarHBondContact O-CA 3.28Å; L207-Y237 WeakPolarHBondContact O-CB 3.38Å; L207-S238 PolarHBondContact N-O 2.84Å; L207-S238 PolarHBondContact O-N 2.81Å; L207-S238 VanDerWaalsContact O-N 3.08Å; L207-W245 HydrophobicContact CB-CH2 3.74Å; L207-W245 HydrophobicContact CB-CZ3 4.01Å; L207-W245 HydrophobicContact CD1-CH2 3.67Å; L207-W245 HydrophobicContact CD1-CZ2 3.94Å; L207-W245 HydrophobicContact CG-CH2 4.35Å
208	V	98.6	Very high	95.4	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	125.6	-179.2	-178.4	0	0	0	0	110.2	G199 I200 L202 R206 M235 V261 L273	G199-V208 CarbonylContact C-O 3.53Å; G199-V208 WeakPolarHBondContact CA-O 3.22Å; I200-V208 HydrophobicContact CG1-CB 4.16Å; I200-V208 PolarHBondContact N-O 3.11Å; I200-V208 PolarHBondContact O-N 3.03Å; L202-V208 HydrophobicContact CD1-CG2 3.92Å; L202-V208 HydrophobicContact CD2-CG2 4.2Å; L202-V208 HydrophobicContact CG-CG2 3.88Å; R206-V208 HydrophobicContact CG-CG2 4.11Å; V208-M235 HydrophobicContact CG1-CB 4.05Å; V208-M235 HydrophobicContact CG1-CG 4.08Å; V208-M235 HydrophobicContact CG1-SD 3.94Å; V208-V261 HydrophobicContact CG1-CG2 4.21Å; V208-L273 HydrophobicContact CG1-CD2 4.24Å
209	I	98.8	Very high	93.7	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	117.8	176.5	-52.3	-59.5	0	0	0	108	C123 V125 F136 V194 I236 W245	C123-I209 HydrophobicContact CB-CG2 4.48Å; V125-I209 HydrophobicContact CB-CD1 3.8Å; V125-I209 HydrophobicContact CG1-CD1 3.55Å; F136-I209 HydrophobicContact CB-CG2 4.21Å; F136-I209 HydrophobicContact CD1-CG1 4.48Å; F136-I209 HydrophobicContact CD2-CD1 3.55Å; F136-I209 HydrophobicContact CD2-CG1 3.73Å; F136-I209 HydrophobicContact CE1-CG1 4.47Å; F136-I209 HydrophobicContact CE2-CD1 3.78Å; F136-I209 HydrophobicContact CE2-CG1 3.74Å; F136-I209 HydrophobicContact CG-CD1 4.26Å; F136-I209 HydrophobicContact CG-CG1 4.12Å; F136-I209 HydrophobicContact CG-CG2 4.17Å; F136-I209 HydrophobicContact CZ-CG1 4.12Å; V194-I209 HydrophobicContact CB-CG2 4.08Å; V194-I209 HydrophobicContact CG1-CG2 3.94Å; I209-I236 HydrophobicContact CB-CB 4.19Å; I209-I236 PolarHBondContact N-O 2.81Å; I209-I236 PolarHBondContact O-N 2.9Å; I209-W245 HydrophobicContact CG1-CH2 4.38Å; I209-W245 HydrophobicContact CG1-CZ3 3.88Å
210	P	98.5	Very high	91.6	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	143.9	173.7	26	-32	0	0	0	111.2	V194 G195 H198 M235 C259 V261	V194-P210 CarbonylContact C-O 3.5Å; V194-P210 WeakPolarHBondContact CA-O 3.24Å; G195-P210 PolarHBondContact N-O 2.67Å; H198-P210 VanDerWaalsContact O-CD 3.3Å; H198-P210 WeakPolarHBondContact O-CD 3.34Å; H198-P210 WeakPolarHBondContact O-CG 3.25Å; P210-M235 HydrophobicContact CB-SD 4.22Å; P210-C259 VanDerWaalsContact CB-O 3.28Å; P210-C259 WeakPolarHBondContact CB-O 3.28Å; P210-V261 HydrophobicContact CG-CG2 4.47Å
211	A	98.6	Very high	89.5	Confident	4 Å²	4	47.2 Å²	47.2	3%	0.033	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	169.6	-179.5	0	0	0	0	0	112.5	A193 V194 S233 L234 I236	A193-A211 CarbonylContact O-C 3.58Å; A193-A211 VanDerWaalsContact O-CA 3.27Å; A193-A211 WeakPolarHBondContact O-CA 3.24Å; A193-A211 WeakPolarHBondContact O-CB 3.16Å; V194-A211 HydrophobicContact CG1-CB 4.41Å; A211-S233 CarbonylContact O-C 3.49Å; A211-S233 VanDerWaalsContact O-CA 3.25Å; A211-S233 WeakPolarHBondContact O-CA 3.34Å; A211-L234 CarbonylContact C-O 3.55Å; A211-L234 HydrophobicContact CB-CD1 4.33Å; A211-L234 HydrophobicContact CB-CG 4.05Å; A211-L234 PolarHBondContact N-O 3.18Å; A211-L234 PolarHBondContact O-N 2.97Å; A211-I236 HydrophobicContact CB-CD1 3.96Å; A211-I236 HydrophobicContact CB-CG1 4.34Å
212	Y	98.5	Very high	87.2	Confident	20 Å²	20	51.7 Å²	51.7	8%	0.078	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	154.8	171.1	66.2	-87	0	0	0	112.5	F192 A193 Y214 H232 V257 E258	F192-Y212 CarbonylContact C-O 3.59Å; F192-Y212 WeakPolarHBondContact CA-O 3.39Å; F192-Y212 VanDerWaalsContact CB-O 3.25Å; F192-Y212 WeakPolarHBondContact CB-O 3.37Å; A193-Y212 HydrophobicContact CB-CD1 4.46Å; A193-Y212 HydrophobicContact CB-CE1 3.74Å; A193-Y212 HydrophobicContact CB-CE2 4.37Å; A193-Y212 PolarHBondContact N-O 3.05Å; A193-Y212 PolarHBondContact O-N 3.43Å; Y212-Y214 HydrophobicContact CD2-CE2 4.4Å; Y212-Y214 AromaticContact CE2-CE2 3.98Å; Y212-Y214 HydrophobicContact CE2-CE2 3.98Å; Y212-H232 WeakPolarHBondContact CA-O 3.29Å; Y212-V257 HydrophobicContact CD2-CB 4.01Å; Y212-V257 HydrophobicContact CD2-CG1 4.14Å; Y212-V257 HydrophobicContact CE2-CB 4.21Å; Y212-V257 HydrophobicContact CE2-CG1 4.38Å; Y212-V257 HydrophobicContact CG-CB 4.24Å; Y212-E258 HydrophobicContact CD1-CG 4.47Å; Y212-E258 HydrophobicContact CE1-CB 4.37Å; Y212-E258 HydrophobicContact CE1-CG 3.69Å
213	T	98.1	Very high	84.9	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	141.8	179.1	-178	0	0	0	0	112.2	W189 T191 Y215 P231 H232 L234 L250	W189-T213 VanDerWaalsContact CB-OG1 3.3Å; W189-T213 WeakPolarHBondContact CB-OG1 3.38Å; W189-T213 HydrophobicContact CD2-CG2 3.92Å; W189-T213 HydrophobicContact CE3-CG2 4.29Å; W189-T213 HydrophobicContact CG-CG2 4.32Å; W189-T213 HydrophobicContact CH2-CG2 4.49Å; W189-T213 HydrophobicContact CZ2-CG2 4.15Å; T191-T213 PolarHBondContact O-OG1 2.83Å; T213-Y215 PolarHBondContact O-N 3.44Å; T213-P231 CarbonylContact O-C 3.54Å; T213-P231 VanDerWaalsContact O-CA 3.24Å; T213-P231 WeakPolarHBondContact O-CA 3.46Å; T213-H232 PolarHBondContact N-O 3Å; T213-H232 PolarHBondContact O-N 3.07Å; T213-L234 HydrophobicContact CG2-CD2 3.75Å; T213-L250 HydrophobicContact CG2-CD1 3.83Å; T213-L250 HydrophobicContact CG2-CD2 3.71Å; T213-L250 HydrophobicContact CG2-CG 4.48Å
214	Y	97.4	Very high	82.6	Confident	33 Å²	33	63.9 Å²	63.9	13%	0.129	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	88.9	168.8	-73.2	-94.1	0	0	0	110.1	E146 I150 A190 T191 Y212 P231	E146-Y214 VanDerWaalsContact CD-OH 3.31Å; E146-Y214 HydrophobicContact CG-CE2 4.17Å; E146-Y214 WeakPolarHBondContact OE1-CE2 3.35Å; E146-Y214 PolarHBondContact OE1-OH 3.19Å; I150-Y214 HydrophobicContact CD1-CD1 3.67Å; I150-Y214 HydrophobicContact CD1-CD2 4.19Å; I150-Y214 HydrophobicContact CD1-CE1 3.44Å; I150-Y214 VanDerWaalsContact CD1-CE1 3.44Å; I150-Y214 HydrophobicContact CD1-CE2 3.96Å; I150-Y214 HydrophobicContact CD1-CG 4.03Å; I150-Y214 HydrophobicContact CG1-CD1 3.82Å; I150-Y214 HydrophobicContact CG1-CD2 4.27Å; I150-Y214 HydrophobicContact CG1-CE1 4.15Å; I150-Y214 HydrophobicContact CG1-CG 3.88Å; A190-Y214 WeakPolarHBondContact CB-O 3.28Å; A190-Y214 PolarHBondContact N-O 2.79Å; T191-Y214 HydrophobicContact CG2-CD2 3.5Å; T191-Y214 HydrophobicContact CG2-CE2 4.06Å; T191-Y214 HydrophobicContact CG2-CG 4.23Å; T191-Y214 PolarHBondContact O-N 2.92Å; Y212-Y214 HydrophobicContact CD2-CE2 4.4Å; Y212-Y214 AromaticContact CE2-CE2 3.98Å; Y212-Y214 HydrophobicContact CE2-CE2 3.98Å; Y214-P231 HydrophobicContact CD1-CB 3.69Å; Y214-P231 HydrophobicContact CD1-CG 3.86Å; Y214-P231 HydrophobicContact CD2-CB 4.47Å; Y214-P231 HydrophobicContact CE1-CB 3.71Å; Y214-P231 HydrophobicContact CE1-CG 3.62Å; Y214-P231 HydrophobicContact CG-CB 4.11Å
215	Y	95.1	Very high	80.6	Confident	44 Å²	44	66 Å²	66	17%	0.173	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	136.1	-172.3	-172.7	-103.1	0	0	0	113.4	H188 T213 P217 T229 R230 L250	H188-Y215 HydrophobicContact CB-CD2 4.1Å; H188-Y215 HydrophobicContact CB-CE2 3.62Å; H188-Y215 CarbonylContact O-C 3.53Å; H188-Y215 WeakPolarHBondContact O-CA 3.3Å; T213-Y215 PolarHBondContact O-N 3.44Å; Y215-P217 HydrophobicContact CD1-CB 4.22Å; Y215-P217 HydrophobicContact CE1-CB 3.97Å; Y215-P217 WeakPolarHBondContact O-CD 3.2Å; Y215-T229 CarbonylContact O-C 3.58Å; Y215-T229 VanDerWaalsContact O-CA 3.28Å; Y215-T229 WeakPolarHBondContact O-CA 3.23Å; Y215-R230 PolarHBondContact N-O 2.82Å; Y215-R230 PolarHBondContact O-N 2.85Å; Y215-L250 HydrophobicContact CD2-CD1 3.75Å; Y215-L250 HydrophobicContact CE2-CD1 4.44Å; Y215-L250 HydrophobicContact CG-CD1 3.92Å
216	I	92.4	Very high	78.6	Confident	10 Å²	10	69.4 Å²	69.4	5%	0.051	34%	0.343	C	S	.	.			trans	-104.1	102.4	176.7	-54.8	164.2	0	0	0	108.2	H188 A190 S218 C227 T229	H188-I216 PolarHBondContact ND1-O 3.49Å; H188-I216 PolarHBondContact O-N 2.8Å; A190-I216 HydrophobicContact CB-CD1 3.92Å; A190-I216 HydrophobicContact CB-CG1 4Å; I216-S218 PolarHBondContact O-N 2.89Å; I216-C227 HydrophobicContact CG2-CB 4.34Å; I216-T229 HydrophobicContact CG1-CG2 4.05Å
217	P	81.9	Confident	76.8	Confident	71 Å²	71	70 Å²	70	46%	0.461	35%	0.349	S	S	.	.			trans	-76.2	-22.8	-170.4	29.3	-35.7	0	0	0	115	Y215 K228	Y215-P217 HydrophobicContact CD1-CB 4.22Å; Y215-P217 HydrophobicContact CE1-CB 3.97Å; Y215-P217 WeakPolarHBondContact O-CD 3.2Å; P217-K228 WeakPolarHBondContact CD-O 3.35Å
218	S	71.4	Confident	75.9	Confident	63 Å²	63	78.3 Å²	78.3	44%	0.441	39%	0.385	S	S	.	.			trans	-159.8	138.8	176.9	51.9	0	0	0	0	110.4	I216	I216-S218 PolarHBondContact O-N 2.89Å
219	W	62.9	Low	75.5	Confident	180 Å²	180	79.8 Å²	79.8	68%	0.682	39%	0.394	S	S	*	.			trans	-97.1	112.5	173.3	-152.2	-12.6	0	0	0	108.6	F221	W219-F221 HydrophobicContact CB-CE2 4.37Å; W219-F221 WeakPolarHBondContact O-CD2 3.44Å; W219-F221 PolarHBondContact O-N 3Å; W219-F221 VanDerWaalsContact O-N 3.11Å
220	F	56.4	Low	75.2	Confident	143 Å²	143	87 Å²	87	63%	0.627	42%	0.422	S	S	*	.			trans	-79.1	93.4	174.3	-77	-86.8	0	0	0	109.4	C222 F223	F220-C222 PolarHBondContact O-N 2.91Å; F220-F223 PolarHBondContact O-N 2.84Å
221	F	52.5	Low	75.1	Confident	185 Å²	185	87.9 Å²	87.9	81%	0.811	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-15.6	-172.5	-87.1	-89.6	0	0	0	116.3	W219	W219-F221 HydrophobicContact CB-CE2 4.37Å; W219-F221 WeakPolarHBondContact O-CD2 3.44Å; W219-F221 PolarHBondContact O-N 3Å; W219-F221 VanDerWaalsContact O-N 3.11Å
222	C	50.1	Low	75	Confident	111 Å²	111	88.1 Å²	88.1	75%	0.75	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	-15.2	-172.7	-58.2	0	0	0	0	115.4	F220	F220-C222 PolarHBondContact O-N 2.91Å
223	F	48.4	Very low	75	Confident	161 Å²	161	87.2 Å²	87.2	71%	0.706	42%	0.424	S	S	*	.	S	Bend	trans	-148.6	144.9	-178.8	-67.9	-78.5	0	0	0	112.2	F220 L225	F220-F223 PolarHBondContact O-N 2.84Å; F223-L225 HydrophobicContact CB-CD1 4.22Å; F223-L225 HydrophobicContact CB-CG 4.09Å; F223-L225 PolarHBondContact O-N 2.78Å
224	Q	47	Very low	75	Confident	202 Å²	202	87.2 Å²	87.2	94%	0.944	42%	0.424	S	S	*	.			trans	-73.2	50.7	169.4	-63.9	-176	5.6	0	0	111.9
225	L	53.6	Low	75	Confident	114 Å²	114	85.7 Å²	85.7	60%	0.597	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-68.6	140.1	168.9	-76.3	163.8	0	0	0	108.8	F223 C227	F223-L225 HydrophobicContact CB-CD1 4.22Å; F223-L225 HydrophobicContact CB-CG 4.09Å; F223-L225 PolarHBondContact O-N 2.78Å; L225-C227 PolarHBondContact O-N 2.87Å
226	P	54.1	Low	75.2	Confident	99 Å²	99	83.7 Å²	83.7	64%	0.643	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-58.2	128.1	-179.6	23.1	-32.8	0	0	0	110.1	K228	P226-K228 PolarHBondContact O-N 3.02Å
227	C	60.7	Low	75.5	Confident	30 Å²	30	84.5 Å²	84.5	20%	0.203	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-57.4	127.8	-178.7	-69.8	0	0	0	0	109.7	I216 L225 T229	I216-C227 HydrophobicContact CG2-CB 4.34Å; L225-C227 PolarHBondContact O-N 2.87Å; C227-T229 HydrophobicContact CB-CG2 4.1Å; C227-T229 PolarHBondContact O-N 3.35Å
228	K	79.6	Confident	76.3	Confident	175 Å²	175	81.1 Å²	81.1	76%	0.761	39%	0.391	S	S	*	.			trans	-75.2	67.1	172.2	-74.1	-173.6	179.1	176.2	0	110.2	P217 P226	P217-K228 WeakPolarHBondContact CD-O 3.35Å; P226-K228 PolarHBondContact O-N 3.02Å
229	T	88.9	Confident	77.5	Confident	31 Å²	31	82.4 Å²	82.4	19%	0.19	39%	0.393	C	S	.	.			trans	-64.2	138.4	175.5	52	0	0	0	0	111.1	I150 A190 Y215 I216 C227	I150-T229 HydrophobicContact CG2-CG2 4.32Å; I150-T229 WeakPolarHBondContact CG2-OG1 3.46Å; I150-T229 WeakPolarHBondContact O-CG2 3.36Å; A190-T229 HydrophobicContact CB-CG2 3.77Å; Y215-T229 CarbonylContact O-C 3.58Å; Y215-T229 VanDerWaalsContact O-CA 3.28Å; Y215-T229 WeakPolarHBondContact O-CA 3.23Å; I216-T229 HydrophobicContact CG1-CG2 4.05Å; C227-T229 HydrophobicContact CB-CG2 4.1Å; C227-T229 PolarHBondContact O-N 3.35Å
230	R	93.3	Very high	79.2	Confident	152 Å²	152	76.6 Å²	76.6	57%	0.574	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.9	125.1	170.2	-68.4	-173.6	174.1	-168.9	-2.9	110	Y215 H232	Y215-R230 PolarHBondContact N-O 2.82Å; Y215-R230 PolarHBondContact O-N 2.85Å; R230-H232 PolarHBondContact O-CD2 3.01Å
231	P	96.2	Very high	81.1	Confident	18 Å²	18	73 Å²	73	12%	0.117	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	138.9	176.3	26.6	-28.1	0	0	0	112	T213 Y214 V255 T256 V257	T213-P231 CarbonylContact O-C 3.54Å; T213-P231 VanDerWaalsContact O-CA 3.24Å; T213-P231 WeakPolarHBondContact O-CA 3.46Å; Y214-P231 HydrophobicContact CD1-CB 3.69Å; Y214-P231 HydrophobicContact CD1-CG 3.86Å; Y214-P231 HydrophobicContact CD2-CB 4.47Å; Y214-P231 HydrophobicContact CE1-CB 3.71Å; Y214-P231 HydrophobicContact CE1-CG 3.62Å; Y214-P231 HydrophobicContact CG-CB 4.11Å; P231-V255 HydrophobicContact CG-CG1 3.64Å; P231-T256 CarbonylContact C-O 3.54Å; P231-T256 PolarHBondContact O-N 3.15Å; P231-T256 VanDerWaalsContact O-N 3.16Å; P231-V257 HydrophobicContact CB-CG1 3.42Å; P231-V257 VanDerWaalsContact CB-CG1 3.42Å; P231-V257 HydrophobicContact CG-CG1 3.68Å
232	H	97.1	Very high	83.2	Confident	9 Å²	9	64.4 Å²	64.4	4%	0.042	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	137.7	172.3	-62.9	-72.7	0	0	0	109.6	Y212 T213 R230 L250 I251 M254 T256	Y212-H232 WeakPolarHBondContact CA-O 3.29Å; T213-H232 PolarHBondContact N-O 3Å; T213-H232 PolarHBondContact O-N 3.07Å; R230-H232 PolarHBondContact O-CD2 3.01Å; H232-L250 HydrophobicContact CB-CB 3.85Å; H232-L250 HydrophobicContact CB-CD1 4.13Å; H232-L250 HydrophobicContact CB-CG 4.49Å; H232-I251 PolarHBondContact ND1-O 3.38Å; H232-M254 PolarHBondContact CE1-O 2.73Å; H232-M254 VanDerWaalsContact CE1-O 3.25Å; H232-M254 PolarHBondContact ND1-O 3.43Å; H232-T256 CarbonylContact C-O 3.56Å; H232-T256 VanDerWaalsContact CA-O 3.29Å; H232-T256 WeakPolarHBondContact CA-O 3.09Å; H232-T256 PolarHBondContact N-O 3.21Å
233	S	97.9	Very high	85.4	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	159.4	170.1	-46.1	0	0	0	0	110.8	A211 L250 I251 T256 V257	A211-S233 CarbonylContact O-C 3.49Å; A211-S233 VanDerWaalsContact O-CA 3.25Å; A211-S233 WeakPolarHBondContact O-CA 3.34Å; S233-L250 WeakPolarHBondContact O-CA 3.2Å; S233-I251 WeakPolarHBondContact O-CG1 3.35Å; S233-I251 PolarHBondContact O-N 3.14Å; S233-T256 WeakPolarHBondContact CB-OG1 3.48Å; S233-T256 PolarHBondContact N-O 2.92Å; S233-T256 PolarHBondContact N-OG1 2.94Å; S233-T256 WeakPolarHBondContact OG-CB 3.22Å; S233-T256 PolarHBondContact OG-OG1 2.82Å; S233-V257 PolarHBondContact OG-O 2.8Å
234	L	97.9	Very high	87.8	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	177.6	174.5	63.8	128.1	0	0	0	109.1	W189 A211 T213 I236 H247 L250	W189-L234 HydrophobicContact CH2-CD1 3.92Å; W189-L234 HydrophobicContact CH2-CD2 4.05Å; W189-L234 HydrophobicContact CZ2-CD2 4.47Å; A211-L234 CarbonylContact C-O 3.55Å; A211-L234 HydrophobicContact CB-CD1 4.33Å; A211-L234 HydrophobicContact CB-CG 4.05Å; A211-L234 PolarHBondContact N-O 3.18Å; A211-L234 PolarHBondContact O-N 2.97Å; T213-L234 HydrophobicContact CG2-CD2 3.75Å; L234-I236 HydrophobicContact CD1-CG1 4.28Å; L234-H247 HydrophobicContact CD1-CB 3.76Å; L234-L250 HydrophobicContact CB-CD2 3.78Å; L234-L250 HydrophobicContact CD2-CD2 3.52Å; L234-L250 HydrophobicContact CG-CD2 4.15Å
235	M	98.1	Very high	90.2	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.005	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	140.9	171.5	-57.5	-58.5	140.9	0	0	109.9	V208 P210 H247 G248 I251 V261 C275 F296	V208-M235 HydrophobicContact CG1-CB 4.05Å; V208-M235 HydrophobicContact CG1-CG 4.08Å; V208-M235 HydrophobicContact CG1-SD 3.94Å; P210-M235 HydrophobicContact CB-SD 4.22Å; M235-H247 CarbonylContact O-C 3.57Å; M235-H247 WeakPolarHBondContact O-CA 3.4Å; M235-G248 PolarHBondContact O-N 3.27Å; M235-I251 HydrophobicContact CE-CD1 4.39Å; M235-V261 HydrophobicContact CE-CG1 3.45Å; M235-V261 VanDerWaalsContact CE-CG1 3.45Å; M235-V261 HydrophobicContact SD-CG1 3.63Å; M235-V261 HydrophobicContact SD-CG2 4.48Å; M235-C275 HydrophobicContact CE-CB 4.39Å; M235-F296 HydrophobicContact CE-CE2 3.88Å; M235-F296 HydrophobicContact CE-CZ 3.74Å; M235-F296 HydrophobicContact CG-CE2 3.57Å; M235-F296 HydrophobicContact CG-CZ 3.87Å; M235-F296 HydrophobicContact SD-CE2 4.49Å; M235-F296 HydrophobicContact SD-CZ 4.37Å
236	I	98.6	Very high	92.3	Very high	3 Å²	3	48.2 Å²	48.2	2%	0.015	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	137.4	162.7	-68.9	161.5	0	0	0	106.6	L159 V181 V194 I209 A211 L234 W245 H246 H247	L159-I236 HydrophobicContact CD1-CD1 3.91Å; L159-I236 HydrophobicContact CD2-CD1 3.78Å; V181-I236 HydrophobicContact CG1-CG1 4.27Å; V181-I236 HydrophobicContact CG1-CG2 4.33Å; V194-I236 HydrophobicContact CG1-CD1 4.12Å; I209-I236 HydrophobicContact CB-CB 4.19Å; I209-I236 PolarHBondContact N-O 2.81Å; I209-I236 PolarHBondContact O-N 2.9Å; A211-I236 HydrophobicContact CB-CD1 3.96Å; A211-I236 HydrophobicContact CB-CG1 4.34Å; L234-I236 HydrophobicContact CD1-CG1 4.28Å; I236-W245 HydrophobicContact CG2-CE3 3.91Å; I236-H246 CarbonylContact C-O 3.49Å; I236-H246 VanDerWaalsContact CA-O 3.26Å; I236-H246 WeakPolarHBondContact CA-O 3.33Å; I236-H247 HydrophobicContact CG1-CB 4.21Å
237	Y	98.5	Very high	94.4	Very high	27 Å²	27	46.1 Å²	46.1	11%	0.106	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	161.2	-173.1	68.2	-87.7	0	0	0	113.5	R206 L207 W245 H246 E294	R206-Y237 HydrophobicContact CG-CD2 4.37Å; L207-Y237 CarbonylContact O-C 3.52Å; L207-Y237 WeakPolarHBondContact O-CA 3.28Å; L207-Y237 WeakPolarHBondContact O-CB 3.38Å; Y237-W245 WeakPolarHBondContact O-CA 3.41Å; Y237-H246 HydrophobicContact CD1-CB 4.36Å; Y237-H246 HydrophobicContact CD2-CB 4.48Å; Y237-H246 HydrophobicContact CE1-CB 3.86Å; Y237-H246 HydrophobicContact CE2-CB 4Å; Y237-H246 PolarHBondContact N-O 2.87Å; Y237-H246 PolarHBondContact O-N 2.8Å; Y237-E294 HydrophobicContact CE1-CG 4.08Å
238	S	98.5	Very high	96	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	134.5	173.3	171.5	0	0	0	0	110.1	R206 L207 D240 G242 T244	R206-S238 CarbonylContact C-O 3.57Å; R206-S238 WeakPolarHBondContact CA-O 3.25Å; L207-S238 PolarHBondContact N-O 2.84Å; L207-S238 PolarHBondContact O-N 2.81Å; L207-S238 VanDerWaalsContact O-N 3.08Å; S238-D240 PolarHBondContact OG-N 2.88Å; S238-D240 PolarHBondContact OG-OD1 3.17Å; S238-G242 WeakPolarHBondContact OG-CA 3.47Å; S238-G242 PolarHBondContact OG-N 3.27Å; S238-T244 WeakPolarHBondContact CB-O 3.44Å; S238-T244 PolarHBondContact OG-O 3.46Å
239	D	97.8	Very high	96.8	Very high	90 Å²	90	45.3 Å²	45.3	48%	0.481	22%	0.22	S	C	.	.	S	Bend	trans	-103.8	-3.8	178.1	-72.9	-52.9	0	0	0	113.1	R206	R206-D239 WeakPolarHBondContact CB-OD1 3.29Å; R206-D239 WeakPolarHBondContact CG-OD1 3.47Å; R206-D239 IonicContact CZ-OD1 3.93Å; R206-D239 IonicContact CZ-OD2 3.59Å; R206-D239 IonicContact NE-OD1 2.8Å; R206-D239 PolarHBondContact NE-OD1 2.85Å; R206-D239 IonicContact NE-OD2 2.71Å; R206-D239 PolarHBondContact NE-OD2 2.84Å; R206-D239 IonicContact NH2-OD1 3.65Å; R206-D239 PolarHBondContact NH2-OD1 2.97Å; R206-D239 IonicContact NH2-OD2 3.11Å; R206-D239 PolarHBondContact NH2-OD2 3.43Å
240	D	97.4	Very high	97.2	Very high	57 Å²	57	44.9 Å²	44.9	31%	0.305	22%	0.216	S	C	.	.	S	Bend	trans	-120.6	33.2	-170	66.5	1.3	0	0	0	113.2	S238 G242 V243 T244	S238-D240 PolarHBondContact OG-N 2.88Å; S238-D240 PolarHBondContact OG-OD1 3.17Å; D240-G242 VanDerWaalsContact C-N 3.31Å; D240-G242 PolarHBondContact O-N 2.99Å; D240-V243 WeakPolarHBondContact O-CG2 3.32Å; D240-V243 PolarHBondContact OD1-N 3.42Å; D240-T244 VanDerWaalsContact CG-N 3.34Å; D240-T244 PolarHBondContact OD1-N 2.96Å; D240-T244 WeakPolarHBondContact OD2-CB 3.39Å; D240-T244 WeakPolarHBondContact OD2-CG2 3.44Å; D240-T244 PolarHBondContact OD2-N 3.21Å; D240-T244 PolarHBondContact OD2-OG1 3.16Å
241	L	96.5	Very high	97.3	Very high	68 Å²	68	37.8 Å²	37.8	36%	0.356	19%	0.19	S	C	.	.	S	Bend	trans	66.6	27.6	-179.4	-44.2	174	0	0	0	113.8	E127 K129	E127-L241 HydrophobicContact CG-CB 4.31Å; E127-L241 HydrophobicContact CG-CD2 4.46Å; K129-L241 HydrophobicContact CB-CD2 4.41Å; K129-L241 HydrophobicContact CD-CD1 3.98Å; K129-L241 HydrophobicContact CD-CD2 4.12Å
242	G	97	Very high	97.1	Very high	4 Å²	4	42.3 Å²	42.3	4%	0.041	20%	0.204	C	C	.	.	S	Bend	trans	86.9	17.7	176.8	0	0	0	0	0	114.6	S238 D240 W245	S238-G242 WeakPolarHBondContact OG-CA 3.47Å; S238-G242 PolarHBondContact OG-N 3.27Å; D240-G242 VanDerWaalsContact C-N 3.31Å; D240-G242 PolarHBondContact O-N 2.99Å; G242-W245 PolarHBondContact O-NE1 2.82Å
243	V	96.8	Very high	96.8	Very high	100 Å²	100	47.5 Å²	47.5	61%	0.606	24%	0.239	S	C	*	.	S	Bend	trans	-77.8	-47.2	177.7	174.6	0	0	0	0	110.5	D240	D240-V243 WeakPolarHBondContact O-CG2 3.32Å; D240-V243 PolarHBondContact OD1-N 3.42Å
244	T	97.8	Very high	96.5	Very high	57 Å²	57	49.4 Å²	49.4	35%	0.35	25%	0.248	S	C	.	.	S	Bend	trans	-121.3	153.1	172.1	65.8	0	0	0	0	111.1	S238 D240	S238-T244 WeakPolarHBondContact CB-O 3.44Å; S238-T244 PolarHBondContact OG-O 3.46Å; D240-T244 VanDerWaalsContact CG-N 3.34Å; D240-T244 PolarHBondContact OD1-N 2.96Å; D240-T244 WeakPolarHBondContact OD2-CB 3.39Å; D240-T244 WeakPolarHBondContact OD2-CG2 3.44Å; D240-T244 PolarHBondContact OD2-N 3.21Å; D240-T244 PolarHBondContact OD2-OG1 3.16Å
245	W	98.4	Very high	96.3	Very high	2 Å²	2	51.6 Å²	51.6	1%	0.008	26%	0.262	C	S	.	.			trans	-132.2	144.5	-175.9	-66.6	84.9	0	0	0	111.8	F134 F136 F161 L177 V181 L207 I209 I236 Y237 G242	F134-W245 HydrophobicContact CD1-CZ2 4.22Å; F134-W245 HydrophobicContact CE1-CZ2 4.4Å; F134-W245 HydrophobicContact CG-CZ2 4.29Å; F136-W245 HydrophobicContact CE1-CD2 4.47Å; F136-W245 HydrophobicContact CE1-CE3 4.47Å; F136-W245 HydrophobicContact CE2-CE3 4.49Å; F136-W245 AromaticContact CE2-CH2 3.56Å; F136-W245 HydrophobicContact CE2-CH2 3.56Å; F136-W245 AromaticContact CE2-CZ2 3.76Å; F136-W245 HydrophobicContact CE2-CZ2 3.76Å; F136-W245 AromaticContact CE2-CZ3 3.98Å; F136-W245 HydrophobicContact CE2-CZ3 3.98Å; F136-W245 AromaticContact CZ-CD2 3.72Å; F136-W245 HydrophobicContact CZ-CD2 3.72Å; F136-W245 AromaticContact CZ-CE2 3.64Å; F136-W245 AromaticContact CZ-CE3 3.75Å; F136-W245 HydrophobicContact CZ-CE3 3.75Å; F136-W245 AromaticContact CZ-CH2 3.59Å; F136-W245 HydrophobicContact CZ-CH2 3.59Å; F136-W245 AromaticContact CZ-CZ2 3.58Å; F136-W245 HydrophobicContact CZ-CZ2 3.58Å; F136-W245 AromaticContact CZ-CZ3 3.69Å; F136-W245 HydrophobicContact CZ-CZ3 3.69Å; F161-W245 AromaticContact CE1-NE1 3.87Å; L177-W245 HydrophobicContact CD1-CB 4.08Å; L177-W245 HydrophobicContact CD1-CG 3.94Å; V181-W245 HydrophobicContact CG2-CB 3.54Å; L207-W245 HydrophobicContact CB-CH2 3.74Å; L207-W245 HydrophobicContact CB-CZ3 4.01Å; L207-W245 HydrophobicContact CD1-CH2 3.67Å; L207-W245 HydrophobicContact CD1-CZ2 3.94Å; L207-W245 HydrophobicContact CG-CH2 4.35Å; I209-W245 HydrophobicContact CG1-CH2 4.38Å; I209-W245 HydrophobicContact CG1-CZ3 3.88Å; I236-W245 HydrophobicContact CG2-CE3 3.91Å; Y237-W245 WeakPolarHBondContact O-CA 3.41Å; G242-W245 PolarHBondContact O-NE1 2.82Å
246	H	97.7	Very high	96.3	Very high	89 Å²	89	51.6 Å²	51.6	41%	0.412	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	166.3	-178.4	-58.3	-47.3	0	0	0	110.6	I236 Y237	I236-H246 CarbonylContact C-O 3.49Å; I236-H246 VanDerWaalsContact CA-O 3.26Å; I236-H246 WeakPolarHBondContact CA-O 3.33Å; Y237-H246 HydrophobicContact CD1-CB 4.36Å; Y237-H246 HydrophobicContact CD2-CB 4.48Å; Y237-H246 HydrophobicContact CE1-CB 3.86Å; Y237-H246 HydrophobicContact CE2-CB 4Å; Y237-H246 PolarHBondContact N-O 2.87Å; Y237-H246 PolarHBondContact O-N 2.8Å
247	H	97.3	Very high	96.2	Very high	55 Å²	55	52.2 Å²	52.2	26%	0.255	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	139.4	170.5	76.5	60.4	0	0	0	112.2	V181 W189 L234 M235 I236	V181-H247 HydrophobicContact CG1-CB 4.17Å; V181-H247 PolarHBondContact O-CD2 3.29Å; W189-H247 AromaticContact CZ2-NE2 3.96Å; L234-H247 HydrophobicContact CD1-CB 3.76Å; M235-H247 CarbonylContact O-C 3.57Å; M235-H247 WeakPolarHBondContact O-CA 3.4Å; I236-H247 HydrophobicContact CG1-CB 4.21Å
248	G	95.8	Very high	96.2	Very high	6 Å²	6	51.3 Å²	51.3	6%	0.062	26%	0.262	C	S	.	.			trans	-73.1	-173	173.3	0	0	0	0	0	112.8	M235	M235-G248 PolarHBondContact O-N 3.27Å
249	R	96.2	Very high	96.2	Very high	182 Å²	182	51.3 Å²	51.3	69%	0.687	26%	0.262	S	S	*	.			trans	-79.5	148	177.9	-59.2	171.6	-170.1	-170.4	6.4	110.7	I251 E294	R249-I251 PolarHBondContact O-N 2.96Å; R249-E294 VanDerWaalsContact CB-O 3.24Å; R249-E294 WeakPolarHBondContact CB-O 3.03Å; R249-E294 VanDerWaalsContact CG-O 3.25Å; R249-E294 WeakPolarHBondContact CG-O 3.23Å; R249-E294 PolarHBondContact N-O 3.08Å
250	L	96.2	Very high	96.2	Very high	22 Å²	22	47 Å²	47	12%	0.115	24%	0.239	C	C	.	.			trans	-66.6	131.3	175.2	-54	-164.7	0	0	0	111.2	T213 Y215 H232 S233 L234 R252	T213-L250 HydrophobicContact CG2-CD1 3.83Å; T213-L250 HydrophobicContact CG2-CD2 3.71Å; T213-L250 HydrophobicContact CG2-CG 4.48Å; Y215-L250 HydrophobicContact CD2-CD1 3.75Å; Y215-L250 HydrophobicContact CE2-CD1 4.44Å; Y215-L250 HydrophobicContact CG-CD1 3.92Å; H232-L250 HydrophobicContact CB-CB 3.85Å; H232-L250 HydrophobicContact CB-CD1 4.13Å; H232-L250 HydrophobicContact CB-CG 4.49Å; S233-L250 WeakPolarHBondContact O-CA 3.2Å; L234-L250 HydrophobicContact CB-CD2 3.78Å; L234-L250 HydrophobicContact CD2-CD2 3.52Å; L234-L250 HydrophobicContact CG-CD2 4.15Å; L250-R252 HydrophobicContact CB-CG 4.31Å; L250-R252 PolarHBondContact O-N 3.04Å; L250-R252 VanDerWaalsContact O-N 3.17Å
251	I	95.1	Very high	96.2	Very high	4 Å²	4	44.3 Å²	44.3	2%	0.021	23%	0.225	C	C	.	.			trans	-66.9	111.7	175.9	-54.4	-171	0	0	0	108.9	H232 S233 M235 R249 F296 L299	H232-I251 PolarHBondContact ND1-O 3.38Å; S233-I251 WeakPolarHBondContact O-CG1 3.35Å; S233-I251 PolarHBondContact O-N 3.14Å; M235-I251 HydrophobicContact CE-CD1 4.39Å; R249-I251 PolarHBondContact O-N 2.96Å; I251-F296 HydrophobicContact CD1-CB 3.94Å; I251-F296 HydrophobicContact CD1-CD1 4.14Å; I251-F296 HydrophobicContact CD1-CD2 3.58Å; I251-F296 HydrophobicContact CD1-CE2 4.14Å; I251-F296 HydrophobicContact CD1-CG 3.58Å; I251-F296 HydrophobicContact CG1-CB 3.95Å; I251-F296 HydrophobicContact CG1-CD2 3.78Å; I251-F296 HydrophobicContact CG1-CG 3.97Å; I251-F296 HydrophobicContact CG2-CB 4.3Å; I251-L299 HydrophobicContact CG2-CD1 3.84Å; I251-L299 HydrophobicContact CG2-CD2 3.92Å; I251-L299 HydrophobicContact CG2-CG 4.49Å
252	R	92.1	Very high	96.3	Very high	113 Å²	113	41.1 Å²	41.1	43%	0.426	21%	0.208	S	C	.	.			trans	-137.4	157.3	-170.9	-78.8	-179.8	177	136.8	-12.3	110.4	L250	L250-R252 HydrophobicContact CB-CG 4.31Å; L250-R252 PolarHBondContact O-N 3.04Å; L250-R252 VanDerWaalsContact O-N 3.17Å
253	P	90.9	Very high	96.2	Very high	118 Å²	118	41.8 Å²	41.8	77%	0.766	21%	0.21	S	C	*	.	S	Bend	cis	-88.8	-3	4.3	35.9	-36.9	0	0	0	114.7
254	M	91.5	Very high	96.1	Very high	40 Å²	40	37 Å²	37	20%	0.197	18%	0.181	C	C	.	.	S	Bend	trans	-65.1	150.9	-177.9	-157.8	175.7	-72.1	0	0	111.6	H232 T256 T279 A285 L299 L301	H232-M254 PolarHBondContact CE1-O 2.73Å; H232-M254 VanDerWaalsContact CE1-O 3.25Å; H232-M254 PolarHBondContact ND1-O 3.43Å; M254-T256 HydrophobicContact CB-CG2 4.39Å; M254-T256 HydrophobicContact CG-CG2 4.44Å; M254-T279 HydrophobicContact SD-CG2 4.26Å; M254-A285 HydrophobicContact SD-CB 3.66Å; M254-L299 HydrophobicContact CB-CD1 4.41Å; M254-L299 HydrophobicContact CB-CD2 3.51Å; M254-L299 HydrophobicContact CB-CG 4.04Å; M254-L299 HydrophobicContact CE-CG 4.02Å; M254-L299 HydrophobicContact SD-CD1 4.3Å; M254-L299 HydrophobicContact SD-CG 4.34Å; M254-L301 HydrophobicContact CE-CD2 3.83Å; M254-L301 HydrophobicContact CE-CG 3.8Å; M254-L301 HydrophobicContact SD-CD2 3.45Å; M254-L301 WeakPolarHBondContact SD-CD2 3.37Å; M254-L301 HydrophobicContact SD-CG 4.13Å
255	V	94.7	Very high	95.8	Very high	46 Å²	46	34.5 Å²	34.5	28%	0.279	17%	0.166	S	C	.	.			trans	-84.7	119.2	173.5	176.6	0	0	0	0	108.5	P231 P280	P231-V255 HydrophobicContact CG-CG1 3.64Å; V255-P280 HydrophobicContact CB-CG 4.37Å; V255-P280 HydrophobicContact CG1-CG 4.21Å
256	T	96.8	Very high	95.2	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.17	C	C	.	.			trans	-139.6	147.8	-177.9	64.9	0	0	0	0	111.7	P231 H232 S233 M254 A277 R278 T279 A285	P231-T256 CarbonylContact C-O 3.54Å; P231-T256 PolarHBondContact O-N 3.15Å; P231-T256 VanDerWaalsContact O-N 3.16Å; H232-T256 CarbonylContact C-O 3.56Å; H232-T256 VanDerWaalsContact CA-O 3.29Å; H232-T256 WeakPolarHBondContact CA-O 3.09Å; H232-T256 PolarHBondContact N-O 3.21Å; S233-T256 WeakPolarHBondContact CB-OG1 3.48Å; S233-T256 PolarHBondContact N-O 2.92Å; S233-T256 PolarHBondContact N-OG1 2.94Å; S233-T256 WeakPolarHBondContact OG-CB 3.22Å; S233-T256 PolarHBondContact OG-OG1 2.82Å; M254-T256 HydrophobicContact CB-CG2 4.39Å; M254-T256 HydrophobicContact CG-CG2 4.44Å; T256-A277 HydrophobicContact CG2-CB 3.99Å; T256-R278 VanDerWaalsContact CA-O 3.27Å; T256-R278 WeakPolarHBondContact CA-O 3.4Å; T256-T279 HydrophobicContact CG2-CG2 4.41Å; T256-A285 HydrophobicContact CG2-CB 3.92Å
257	V	97.3	Very high	94.2	Very high	16 Å²	16	38.4 Å²	38.4	10%	0.097	18%	0.18	C	C	.	.			trans	-124.5	-131.4	177.5	-68.9	0	0	0	0	110.4	Y212 P231 S233 C259 R278	Y212-V257 HydrophobicContact CD2-CB 4.01Å; Y212-V257 HydrophobicContact CD2-CG1 4.14Å; Y212-V257 HydrophobicContact CE2-CB 4.21Å; Y212-V257 HydrophobicContact CE2-CG1 4.38Å; Y212-V257 HydrophobicContact CG-CB 4.24Å; P231-V257 HydrophobicContact CB-CG1 3.42Å; P231-V257 VanDerWaalsContact CB-CG1 3.42Å; P231-V257 HydrophobicContact CG-CG1 3.68Å; S233-V257 PolarHBondContact OG-O 2.8Å; V257-C259 PolarHBondContact O-N 2.93Å; V257-R278 HydrophobicContact CG2-CB 3.65Å; V257-R278 HydrophobicContact CG2-CG 3.52Å; V257-R278 PolarHBondContact N-O 2.85Å
258	E	98.1	Very high	93.3	Very high	8 Å²	8	39.7 Å²	39.7	4%	0.037	20%	0.2	C	C	.	.	S	Bend	trans	-37	120	174.4	-60.2	166.3	145.9	0	0	111.9	Y212 R278 R284 Q313 Y403	Y212-E258 HydrophobicContact CD1-CG 4.47Å; Y212-E258 HydrophobicContact CE1-CB 4.37Å; Y212-E258 HydrophobicContact CE1-CG 3.69Å; E258-R278 HydrophobicContact CB-CB 4.35Å; E258-R278 VanDerWaalsContact O-CB 3.25Å; E258-R278 WeakPolarHBondContact O-CB 3.43Å; E258-R278 PolarHBondContact O-N 2.8Å; E258-R278 IonicContact OE1-NH1 3.61Å; E258-R278 WeakPolarHBondContact OE2-CD 3.41Å; E258-R278 IonicContact OE2-CZ 2.98Å; E258-R278 IonicContact OE2-NE 3.27Å; E258-R278 IonicContact OE2-NH1 2.76Å; E258-R278 PolarHBondContact OE2-NH1 3.41Å; E258-R284 PolarHBondContact O-NH2 2.8Å; E258-Q313 HydrophobicContact CB-CB 4.41Å; E258-Y403 VanDerWaalsContact OE1-CE1 3.23Å; E258-Y403 WeakPolarHBondContact OE1-CE1 3.42Å; E258-Y403 VanDerWaalsContact OE1-CZ 3.28Å; E258-Y403 PolarHBondContact OE1-OH 3.14Å; E258-Y403 PolarHBondContact OE2-OH 3.18Å
259	C	98.1	Very high	92.6	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.007	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	159.2	-174.9	70.6	0	0	0	0	110.5	P210 V257 S276 A277	P210-C259 VanDerWaalsContact CB-O 3.28Å; P210-C259 WeakPolarHBondContact CB-O 3.28Å; V257-C259 PolarHBondContact O-N 2.93Å; C259-S276 VanDerWaalsContact CA-O 3.31Å; C259-S276 WeakPolarHBondContact CA-O 3.38Å; C259-A277 HydrophobicContact CB-CB 3.53Å
260	E	98.1	Very high	92.1	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	150.9	-176.9	-99.5	-72.2	-163.8	0	0	110	G197 H198 C275 S276 V316	G197-E260 VanDerWaalsContact CA-OE1 3.27Å; G197-E260 WeakPolarHBondContact CA-OE1 3.38Å; H198-E260 IonicContact CE1-OE1 2.76Å; H198-E260 IonicContact CE1-OE2 2.73Å; H198-E260 IonicContact CG-OE1 3.49Å; H198-E260 PolarHBondContact N-OE1 3.23Å; H198-E260 IonicContact ND1-OE1 3.28Å; H198-E260 PolarHBondContact ND1-OE1 2.92Å; E260-C275 WeakPolarHBondContact O-CA 3.27Å; E260-S276 PolarHBondContact N-O 2.91Å; E260-S276 VanDerWaalsContact N-O 3.07Å; E260-S276 PolarHBondContact O-N 2.83Å; E260-V316 HydrophobicContact CB-CG1 4.14Å
261	V	98.2	Very high	91.9	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	145.8	-167.1	-67.7	0	0	0	0	114.4	I200 V208 P210 M235 L273 Y274 C275	I200-V261 HydrophobicContact CD1-CG2 4.1Å; I200-V261 HydrophobicContact CG1-CG2 4.17Å; V208-V261 HydrophobicContact CG1-CG2 4.21Å; P210-V261 HydrophobicContact CG-CG2 4.47Å; M235-V261 HydrophobicContact CE-CG1 3.45Å; M235-V261 VanDerWaalsContact CE-CG1 3.45Å; M235-V261 HydrophobicContact SD-CG1 3.63Å; M235-V261 HydrophobicContact SD-CG2 4.48Å; V261-L273 HydrophobicContact CB-CD1 3.92Å; V261-L273 HydrophobicContact CG2-CD1 4.43Å; V261-Y274 VanDerWaalsContact CA-O 3.23Å; V261-Y274 WeakPolarHBondContact CA-O 3.09Å; V261-Y274 WeakPolarHBondContact CB-O 3.38Å; V261-C275 HydrophobicContact CG1-CB 3.87Å
262	A	97.7	Very high	91.9	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.008	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	144	176.1	0	0	0	0	0	110.7	Y274 V316 L362	A262-Y274 PolarHBondContact N-O 3.15Å; A262-Y274 PolarHBondContact O-N 2.76Å; A262-V316 HydrophobicContact CB-CG1 4.05Å; A262-V316 HydrophobicContact CB-CG2 4.49Å; A262-L362 HydrophobicContact CB-CD2 3.57Å
263	E	96.8	Very high	92.1	Very high	17 Å²	17	35.3 Å²	35.3	8%	0.079	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	122.4	175.1	-169.5	179.5	-123.1	0	0	109.9	I200 L202 Q203 P271 S318	I200-E263 HydrophobicContact CD1-CB 4.48Å; L202-E263 WeakPolarHBondContact CB-OE1 3.38Å; L202-E263 HydrophobicContact CD2-CB 3.98Å; L202-E263 HydrophobicContact CD2-CG 4.27Å; Q203-E263 WeakPolarHBondContact CB-OE2 3.44Å; Q203-E263 WeakPolarHBondContact CG-OE2 3.31Å; Q203-E263 PolarHBondContact N-OE1 2.82Å; Q203-E263 PolarHBondContact N-OE2 2.88Å; Q203-E263 PolarHBondContact NE2-OE2 3.47Å; E263-P271 HydrophobicContact CG-CB 3.88Å; E263-S318 WeakPolarHBondContact O-CB 3.43Å; E263-S318 PolarHBondContact O-OG 3.2Å
264	V	94.3	Very high	92.4	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	133.3	-177.9	-69.2	0	0	0	0	111.5	P271 V272 L362 P384 L385	V264-P271 WeakPolarHBondContact O-CA 3.25Å; V264-V272 HydrophobicContact CG2-CB 4.38Å; V264-V272 WeakPolarHBondContact CG2-O 3.22Å; V264-V272 PolarHBondContact N-O 2.99Å; V264-V272 PolarHBondContact O-N 2.76Å; V264-L362 HydrophobicContact CG1-CD1 4.18Å; V264-L362 HydrophobicContact CG1-CD2 3.32Å; V264-L362 HydrophobicContact CG1-CG 3.64Å; V264-P384 HydrophobicContact CB-CB 4.42Å; V264-P384 HydrophobicContact CB-CG 3.91Å; V264-P384 HydrophobicContact CG1-CB 4.06Å; V264-P384 HydrophobicContact CG1-CG 3.82Å; V264-P384 HydrophobicContact CG2-CB 4.44Å; V264-P384 HydrophobicContact CG2-CG 4.32Å; V264-L385 HydrophobicContact CG2-CD2 3.81Å
265	T	91.9	Very high	92.6	Very high	5 Å²	5	28 Å²	28	3%	0.031	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	118.9	172.5	-55.6	0	0	0	0	109.2	G269 E359 S360	T265-G269 WeakPolarHBondContact CG2-O 3.26Å; T265-E359 WeakPolarHBondContact O-CA 3.19Å; T265-S360 PolarHBondContact N-OG 2.91Å; T265-S360 PolarHBondContact O-N 3.35Å
266	G	84.1	Confident	92.7	Very high	9 Å²	9	25.8 Å²	25.8	9%	0.093	14%	0.144	C	C	.	.			trans	-94	-175.7	174.2	0	0	0	0	0	113.1	A268 G269	G266-A268 PolarHBondContact O-N 2.91Å; G266-G269 PolarHBondContact O-N 2.75Å
267	R	77.1	Confident	92.7	Very high	164 Å²	164	26 Å²	26	62%	0.619	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.3	-29.9	179.6	-65.9	-177.2	-171.9	-66.7	-23.1	115.3	G269 E359	R267-G269 PolarHBondContact O-N 2.57Å; R267-E359 HydrophobicContact CG-CG 3.97Å; R267-E359 WeakPolarHBondContact CG-OE1 3.38Å; R267-E359 WeakPolarHBondContact CG-OE2 3.43Å; R267-E359 IonicContact CZ-OE1 2.86Å; R267-E359 IonicContact CZ-OE2 3.11Å; R267-E359 IonicContact NE-OE1 3.63Å; R267-E359 IonicContact NE-OE2 3.32Å; R267-E359 PolarHBondContact NE-OE2 2.67Å; R267-E359 IonicContact NH1-OE1 2.75Å; R267-E359 PolarHBondContact NH1-OE1 3.43Å; R267-E359 IonicContact NH1-OE2 3.83Å; R267-E359 IonicContact NH2-OE1 2.84Å; R267-E359 PolarHBondContact NH2-OE1 2.83Å; R267-E359 IonicContact NH2-OE2 2.73Å; R267-E359 PolarHBondContact NH2-OE2 3.46Å
268	A	77.7	Confident	92.7	Very high	82 Å²	82	27.9 Å²	27.9	68%	0.678	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-1.5	178.4	0	0	0	0	0	114	G266 H270	G266-A268 PolarHBondContact O-N 2.91Å; A268-H270 PolarHBondContact O-N 3.08Å
269	G	81.3	Confident	92.6	Very high	29 Å²	29	27.8 Å²	27.8	30%	0.299	15%	0.15	S	C	.	.			trans	74.8	-15	177	0	0	0	0	0	115.8	T265 G266 R267	T265-G269 WeakPolarHBondContact CG2-O 3.26Å; G266-G269 PolarHBondContact O-N 2.75Å; R267-G269 PolarHBondContact O-N 2.57Å
270	H	85.9	Confident	92.3	Very high	144 Å²	144	32 Å²	32	67%	0.667	18%	0.178	S	C	*	.			trans	-79.1	127.9	177.8	-61.6	-55.8	0	0	0	111.9	A268	A268-H270 PolarHBondContact O-N 3.08Å
271	P	92.6	Very high	92	Very high	41 Å²	41	36 Å²	36	27%	0.266	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	143.4	173.6	29.8	-33.7	0	0	0	111	E263 V264	E263-P271 HydrophobicContact CG-CB 3.88Å; V264-P271 WeakPolarHBondContact O-CA 3.25Å
272	V	94.3	Very high	91.8	Very high	18 Å²	18	41.2 Å²	41.2	11%	0.109	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	135.3	177.5	179.7	0	0	0	0	108.1	V264 Y274 L288 S289 T290 L385	V264-V272 HydrophobicContact CG2-CB 4.38Å; V264-V272 WeakPolarHBondContact CG2-O 3.22Å; V264-V272 PolarHBondContact N-O 2.99Å; V264-V272 PolarHBondContact O-N 2.76Å; V272-Y274 PolarHBondContact O-N 2.99Å; V272-L288 HydrophobicContact CG1-CB 3.84Å; V272-L288 HydrophobicContact CG1-CD2 4.03Å; V272-L288 HydrophobicContact CG1-CG 4.35Å; V272-S289 WeakPolarHBondContact CG1-O 3.11Å; V272-T290 HydrophobicContact CG2-CG2 4.43Å; V272-L385 HydrophobicContact CB-CD2 3.99Å; V272-L385 HydrophobicContact CG1-CD2 4.26Å; V272-L385 HydrophobicContact CG2-CD2 4.12Å
273	L	96.6	Very high	91.7	Very high	3 Å²	3	41.4 Å²	41.4	2%	0.016	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	112.7	174.6	-176.4	61.3	0	0	0	109.6	I200 L202 V208 V261 L288 S289 F296	I200-L273 HydrophobicContact CD1-CD1 3.73Å; L202-L273 HydrophobicContact CD2-CD1 4.02Å; V208-L273 HydrophobicContact CG1-CD2 4.24Å; V261-L273 HydrophobicContact CB-CD1 3.92Å; V261-L273 HydrophobicContact CG2-CD1 4.43Å; L273-L288 CarbonylContact O-C 3.48Å; L273-L288 WeakPolarHBondContact O-CA 3.31Å; L273-S289 PolarHBondContact N-O 2.76Å; L273-S289 PolarHBondContact O-N 2.85Å; L273-F296 HydrophobicContact CD2-CE1 4.47Å; L273-F296 HydrophobicContact CD2-CZ 3.77Å; L273-F296 HydrophobicContact CG-CE1 4.35Å; L273-F296 HydrophobicContact CG-CZ 4.12Å
274	Y	96.8	Very high	91.6	Very high	3 Å²	3	40.6 Å²	40.6	1%	0.012	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	143.4	171.8	168	-87.5	0	0	0	110.6	V261 A262 V272 E286 L288 V316 L362 W390	V261-Y274 VanDerWaalsContact CA-O 3.23Å; V261-Y274 WeakPolarHBondContact CA-O 3.09Å; V261-Y274 WeakPolarHBondContact CB-O 3.38Å; A262-Y274 PolarHBondContact N-O 3.15Å; A262-Y274 PolarHBondContact O-N 2.76Å; V272-Y274 PolarHBondContact O-N 2.99Å; Y274-E286 HydrophobicContact CE2-CB 4.07Å; Y274-E286 HydrophobicContact CE2-CG 4.06Å; Y274-E286 PolarHBondContact OH-OE1 2.94Å; Y274-L288 HydrophobicContact CD2-CD2 3.89Å; Y274-L288 HydrophobicContact CG-CD2 4.42Å; Y274-V316 HydrophobicContact CD1-CG1 4.17Å; Y274-V316 HydrophobicContact CD1-CG2 4.26Å; Y274-V316 HydrophobicContact CE1-CB 4.36Å; Y274-V316 HydrophobicContact CE1-CG1 4.06Å; Y274-V316 HydrophobicContact CE1-CG2 3.88Å; Y274-L362 HydrophobicContact CD1-CD1 3.62Å; Y274-L362 HydrophobicContact CD1-CD2 4.45Å; Y274-L362 HydrophobicContact CD2-CD1 3.83Å; Y274-L362 HydrophobicContact CE1-CD1 3.82Å; Y274-L362 HydrophobicContact CE2-CD1 4.02Å; Y274-L362 HydrophobicContact CG-CD1 3.63Å; Y274-W390 WeakPolarHBondContact OH-CZ2 3.48Å
275	C	97.1	Very high	91.7	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.007	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	130.2	174.3	177.7	0	0	0	0	111.3	M235 E260 V261 E286 A287 F296	M235-C275 HydrophobicContact CE-CB 4.39Å; E260-C275 WeakPolarHBondContact O-CA 3.27Å; V261-C275 HydrophobicContact CG1-CB 3.87Å; C275-E286 WeakPolarHBondContact O-CA 3.21Å; C275-A287 PolarHBondContact N-O 2.78Å; C275-A287 PolarHBondContact O-N 3.25Å; C275-F296 HydrophobicContact CB-CD1 3.92Å; C275-F296 HydrophobicContact CB-CE1 3.42Å; C275-F296 VanDerWaalsContact CB-CE1 3.42Å; C275-F296 HydrophobicContact CB-CZ 4.09Å
276	S	96.7	Very high	91.8	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	106.6	170.1	177.3	0	0	0	0	109.8	C259 E260 R284 A285	C259-S276 VanDerWaalsContact CA-O 3.31Å; C259-S276 WeakPolarHBondContact CA-O 3.38Å; E260-S276 PolarHBondContact N-O 2.91Å; E260-S276 VanDerWaalsContact N-O 3.07Å; E260-S276 PolarHBondContact O-N 2.83Å; S276-R284 PolarHBondContact O-NH2 3Å; S276-R284 PolarHBondContact OG-NE 2.83Å; S276-A285 CarbonylContact C-O 3.59Å; S276-A285 WeakPolarHBondContact CA-O 3.29Å
277	A	97.1	Very high	92.3	Very high	3 Å²	3	41.2 Å²	41.2	3%	0.025	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	144.2	-176.1	0	0	0	0	0	113.4	T256 C259 R284 A285	T256-A277 HydrophobicContact CG2-CB 3.99Å; C259-A277 HydrophobicContact CB-CB 3.53Å; A277-R284 VanDerWaalsContact C-CZ 3.48Å; A277-A285 HydrophobicContact CB-CB 4.35Å; A277-A285 PolarHBondContact N-O 2.82Å; A277-A285 PolarHBondContact O-N 3.28Å
278	R	96.8	Very high	93.2	Very high	57 Å²	57	34.3 Å²	34.3	22%	0.215	19%	0.192	C	C	.	.			trans	-71.2	138.8	178	174.4	168.7	165.2	-142.8	-8.6	111.5	T256 V257 E258 R284 E307 H310	T256-R278 VanDerWaalsContact CA-O 3.27Å; T256-R278 WeakPolarHBondContact CA-O 3.4Å; V257-R278 HydrophobicContact CG2-CB 3.65Å; V257-R278 HydrophobicContact CG2-CG 3.52Å; V257-R278 PolarHBondContact N-O 2.85Å; E258-R278 HydrophobicContact CB-CB 4.35Å; E258-R278 VanDerWaalsContact O-CB 3.25Å; E258-R278 WeakPolarHBondContact O-CB 3.43Å; E258-R278 PolarHBondContact O-N 2.8Å; E258-R278 IonicContact OE1-NH1 3.61Å; E258-R278 WeakPolarHBondContact OE2-CD 3.41Å; E258-R278 IonicContact OE2-CZ 2.98Å; E258-R278 IonicContact OE2-NE 3.27Å; E258-R278 IonicContact OE2-NH1 2.76Å; E258-R278 PolarHBondContact OE2-NH1 3.41Å; R278-R284 VanDerWaalsContact CA-NH1 3.31Å; R278-R284 VanDerWaalsContact CB-NH1 3.33Å; R278-E307 VanDerWaalsContact CA-OE1 3.3Å; R278-E307 WeakPolarHBondContact CA-OE1 3.28Å; R278-E307 WeakPolarHBondContact CG-OE2 3.36Å; R278-H310 PolarHBondContact NH2-O 3.16Å
279	T	95	Very high	94	Very high	5 Å²	5	30.4 Å²	30.4	3%	0.031	16%	0.16	C	C	.	.			trans	-133.3	154.5	179.7	88.3	0	0	0	0	112.8	M254 T256 N281 C283 A285 L301	M254-T279 HydrophobicContact SD-CG2 4.26Å; T256-T279 HydrophobicContact CG2-CG2 4.41Å; T279-N281 PolarHBondContact O-N 3.11Å; T279-N281 WeakPolarHBondContact OG1-CB 3.47Å; T279-N281 PolarHBondContact OG1-N 3.37Å; T279-C283 WeakPolarHBondContact CG2-O 3.3Å; T279-C283 PolarHBondContact OG1-O 3.11Å; T279-A285 HydrophobicContact CG2-CB 3.47Å; T279-A285 VanDerWaalsContact CG2-CB 3.47Å; T279-L301 HydrophobicContact CG2-CD2 4.05Å
280	P	92.4	Very high	94.5	Very high	90 Å²	90	33.6 Å²	33.6	58%	0.584	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-9.3	169.4	29.9	-36.2	0	0	0	113.5	V255 R282	V255-P280 HydrophobicContact CB-CG 4.37Å; V255-P280 HydrophobicContact CG1-CG 4.21Å; P280-R282 PolarHBondContact O-N 2.83Å
281	N	92.4	Very high	94.8	Very high	84 Å²	84	29.1 Å²	29.1	45%	0.449	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	13	-172.7	-58.2	-37.5	0	0	0	113.8	T279 C283 L301	T279-N281 PolarHBondContact O-N 3.11Å; T279-N281 WeakPolarHBondContact OG1-CB 3.47Å; T279-N281 PolarHBondContact OG1-N 3.37Å; N281-C283 VanDerWaalsContact C-N 3.25Å; N281-C283 PolarHBondContact O-N 2.89Å; N281-C283 PolarHBondContact O-SG 2.8Å; N281-L301 HydrophobicContact CB-CD1 4.03Å; N281-L301 HydrophobicContact CB-CD2 4.32Å
282	R	93.4	Very high	94.7	Very high	109 Å²	109	30.5 Å²	30.5	41%	0.411	16%	0.158	S	C	.	.	S	Bend	trans	65.4	25.8	176.4	-54	-69.8	-70.7	-83.1	-7.4	114.3	P280 E307 P308 P309 R370	P280-R282 PolarHBondContact O-N 2.83Å; R282-E307 PolarHBondContact NE-O 2.95Å; R282-E307 PolarHBondContact O-N 2.59Å; R282-P308 PolarHBondContact NE-O 2.81Å; R282-P309 VanDerWaalsContact CZ-CA 3.47Å; R282-R370 PolarHBondContact NH2-O 3Å
283	C	94.5	Very high	94.3	Very high	5 Å²	5	29.6 Å²	29.6	3%	0.034	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	159.8	174	50.7	0	0	0	0	110.7	T279 N281 S302 L305	T279-C283 WeakPolarHBondContact CG2-O 3.3Å; T279-C283 PolarHBondContact OG1-O 3.11Å; N281-C283 VanDerWaalsContact C-N 3.25Å; N281-C283 PolarHBondContact O-N 2.89Å; N281-C283 PolarHBondContact O-SG 2.8Å; C283-S302 VanDerWaalsContact CB-O 3.25Å; C283-S302 WeakPolarHBondContact CB-O 3.44Å; C283-L305 CarbonylContact C-O 3.52Å; C283-L305 VanDerWaalsContact CA-O 3.25Å; C283-L305 WeakPolarHBondContact CA-O 3.42Å
284	R	95.7	Very high	94	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	147.6	174.4	-56.8	-55.3	-69.7	-174.1	-8.4	111.4	E258 S276 A277 R278 L301 S302 L305 E307 C312 Y364	E258-R284 PolarHBondContact O-NH2 2.8Å; S276-R284 PolarHBondContact O-NH2 3Å; S276-R284 PolarHBondContact OG-NE 2.83Å; A277-R284 VanDerWaalsContact C-CZ 3.48Å; R278-R284 VanDerWaalsContact CA-NH1 3.31Å; R278-R284 VanDerWaalsContact CB-NH1 3.33Å; R284-L301 WeakPolarHBondContact O-CA 3.44Å; R284-S302 PolarHBondContact O-N 2.83Å; R284-L305 HydrophobicContact CB-CB 3.97Å; R284-L305 HydrophobicContact CB-CD1 4.37Å; R284-L305 HydrophobicContact CG-CB 3.48Å; R284-L305 VanDerWaalsContact CG-CB 3.48Å; R284-L305 HydrophobicContact CG-CD1 4.04Å; R284-L305 HydrophobicContact CG-CG 4.44Å; R284-L305 PolarHBondContact N-O 3.36Å; R284-E307 VanDerWaalsContact CD-OE1 3.23Å; R284-E307 WeakPolarHBondContact CD-OE1 3.44Å; R284-E307 IonicContact CZ-OE1 2.75Å; R284-E307 IonicContact NE-OE1 2.76Å; R284-E307 IonicContact NH1-OE1 2.91Å; R284-E307 PolarHBondContact NH1-OE1 3.46Å; R284-C312 PolarHBondContact NH1-O 2.78Å; R284-C312 VanDerWaalsContact NH1-O 3.15Å; R284-Y364 VanDerWaalsContact CD-OH 3.24Å; R284-Y364 WeakPolarHBondContact CD-OH 3.42Å; R284-Y364 HydrophobicContact CG-CE1 4.4Å; R284-Y364 PolarHBondContact NE-OH 3.08Å
285	A	95.4	Very high	93.6	Very high	1 Å²	1	33 Å²	33	1%	0.008	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	128.7	158.3	0	0	0	0	0	108.6	M254 T256 S276 A277 T279 L299 A300	M254-A285 HydrophobicContact SD-CB 3.66Å; T256-A285 HydrophobicContact CG2-CB 3.92Å; S276-A285 CarbonylContact C-O 3.59Å; S276-A285 WeakPolarHBondContact CA-O 3.29Å; A277-A285 HydrophobicContact CB-CB 4.35Å; A277-A285 PolarHBondContact N-O 2.82Å; A277-A285 PolarHBondContact O-N 3.28Å; T279-A285 HydrophobicContact CG2-CB 3.47Å; T279-A285 VanDerWaalsContact CG2-CB 3.47Å; A285-L299 HydrophobicContact CB-CD1 4.01Å; A285-A300 CarbonylContact C-O 3.56Å; A285-A300 VanDerWaalsContact CA-O 3.31Å; A285-A300 WeakPolarHBondContact CA-O 3.44Å
286	E	95.5	Very high	93.4	Very high	24 Å²	24	34.4 Å²	34.4	11%	0.112	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	135	171.5	-62.3	179.4	99.3	0	0	108.2	Y274 C275 L299 A300 S302 W390	Y274-E286 HydrophobicContact CE2-CB 4.07Å; Y274-E286 HydrophobicContact CE2-CG 4.06Å; Y274-E286 PolarHBondContact OH-OE1 2.94Å; C275-E286 WeakPolarHBondContact O-CA 3.21Å; E286-L299 WeakPolarHBondContact O-CA 2.97Å; E286-A300 PolarHBondContact N-O 3.29Å; E286-A300 PolarHBondContact O-N 2.83Å; E286-S302 WeakPolarHBondContact OE2-CB 3.31Å; E286-S302 PolarHBondContact OE2-OG 2.86Å; E286-W390 PolarHBondContact OE1-NE1 2.89Å
287	A	94.7	Very high	93	Very high	2 Å²	2	39.8 Å²	39.8	2%	0.017	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	153.3	176.8	0	0	0	0	0	111.2	C275 F296 L299	C275-A287 PolarHBondContact N-O 2.78Å; C275-A287 PolarHBondContact O-N 3.25Å; A287-F296 HydrophobicContact CB-CB 4.01Å; A287-F296 HydrophobicContact CB-CD1 3.84Å; A287-F296 HydrophobicContact CB-CG 4.32Å; A287-L299 HydrophobicContact CB-CD1 3.94Å
288	L	94.6	Very high	92.1	Very high	19 Å²	19	47 Å²	47	10%	0.099	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	136.7	-176.9	-63.5	179.6	0	0	0	110.7	V272 L273 Y274 Q297 L385	V272-L288 HydrophobicContact CG1-CB 3.84Å; V272-L288 HydrophobicContact CG1-CD2 4.03Å; V272-L288 HydrophobicContact CG1-CG 4.35Å; L273-L288 CarbonylContact O-C 3.48Å; L273-L288 WeakPolarHBondContact O-CA 3.31Å; Y274-L288 HydrophobicContact CD2-CD2 3.89Å; Y274-L288 HydrophobicContact CG-CD2 4.42Å; L288-Q297 PolarHBondContact N-O 3.44Å; L288-Q297 PolarHBondContact O-N 2.78Å; L288-L385 HydrophobicContact CD1-CD2 4.29Å; L288-L385 HydrophobicContact CD2-CD2 4.47Å
289	S	95.1	Very high	91.6	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.007	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	125.1	177.8	135.5	0	0	0	0	110	V272 L273 D291 H292 G293 G295	V272-S289 WeakPolarHBondContact CG1-O 3.11Å; L273-S289 PolarHBondContact N-O 2.76Å; L273-S289 PolarHBondContact O-N 2.85Å; S289-D291 PolarHBondContact OG-OD1 3.28Å; S289-H292 PolarHBondContact OG-N 2.94Å; S289-G293 PolarHBondContact OG-N 3.49Å; S289-G295 WeakPolarHBondContact CB-O 3.43Å
290	T	92.8	Very high	91.4	Very high	95 Å²	95	48.4 Å²	48.4	58%	0.583	25%	0.247	S	C	*	.	S	Bend	trans	-99.5	2.5	172.3	58.5	0	0	0	0	113.1	V272	V272-T290 HydrophobicContact CG2-CG2 4.43Å
291	D	91.4	Very high	91.5	Very high	50 Å²	50	47 Å²	47	27%	0.267	24%	0.235	S	C	.	.	S	Bend	trans	-117.8	34.7	-179.2	59.6	11.4	0	0	0	111.4	R206 S289 G293 E294 G295	R206-D291 PolarHBondContact NH1-O 2.73Å; S289-D291 PolarHBondContact OG-OD1 3.28Å; D291-G293 PolarHBondContact O-N 2.84Å; D291-G293 VanDerWaalsContact O-N 3.14Å; D291-E294 HydrophobicContact CB-CB 4.4Å; D291-E294 PolarHBondContact O-N 2.78Å; D291-E294 PolarHBondContact OD1-N 2.86Å; D291-G295 VanDerWaalsContact CG-N 3.29Å; D291-G295 PolarHBondContact OD1-N 2.67Å; D291-G295 VanDerWaalsContact OD1-O 3.06Å; D291-G295 WeakPolarHBondContact OD2-CA 3.46Å; D291-G295 PolarHBondContact OD2-N 2.85Å; D291-G295 VanDerWaalsContact OD2-N 3.17Å
292	H	90.1	Very high	91.5	Very high	70 Å²	70	43.1 Å²	43.1	32%	0.324	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	52	37.1	174.6	-52.1	-74	0	0	0	114.6	L202 R206 S289	L202-H292 HydrophobicContact CD1-CB 3.7Å; R206-H292 WeakPolarHBondContact CD-O 3.28Å; R206-H292 PolarHBondContact NH1-O 2.89Å; S289-H292 PolarHBondContact OG-N 2.94Å
293	G	86.1	Confident	91.4	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	99.4	-0.2	172.8	0	0	0	0	0	115.6	S289 D291	S289-G293 PolarHBondContact OG-N 3.49Å; D291-G293 PolarHBondContact O-N 2.84Å; D291-G293 VanDerWaalsContact O-N 3.14Å
294	E	89.4	Confident	91.3	Very high	67 Å²	67	47.1 Å²	47.1	31%	0.313	24%	0.237	S	C	.	.	S	Bend	trans	-73.1	-31.8	177	-76.9	174.6	-136.4	0	0	112.8	R206 Y237 R249 D291	R206-E294 IonicContact CZ-OE1 2.83Å; R206-E294 IonicContact NH1-OE1 2.74Å; R206-E294 PolarHBondContact NH1-OE1 2.8Å; R206-E294 IonicContact NH2-OE1 2.7Å; R206-E294 PolarHBondContact NH2-OE1 2.88Å; Y237-E294 HydrophobicContact CE1-CG 4.08Å; R249-E294 VanDerWaalsContact CB-O 3.24Å; R249-E294 WeakPolarHBondContact CB-O 3.03Å; R249-E294 VanDerWaalsContact CG-O 3.25Å; R249-E294 WeakPolarHBondContact CG-O 3.23Å; R249-E294 PolarHBondContact N-O 3.08Å; D291-E294 HydrophobicContact CB-CB 4.4Å; D291-E294 PolarHBondContact O-N 2.78Å; D291-E294 PolarHBondContact OD1-N 2.86Å
295	G	89.8	Confident	91.2	Very high	11 Å²	11	47.1 Å²	47.1	11%	0.113	24%	0.237	C	C	.	.			trans	-152.8	126	-176.1	0	0	0	0	0	113.7	S289 D291	S289-G295 WeakPolarHBondContact CB-O 3.43Å; D291-G295 VanDerWaalsContact CG-N 3.29Å; D291-G295 PolarHBondContact OD1-N 2.67Å; D291-G295 VanDerWaalsContact OD1-O 3.06Å; D291-G295 WeakPolarHBondContact OD2-CA 3.46Å; D291-G295 PolarHBondContact OD2-N 2.85Å; D291-G295 VanDerWaalsContact OD2-N 3.17Å
296	F	92.9	Very high	91.1	Very high	29 Å²	29	47.5 Å²	47.5	13%	0.127	24%	0.239	C	C	.	.			trans	-98.7	137.2	178.4	-74.4	-95.2	0	0	0	112.6	M235 I251 L273 C275 A287	M235-F296 HydrophobicContact CE-CE2 3.88Å; M235-F296 HydrophobicContact CE-CZ 3.74Å; M235-F296 HydrophobicContact CG-CE2 3.57Å; M235-F296 HydrophobicContact CG-CZ 3.87Å; M235-F296 HydrophobicContact SD-CE2 4.49Å; M235-F296 HydrophobicContact SD-CZ 4.37Å; I251-F296 HydrophobicContact CD1-CB 3.94Å; I251-F296 HydrophobicContact CD1-CD1 4.14Å; I251-F296 HydrophobicContact CD1-CD2 3.58Å; I251-F296 HydrophobicContact CD1-CE2 4.14Å; I251-F296 HydrophobicContact CD1-CG 3.58Å; I251-F296 HydrophobicContact CG1-CB 3.95Å; I251-F296 HydrophobicContact CG1-CD2 3.78Å; I251-F296 HydrophobicContact CG1-CG 3.97Å; I251-F296 HydrophobicContact CG2-CB 4.3Å; L273-F296 HydrophobicContact CD2-CE1 4.47Å; L273-F296 HydrophobicContact CD2-CZ 3.77Å; L273-F296 HydrophobicContact CG-CE1 4.35Å; L273-F296 HydrophobicContact CG-CZ 4.12Å; C275-F296 HydrophobicContact CB-CD1 3.92Å; C275-F296 HydrophobicContact CB-CE1 3.42Å; C275-F296 VanDerWaalsContact CB-CE1 3.42Å; C275-F296 HydrophobicContact CB-CZ 4.09Å; A287-F296 HydrophobicContact CB-CB 4.01Å; A287-F296 HydrophobicContact CB-CD1 3.84Å; A287-F296 HydrophobicContact CB-CG 4.32Å
297	Q	87.6	Confident	91	Very high	114 Å²	114	46.5 Å²	46.5	53%	0.533	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	177.9	179.8	-55.9	-178	42.9	0	0	110.1	L288 L299	L288-Q297 PolarHBondContact N-O 3.44Å; L288-Q297 PolarHBondContact O-N 2.78Å; Q297-L299 PolarHBondContact O-N 2.93Å; Q297-L299 VanDerWaalsContact O-N 3.1Å
298	R	79.4	Confident	90.9	Very high	153 Å²	153	46.6 Å²	46.6	58%	0.577	24%	0.235	S	C	*	.	E	Extended strand (participates in β ladder)	trans	53.8	30.7	176.3	-65.3	179.4	55.5	-172.9	-6.6	114.7	A300 L385	R298-A300 PolarHBondContact O-N 3.44Å; R298-A300 VanDerWaalsContact O-N 3.12Å; R298-L385 PolarHBondContact NH1-O 3.13Å; R298-L385 PolarHBondContact NH2-O 3.23Å
299	L	85.3	Confident	90.8	Very high	43 Å²	43	48.6 Å²	48.6	23%	0.225	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	107.3	-177.5	-176.3	59.4	0	0	0	112	I251 M254 A285 E286 A287 Q297	I251-L299 HydrophobicContact CG2-CD1 3.84Å; I251-L299 HydrophobicContact CG2-CD2 3.92Å; I251-L299 HydrophobicContact CG2-CG 4.49Å; M254-L299 HydrophobicContact CB-CD1 4.41Å; M254-L299 HydrophobicContact CB-CD2 3.51Å; M254-L299 HydrophobicContact CB-CG 4.04Å; M254-L299 HydrophobicContact CE-CG 4.02Å; M254-L299 HydrophobicContact SD-CD1 4.3Å; M254-L299 HydrophobicContact SD-CG 4.34Å; A285-L299 HydrophobicContact CB-CD1 4.01Å; E286-L299 WeakPolarHBondContact O-CA 2.97Å; A287-L299 HydrophobicContact CB-CD1 3.94Å; Q297-L299 PolarHBondContact O-N 2.93Å; Q297-L299 VanDerWaalsContact O-N 3.1Å
300	A	91.6	Very high	90.6	Very high	49 Å²	49	56 Å²	56	41%	0.405	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	156.8	-172.9	0	0	0	0	0	112.2	A285 E286 R298	A285-A300 CarbonylContact C-O 3.56Å; A285-A300 VanDerWaalsContact CA-O 3.31Å; A285-A300 WeakPolarHBondContact CA-O 3.44Å; E286-A300 PolarHBondContact N-O 3.29Å; E286-A300 PolarHBondContact O-N 2.83Å; R298-A300 PolarHBondContact O-N 3.44Å; R298-A300 VanDerWaalsContact O-N 3.12Å
301	L	92.9	Very high	90.6	Very high	62 Å²	62	51.6 Å²	51.6	33%	0.325	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	118.9	176.4	-71.3	179.3	0	0	0	111.5	M254 T279 N281 R284 Q303	M254-L301 HydrophobicContact CE-CD2 3.83Å; M254-L301 HydrophobicContact CE-CG 3.8Å; M254-L301 HydrophobicContact SD-CD2 3.45Å; M254-L301 WeakPolarHBondContact SD-CD2 3.37Å; M254-L301 HydrophobicContact SD-CG 4.13Å; T279-L301 HydrophobicContact CG2-CD2 4.05Å; N281-L301 HydrophobicContact CB-CD1 4.03Å; N281-L301 HydrophobicContact CB-CD2 4.32Å; R284-L301 WeakPolarHBondContact O-CA 3.44Å; L301-Q303 PolarHBondContact O-N 2.93Å
302	S	93.1	Very high	90.9	Very high	1 Å²	1	49.2 Å²	49.2	1%	0.007	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	104.1	-177.7	-155.3	0	0	0	0	112.4	C283 R284 E286 Q304 L305	C283-S302 VanDerWaalsContact CB-O 3.25Å; C283-S302 WeakPolarHBondContact CB-O 3.44Å; R284-S302 PolarHBondContact O-N 2.83Å; E286-S302 WeakPolarHBondContact OE2-CB 3.31Å; E286-S302 PolarHBondContact OE2-OG 2.86Å; S302-Q304 PolarHBondContact O-N 3.49Å; S302-L305 PolarHBondContact O-N 3.04Å
303	Q	90.9	Very high	91.2	Very high	124 Å²	124	46 Å²	46	58%	0.579	23%	0.23	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-70.1	-17.3	-179.8	-61.2	-54	-55.8	0	0	113.7	L301 R370	L301-Q303 PolarHBondContact O-N 2.93Å; Q303-R370 PolarHBondContact O-NH2 3.45Å
304	Q	92.9	Very high	91.7	Very high	74 Å²	74	46 Å²	46	35%	0.346	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	-42	174.7	-72.6	157.4	-22.9	0	0	111.9	S302 C306 A388 W390	S302-Q304 PolarHBondContact O-N 3.49Å; Q304-C306 PolarHBondContact O-N 2.84Å; Q304-A388 VanDerWaalsContact CD-O 3.31Å; Q304-A388 PolarHBondContact NE2-O 3.26Å; Q304-A388 PolarHBondContact OE1-O 3.19Å; Q304-W390 HydrophobicContact CB-CB 3.93Å; Q304-W390 HydrophobicContact CG-CB 4.45Å; Q304-W390 PolarHBondContact NE2-O 2.75Å
305	L	94.1	Very high	92.2	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	81.1	177.6	-53.5	-173.6	0	0	0	110.6	C283 R284 S302 Y364 Y379 W390	C283-L305 CarbonylContact C-O 3.52Å; C283-L305 VanDerWaalsContact CA-O 3.25Å; C283-L305 WeakPolarHBondContact CA-O 3.42Å; R284-L305 HydrophobicContact CB-CB 3.97Å; R284-L305 HydrophobicContact CB-CD1 4.37Å; R284-L305 HydrophobicContact CG-CB 3.48Å; R284-L305 VanDerWaalsContact CG-CB 3.48Å; R284-L305 HydrophobicContact CG-CD1 4.04Å; R284-L305 HydrophobicContact CG-CG 4.44Å; R284-L305 PolarHBondContact N-O 3.36Å; S302-L305 PolarHBondContact O-N 3.04Å; L305-Y364 HydrophobicContact CB-CE1 4.34Å; L305-Y364 HydrophobicContact CD1-CD1 3.73Å; L305-Y364 HydrophobicContact CD1-CE1 3.83Å; L305-Y364 HydrophobicContact CD1-CG 4.23Å; L305-Y364 HydrophobicContact CD2-CD1 3.64Å; L305-Y364 HydrophobicContact CD2-CE1 4.01Å; L305-Y364 HydrophobicContact CG-CD1 4.23Å; L305-Y364 HydrophobicContact CG-CE1 4.29Å; L305-Y379 HydrophobicContact CD2-CD1 3.75Å; L305-Y379 HydrophobicContact CD2-CD2 4.33Å; L305-Y379 HydrophobicContact CD2-CE1 4.03Å; L305-Y379 HydrophobicContact CD2-CG 3.9Å; L305-W390 HydrophobicContact CD1-CD2 4.05Å; L305-W390 HydrophobicContact CD1-CG 4.34Å; L305-W390 HydrophobicContact CD1-CZ2 3.98Å; L305-W390 HydrophobicContact CD2-CB 4.21Å; L305-W390 HydrophobicContact CD2-CD2 3.89Å; L305-W390 HydrophobicContact CD2-CE3 4.32Å; L305-W390 HydrophobicContact CD2-CG 3.82Å; L305-W390 HydrophobicContact CG-CD2 4.16Å; L305-W390 HydrophobicContact CG-CG 4Å
306	C	92.4	Very high	92.6	Very high	10 Å²	10	42.3 Å²	42.3	7%	0.068	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	159.6	-177.7	64.2	0	0	0	0	113.7	Q304 H366 R370	Q304-C306 PolarHBondContact O-N 2.84Å; C306-H366 PolarHBondContact O-CE1 3.3Å; C306-H366 VanDerWaalsContact O-CE1 3.29Å; C306-H366 PolarHBondContact O-ND1 2.88Å; C306-R370 HydrophobicContact CB-CG 3.68Å; C306-R370 WeakPolarHBondContact SG-CG 3.35Å
307	E	93.4	Very high	92.8	Very high	2 Å²	2	41.3 Å²	41.3	1%	0.009	21%	0.206	C	C	.	.			trans	-123.3	147.9	178.5	-68.5	-161.3	-171.7	0	0	115	R278 R282 R284 G311	R278-E307 VanDerWaalsContact CA-OE1 3.3Å; R278-E307 WeakPolarHBondContact CA-OE1 3.28Å; R278-E307 WeakPolarHBondContact CG-OE2 3.36Å; R282-E307 PolarHBondContact NE-O 2.95Å; R282-E307 PolarHBondContact O-N 2.59Å; R284-E307 VanDerWaalsContact CD-OE1 3.23Å; R284-E307 WeakPolarHBondContact CD-OE1 3.44Å; R284-E307 IonicContact CZ-OE1 2.75Å; R284-E307 IonicContact NE-OE1 2.76Å; R284-E307 IonicContact NH1-OE1 2.91Å; R284-E307 PolarHBondContact NH1-OE1 3.46Å; E307-G311 WeakPolarHBondContact OE2-CA 3.47Å
308	P	93.9	Very high	93.2	Very high	4 Å²	4	36.9 Å²	36.9	3%	0.026	19%	0.187	C	C	.	.			trans	-66.9	167.4	170.3	29.3	-34.7	0	0	0	112.2	R282 H310 G311 C312 R373	R282-P308 PolarHBondContact NE-O 2.81Å; P308-H310 VanDerWaalsContact C-N 3.26Å; P308-H310 PolarHBondContact O-N 3.01Å; P308-H310 VanDerWaalsContact O-N 3.11Å; P308-G311 PolarHBondContact O-N 2.83Å; P308-C312 HydrophobicContact CG-CB 4.36Å; P308-R373 HydrophobicContact CG-CG 3.95Å
309	P	91.4	Very high	93.9	Very high	62 Å²	62	29.8 Å²	29.8	40%	0.403	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-33.5	-173.2	-25.8	32.2	0	0	0	116.4	R282 K371	R282-P309 VanDerWaalsContact CZ-CA 3.47Å; P309-K371 WeakPolarHBondContact CD-O 3.42Å
310	H	90.8	Very high	94.2	Very high	155 Å²	155	31.5 Å²	31.5	72%	0.718	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.1	9.2	178.9	-57.5	-64.5	0	0	0	112.4	R278 P308	R278-H310 PolarHBondContact NH2-O 3.16Å; P308-H310 VanDerWaalsContact C-N 3.26Å; P308-H310 PolarHBondContact O-N 3.01Å; P308-H310 VanDerWaalsContact O-N 3.11Å
311	G	94.1	Very high	93.8	Very high	4 Å²	4	29.7 Å²	29.7	4%	0.041	15%	0.148	C	C	.	.			trans	63.4	177.1	-174.1	0	0	0	0	0	114.5	E307 P308 R373	E307-G311 WeakPolarHBondContact OE2-CA 3.47Å; P308-G311 PolarHBondContact O-N 2.83Å; G311-R373 PolarHBondContact O-NE 2.7Å; G311-R373 PolarHBondContact O-NH2 3.47Å
312	C	96.9	Very high	93	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.158	C	C	.	.			trans	-156	147.2	170.7	-159.2	0	0	0	0	108.4	R284 P308 H366 P367 R373 G402	R284-C312 PolarHBondContact NH1-O 2.78Å; R284-C312 VanDerWaalsContact NH1-O 3.15Å; P308-C312 HydrophobicContact CG-CB 4.36Å; C312-H366 PolarHBondContact O-NE2 2.86Å; C312-P367 HydrophobicContact CB-CG 4.44Å; C312-R373 HydrophobicContact CB-CG 4.4Å; C312-G402 VanDerWaalsContact SG-C 3.55Å; C312-G402 PolarHBondContact SG-O 2.71Å
313	Q	97.1	Very high	91.7	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.009	19%	0.186	C	C	.	.			trans	-62.1	155.3	159.7	178.5	-84.6	0.8	0	0	109.1	P196 E258 H366 Y403 S404	P196-Q313 HydrophobicContact CG-CG 4.24Å; P196-Q313 WeakPolarHBondContact O-CG 3.36Å; P196-Q313 PolarHBondContact O-NE2 3.32Å; E258-Q313 HydrophobicContact CB-CB 4.41Å; Q313-H366 PolarHBondContact O-CD2 3.21Å; Q313-Y403 HydrophobicContact CB-CD1 3.43Å; Q313-Y403 VanDerWaalsContact CB-CD1 3.43Å; Q313-Y403 HydrophobicContact CB-CE1 3.42Å; Q313-Y403 VanDerWaalsContact CB-CE1 3.42Å; Q313-Y403 HydrophobicContact CB-CG 4.01Å; Q313-Y403 HydrophobicContact CG-CD1 3.99Å; Q313-Y403 HydrophobicContact CG-CE1 4.24Å; Q313-S404 PolarHBondContact NE2-O 2.91Å; Q313-S404 PolarHBondContact OE1-O 2.73Å
314	G	96.7	Very high	90.1	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.186	C	C	.	.			trans	-156.3	153.1	167.2	0	0	0	0	0	108	S365	G314-S365 CarbonylContact C-O 3.52Å; G314-S365 WeakPolarHBondContact CA-O 3.4Å
315	S	98.6	Very high	87.8	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	146.9	-169.7	176.6	0	0	0	0	111.7	H198 Y364 S365 S404 D405 L406	H198-S315 PolarHBondContact CE1-OG 2.8Å; S315-Y364 CarbonylContact O-C 3.42Å; S315-Y364 WeakPolarHBondContact O-CA 3.44Å; S315-Y364 WeakPolarHBondContact O-CD2 3.49Å; S315-S365 PolarHBondContact N-O 3.24Å; S315-S365 PolarHBondContact O-N 3.5Å; S315-S404 WeakPolarHBondContact CB-O 3.46Å; S315-D405 VanDerWaalsContact CB-OD1 3.29Å; S315-D405 WeakPolarHBondContact CB-OD1 3.44Å; S315-D405 PolarHBondContact OG-OD1 2.86Å; S315-L406 PolarHBondContact OG-N 3.44Å; S315-L406 VanDerWaalsContact OG-N 3.11Å
316	V	98.3	Very high	85.3	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	138.8	177.8	74	0	0	0	0	109.6	H198 E260 A262 Y274 L362 L363 Y364 W390	H198-V316 PolarHBondContact CE1-O 3.29Å; E260-V316 HydrophobicContact CB-CG1 4.14Å; A262-V316 HydrophobicContact CB-CG1 4.05Å; A262-V316 HydrophobicContact CB-CG2 4.49Å; Y274-V316 HydrophobicContact CD1-CG1 4.17Å; Y274-V316 HydrophobicContact CD1-CG2 4.26Å; Y274-V316 HydrophobicContact CE1-CB 4.36Å; Y274-V316 HydrophobicContact CE1-CG1 4.06Å; Y274-V316 HydrophobicContact CE1-CG2 3.88Å; V316-L362 HydrophobicContact CG2-CB 4.29Å; V316-L362 HydrophobicContact CG2-CD1 4.41Å; V316-L362 HydrophobicContact CG2-CD2 3.97Å; V316-L362 HydrophobicContact CG2-CG 4.47Å; V316-L363 CarbonylContact C-O 3.5Å; V316-L363 VanDerWaalsContact CA-O 3.27Å; V316-L363 WeakPolarHBondContact CA-O 3.42Å; V316-L363 VanDerWaalsContact CG2-O 3.3Å; V316-L363 WeakPolarHBondContact CG2-O 3.48Å; V316-Y364 HydrophobicContact CB-CD2 4.03Å; V316-Y364 HydrophobicContact CG2-CD2 4.47Å; V316-W390 HydrophobicContact CG2-CH2 4.33Å
317	V	98	Very high	82.8	Confident	8 Å²	8	54.5 Å²	54.5	5%	0.048	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	147.6	169.4	-68.6	0	0	0	0	110.2	L362 L363 L406 A408 F415	V317-L362 WeakPolarHBondContact O-CA 3.22Å; V317-L363 HydrophobicContact CG2-CB 3.95Å; V317-L363 PolarHBondContact N-O 2.9Å; V317-L363 PolarHBondContact O-N 3.16Å; V317-L406 HydrophobicContact CG1-CB 3.73Å; V317-L406 HydrophobicContact CG2-CB 3.98Å; V317-L406 HydrophobicContact CG2-CD1 4.07Å; V317-A408 HydrophobicContact CB-CB 4.08Å; V317-A408 HydrophobicContact CG2-CB 4.03Å; V317-F415 HydrophobicContact CG2-CD1 4.4Å
318	S	96.1	Very high	79.8	Confident	21 Å²	21	60 Å²	60	15%	0.147	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	151.9	165.2	49.4	0	0	0	0	110.4	E263 W361	E263-S318 WeakPolarHBondContact O-CB 3.43Å; E263-S318 PolarHBondContact O-OG 3.2Å; S318-W361 WeakPolarHBondContact CA-O 3.41Å
319	F	94.4	Very high	76.9	Confident	4 Å²	4	68.5 Å²	68.5	2%	0.018	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	166.4	162.5	70.5	-76.9	0	0	0	110.6	S360 W361 L363 L380 E410 F415 D437	F319-S360 CarbonylContact O-C 3.15Å; F319-S360 WeakPolarHBondContact O-CA 3.28Å; F319-W361 HydrophobicContact CD1-CB 4.38Å; F319-W361 HydrophobicContact CE1-CB 3.95Å; F319-W361 HydrophobicContact CE2-CE3 4.06Å; F319-W361 HydrophobicContact CZ-CB 4.12Å; F319-W361 AromaticContact CZ-CE3 3.79Å; F319-W361 HydrophobicContact CZ-CE3 3.79Å; F319-W361 PolarHBondContact N-O 2.75Å; F319-W361 PolarHBondContact O-N 2.84Å; F319-L363 HydrophobicContact CD1-CB 4.48Å; F319-L363 HydrophobicContact CE1-CB 4.2Å; F319-L363 HydrophobicContact CE1-CD1 4.5Å; F319-L380 HydrophobicContact CE1-CD1 3.76Å; F319-L380 HydrophobicContact CZ-CD1 3.75Å; F319-E410 HydrophobicContact CB-CG 4.02Å; F319-F415 HydrophobicContact CB-CE1 4.06Å; F319-F415 HydrophobicContact CB-CZ 4.21Å; F319-F415 AromaticContact CD1-CE1 3.77Å; F319-F415 HydrophobicContact CD1-CE1 3.77Å; F319-F415 AromaticContact CD1-CZ 3.74Å; F319-F415 HydrophobicContact CD1-CZ 3.74Å; F319-F415 HydrophobicContact CD2-CE1 4.37Å; F319-F415 AromaticContact CD2-CZ 3.7Å; F319-F415 HydrophobicContact CD2-CZ 3.7Å; F319-F415 HydrophobicContact CE1-CE1 4.24Å; F319-F415 AromaticContact CE1-CZ 3.9Å; F319-F415 HydrophobicContact CE1-CZ 3.9Å; F319-F415 AromaticContact CE2-CZ 3.87Å; F319-F415 HydrophobicContact CE2-CZ 3.87Å; F319-F415 AromaticContact CG-CE1 3.83Å; F319-F415 HydrophobicContact CG-CE1 3.83Å; F319-F415 AromaticContact CG-CZ 3.63Å; F319-F415 HydrophobicContact CG-CZ 3.63Å; F319-F415 AromaticContact CZ-CZ 3.95Å; F319-F415 HydrophobicContact CZ-CZ 3.95Å; F319-D437 HydrophobicContact CE2-CB 4.44Å
320	R	90.9	Very high	74	Confident	80 Å²	80	73.2 Å²	73.2	30%	0.302	36%	0.361	S	S	.	.			trans	-105	132.7	168.2	-66.3	173.9	-177.6	81.3	-1.7	109	E410	R320-E410 IonicContact NH1-OE2 3.29Å; R320-E410 PolarHBondContact NH1-OE2 3.21Å
321	P	83.2	Confident	71.2	Confident	11 Å²	11	71.5 Å²	71.5	7%	0.071	37%	0.367	C	S	.	.			trans	-67.6	135.4	176.3	29.5	-35.3	0	0	0	110.5	I324 E359 W361	P321-I324 HydrophobicContact CG-CG1 4.31Å; P321-E359 WeakPolarHBondContact CD-O 3.37Å; P321-W361 HydrophobicContact CB-CD2 4.29Å; P321-W361 HydrophobicContact CB-CE3 4.05Å; P321-W361 HydrophobicContact CB-CH2 3.81Å; P321-W361 HydrophobicContact CB-CZ2 4.08Å; P321-W361 HydrophobicContact CB-CZ3 3.81Å; P321-W361 HydrophobicContact CG-CD2 4.06Å; P321-W361 HydrophobicContact CG-CE3 4.34Å; P321-W361 HydrophobicContact CG-CH2 4.08Å; P321-W361 HydrophobicContact CG-CZ2 3.8Å; P321-W361 HydrophobicContact CG-CZ3 4.35Å
322	L	76.3	Confident	68.4	Low	101 Å²	101	78.4 Å²	78.4	53%	0.529	40%	0.403	S	S	.	.	S	Bend	trans	-70.7	-35.6	176.8	-66.9	175.6	0	0	0	112.1
323	E	64.5	Low	65.3	Low	128 Å²	128	83.6 Å²	83.6	60%	0.598	44%	0.439	S	S	*	.	S	Bend	trans	-122.1	119.6	174.5	-66.1	172.2	-145.5	0	0	108.3	P325 R438	E323-P325 VanDerWaalsContact O-CD 3.3Å; E323-P325 WeakPolarHBondContact O-CD 3.38Å; E323-R438 IonicContact OE1-NH2 3.13Å; E323-R438 PolarHBondContact OE1-NH2 2.8Å; E323-R438 VanDerWaalsContact OE1-NH2 3.13Å
324	I	58.1	Low	62.3	Low	111 Å²	111	92.6 Å²	92.6	57%	0.569	48%	0.478	S	S	*	.			trans	-80.4	115.4	170.4	-58.4	176.6	0	0	0	107.2	P321 H326	P321-I324 HydrophobicContact CG-CG1 4.31Å; I324-H326 PolarHBondContact O-N 2.57Å; I324-H326 VanDerWaalsContact O-N 3.12Å
325	P	45.7	Very low	59.3	Low	60 Å²	60	100.3 Å²	100.3	39%	0.39	52%	0.519	S	S	.	.			trans	-61.2	122	173.7	-18.4	32	0	0	0	108.3	E323 R327	E323-P325 VanDerWaalsContact O-CD 3.3Å; E323-P325 WeakPolarHBondContact O-CD 3.38Å; P325-R327 PolarHBondContact O-N 2.89Å
326	H	41.4	Very low	56.2	Low	185 Å²	185	106.4 Å²	106.4	86%	0.856	56%	0.556	S	S	*	*			trans	-55.4	104.9	-178.9	-72.1	-65	0	0	0	110.1	I324 C328	I324-H326 PolarHBondContact O-N 2.57Å; I324-H326 VanDerWaalsContact O-N 3.12Å; H326-C328 PolarHBondContact O-N 2.84Å
327	R	39.4	Very low	53.2	Low	207 Å²	207	111.9 Å²	111.9	78%	0.781	59%	0.592	S	S	*	*			trans	-58.9	113.1	171.4	-165.2	-178.9	-160	167.9	7.3	106.2	P325 Q329	P325-R327 PolarHBondContact O-N 2.89Å; R327-Q329 PolarHBondContact O-N 3.04Å
328	C	30.4	Very low	50	Low	118 Å²	118	118.3 Å²	118.3	80%	0.797	63%	0.631	S	S	*	*			trans	-51.6	110.3	-177.1	-61.6	0	0	0	0	109.4	H326 D330	H326-C328 PolarHBondContact O-N 2.84Å; C328-D330 PolarHBondContact O-N 2.86Å
329	Q	32.2	Very low	47	Very low	182 Å²	182	124.4 Å²	124.4	85%	0.85	66%	0.661	S	S	*	*			trans	-74.6	121.2	164.7	-71.5	-168.2	-1.6	0	0	106.6	R327 S331	R327-Q329 PolarHBondContact O-N 3.04Å; Q329-S331 VanDerWaalsContact C-N 3.29Å; Q329-S331 PolarHBondContact O-N 2.92Å
330	D	31.2	Very low	44	Very low	160 Å²	160	133.7 Å²	133.7	86%	0.856	70%	0.704	S	S	*	*			trans	-64.3	92.2	169	-73.9	-48.1	0	0	0	108.9	C328 N332	C328-D330 PolarHBondContact O-N 2.86Å; D330-N332 PolarHBondContact O-N 3.38Å
331	S	32	Very low	41.1	Very low	120 Å²	120	138.3 Å²	138.3	84%	0.839	73%	0.729	S	S	*	*			trans	-75.5	72.6	177.2	49.3	0	0	0	0	110.8	Q329	Q329-S331 VanDerWaalsContact C-N 3.29Å; Q329-S331 PolarHBondContact O-N 2.92Å
332	N	35.4	Very low	38.5	Very low	148 Å²	148	143.3 Å²	143.3	79%	0.791	76%	0.764	S	S	*	*			trans	-118.8	53.5	172.5	-155.3	16	0	0	0	112.7	D330	D330-N332 PolarHBondContact O-N 3.38Å
333	S	30.9	Very low	36.3	Very low	109 Å²	109	143.8 Å²	143.8	76%	0.762	78%	0.776	S	S	*	*			trans	-119.8	101.5	155.9	58.4	0	0	0	0	108.5	D335	S333-D335 PolarHBondContact O-N 3.12Å
334	K	35.6	Very low	35.1	Very low	191 Å²	191	144.1 Å²	144.1	83%	0.83	79%	0.789	S	S	*	*			trans	-65.4	124.5	165.5	-71.6	173.5	174.4	175.5	0	108.3
335	D	32.8	Very low	33.7	Very low	163 Å²	163	142.7 Å²	142.7	87%	0.872	80%	0.802	S	S	*	*			trans	-147.2	147.9	147.6	-93.1	-44.7	0	0	0	110.4	S333	S333-D335 PolarHBondContact O-N 3.12Å
336	V	32.6	Very low	32.9	Very low	128 Å²	128	144.5 Å²	144.5	78%	0.776	82%	0.816	S	S	*	*			trans	-94.9	139.9	-163.5	174	0	0	0	0	110.4
337	P	36	Very low	32.9	Very low	114 Å²	114	141.6 Å²	141.6	74%	0.74	82%	0.816	S	S	*	*			trans	-73.9	138.3	-175.1	30	-35.8	0	0	0	112.3
338	T	30.2	Very low	32.5	Very low	143 Å²	143	138.8 Å²	138.8	88%	0.877	82%	0.816	S	S	*	*			trans	-108.7	126.4	165	-58.2	0	0	0	0	109.3
339	I	33.2	Very low	32.5	Very low	150 Å²	150	143.9 Å²	143.9	77%	0.769	82%	0.819	S	S	*	*			trans	-84.4	132.9	-177.2	-65.2	165.7	0	0	0	110
340	Q	31.5	Very low	32.3	Very low	198 Å²	198	143.7 Å²	143.7	93%	0.925	82%	0.822	S	S	*	*			trans	-146.8	136.1	153.3	-120.6	172.5	6.6	0	0	111.2
341	Q	30.1	Very low	32.3	Very low	178 Å²	178	144.2 Å²	144.2	83%	0.832	82%	0.82	S	S	*	*			trans	-112	132.7	-175.9	-71.8	178	-35.4	0	0	111.5
342	S	29.3	Very low	32.5	Very low	115 Å²	115	147.8 Å²	147.8	80%	0.804	82%	0.823	S	S	*	*			trans	160.4	141.8	152.4	56.1	0	0	0	0	108.3
343	S	29.1	Very low	32.4	Very low	111 Å²	111	149.5 Å²	149.5	78%	0.776	83%	0.826	S	S	*	*			cis	-160.2	166	-7.8	-89	0	0	0	0	107.1
344	P	40.4	Very low	32.8	Very low	136 Å²	136	149.1 Å²	149.1	88%	0.883	83%	0.83	S	S	*	*			trans	-87.2	143	-165.6	33.4	-34.7	0	0	0	114.3
345	G	28.7	Very low	33	Very low	80 Å²	80	143 Å²	143	83%	0.825	82%	0.821	S	S	*	*			trans	126.2	93.2	157.9	0	0	0	0	0	116.4
346	S	28.6	Very low	33.6	Very low	98 Å²	98	141.6 Å²	141.6	69%	0.685	82%	0.819	S	S	*	*			trans	-159.6	121.9	140.8	-167	0	0	0	0	110	L348	S346-L348 PolarHBondContact O-N 3.23Å; S346-L348 VanDerWaalsContact O-N 3.16Å
347	S	42.3	Very low	34.7	Very low	124 Å²	124	139 Å²	139	87%	0.867	80%	0.804	S	S	*	*			trans	-76.9	95.2	171.4	54	0	0	0	0	109.2
348	L	30.9	Very low	36.3	Very low	148 Å²	148	135.5 Å²	135.5	78%	0.775	78%	0.783	S	S	*	*			trans	-115.7	123.6	171.1	-74	171.1	0	0	0	110	S346	S346-L348 PolarHBondContact O-N 3.23Å; S346-L348 VanDerWaalsContact O-N 3.16Å
349	R	29.1	Very low	39.1	Very low	226 Å²	226	130.5 Å²	130.5	85%	0.853	75%	0.749	S	S	*	*			trans	-27.8	134	173.9	-64.9	161.1	176.2	161.8	-2.5	112.6	E351	R349-E351 VanDerWaalsContact C-N 3.31Å; R349-E351 PolarHBondContact O-N 2.97Å
350	L	28.1	Very low	41.9	Very low	177 Å²	177	123.5 Å²	123.5	93%	0.927	71%	0.713	S	S	*	*			trans	-59.5	105.9	150.3	-87.7	81.9	0	0	0	106.1
351	E	30.8	Very low	44.9	Very low	172 Å²	172	114.9 Å²	114.9	80%	0.804	67%	0.673	S	S	*	*			trans	-67.6	131.7	155.4	-68.9	-174.9	154.8	0	0	106.6	R349 E353	R349-E351 VanDerWaalsContact C-N 3.31Å; R349-E351 PolarHBondContact O-N 2.97Å; E351-E353 VanDerWaalsContact C-N 3.3Å; E351-E353 PolarHBondContact O-N 2.85Å
352	E	36.7	Very low	48.1	Very low	194 Å²	194	106.4 Å²	106.4	91%	0.907	63%	0.633	S	S	*	*			trans	-69.9	89.8	179.5	-164.3	168	-154.9	0	0	107.1	A354	E352-A354 PolarHBondContact O-N 2.87Å
353	E	33.5	Very low	51.4	Low	184 Å²	184	101 Å²	101	86%	0.86	60%	0.595	S	S	*	*			trans	-53.3	115	173	-80.4	-165.5	150.9	0	0	107.5	E351 G355	E351-E353 VanDerWaalsContact C-N 3.3Å; E351-E353 PolarHBondContact O-N 2.85Å; E353-G355 VanDerWaalsContact C-N 3.3Å; E353-G355 PolarHBondContact O-N 2.85Å
354	A	39.8	Very low	54.6	Low	101 Å²	101	95.7 Å²	95.7	84%	0.835	56%	0.558	S	S	*	*			trans	-61.1	94.6	-179	0	0	0	0	0	108.9	E352 T356	E352-A354 PolarHBondContact O-N 2.87Å; A354-T356 PolarHBondContact O-N 2.87Å
355	G	38.8	Very low	57.4	Low	64 Å²	64	89.2 Å²	89.2	66%	0.66	52%	0.516	S	S	*	.	P	Polyproline II helix	trans	-54.8	135.3	-171.1	0	0	0	0	0	110.8	E353 P357	E353-G355 VanDerWaalsContact C-N 3.3Å; E353-G355 PolarHBondContact O-N 2.85Å; G355-P357 VanDerWaalsContact O-N 3.15Å
356	T	46.1	Very low	60.7	Low	133 Å²	133	85.4 Å²	85.4	82%	0.816	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-50.5	124.5	172.4	49.2	0	0	0	0	108.5	A354 S358	A354-T356 PolarHBondContact O-N 2.87Å; T356-S358 PolarHBondContact O-N 3.31Å; T356-S358 VanDerWaalsContact O-N 3.08Å
357	P	56.2	Low	64	Low	73 Å²	73	80.7 Å²	80.7	47%	0.474	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-55.9	121	-172.5	16.9	-29.1	0	0	0	110.2	G355 E359	G355-P357 VanDerWaalsContact O-N 3.15Å; P357-E359 PolarHBondContact O-N 3.06Å
358	S	69.8	Low	66.6	Low	40 Å²	40	76.2 Å²	76.2	28%	0.28	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-59.8	126.8	-175.2	-170.8	0	0	0	0	110.1	T356 S360	T356-S358 PolarHBondContact O-N 3.31Å; T356-S358 VanDerWaalsContact O-N 3.08Å; S358-S360 PolarHBondContact O-N 3.42Å
359	E	88.1	Confident	69.7	Low	39 Å²	39	70.7 Å²	70.7	18%	0.182	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-62.8	130	-177.5	-75.2	160.6	-106	0	0	110.7	T265 R267 P321 P357	T265-E359 WeakPolarHBondContact O-CA 3.19Å; R267-E359 HydrophobicContact CG-CG 3.97Å; R267-E359 WeakPolarHBondContact CG-OE1 3.38Å; R267-E359 WeakPolarHBondContact CG-OE2 3.43Å; R267-E359 IonicContact CZ-OE1 2.86Å; R267-E359 IonicContact CZ-OE2 3.11Å; R267-E359 IonicContact NE-OE1 3.63Å; R267-E359 IonicContact NE-OE2 3.32Å; R267-E359 PolarHBondContact NE-OE2 2.67Å; R267-E359 IonicContact NH1-OE1 2.75Å; R267-E359 PolarHBondContact NH1-OE1 3.43Å; R267-E359 IonicContact NH1-OE2 3.83Å; R267-E359 IonicContact NH2-OE1 2.84Å; R267-E359 PolarHBondContact NH2-OE1 2.83Å; R267-E359 IonicContact NH2-OE2 2.73Å; R267-E359 PolarHBondContact NH2-OE2 3.46Å; P321-E359 WeakPolarHBondContact CD-O 3.37Å; P357-E359 PolarHBondContact O-N 3.06Å
360	S	92.9	Very high	72.8	Confident	2 Å²	2	67 Å²	67	1%	0.014	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-72.4	136.1	171.4	-51.7	0	0	0	0	110.3	T265 F319 S358 P384	T265-S360 PolarHBondContact N-OG 2.91Å; T265-S360 PolarHBondContact O-N 3.35Å; F319-S360 CarbonylContact O-C 3.15Å; F319-S360 WeakPolarHBondContact O-CA 3.28Å; S358-S360 PolarHBondContact O-N 3.42Å; S360-P384 WeakPolarHBondContact O-CD 3.21Å; S360-P384 VanDerWaalsContact O-CG 3.29Å; S360-P384 WeakPolarHBondContact O-CG 3.43Å
361	W	94.6	Very high	76	Confident	18 Å²	18	66.7 Å²	66.7	7%	0.068	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	159.4	166.6	-64.3	-4.1	0	0	0	109.8	S318 F319 P321 L380 N381 Q382 L441	S318-W361 WeakPolarHBondContact CA-O 3.41Å; F319-W361 HydrophobicContact CD1-CB 4.38Å; F319-W361 HydrophobicContact CE1-CB 3.95Å; F319-W361 HydrophobicContact CE2-CE3 4.06Å; F319-W361 HydrophobicContact CZ-CB 4.12Å; F319-W361 AromaticContact CZ-CE3 3.79Å; F319-W361 HydrophobicContact CZ-CE3 3.79Å; F319-W361 PolarHBondContact N-O 2.75Å; F319-W361 PolarHBondContact O-N 2.84Å; P321-W361 HydrophobicContact CB-CD2 4.29Å; P321-W361 HydrophobicContact CB-CE3 4.05Å; P321-W361 HydrophobicContact CB-CH2 3.81Å; P321-W361 HydrophobicContact CB-CZ2 4.08Å; P321-W361 HydrophobicContact CB-CZ3 3.81Å; P321-W361 HydrophobicContact CG-CD2 4.06Å; P321-W361 HydrophobicContact CG-CE3 4.34Å; P321-W361 HydrophobicContact CG-CH2 4.08Å; P321-W361 HydrophobicContact CG-CZ2 3.8Å; P321-W361 HydrophobicContact CG-CZ3 4.35Å; W361-L380 HydrophobicContact CB-CD1 4.34Å; W361-L380 HydrophobicContact CE3-CD1 4.08Å; W361-L380 HydrophobicContact CE3-CD2 4.07Å; W361-L380 HydrophobicContact CZ3-CD2 4.25Å; W361-N381 WeakPolarHBondContact CA-O 3.18Å; W361-Q382 VanDerWaalsContact CD1-O 3.31Å; W361-Q382 HydrophobicContact CD2-CB 4.16Å; W361-Q382 HydrophobicContact CD2-CG 3.87Å; W361-Q382 HydrophobicContact CE3-CG 4.14Å; W361-Q382 HydrophobicContact CG-CB 4.27Å; W361-Q382 HydrophobicContact CG-CG 4.34Å; W361-Q382 HydrophobicContact CH2-CG 4.44Å; W361-Q382 HydrophobicContact CZ2-CB 4.4Å; W361-Q382 HydrophobicContact CZ2-CG 4.15Å; W361-Q382 HydrophobicContact CZ3-CG 4.42Å; W361-Q382 PolarHBondContact NE1-O 3.17Å; W361-L441 HydrophobicContact CH2-CD2 4.43Å; W361-L441 HydrophobicContact CZ3-CD2 4.06Å
362	L	96.6	Very high	79.1	Confident	0 Å²	0	66 Å²	66	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	139.7	170.7	-70.2	177.7	0	0	0	111	A262 V264 Y274 V316 V317 N381 P384 W390	A262-L362 HydrophobicContact CB-CD2 3.57Å; V264-L362 HydrophobicContact CG1-CD1 4.18Å; V264-L362 HydrophobicContact CG1-CD2 3.32Å; V264-L362 HydrophobicContact CG1-CG 3.64Å; Y274-L362 HydrophobicContact CD1-CD1 3.62Å; Y274-L362 HydrophobicContact CD1-CD2 4.45Å; Y274-L362 HydrophobicContact CD2-CD1 3.83Å; Y274-L362 HydrophobicContact CE1-CD1 3.82Å; Y274-L362 HydrophobicContact CE2-CD1 4.02Å; Y274-L362 HydrophobicContact CG-CD1 3.63Å; V316-L362 HydrophobicContact CG2-CB 4.29Å; V316-L362 HydrophobicContact CG2-CD1 4.41Å; V316-L362 HydrophobicContact CG2-CD2 3.97Å; V316-L362 HydrophobicContact CG2-CG 4.47Å; V317-L362 WeakPolarHBondContact O-CA 3.22Å; L362-N381 HydrophobicContact CB-CB 4.38Å; L362-N381 PolarHBondContact N-O 3.45Å; L362-N381 PolarHBondContact O-N 2.97Å; L362-P384 HydrophobicContact CB-CB 4.45Å; L362-P384 HydrophobicContact CD1-CB 3.49Å; L362-P384 VanDerWaalsContact CD1-CB 3.49Å; L362-P384 HydrophobicContact CG-CB 3.64Å; L362-P384 HydrophobicContact CG-CG 4.29Å; L362-W390 HydrophobicContact CB-CH2 3.64Å; L362-W390 HydrophobicContact CB-CZ2 4.41Å; L362-W390 HydrophobicContact CB-CZ3 4.21Å; L362-W390 HydrophobicContact CD1-CH2 4.15Å; L362-W390 HydrophobicContact CD1-CZ2 4.17Å
363	L	97.4	Very high	81.9	Confident	0 Å²	0	59 Å²	59	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	136.2	167	-158	75.7	0	0	0	109.6	V316 V317 F319 I378 Y379 L380 L406 F415 F435 I440	V316-L363 CarbonylContact C-O 3.5Å; V316-L363 VanDerWaalsContact CA-O 3.27Å; V316-L363 WeakPolarHBondContact CA-O 3.42Å; V316-L363 VanDerWaalsContact CG2-O 3.3Å; V316-L363 WeakPolarHBondContact CG2-O 3.48Å; V317-L363 HydrophobicContact CG2-CB 3.95Å; V317-L363 PolarHBondContact N-O 2.9Å; V317-L363 PolarHBondContact O-N 3.16Å; F319-L363 HydrophobicContact CD1-CB 4.48Å; F319-L363 HydrophobicContact CE1-CB 4.2Å; F319-L363 HydrophobicContact CE1-CD1 4.5Å; L363-I378 HydrophobicContact CD1-CG2 3.53Å; L363-I378 HydrophobicContact CD2-CG2 3.97Å; L363-I378 HydrophobicContact CG-CG2 3.8Å; L363-Y379 WeakPolarHBondContact CA-O 3.34Å; L363-L380 HydrophobicContact CD1-CD1 3.93Å; L363-L406 HydrophobicContact CD2-CD1 4.26Å; L363-L406 HydrophobicContact CG-CD1 4.43Å; L363-F415 HydrophobicContact CD2-CD1 3.91Å; L363-F415 HydrophobicContact CD2-CE1 4.22Å; L363-F415 HydrophobicContact CD2-CG 4.1Å; L363-F435 HydrophobicContact CD2-CE2 3.68Å; L363-F435 HydrophobicContact CD2-CZ 3.8Å; L363-I440 HydrophobicContact CD1-CD1 3.71Å; L363-I440 HydrophobicContact CD1-CG1 4.43Å; L363-I440 HydrophobicContact CD1-CG2 4.28Å; L363-I440 HydrophobicContact CD2-CD1 4.04Å
364	Y	98.3	Very high	85	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	134.5	-179.9	-179.4	-112.3	0	0	0	111.8	R284 L305 S315 V316 H366 I378 Y379 W390	R284-Y364 VanDerWaalsContact CD-OH 3.24Å; R284-Y364 WeakPolarHBondContact CD-OH 3.42Å; R284-Y364 HydrophobicContact CG-CE1 4.4Å; R284-Y364 PolarHBondContact NE-OH 3.08Å; L305-Y364 HydrophobicContact CB-CE1 4.34Å; L305-Y364 HydrophobicContact CD1-CD1 3.73Å; L305-Y364 HydrophobicContact CD1-CE1 3.83Å; L305-Y364 HydrophobicContact CD1-CG 4.23Å; L305-Y364 HydrophobicContact CD2-CD1 3.64Å; L305-Y364 HydrophobicContact CD2-CE1 4.01Å; L305-Y364 HydrophobicContact CG-CD1 4.23Å; L305-Y364 HydrophobicContact CG-CE1 4.29Å; S315-Y364 CarbonylContact O-C 3.42Å; S315-Y364 WeakPolarHBondContact O-CA 3.44Å; S315-Y364 WeakPolarHBondContact O-CD2 3.49Å; V316-Y364 HydrophobicContact CB-CD2 4.03Å; V316-Y364 HydrophobicContact CG2-CD2 4.47Å; Y364-H366 HydrophobicContact CD1-CB 4.09Å; Y364-H366 HydrophobicContact CE1-CB 3.36Å; Y364-H366 AromaticContact CE1-CG 3.92Å; Y364-H366 PolarHBondContact OH-CD2 2.73Å; Y364-H366 VanDerWaalsContact OH-CD2 3.22Å; Y364-I378 WeakPolarHBondContact O-CA 3.3Å; Y364-Y379 HydrophobicContact CD1-CD2 4.02Å; Y364-Y379 PolarHBondContact N-O 2.88Å; Y364-Y379 PolarHBondContact O-N 2.83Å; Y364-W390 VanDerWaalsContact CB-CZ3 3.45Å; Y364-W390 HydrophobicContact CG-CH2 4.49Å
365	S	98.6	Very high	87.7	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	126.3	176.9	65.6	0	0	0	0	112.1	G314 S315 G377 S404	G314-S365 CarbonylContact C-O 3.52Å; G314-S365 WeakPolarHBondContact CA-O 3.4Å; S315-S365 PolarHBondContact N-O 3.24Å; S315-S365 PolarHBondContact O-N 3.5Å; S365-G377 WeakPolarHBondContact CA-O 3.35Å; S365-S404 PolarHBondContact O-OG 3.47Å; S365-S404 PolarHBondContact OG-OG 2.88Å
366	H	98.1	Very high	90.5	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.9	151.3	-179.5	-165.6	-107.4	0	0	0	114	C306 C312 Q313 Y364 T368 G377 Y379	C306-H366 PolarHBondContact O-CE1 3.3Å; C306-H366 VanDerWaalsContact O-CE1 3.29Å; C306-H366 PolarHBondContact O-ND1 2.88Å; C312-H366 PolarHBondContact O-NE2 2.86Å; Q313-H366 PolarHBondContact O-CD2 3.21Å; Y364-H366 HydrophobicContact CD1-CB 4.09Å; Y364-H366 HydrophobicContact CE1-CB 3.36Å; Y364-H366 AromaticContact CE1-CG 3.92Å; Y364-H366 PolarHBondContact OH-CD2 2.73Å; Y364-H366 VanDerWaalsContact OH-CD2 3.22Å; H366-T368 PolarHBondContact O-N 3.16Å; H366-G377 PolarHBondContact N-O 2.83Å; H366-G377 PolarHBondContact O-N 3.04Å; H366-Y379 HydrophobicContact CB-CE2 4.33Å
367	P	97.9	Very high	93	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	119.4	171.4	-24	34.4	0	0	0	113.1	C312 S369 R373	C312-P367 HydrophobicContact CB-CG 4.44Å; P367-S369 VanDerWaalsContact C-N 3.28Å; P367-S369 PolarHBondContact O-N 3.03Å; P367-R373 HydrophobicContact CB-CB 4.29Å; P367-R373 HydrophobicContact CG-CB 4.21Å
368	T	96.7	Very high	95	Very high	30 Å²	30	36.3 Å²	36.3	18%	0.184	17%	0.165	C	C	.	.			trans	-73.2	-14.7	-169.4	59.3	0	0	0	0	115	H366 V374 D375 Y379 P393 I395	H366-T368 PolarHBondContact O-N 3.16Å; T368-V374 PolarHBondContact N-O 3.34Å; T368-D375 WeakPolarHBondContact CB-O 3.09Å; T368-D375 VanDerWaalsContact CG2-O 3.29Å; T368-D375 WeakPolarHBondContact CG2-O 3.38Å; T368-D375 PolarHBondContact N-O 2.83Å; T368-D375 WeakPolarHBondContact OG1-CB 3.45Å; T368-D375 PolarHBondContact OG1-O 3.03Å; T368-Y379 HydrophobicContact CG2-CE2 4.27Å; T368-P393 HydrophobicContact CG2-CB 3.58Å; T368-P393 HydrophobicContact CG2-CG 3.47Å; T368-P393 VanDerWaalsContact CG2-CG 3.47Å; T368-I395 HydrophobicContact CG2-CD1 3.72Å
369	S	94.9	Very high	96.3	Very high	31 Å²	31	34.9 Å²	34.9	22%	0.217	15%	0.153	C	C	.	.			trans	-87	120.9	-174.6	176	0	0	0	0	113.8	P367 K371 R372 V374	P367-S369 VanDerWaalsContact C-N 3.28Å; P367-S369 PolarHBondContact O-N 3.03Å; S369-K371 PolarHBondContact O-N 2.98Å; S369-K371 PolarHBondContact OG-N 3.47Å; S369-R372 VanDerWaalsContact CB-O 3.3Å; S369-R372 WeakPolarHBondContact CB-O 3.21Å; S369-R372 PolarHBondContact OG-N 2.91Å; S369-V374 VanDerWaalsContact CB-CG2 3.42Å
370	R	94.4	Very high	96.7	Very high	150 Å²	150	33.2 Å²	33.2	57%	0.566	15%	0.146	S	C	*	.	S	Bend	trans	-57.8	-11.3	171.2	-68	-175.8	176.3	-169.4	-5.5	114.7	R282 Q303 C306	R282-R370 PolarHBondContact NH2-O 3Å; Q303-R370 PolarHBondContact O-NH2 3.45Å; C306-R370 HydrophobicContact CB-CG 3.68Å; C306-R370 WeakPolarHBondContact SG-CG 3.35Å
371	K	94.9	Very high	96.8	Very high	170 Å²	170	33.2 Å²	33.2	74%	0.739	15%	0.145	S	C	*	.	S	Bend	trans	-112.3	-33.2	-172.9	-65.1	-175.5	-178	178.5	0	114.2	P309 S369	P309-K371 WeakPolarHBondContact CD-O 3.42Å; S369-K371 PolarHBondContact O-N 2.98Å; S369-K371 PolarHBondContact OG-N 3.47Å
372	R	95.9	Very high	96.8	Very high	156 Å²	156	36.3 Å²	36.3	59%	0.589	16%	0.161	S	C	*	.	S	Bend	trans	-147.3	158.5	-173.3	-68	-176.7	63.8	-168	-4.2	109	S369 V374	S369-R372 VanDerWaalsContact CB-O 3.3Å; S369-R372 WeakPolarHBondContact CB-O 3.21Å; S369-R372 PolarHBondContact OG-N 2.91Å; R372-V374 VanDerWaalsContact C-N 3.34Å; R372-V374 HydrophobicContact CB-CG1 4.15Å; R372-V374 HydrophobicContact CB-CG2 4.26Å; R372-V374 PolarHBondContact O-N 3.4Å
373	R	97.3	Very high	96.5	Very high	48 Å²	48	37.8 Å²	37.8	18%	0.181	17%	0.17	C	C	.	.	S	Bend	trans	-79.1	89.5	169.2	-52.5	175.7	173.1	171.6	-9	108.6	P308 G311 C312 P367 C401 E426	P308-R373 HydrophobicContact CG-CG 3.95Å; G311-R373 PolarHBondContact O-NE 2.7Å; G311-R373 PolarHBondContact O-NH2 3.47Å; C312-R373 HydrophobicContact CB-CG 4.4Å; P367-R373 HydrophobicContact CB-CB 4.29Å; P367-R373 HydrophobicContact CG-CB 4.21Å; R373-C401 CarbonylContact C-O 3.51Å; R373-C401 WeakPolarHBondContact CB-O 3.45Å; R373-C401 PolarHBondContact O-N 2.85Å; R373-C401 VanDerWaalsContact O-O 3.09Å; R373-E426 IonicContact NH1-OE1 3.01Å
374	V	97.5	Very high	96.2	Very high	21 Å²	21	38.4 Å²	38.4	13%	0.127	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	156.5	178.3	-63.8	0	0	0	0	109.4	T368 S369 R372 G399 C401	T368-V374 PolarHBondContact N-O 3.34Å; S369-V374 VanDerWaalsContact CB-CG2 3.42Å; R372-V374 VanDerWaalsContact C-N 3.34Å; R372-V374 HydrophobicContact CB-CG1 4.15Å; R372-V374 HydrophobicContact CB-CG2 4.26Å; R372-V374 PolarHBondContact O-N 3.4Å; V374-G399 CarbonylContact C-O 3.53Å; V374-G399 WeakPolarHBondContact CA-O 3.27Å; V374-C401 VanDerWaalsContact CA-SG 3.6Å
375	D	97.3	Very high	95.7	Very high	56 Å²	56	40.7 Å²	40.7	30%	0.299	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	58	83.8	174.5	-51.5	-43.6	0	0	0	111.4	T368 G377 I395 H397 C398 G399 C401	T368-D375 WeakPolarHBondContact CB-O 3.09Å; T368-D375 VanDerWaalsContact CG2-O 3.29Å; T368-D375 WeakPolarHBondContact CG2-O 3.38Å; T368-D375 PolarHBondContact N-O 2.83Å; T368-D375 WeakPolarHBondContact OG1-CB 3.45Å; T368-D375 PolarHBondContact OG1-O 3.03Å; D375-G377 PolarHBondContact O-N 2.88Å; D375-I395 HydrophobicContact CB-CD1 4.38Å; D375-I395 HydrophobicContact CB-CG2 4.34Å; D375-H397 CarbonylContact C-O 3.6Å; D375-H397 WeakPolarHBondContact CA-O 3.5Å; D375-C398 WeakPolarHBondContact OD1-CA 3.42Å; D375-G399 PolarHBondContact N-O 2.62Å; D375-G399 PolarHBondContact OD1-N 2.86Å; D375-C401 PolarHBondContact N-SG 3.47Å
376	L	98.1	Very high	95.1	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	116.6	-177.6	-174.9	68.5	0	0	0	109.6	L396 H397 C401 F419	L376-L396 HydrophobicContact CD2-CD2 4.4Å; L376-L396 PolarHBondContact O-N 2.93Å; L376-H397 HydrophobicContact CB-CB 4.26Å; L376-H397 PolarHBondContact N-O 2.95Å; L376-H397 PolarHBondContact O-N 3.05Å; L376-C401 HydrophobicContact CB-CB 3.95Å; L376-C401 PolarHBondContact N-SG 2.6Å; L376-C401 VanDerWaalsContact N-SG 3.41Å; L376-F419 HydrophobicContact CD2-CB 3.63Å; L376-F419 HydrophobicContact CD2-CD1 3.85Å; L376-F419 HydrophobicContact CD2-CD2 3.53Å; L376-F419 HydrophobicContact CD2-CE1 4.37Å; L376-F419 HydrophobicContact CD2-CE2 4.09Å; L376-F419 HydrophobicContact CD2-CG 3.38Å; L376-F419 HydrophobicContact CD2-CZ 4.47Å
377	G	97.6	Very high	93.9	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	143.5	-178	0	0	0	0	0	112.8	S365 H366 D375 W394	S365-G377 WeakPolarHBondContact CA-O 3.35Å; H366-G377 PolarHBondContact N-O 2.83Å; H366-G377 PolarHBondContact O-N 3.04Å; D375-G377 PolarHBondContact O-N 2.88Å; G377-W394 CarbonylContact C-O 3.58Å; G377-W394 VanDerWaalsContact CA-O 3.31Å; G377-W394 WeakPolarHBondContact CA-O 3.29Å
378	I	98	Very high	92.6	Very high	2 Å²	2	52.4 Å²	52.4	1%	0.01	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	118.2	167.4	-63.3	-61.2	0	0	0	108	L363 Y364 P393 W394 L396 L406 F435 I440	L363-I378 HydrophobicContact CD1-CG2 3.53Å; L363-I378 HydrophobicContact CD2-CG2 3.97Å; L363-I378 HydrophobicContact CG-CG2 3.8Å; Y364-I378 WeakPolarHBondContact O-CA 3.3Å; I378-P393 CarbonylContact O-C 3.55Å; I378-P393 VanDerWaalsContact O-CA 3.31Å; I378-P393 WeakPolarHBondContact O-CA 3.5Å; I378-W394 HydrophobicContact CB-CE3 4.17Å; I378-W394 HydrophobicContact CG1-CE3 4.38Å; I378-W394 HydrophobicContact CG2-CE3 4.37Å; I378-W394 PolarHBondContact N-O 2.76Å; I378-W394 PolarHBondContact O-N 3.17Å; I378-L396 HydrophobicContact CD1-CD2 4.24Å; I378-L396 HydrophobicContact CG1-CB 3.97Å; I378-L396 HydrophobicContact CG1-CD2 4.24Å; I378-L396 HydrophobicContact CG1-CG 4.47Å; I378-L406 HydrophobicContact CD1-CD2 4.2Å; I378-F435 HydrophobicContact CD1-CE1 4.26Å; I378-F435 HydrophobicContact CD1-CZ 3.91Å; I378-F435 HydrophobicContact CG1-CE1 4.49Å; I378-F435 HydrophobicContact CG1-CZ 4.18Å; I378-F435 HydrophobicContact CG2-CE2 4.44Å; I378-I440 HydrophobicContact CG2-CG1 4.41Å
379	Y	97.6	Very high	92.2	Very high	9 Å²	9	52.9 Å²	52.9	4%	0.035	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	137.6	179.2	-57.6	-108.5	0	0	0	109.2	L305 L363 Y364 H366 T368 P393	L305-Y379 HydrophobicContact CD2-CD1 3.75Å; L305-Y379 HydrophobicContact CD2-CD2 4.33Å; L305-Y379 HydrophobicContact CD2-CE1 4.03Å; L305-Y379 HydrophobicContact CD2-CG 3.9Å; L363-Y379 WeakPolarHBondContact CA-O 3.34Å; Y364-Y379 HydrophobicContact CD1-CD2 4.02Å; Y364-Y379 PolarHBondContact N-O 2.88Å; Y364-Y379 PolarHBondContact O-N 2.83Å; H366-Y379 HydrophobicContact CB-CE2 4.33Å; T368-Y379 HydrophobicContact CG2-CE2 4.27Å; Y379-P393 HydrophobicContact CD1-CB 4Å; Y379-P393 HydrophobicContact CD1-CG 4.43Å; Y379-P393 HydrophobicContact CD2-CB 4.12Å; Y379-P393 HydrophobicContact CE1-CB 3.78Å; Y379-P393 HydrophobicContact CE1-CG 3.85Å; Y379-P393 HydrophobicContact CE2-CB 3.88Å; Y379-P393 HydrophobicContact CG-CB 4.18Å
380	L	96.9	Very high	92.2	Very high	5 Å²	5	52 Å²	52	3%	0.026	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	138.6	174.7	-174.2	71.3	0	0	0	110	F319 W361 L363 Q382 S391 I440 L441 L444	F319-L380 HydrophobicContact CE1-CD1 3.76Å; F319-L380 HydrophobicContact CZ-CD1 3.75Å; W361-L380 HydrophobicContact CB-CD1 4.34Å; W361-L380 HydrophobicContact CE3-CD1 4.08Å; W361-L380 HydrophobicContact CE3-CD2 4.07Å; W361-L380 HydrophobicContact CZ3-CD2 4.25Å; L363-L380 HydrophobicContact CD1-CD1 3.93Å; L380-Q382 HydrophobicContact CD2-CG 3.71Å; L380-Q382 HydrophobicContact CG-CG 4.03Å; L380-S391 PolarHBondContact N-OG 2.83Å; L380-S391 WeakPolarHBondContact O-CB 3.17Å; L380-S391 PolarHBondContact O-N 3.5Å; L380-I440 HydrophobicContact CB-CG2 4.3Å; L380-I440 HydrophobicContact CD2-CG2 4.34Å; L380-L441 HydrophobicContact CD2-CD2 4.39Å; L380-L444 HydrophobicContact CB-CD1 4.26Å; L380-L444 HydrophobicContact CD2-CD1 3.53Å
381	N	95.3	Very high	92.2	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	113.8	165.9	-179.2	-12.3	0	0	0	109.3	W361 L362 T383 C389 W390	W361-N381 WeakPolarHBondContact CA-O 3.18Å; L362-N381 HydrophobicContact CB-CB 4.38Å; L362-N381 PolarHBondContact N-O 3.45Å; L362-N381 PolarHBondContact O-N 2.97Å; N381-T383 PolarHBondContact OD1-N 2.94Å; N381-T383 PolarHBondContact OD1-O 3.34Å; N381-C389 WeakPolarHBondContact OD1-CB 3.28Å; N381-W390 HydrophobicContact CB-CD2 3.7Å; N381-W390 HydrophobicContact CB-CE3 3.57Å; N381-W390 HydrophobicContact CB-CG 4.33Å; N381-W390 HydrophobicContact CB-CH2 4.01Å; N381-W390 HydrophobicContact CB-CZ2 4.09Å; N381-W390 HydrophobicContact CB-CZ3 3.74Å
382	Q	93.4	Very high	92.2	Very high	84 Å²	84	47.8 Å²	47.8	39%	0.393	24%	0.242	S	C	.	.	S	Bend	trans	-87.8	-8.3	-176.1	-58.3	-179.3	-73.8	0	0	113.4	W361 L380	W361-Q382 VanDerWaalsContact CD1-O 3.31Å; W361-Q382 HydrophobicContact CD2-CB 4.16Å; W361-Q382 HydrophobicContact CD2-CG 3.87Å; W361-Q382 HydrophobicContact CE3-CG 4.14Å; W361-Q382 HydrophobicContact CG-CB 4.27Å; W361-Q382 HydrophobicContact CG-CG 4.34Å; W361-Q382 HydrophobicContact CH2-CG 4.44Å; W361-Q382 HydrophobicContact CZ2-CB 4.4Å; W361-Q382 HydrophobicContact CZ2-CG 4.15Å; W361-Q382 HydrophobicContact CZ3-CG 4.42Å; W361-Q382 PolarHBondContact NE1-O 3.17Å; L380-Q382 HydrophobicContact CD2-CG 3.71Å; L380-Q382 HydrophobicContact CG-CG 4.03Å
383	T	91.2	Very high	92.2	Very high	31 Å²	31	42.5 Å²	42.5	19%	0.19	23%	0.228	C	C	.	.			trans	-136.2	62.9	-178.7	47	0	0	0	0	110.2	N381 L385 E386 C389	N381-T383 PolarHBondContact OD1-N 2.94Å; N381-T383 PolarHBondContact OD1-O 3.34Å; T383-L385 PolarHBondContact O-N 3.22Å; T383-E386 WeakPolarHBondContact O-CB 3.38Å; T383-E386 PolarHBondContact O-N 3.37Å; T383-C389 VanDerWaalsContact OG1-CB 3.24Å; T383-C389 WeakPolarHBondContact OG1-CB 3.1Å; T383-C389 PolarHBondContact OG1-SG 2.98Å; T383-C389 VanDerWaalsContact OG1-SG 3.37Å
384	P	90.1	Very high	92.1	Very high	12 Å²	12	41.4 Å²	41.4	8%	0.078	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-8.9	-165.8	28.3	-37.7	0	0	0	116	V264 S360 L362	V264-P384 HydrophobicContact CB-CB 4.42Å; V264-P384 HydrophobicContact CB-CG 3.91Å; V264-P384 HydrophobicContact CG1-CB 4.06Å; V264-P384 HydrophobicContact CG1-CG 3.82Å; V264-P384 HydrophobicContact CG2-CB 4.44Å; V264-P384 HydrophobicContact CG2-CG 4.32Å; S360-P384 WeakPolarHBondContact O-CD 3.21Å; S360-P384 VanDerWaalsContact O-CG 3.29Å; S360-P384 WeakPolarHBondContact O-CG 3.43Å; L362-P384 HydrophobicContact CB-CB 4.45Å; L362-P384 HydrophobicContact CD1-CB 3.49Å; L362-P384 VanDerWaalsContact CD1-CB 3.49Å; L362-P384 HydrophobicContact CG-CB 3.64Å; L362-P384 HydrophobicContact CG-CG 4.29Å
385	L	88.4	Confident	92.1	Very high	49 Å²	49	43.3 Å²	43.3	26%	0.257	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-11.7	172.5	-57.5	-175.2	0	0	0	113.2	V264 V272 L288 R298 T383	V264-L385 HydrophobicContact CG2-CD2 3.81Å; V272-L385 HydrophobicContact CB-CD2 3.99Å; V272-L385 HydrophobicContact CG1-CD2 4.26Å; V272-L385 HydrophobicContact CG2-CD2 4.12Å; L288-L385 HydrophobicContact CD1-CD2 4.29Å; L288-L385 HydrophobicContact CD2-CD2 4.47Å; R298-L385 PolarHBondContact NH1-O 3.13Å; R298-L385 PolarHBondContact NH2-O 3.23Å; T383-L385 PolarHBondContact O-N 3.22Å
386	E	84.9	Confident	92	Very high	115 Å²	115	40.9 Å²	40.9	54%	0.537	22%	0.22	S	C	.	.	S	Bend	trans	-88.4	154.6	171.5	-63.2	179.3	-156.7	0	0	110.2	T383	T383-E386 WeakPolarHBondContact O-CB 3.38Å; T383-E386 PolarHBondContact O-N 3.37Å
387	A	73.3	Confident	91.9	Very high	84 Å²	84	42.3 Å²	42.3	69%	0.694	23%	0.226	S	C	*	.	S	Bend	trans	-85.3	129.1	-173.8	0	0	0	0	0	111.6
388	A	70.3	Confident	91.8	Very high	46 Å²	46	46.8 Å²	46.8	38%	0.38	26%	0.257	S	S	.	.	S	Bend	trans	56	56.7	173	0	0	0	0	0	114.3	Q304	Q304-A388 VanDerWaalsContact CD-O 3.31Å; Q304-A388 PolarHBondContact NE2-O 3.26Å; Q304-A388 PolarHBondContact OE1-O 3.19Å
389	C	88.6	Confident	91.8	Very high	41 Å²	41	47.8 Å²	47.8	28%	0.277	27%	0.267	S	S	.	.			trans	-106.1	27	176.9	-64.1	0	0	0	0	113.5	N381 T383	N381-C389 WeakPolarHBondContact OD1-CB 3.28Å; T383-C389 VanDerWaalsContact OG1-CB 3.24Å; T383-C389 WeakPolarHBondContact OG1-CB 3.1Å; T383-C389 PolarHBondContact OG1-SG 2.98Å; T383-C389 VanDerWaalsContact OG1-SG 3.37Å
390	W	95.1	Very high	91.8	Very high	12 Å²	12	48.1 Å²	48.1	5%	0.045	27%	0.27	C	S	.	.	B	Isolated β-bridge	trans	-77	136.8	177.7	-65.5	96.4	0	0	0	112.5	Y274 E286 Q304 L305 V316 L362 Y364 N381	Y274-W390 WeakPolarHBondContact OH-CZ2 3.48Å; E286-W390 PolarHBondContact OE1-NE1 2.89Å; Q304-W390 HydrophobicContact CB-CB 3.93Å; Q304-W390 HydrophobicContact CG-CB 4.45Å; Q304-W390 PolarHBondContact NE2-O 2.75Å; L305-W390 HydrophobicContact CD1-CD2 4.05Å; L305-W390 HydrophobicContact CD1-CG 4.34Å; L305-W390 HydrophobicContact CD1-CZ2 3.98Å; L305-W390 HydrophobicContact CD2-CB 4.21Å; L305-W390 HydrophobicContact CD2-CD2 3.89Å; L305-W390 HydrophobicContact CD2-CE3 4.32Å; L305-W390 HydrophobicContact CD2-CG 3.82Å; L305-W390 HydrophobicContact CG-CD2 4.16Å; L305-W390 HydrophobicContact CG-CG 4Å; V316-W390 HydrophobicContact CG2-CH2 4.33Å; L362-W390 HydrophobicContact CB-CH2 3.64Å; L362-W390 HydrophobicContact CB-CZ2 4.41Å; L362-W390 HydrophobicContact CB-CZ3 4.21Å; L362-W390 HydrophobicContact CD1-CH2 4.15Å; L362-W390 HydrophobicContact CD1-CZ2 4.17Å; Y364-W390 VanDerWaalsContact CB-CZ3 3.45Å; Y364-W390 HydrophobicContact CG-CH2 4.49Å; N381-W390 HydrophobicContact CB-CD2 3.7Å; N381-W390 HydrophobicContact CB-CE3 3.57Å; N381-W390 HydrophobicContact CB-CG 4.33Å; N381-W390 HydrophobicContact CB-CH2 4.01Å; N381-W390 HydrophobicContact CB-CZ2 4.09Å; N381-W390 HydrophobicContact CB-CZ3 3.74Å
391	S	95.1	Very high	91.8	Very high	27 Å²	27	47.9 Å²	47.9	19%	0.189	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-64.9	171.2	174.4	76.1	0	0	0	0	112.8	L380	L380-S391 PolarHBondContact N-OG 2.83Å; L380-S391 WeakPolarHBondContact O-CB 3.17Å; L380-S391 PolarHBondContact O-N 3.5Å
392	R	94.2	Very high	91.9	Very high	205 Å²	205	47.8 Å²	47.8	77%	0.774	27%	0.269	S	S	*	.	P	Polyproline II helix	trans	-67	145.1	157.7	-56	-175.5	83	149.4	3.2	108.3
393	P	95.4	Very high	92.2	Very high	45 Å²	45	44.6 Å²	44.6	29%	0.292	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-73.2	136.2	-177.7	26.9	-32.8	0	0	0	111.9	T368 I378 Y379	T368-P393 HydrophobicContact CG2-CB 3.58Å; T368-P393 HydrophobicContact CG2-CG 3.47Å; T368-P393 VanDerWaalsContact CG2-CG 3.47Å; I378-P393 CarbonylContact O-C 3.55Å; I378-P393 VanDerWaalsContact O-CA 3.31Å; I378-P393 WeakPolarHBondContact O-CA 3.5Å; Y379-P393 HydrophobicContact CD1-CB 4Å; Y379-P393 HydrophobicContact CD1-CG 4.43Å; Y379-P393 HydrophobicContact CD2-CB 4.12Å; Y379-P393 HydrophobicContact CE1-CB 3.78Å; Y379-P393 HydrophobicContact CE1-CG 3.85Å; Y379-P393 HydrophobicContact CE2-CB 3.88Å; Y379-P393 HydrophobicContact CG-CB 4.18Å
394	W	96.4	Very high	92.5	Very high	25 Å²	25	43.1 Å²	43.1	10%	0.095	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	127.4	158.3	168.2	42.2	0	0	0	109	G377 I378 L396 F435 E439 I440 H443	G377-W394 CarbonylContact C-O 3.58Å; G377-W394 VanDerWaalsContact CA-O 3.31Å; G377-W394 WeakPolarHBondContact CA-O 3.29Å; I378-W394 HydrophobicContact CB-CE3 4.17Å; I378-W394 HydrophobicContact CG1-CE3 4.38Å; I378-W394 HydrophobicContact CG2-CE3 4.37Å; I378-W394 PolarHBondContact N-O 2.76Å; I378-W394 PolarHBondContact O-N 3.17Å; W394-L396 HydrophobicContact CH2-CD1 3.91Å; W394-L396 HydrophobicContact CZ2-CD1 4.3Å; W394-L396 HydrophobicContact CZ3-CD1 4.08Å; W394-L396 PolarHBondContact O-N 2.89Å; W394-F435 HydrophobicContact CH2-CB 3.71Å; W394-F435 HydrophobicContact CH2-CD2 4.39Å; W394-F435 HydrophobicContact CH2-CG 4.07Å; W394-F435 HydrophobicContact CZ3-CB 3.91Å; W394-F435 HydrophobicContact CZ3-CD1 4.5Å; W394-F435 AromaticContact CZ3-CD2 3.7Å; W394-F435 HydrophobicContact CZ3-CD2 3.7Å; W394-F435 HydrophobicContact CZ3-CE2 4.36Å; W394-F435 AromaticContact CZ3-CG 3.78Å; W394-F435 HydrophobicContact CZ3-CG 3.78Å; W394-E439 HydrophobicContact CH2-CB 3.65Å; W394-E439 HydrophobicContact CH2-CG 4.31Å; W394-E439 HydrophobicContact CZ2-CB 4.23Å; W394-E439 HydrophobicContact CZ3-CB 4.06Å; W394-I440 HydrophobicContact CE3-CG1 4.1Å; W394-I440 HydrophobicContact CZ3-CG1 4.04Å; W394-H443 HydrophobicContact CB-CB 4.14Å; W394-H443 AromaticContact CD1-CD2 3.33Å; W394-H443 AromaticContact CD1-CE1 3.8Å; W394-H443 AromaticContact CD1-CG 3.38Å; W394-H443 AromaticContact CD1-ND1 3.67Å; W394-H443 AromaticContact CD1-NE2 3.59Å; W394-H443 AromaticContact CD2-CD2 3.8Å; W394-H443 AromaticContact CE2-CD2 3.38Å; W394-H443 AromaticContact CE2-NE2 3.6Å; W394-H443 HydrophobicContact CG-CB 4.02Å; W394-H443 AromaticContact CG-CD2 3.78Å; W394-H443 AromaticContact CG-CG 3.85Å; W394-H443 AromaticContact CZ2-CD2 3.94Å; W394-H443 AromaticContact NE1-CD2 3.08Å; W394-H443 PolarHBondContact NE1-CD2 3.38Å; W394-H443 AromaticContact NE1-CE1 3.57Å; W394-H443 AromaticContact NE1-CG 3.65Å; W394-H443 AromaticContact NE1-ND1 3.91Å; W394-H443 AromaticContact NE1-NE2 3.01Å; W394-H443 PolarHBondContact NE1-NE2 2.97Å
395	I	96.2	Very high	93	Very high	60 Å²	60	42.6 Å²	42.6	31%	0.308	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	105.1	-179.6	-52	-55.7	0	0	0	110	T368 D375	T368-I395 HydrophobicContact CG2-CD1 3.72Å; D375-I395 HydrophobicContact CB-CD1 4.38Å; D375-I395 HydrophobicContact CB-CG2 4.34Å
396	L	95.8	Very high	93.4	Very high	5 Å²	5	40.2 Å²	40.2	3%	0.026	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	-31.6	177.1	-169.2	73.5	0	0	0	111.9	L376 I378 W394 C417 F419 R433 F435	L376-L396 HydrophobicContact CD2-CD2 4.4Å; L376-L396 PolarHBondContact O-N 2.93Å; I378-L396 HydrophobicContact CD1-CD2 4.24Å; I378-L396 HydrophobicContact CG1-CB 3.97Å; I378-L396 HydrophobicContact CG1-CD2 4.24Å; I378-L396 HydrophobicContact CG1-CG 4.47Å; W394-L396 HydrophobicContact CH2-CD1 3.91Å; W394-L396 HydrophobicContact CZ2-CD1 4.3Å; W394-L396 HydrophobicContact CZ3-CD1 4.08Å; W394-L396 PolarHBondContact O-N 2.89Å; L396-C417 HydrophobicContact CD2-CB 3.81Å; L396-F419 HydrophobicContact CD2-CE1 4.3Å; L396-R433 HydrophobicContact CD1-CG 4.3Å; L396-R433 PolarHBondContact O-NH1 3.07Å; L396-R433 VanDerWaalsContact O-NH1 3.12Å; L396-F435 HydrophobicContact CD1-CD1 3.61Å; L396-F435 HydrophobicContact CD1-CE1 4.04Å; L396-F435 HydrophobicContact CD1-CG 4.22Å; L396-F435 HydrophobicContact CD2-CD1 4.22Å; L396-F435 HydrophobicContact CD2-CE1 3.94Å
397	H	96.1	Very high	94.1	Very high	31 Å²	31	35.1 Å²	35.1	14%	0.144	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	121.6	177.1	173.6	71.4	0	0	0	111.6	N43 D375 L376 F419 C421	N43-H397 PolarHBondContact ND2-ND1 3.21Å; D375-H397 CarbonylContact C-O 3.6Å; D375-H397 WeakPolarHBondContact CA-O 3.5Å; L376-H397 HydrophobicContact CB-CB 4.26Å; L376-H397 PolarHBondContact N-O 2.95Å; L376-H397 PolarHBondContact O-N 3.05Å; H397-F419 HydrophobicContact CB-CE2 3.68Å; H397-F419 HydrophobicContact CB-CZ 3.94Å; H397-F419 AromaticContact CG-CE2 3.77Å; H397-C421 WeakPolarHBondContact NE2-CB 3.4Å
398	C	96.3	Very high	95.2	Very high	94 Å²	94	32.5 Å²	32.5	64%	0.635	18%	0.184	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-84.6	138.8	174.3	-53.8	0	0	0	0	111.3	D375	D375-C398 WeakPolarHBondContact OD1-CA 3.42Å
399	G	96.7	Very high	96.3	Very high	22 Å²	22	30.7 Å²	30.7	23%	0.227	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	106	-169.2	-179.9	0	0	0	0	0	114.2	V374 D375 C401	V374-G399 CarbonylContact C-O 3.53Å; V374-G399 WeakPolarHBondContact CA-O 3.27Å; D375-G399 PolarHBondContact N-O 2.62Å; D375-G399 PolarHBondContact OD1-N 2.86Å; G399-C401 PolarHBondContact O-N 3.11Å
400	P	97.9	Very high	95.8	Very high	16 Å²	16	31.8 Å²	31.8	10%	0.104	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.1	121.3	178.2	-26.3	34.4	0	0	0	112.9	C421 G422	P400-C421 CarbonylContact O-C 3.59Å; P400-C421 WeakPolarHBondContact O-CA 3.5Å; P400-G422 WeakPolarHBondContact CD-O 3.42Å; P400-G422 PolarHBondContact O-N 2.95Å
401	C	97.7	Very high	95.2	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	164.8	177	66.1	0	0	0	0	110.4	R373 V374 D375 L376 G399 E420 E426	R373-C401 CarbonylContact C-O 3.51Å; R373-C401 WeakPolarHBondContact CB-O 3.45Å; R373-C401 PolarHBondContact O-N 2.85Å; R373-C401 VanDerWaalsContact O-O 3.09Å; V374-C401 VanDerWaalsContact CA-SG 3.6Å; D375-C401 PolarHBondContact N-SG 3.47Å; L376-C401 HydrophobicContact CB-CB 3.95Å; L376-C401 PolarHBondContact N-SG 2.6Å; L376-C401 VanDerWaalsContact N-SG 3.41Å; G399-C401 PolarHBondContact O-N 3.11Å; C401-E420 CarbonylContact C-O 3.53Å; C401-E420 WeakPolarHBondContact CA-O 3.13Å; C401-E426 VanDerWaalsContact C-CB 3.4Å; C401-E426 VanDerWaalsContact O-CB 3.23Å; C401-E426 WeakPolarHBondContact O-CB 3.28Å
402	G	97.4	Very high	94.8	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	-128.4	-174.8	0	0	0	0	0	112.9	C312 E420	C312-G402 VanDerWaalsContact SG-C 3.55Å; C312-G402 PolarHBondContact SG-O 2.71Å; G402-E420 PolarHBondContact N-O 2.98Å
403	Y	98.6	Very high	94.5	Very high	17 Å²	17	33 Å²	33	7%	0.067	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	148.7	176.2	-73.9	-128.9	0	0	0	109.3	R58 I59 P196 E258 Q313 F419 E420	R58-Y403 VanDerWaalsContact NH2-CE2 3.28Å; I59-Y403 HydrophobicContact CD1-CD1 3.69Å; I59-Y403 HydrophobicContact CD1-CD2 4.41Å; I59-Y403 HydrophobicContact CD1-CE1 3.63Å; I59-Y403 HydrophobicContact CD1-CE2 4.35Å; I59-Y403 HydrophobicContact CD1-CG 4.13Å; I59-Y403 HydrophobicContact CG2-CD1 4.44Å; P196-Y403 HydrophobicContact CG-CD1 3.89Å; P196-Y403 HydrophobicContact CG-CE1 3.75Å; E258-Y403 VanDerWaalsContact OE1-CE1 3.23Å; E258-Y403 WeakPolarHBondContact OE1-CE1 3.42Å; E258-Y403 VanDerWaalsContact OE1-CZ 3.28Å; E258-Y403 PolarHBondContact OE1-OH 3.14Å; E258-Y403 PolarHBondContact OE2-OH 3.18Å; Q313-Y403 HydrophobicContact CB-CD1 3.43Å; Q313-Y403 VanDerWaalsContact CB-CD1 3.43Å; Q313-Y403 HydrophobicContact CB-CE1 3.42Å; Q313-Y403 VanDerWaalsContact CB-CE1 3.42Å; Q313-Y403 HydrophobicContact CB-CG 4.01Å; Q313-Y403 HydrophobicContact CG-CD1 3.99Å; Q313-Y403 HydrophobicContact CG-CE1 4.24Å; Y403-F419 WeakPolarHBondContact O-CA 3.43Å; Y403-E420 WeakPolarHBondContact CB-OE2 3.5Å; Y403-E420 WeakPolarHBondContact CD2-OE2 3.41Å; Y403-E420 PolarHBondContact N-OE2 2.73Å; Y403-E420 PolarHBondContact O-N 3.31Å
404	S	98.7	Very high	94.5	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	146.6	-179.1	58.8	0	0	0	0	110.7	Q313 S315 S365 L418	Q313-S404 PolarHBondContact NE2-O 2.91Å; Q313-S404 PolarHBondContact OE1-O 2.73Å; S315-S404 WeakPolarHBondContact CB-O 3.46Å; S365-S404 PolarHBondContact O-OG 3.47Å; S365-S404 PolarHBondContact OG-OG 2.88Å; S404-L418 CarbonylContact C-O 3.59Å; S404-L418 WeakPolarHBondContact CA-O 3.42Å
405	D	98.9	Very high	94.5	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	137.2	174	-157.2	22.2	0	0	0	112.4	A61 L62 G197 H198 S315 C417 L418	A61-D405 WeakPolarHBondContact CA-OD2 3.44Å; L62-D405 HydrophobicContact CB-CB 4.2Å; L62-D405 PolarHBondContact N-OD2 2.89Å; G197-D405 WeakPolarHBondContact CA-OD2 3.37Å; H198-D405 IonicContact CE1-OD1 2.61Å; H198-D405 IonicContact CG-OD1 3.03Å; H198-D405 PolarHBondContact N-OD2 2.92Å; H198-D405 IonicContact ND1-OD1 3.91Å; H198-D405 PolarHBondContact ND1-OD1 3.07Å; H198-D405 IonicContact ND1-OD2 3.82Å; S315-D405 VanDerWaalsContact CB-OD1 3.29Å; S315-D405 WeakPolarHBondContact CB-OD1 3.44Å; S315-D405 PolarHBondContact OG-OD1 2.86Å; D405-C417 CarbonylContact O-C 3.59Å; D405-C417 WeakPolarHBondContact O-CA 3.26Å; D405-L418 PolarHBondContact N-O 2.88Å; D405-L418 PolarHBondContact O-N 3.33Å
406	L	98.8	Very high	94.6	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	146.8	-176.1	-71.9	173.3	0	0	0	110.5	H198 S315 V317 L363 I378 G416 C417 F435	H198-L406 PolarHBondContact CE1-O 2.7Å; S315-L406 PolarHBondContact OG-N 3.44Å; S315-L406 VanDerWaalsContact OG-N 3.11Å; V317-L406 HydrophobicContact CG1-CB 3.73Å; V317-L406 HydrophobicContact CG2-CB 3.98Å; V317-L406 HydrophobicContact CG2-CD1 4.07Å; L363-L406 HydrophobicContact CD2-CD1 4.26Å; L363-L406 HydrophobicContact CG-CD1 4.43Å; I378-L406 HydrophobicContact CD1-CD2 4.2Å; L406-G416 CarbonylContact C-O 3.56Å; L406-G416 WeakPolarHBondContact CA-O 3.34Å; L406-C417 HydrophobicContact CD2-CB 3.73Å; L406-F435 HydrophobicContact CD2-CE1 4.42Å; L406-F435 HydrophobicContact CD2-CZ 4.07Å
407	A	98.1	Very high	94.7	Very high	8 Å²	8	26.9 Å²	26.9	7%	0.066	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	123.5	166.3	0	0	0	0	0	109.1	L62 F71 F415 G416	L62-A407 HydrophobicContact CD2-CB 3.75Å; L62-A407 HydrophobicContact CG-CB 3.97Å; F71-A407 HydrophobicContact CE1-CB 4.18Å; A407-F415 WeakPolarHBondContact O-CA 3.41Å; A407-G416 PolarHBondContact N-O 2.86Å; A407-G416 PolarHBondContact O-N 2.91Å
408	A	96.1	Very high	94.9	Very high	29 Å²	29	25.4 Å²	25.4	24%	0.24	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	135.6	176.6	0	0	0	0	0	111.3	V317 E410 F415	V317-A408 HydrophobicContact CB-CB 4.08Å; V317-A408 HydrophobicContact CG2-CB 4.03Å; A408-E410 HydrophobicContact CB-CG 4.49Å; A408-F415 HydrophobicContact CB-CD1 3.98Å; A408-F415 HydrophobicContact CB-CE1 3.94Å
409	L	93.5	Very high	95	Very high	7 Å²	7	20.9 Å²	20.9	4%	0.037	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	73.9	171.7	-66	73.1	0	0	0	106.6	Y64 F71 E411 E412 G413 L414	Y64-L409 HydrophobicContact CD1-CD1 4.16Å; Y64-L409 HydrophobicContact CD1-CD2 3.97Å; Y64-L409 HydrophobicContact CD1-CG 3.58Å; Y64-L409 HydrophobicContact CD2-CD2 4.18Å; Y64-L409 HydrophobicContact CD2-CG 4.43Å; Y64-L409 HydrophobicContact CE1-CB 4.5Å; Y64-L409 HydrophobicContact CE1-CD2 3.52Å; Y64-L409 HydrophobicContact CE1-CG 3.55Å; Y64-L409 HydrophobicContact CE2-CD2 3.77Å; Y64-L409 HydrophobicContact CE2-CG 4.42Å; Y64-L409 HydrophobicContact CG-CD1 4.13Å; Y64-L409 HydrophobicContact CG-CD2 4.25Å; Y64-L409 HydrophobicContact CG-CG 4.01Å; F71-L409 HydrophobicContact CE1-CD1 4.09Å; F71-L409 HydrophobicContact CZ-CD1 3.86Å; F71-L409 HydrophobicContact CZ-CD2 4.28Å; L409-E411 VanDerWaalsContact C-N 3.26Å; L409-E411 PolarHBondContact O-N 3.26Å; L409-E411 VanDerWaalsContact O-N 3.14Å; L409-E412 PolarHBondContact O-N 2.91Å; L409-G413 PolarHBondContact O-N 2.83Å; L409-L414 WeakPolarHBondContact CA-O 3.41Å; L409-L414 HydrophobicContact CB-CB 4.29Å; L409-L414 VanDerWaalsContact CB-O 3.3Å; L409-L414 WeakPolarHBondContact CB-O 3.17Å; L409-L414 HydrophobicContact CD2-CD2 4.27Å; L409-L414 PolarHBondContact N-O 2.89Å
410	E	79.2	Confident	95.1	Very high	65 Å²	65	19.9 Å²	19.9	30%	0.304	10%	0.101	S	C	.	.	G	3₁₀ helix	trans	-51.7	-41.4	-166.4	-64.1	-165.7	-166.4	0	0	113.3	F319 R320 A408 E412	F319-E410 HydrophobicContact CB-CG 4.02Å; R320-E410 IonicContact NH1-OE2 3.29Å; R320-E410 PolarHBondContact NH1-OE2 3.21Å; A408-E410 HydrophobicContact CB-CG 4.49Å; E410-E412 PolarHBondContact O-N 2.88Å
411	E	82.7	Confident	95.1	Very high	180 Å²	180	19.1 Å²	19.1	84%	0.841	10%	0.096	S	C	*	.	G	3₁₀ helix	trans	-66.8	-15.7	-178.1	-62.4	177.9	-171.9	0	0	114	L409	L409-E411 VanDerWaalsContact C-N 3.26Å; L409-E411 PolarHBondContact O-N 3.26Å; L409-E411 VanDerWaalsContact O-N 3.14Å
412	E	85.4	Confident	94.9	Very high	86 Å²	86	19.6 Å²	19.6	40%	0.402	10%	0.101	S	C	.	.	G	3₁₀ helix	trans	-119.3	-0.8	-173.5	-64	177.8	-97.2	0	0	113.3	R96 L409 E410 L414	R96-E412 IonicContact CZ-OE1 3.42Å; R96-E412 VanDerWaalsContact CZ-OE1 3.27Å; R96-E412 IonicContact CZ-OE2 2.84Å; R96-E412 IonicContact NE-OE1 3.39Å; R96-E412 IonicContact NH1-OE1 3.53Å; R96-E412 IonicContact NH1-OE2 3.83Å; R96-E412 PolarHBondContact NH1-OE2 3.29Å; R96-E412 IonicContact NH2-OE1 2.85Å; R96-E412 PolarHBondContact NH2-OE1 2.92Å; R96-E412 IonicContact NH2-OE2 3.71Å; R96-E412 PolarHBondContact NH2-OE2 3.19Å; L409-E412 PolarHBondContact O-N 2.91Å; E410-E412 PolarHBondContact O-N 2.88Å; E412-L414 HydrophobicContact CB-CB 4.19Å; E412-L414 PolarHBondContact O-N 3.45Å; E412-L414 VanDerWaalsContact O-N 3.16Å
413	G	89.7	Confident	94.7	Very high	3 Å²	3	25.4 Å²	25.4	3%	0.031	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.5	20.2	-175.3	0	0	0	0	0	113.6	L409 T436 D437	L409-G413 PolarHBondContact O-N 2.83Å; G413-T436 CarbonylContact O-C 3.6Å; G413-T436 WeakPolarHBondContact O-CA 3.34Å; G413-D437 PolarHBondContact O-N 2.76Å
414	L	94.2	Very high	94.5	Very high	4 Å²	4	32.7 Å²	32.7	2%	0.021	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	145.2	-171	-168.8	70.9	0	0	0	110.7	L409 E412 L434 F435 T436	L409-L414 WeakPolarHBondContact CA-O 3.41Å; L409-L414 HydrophobicContact CB-CB 4.29Å; L409-L414 VanDerWaalsContact CB-O 3.3Å; L409-L414 WeakPolarHBondContact CB-O 3.17Å; L409-L414 HydrophobicContact CD2-CD2 4.27Å; L409-L414 PolarHBondContact N-O 2.89Å; E412-L414 HydrophobicContact CB-CB 4.19Å; E412-L414 PolarHBondContact O-N 3.45Å; E412-L414 VanDerWaalsContact O-N 3.16Å; L414-L434 HydrophobicContact CD1-CB 4.45Å; L414-L434 HydrophobicContact CD2-CD1 4.31Å; L414-L434 HydrophobicContact CD2-CD2 4.14Å; L414-L434 HydrophobicContact CG-CD2 4.18Å; L414-F435 WeakPolarHBondContact CD1-O 3.2Å; L414-T436 HydrophobicContact CD1-CG2 3.87Å
415	F	97.1	Very high	94.3	Very high	2 Å²	2	36.7 Å²	36.7	1%	0.009	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	140.1	-179.4	-54.9	-88.7	0	0	0	110.4	V317 F319 L363 A407 A408 L434 F435 D437 I440	V317-F415 HydrophobicContact CG2-CD1 4.4Å; F319-F415 HydrophobicContact CB-CE1 4.06Å; F319-F415 HydrophobicContact CB-CZ 4.21Å; F319-F415 AromaticContact CD1-CE1 3.77Å; F319-F415 HydrophobicContact CD1-CE1 3.77Å; F319-F415 AromaticContact CD1-CZ 3.74Å; F319-F415 HydrophobicContact CD1-CZ 3.74Å; F319-F415 HydrophobicContact CD2-CE1 4.37Å; F319-F415 AromaticContact CD2-CZ 3.7Å; F319-F415 HydrophobicContact CD2-CZ 3.7Å; F319-F415 HydrophobicContact CE1-CE1 4.24Å; F319-F415 AromaticContact CE1-CZ 3.9Å; F319-F415 HydrophobicContact CE1-CZ 3.9Å; F319-F415 AromaticContact CE2-CZ 3.87Å; F319-F415 HydrophobicContact CE2-CZ 3.87Å; F319-F415 AromaticContact CG-CE1 3.83Å; F319-F415 HydrophobicContact CG-CE1 3.83Å; F319-F415 AromaticContact CG-CZ 3.63Å; F319-F415 HydrophobicContact CG-CZ 3.63Å; F319-F415 AromaticContact CZ-CZ 3.95Å; F319-F415 HydrophobicContact CZ-CZ 3.95Å; L363-F415 HydrophobicContact CD2-CD1 3.91Å; L363-F415 HydrophobicContact CD2-CE1 4.22Å; L363-F415 HydrophobicContact CD2-CG 4.1Å; A407-F415 WeakPolarHBondContact O-CA 3.41Å; A408-F415 HydrophobicContact CB-CD1 3.98Å; A408-F415 HydrophobicContact CB-CE1 3.94Å; F415-L434 CarbonylContact O-C 3.56Å; F415-L434 VanDerWaalsContact O-CA 3.24Å; F415-L434 WeakPolarHBondContact O-CA 3.25Å; F415-L434 WeakPolarHBondContact O-CD2 3.43Å; F415-F435 HydrophobicContact CB-CD2 3.97Å; F415-F435 HydrophobicContact CB-CE1 4.16Å; F415-F435 HydrophobicContact CB-CE2 3.48Å; F415-F435 VanDerWaalsContact CB-CE2 3.48Å; F415-F435 HydrophobicContact CB-CG 4.48Å; F415-F435 HydrophobicContact CB-CZ 3.6Å; F415-F435 AromaticContact CD2-CD2 3.99Å; F415-F435 HydrophobicContact CD2-CD2 3.99Å; F415-F435 AromaticContact CD2-CE2 3.76Å; F415-F435 HydrophobicContact CD2-CE2 3.76Å; F415-F435 HydrophobicContact CG-CD2 4.33Å; F415-F435 AromaticContact CG-CE2 3.77Å; F415-F435 HydrophobicContact CG-CE2 3.77Å; F415-F435 HydrophobicContact CG-CZ 4.26Å; F415-F435 PolarHBondContact N-O 2.88Å; F415-F435 PolarHBondContact O-N 3Å; F415-D437 HydrophobicContact CE2-CB 4.07Å; F415-I440 HydrophobicContact CD2-CD1 3.93Å; F415-I440 HydrophobicContact CE2-CD1 3.76Å; F415-I440 HydrophobicContact CZ-CD1 4.47Å
416	G	97.8	Very high	94.1	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	139.2	164.1	0	0	0	0	0	110.7	L406 A407	L406-G416 CarbonylContact C-O 3.56Å; L406-G416 WeakPolarHBondContact CA-O 3.34Å; A407-G416 PolarHBondContact N-O 2.86Å; A407-G416 PolarHBondContact O-N 2.91Å
417	C	98.6	Very high	93.9	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	124	167.9	-176.3	0	0	0	0	109.9	L396 D405 L406 F419 F432 R433 F435	L396-C417 HydrophobicContact CD2-CB 3.81Å; D405-C417 CarbonylContact O-C 3.59Å; D405-C417 WeakPolarHBondContact O-CA 3.26Å; L406-C417 HydrophobicContact CD2-CB 3.73Å; C417-F419 HydrophobicContact CB-CD1 4.38Å; C417-F432 CarbonylContact O-C 3.54Å; C417-F432 VanDerWaalsContact O-CA 3.28Å; C417-F432 WeakPolarHBondContact O-CA 3.35Å; C417-R433 PolarHBondContact N-O 2.89Å; C417-R433 PolarHBondContact O-N 3.47Å; C417-F435 HydrophobicContact CB-CE1 3.89Å
418	L	98.9	Very high	93.8	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	121.3	172.2	-174.9	72.6	0	0	0	108.5	L46 P60 A61 L62 A73 S404 D405 I430 A431 F432	L46-L418 HydrophobicContact CD1-CD1 3.75Å; L46-L418 HydrophobicContact CG-CD1 4.44Å; P60-L418 HydrophobicContact CB-CB 4.33Å; P60-L418 HydrophobicContact CB-CD2 3.66Å; P60-L418 HydrophobicContact CB-CG 3.69Å; A61-L418 WeakPolarHBondContact O-CD2 3.32Å; L62-L418 HydrophobicContact CB-CB 3.96Å; L62-L418 HydrophobicContact CB-CD2 4.27Å; L62-L418 HydrophobicContact CD1-CB 4.28Å; L62-L418 HydrophobicContact CD1-CD2 4.47Å; L62-L418 HydrophobicContact CD2-CB 4.08Å; L62-L418 HydrophobicContact CG-CB 4.33Å; A73-L418 HydrophobicContact CB-CD1 4.12Å; A73-L418 HydrophobicContact CB-CD2 3.77Å; S404-L418 CarbonylContact C-O 3.59Å; S404-L418 WeakPolarHBondContact CA-O 3.42Å; D405-L418 PolarHBondContact N-O 2.88Å; D405-L418 PolarHBondContact O-N 3.33Å; L418-I430 HydrophobicContact CD1-CG2 3.59Å; L418-I430 HydrophobicContact CD2-CG2 4.38Å; L418-I430 HydrophobicContact CG-CG2 3.66Å; L418-A431 CarbonylContact C-O 3.56Å; L418-A431 WeakPolarHBondContact CA-O 3.21Å; L418-F432 HydrophobicContact CD1-CB 4.02Å
419	F	98.8	Very high	93.8	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	148	-170	62.5	-85	0	0	0	114.4	L376 L396 H397 Y403 C417 C421 I430 A431 R433	L376-F419 HydrophobicContact CD2-CB 3.63Å; L376-F419 HydrophobicContact CD2-CD1 3.85Å; L376-F419 HydrophobicContact CD2-CD2 3.53Å; L376-F419 HydrophobicContact CD2-CE1 4.37Å; L376-F419 HydrophobicContact CD2-CE2 4.09Å; L376-F419 HydrophobicContact CD2-CG 3.38Å; L376-F419 HydrophobicContact CD2-CZ 4.47Å; L396-F419 HydrophobicContact CD2-CE1 4.3Å; H397-F419 HydrophobicContact CB-CE2 3.68Å; H397-F419 HydrophobicContact CB-CZ 3.94Å; H397-F419 AromaticContact CG-CE2 3.77Å; Y403-F419 WeakPolarHBondContact O-CA 3.43Å; C417-F419 HydrophobicContact CB-CD1 4.38Å; F419-C421 HydrophobicContact CD2-CB 3.9Å; F419-C421 HydrophobicContact CE2-CB 3.75Å; F419-I430 CarbonylContact O-C 3.48Å; F419-I430 VanDerWaalsContact O-CA 3.3Å; F419-I430 WeakPolarHBondContact O-CA 3.48Å; F419-A431 HydrophobicContact CE1-CB 4.49Å; F419-A431 HydrophobicContact CE2-CB 4.44Å; F419-A431 HydrophobicContact CZ-CB 4.21Å; F419-A431 PolarHBondContact N-O 3.19Å; F419-A431 PolarHBondContact O-N 3.43Å; F419-R433 HydrophobicContact CE1-CB 4.26Å
420	E	98.7	Very high	94.1	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	130.5	170.7	-66.8	-178.7	151.8	0	0	110.5	R58 I59 P60 C401 G402 Y403 E426 Q429 I430	R58-E420 VanDerWaalsContact CA-OE1 3.28Å; R58-E420 WeakPolarHBondContact CA-OE1 3.49Å; R58-E420 WeakPolarHBondContact CB-OE1 3.45Å; R58-E420 IonicContact CZ-OE1 3.79Å; R58-E420 IonicContact CZ-OE2 3.66Å; R58-E420 IonicContact NE-OE1 3.18Å; R58-E420 PolarHBondContact NE-OE1 3.11Å; R58-E420 IonicContact NE-OE2 3.8Å; R58-E420 IonicContact NH2-OE1 3.19Å; R58-E420 PolarHBondContact NH2-OE1 3.3Å; R58-E420 IonicContact NH2-OE2 3.81Å; R58-E420 PolarHBondContact NH2-OE2 3.39Å; I59-E420 PolarHBondContact N-OE1 2.96Å; P60-E420 HydrophobicContact CG-CG 4.33Å; C401-E420 CarbonylContact C-O 3.53Å; C401-E420 WeakPolarHBondContact CA-O 3.13Å; G402-E420 PolarHBondContact N-O 2.98Å; Y403-E420 WeakPolarHBondContact CB-OE2 3.5Å; Y403-E420 WeakPolarHBondContact CD2-OE2 3.41Å; Y403-E420 PolarHBondContact N-OE2 2.73Å; Y403-E420 PolarHBondContact O-N 3.31Å; E420-E426 CarbonylContact C-O 3.37Å; E420-E426 WeakPolarHBondContact CB-O 3.22Å; E420-Q429 WeakPolarHBondContact CA-O 3.29Å; E420-I430 HydrophobicContact CG-CG1 4.06Å
421	C	97.9	Very high	95	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	170.8	175	55.5	0	0	0	0	113.5	H397 P400 F419 E426 Q429 A431	H397-C421 WeakPolarHBondContact NE2-CB 3.4Å; P400-C421 CarbonylContact O-C 3.59Å; P400-C421 WeakPolarHBondContact O-CA 3.5Å; F419-C421 HydrophobicContact CD2-CB 3.9Å; F419-C421 HydrophobicContact CE2-CB 3.75Å; C421-E426 CarbonylContact C-O 3.59Å; C421-E426 WeakPolarHBondContact CA-O 3.24Å; C421-E426 PolarHBondContact N-O 2.81Å; C421-Q429 PolarHBondContact N-O 3.2Å; C421-Q429 WeakPolarHBondContact O-CG 3.3Å; C421-Q429 PolarHBondContact O-N 3.07Å; C421-Q429 VanDerWaalsContact O-O 3.05Å; C421-Q429 PolarHBondContact SG-NE2 2.82Å; C421-Q429 VanDerWaalsContact SG-NE2 3.36Å; C421-A431 VanDerWaalsContact SG-CB 3.56Å
422	G	94.8	Very high	95.7	Very high	10 Å²	10	30.6 Å²	30.6	10%	0.103	15%	0.15	C	C	.	.			trans	-177.2	-174	174.1	0	0	0	0	0	113.8	P400 R425	P400-G422 WeakPolarHBondContact CD-O 3.42Å; P400-G422 PolarHBondContact O-N 2.95Å; G422-R425 WeakPolarHBondContact CA-O 3.23Å
423	T	93.3	Very high	96.3	Very high	123 Å²	123	27.8 Å²	27.8	76%	0.755	14%	0.135	S	C	*	.	S	Bend	trans	-89.8	-40.3	176.4	-53	0	0	0	0	111.6	E428	T423-E428 PolarHBondContact N-OE2 3.31Å
424	K	93.7	Very high	96.6	Very high	169 Å²	169	28 Å²	28	74%	0.735	14%	0.136	S	C	*	.	S	Bend	trans	-113.2	-38.5	-178.6	-47.6	172.5	-177.6	169.9	0	112.4	E428	K424-E428 WeakPolarHBondContact CA-OE1 3.41Å; K424-E428 WeakPolarHBondContact CB-OE1 3.4Å; K424-E428 PolarHBondContact N-OE1 3.32Å; K424-E428 PolarHBondContact N-OE2 3.25Å
425	R	94.4	Very high	96.7	Very high	84 Å²	84	27.8 Å²	27.8	32%	0.317	14%	0.135	S	C	.	.	S	Bend	trans	-131	152.6	-178.9	-55.4	-179.5	-63	-172.7	6.8	110.7	G422 C427 E428	G422-R425 WeakPolarHBondContact CA-O 3.23Å; R425-C427 VanDerWaalsContact C-N 3.28Å; R425-C427 PolarHBondContact O-N 3.09Å; R425-E428 HydrophobicContact CB-CG 4.3Å; R425-E428 PolarHBondContact N-OE1 3.11Å
426	E	93.9	Very high	96.5	Very high	55 Å²	55	28.7 Å²	28.7	26%	0.257	14%	0.14	S	C	.	.	G	3₁₀ helix	trans	-66.9	-24.5	179.4	63.9	-92.4	-138.3	0	0	114.2	R373 C401 E420 C421	R373-E426 IonicContact NH1-OE1 3.01Å; C401-E426 VanDerWaalsContact C-CB 3.4Å; C401-E426 VanDerWaalsContact O-CB 3.23Å; C401-E426 WeakPolarHBondContact O-CB 3.28Å; E420-E426 CarbonylContact C-O 3.37Å; E420-E426 WeakPolarHBondContact CB-O 3.22Å; C421-E426 CarbonylContact C-O 3.59Å; C421-E426 WeakPolarHBondContact CA-O 3.24Å; C421-E426 PolarHBondContact N-O 2.81Å
427	C	94.4	Very high	96.2	Very high	9 Å²	9	29.6 Å²	29.6	6%	0.061	15%	0.145	C	C	.	.	G	3₁₀ helix	trans	-92.9	14.6	-174.9	69.1	0	0	0	0	114.5	T56 R58 R425	T56-C427 HydrophobicContact CG2-CB 4.04Å; R58-C427 HydrophobicContact CG-CB 4.16Å; R425-C427 VanDerWaalsContact C-N 3.28Å; R425-C427 PolarHBondContact O-N 3.09Å
428	E	96.4	Very high	95.8	Very high	41 Å²	41	37.5 Å²	37.5	19%	0.192	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-73.9	-29.7	179.7	-70.7	169.7	-164.1	0	0	111.9	Q49 T423 K424 R425	Q49-E428 WeakPolarHBondContact CB-O 3.44Å; Q49-E428 PolarHBondContact N-O 3.04Å; T423-E428 PolarHBondContact N-OE2 3.31Å; K424-E428 WeakPolarHBondContact CA-OE1 3.41Å; K424-E428 WeakPolarHBondContact CB-OE1 3.4Å; K424-E428 PolarHBondContact N-OE1 3.32Å; K424-E428 PolarHBondContact N-OE2 3.25Å; R425-E428 HydrophobicContact CB-CG 4.3Å; R425-E428 PolarHBondContact N-OE1 3.11Å
429	Q	96.8	Very high	95.5	Very high	49 Å²	49	38.9 Å²	38.9	23%	0.229	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	161.4	173.8	53.8	173.8	38.8	0	0	112	F47 R48 E420 C421	F47-Q429 CarbonylContact O-C 3.5Å; F47-Q429 WeakPolarHBondContact O-CA 3.36Å; F47-Q429 VanDerWaalsContact O-CB 3.24Å; F47-Q429 WeakPolarHBondContact O-CB 3.16Å; R48-Q429 HydrophobicContact CG-CB 4.25Å; E420-Q429 WeakPolarHBondContact CA-O 3.29Å; C421-Q429 PolarHBondContact N-O 3.2Å; C421-Q429 WeakPolarHBondContact O-CG 3.3Å; C421-Q429 PolarHBondContact O-N 3.07Å; C421-Q429 VanDerWaalsContact O-O 3.05Å; C421-Q429 PolarHBondContact SG-NE2 2.82Å; C421-Q429 VanDerWaalsContact SG-NE2 3.36Å
430	I	98.7	Very high	95.1	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	121.1	160.7	-61.1	171.6	0	0	0	107	L46 F47 P60 A75 L418 F419 E420	L46-I430 PolarHBondContact N-O 3.49Å; F47-I430 HydrophobicContact CB-CB 4.17Å; F47-I430 HydrophobicContact CD2-CB 3.98Å; F47-I430 HydrophobicContact CD2-CD1 4.45Å; F47-I430 HydrophobicContact CD2-CG2 4.16Å; F47-I430 PolarHBondContact N-O 2.67Å; F47-I430 PolarHBondContact O-N 3Å; P60-I430 HydrophobicContact CB-CD1 4.39Å; P60-I430 HydrophobicContact CB-CG2 3.96Å; A75-I430 HydrophobicContact CB-CD1 3.6Å; L418-I430 HydrophobicContact CD1-CG2 3.59Å; L418-I430 HydrophobicContact CD2-CG2 4.38Å; L418-I430 HydrophobicContact CG-CG2 3.66Å; F419-I430 CarbonylContact O-C 3.48Å; F419-I430 VanDerWaalsContact O-CA 3.3Å; F419-I430 WeakPolarHBondContact O-CA 3.48Å; E420-I430 HydrophobicContact CG-CG1 4.06Å
431	A	98.4	Very high	94.8	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	156	177.7	0	0	0	0	0	111.6	N43 S44 L418 F419 C421	N43-A431 HydrophobicContact CB-CB 4.22Å; S44-A431 CarbonylContact O-C 3.55Å; S44-A431 WeakPolarHBondContact O-CA 3.27Å; L418-A431 CarbonylContact C-O 3.56Å; L418-A431 WeakPolarHBondContact CA-O 3.21Å; F419-A431 HydrophobicContact CE1-CB 4.49Å; F419-A431 HydrophobicContact CE2-CB 4.44Å; F419-A431 HydrophobicContact CZ-CB 4.21Å; F419-A431 PolarHBondContact N-O 3.19Å; F419-A431 PolarHBondContact O-N 3.43Å; C421-A431 VanDerWaalsContact SG-CB 3.56Å
432	F	98.4	Very high	94.4	Very high	7 Å²	7	43.7 Å²	43.7	3%	0.031	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	139	174.5	172.6	-94.9	0	0	0	109.8	S44 L46 L62 F71 V101 W103 C417 L418 L434	S44-F432 PolarHBondContact N-O 2.84Å; S44-F432 PolarHBondContact O-N 3.26Å; L46-F432 HydrophobicContact CD1-CB 3.64Å; L46-F432 HydrophobicContact CD1-CG 4.37Å; L46-F432 HydrophobicContact CD2-CB 4.3Å; L46-F432 HydrophobicContact CG-CB 3.81Å; L62-F432 HydrophobicContact CD1-CD2 4.33Å; L62-F432 HydrophobicContact CD1-CE2 4.19Å; L62-F432 HydrophobicContact CD2-CD2 4.3Å; L62-F432 HydrophobicContact CD2-CE2 3.98Å; F71-F432 HydrophobicContact CD1-CE2 4.25Å; F71-F432 HydrophobicContact CD1-CZ 4.47Å; F71-F432 HydrophobicContact CD2-CZ 4.22Å; F71-F432 HydrophobicContact CE1-CE2 4.21Å; F71-F432 HydrophobicContact CE1-CZ 4.25Å; F71-F432 AromaticContact CE2-CZ 3.98Å; F71-F432 HydrophobicContact CE2-CZ 3.98Å; F71-F432 HydrophobicContact CG-CE2 4.49Å; F71-F432 HydrophobicContact CG-CZ 4.45Å; F71-F432 HydrophobicContact CZ-CE2 4.42Å; F71-F432 AromaticContact CZ-CZ 4Å; F71-F432 HydrophobicContact CZ-CZ 4Å; V101-F432 HydrophobicContact CB-CE1 4.07Å; V101-F432 HydrophobicContact CG2-CE1 3.6Å; V101-F432 HydrophobicContact CG2-CZ 3.9Å; W103-F432 HydrophobicContact CH2-CD2 4.36Å; W103-F432 HydrophobicContact CH2-CE2 4.49Å; W103-F432 HydrophobicContact CZ2-CB 4.23Å; W103-F432 AromaticContact CZ2-CD1 3.68Å; W103-F432 HydrophobicContact CZ2-CD1 3.68Å; W103-F432 AromaticContact CZ2-CD2 3.77Å; W103-F432 HydrophobicContact CZ2-CD2 3.77Å; W103-F432 AromaticContact CZ2-CE1 3.87Å; W103-F432 HydrophobicContact CZ2-CE1 3.87Å; W103-F432 AromaticContact CZ2-CE2 3.96Å; W103-F432 HydrophobicContact CZ2-CE2 3.96Å; W103-F432 AromaticContact CZ2-CG 3.62Å; W103-F432 HydrophobicContact CZ2-CG 3.62Å; W103-F432 AromaticContact CZ2-CZ 4Å; W103-F432 HydrophobicContact CZ2-CZ 4Å; W103-F432 AromaticContact NE1-CD1 3.79Å; C417-F432 CarbonylContact O-C 3.54Å; C417-F432 VanDerWaalsContact O-CA 3.28Å; C417-F432 WeakPolarHBondContact O-CA 3.35Å; L418-F432 HydrophobicContact CD1-CB 4.02Å; F432-L434 HydrophobicContact CE1-CD2 4.21Å; F432-L434 HydrophobicContact CE1-CG 3.8Å; F432-L434 HydrophobicContact CZ-CD2 3.72Å; F432-L434 HydrophobicContact CZ-CG 3.85Å
433	R	97.1	Very high	94	Very high	28 Å²	28	47.3 Å²	47.3	11%	0.106	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	139.5	172.3	176.3	163.5	172.9	-167.5	-0.7	110.1	C40 N43 L396 C417 F419 E439	C40-R433 PolarHBondContact O-NE 3.08Å; N43-R433 WeakPolarHBondContact OD1-CD 3.49Å; L396-R433 HydrophobicContact CD1-CG 4.3Å; L396-R433 PolarHBondContact O-NH1 3.07Å; L396-R433 VanDerWaalsContact O-NH1 3.12Å; C417-R433 PolarHBondContact N-O 2.89Å; C417-R433 PolarHBondContact O-N 3.47Å; F419-R433 HydrophobicContact CE1-CB 4.26Å; R433-E439 IonicContact NH2-OE1 3.62Å; R433-E439 PolarHBondContact NH2-OE1 2.87Å
434	L	96.6	Very high	93.4	Very high	7 Å²	7	43.8 Å²	43.8	4%	0.037	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	151.9	164.5	-74.9	174.3	0	0	0	109.9	C40 F71 H99 V101 L414 F415 F432	C40-L434 CarbonylContact C-O 3.52Å; C40-L434 HydrophobicContact CB-CB 4.32Å; C40-L434 WeakPolarHBondContact CB-O 3.38Å; F71-L434 HydrophobicContact CE2-CD2 4.21Å; F71-L434 HydrophobicContact CZ-CD2 3.86Å; H99-L434 VanDerWaalsContact O-CD1 3.25Å; H99-L434 WeakPolarHBondContact O-CD1 3.44Å; V101-L434 HydrophobicContact CG2-CD1 3.78Å; V101-L434 HydrophobicContact CG2-CG 4.31Å; L414-L434 HydrophobicContact CD1-CB 4.45Å; L414-L434 HydrophobicContact CD2-CD1 4.31Å; L414-L434 HydrophobicContact CD2-CD2 4.14Å; L414-L434 HydrophobicContact CG-CD2 4.18Å; F415-L434 CarbonylContact O-C 3.56Å; F415-L434 VanDerWaalsContact O-CA 3.24Å; F415-L434 WeakPolarHBondContact O-CA 3.25Å; F415-L434 WeakPolarHBondContact O-CD2 3.43Å; F432-L434 HydrophobicContact CE1-CD2 4.21Å; F432-L434 HydrophobicContact CE1-CG 3.8Å; F432-L434 HydrophobicContact CZ-CD2 3.72Å; F432-L434 HydrophobicContact CZ-CG 3.85Å
435	F	95.3	Very high	92.4	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	163.2	167.2	57.2	-92.3	0	0	0	110.8	L363 I378 W394 L396 L406 L414 F415 C417 E439 I440	L363-F435 HydrophobicContact CD2-CE2 3.68Å; L363-F435 HydrophobicContact CD2-CZ 3.8Å; I378-F435 HydrophobicContact CD1-CE1 4.26Å; I378-F435 HydrophobicContact CD1-CZ 3.91Å; I378-F435 HydrophobicContact CG1-CE1 4.49Å; I378-F435 HydrophobicContact CG1-CZ 4.18Å; I378-F435 HydrophobicContact CG2-CE2 4.44Å; W394-F435 HydrophobicContact CH2-CB 3.71Å; W394-F435 HydrophobicContact CH2-CD2 4.39Å; W394-F435 HydrophobicContact CH2-CG 4.07Å; W394-F435 HydrophobicContact CZ3-CB 3.91Å; W394-F435 HydrophobicContact CZ3-CD1 4.5Å; W394-F435 AromaticContact CZ3-CD2 3.7Å; W394-F435 HydrophobicContact CZ3-CD2 3.7Å; W394-F435 HydrophobicContact CZ3-CE2 4.36Å; W394-F435 AromaticContact CZ3-CG 3.78Å; W394-F435 HydrophobicContact CZ3-CG 3.78Å; L396-F435 HydrophobicContact CD1-CD1 3.61Å; L396-F435 HydrophobicContact CD1-CE1 4.04Å; L396-F435 HydrophobicContact CD1-CG 4.22Å; L396-F435 HydrophobicContact CD2-CD1 4.22Å; L396-F435 HydrophobicContact CD2-CE1 3.94Å; L406-F435 HydrophobicContact CD2-CE1 4.42Å; L406-F435 HydrophobicContact CD2-CZ 4.07Å; L414-F435 WeakPolarHBondContact CD1-O 3.2Å; F415-F435 HydrophobicContact CB-CD2 3.97Å; F415-F435 HydrophobicContact CB-CE1 4.16Å; F415-F435 HydrophobicContact CB-CE2 3.48Å; F415-F435 VanDerWaalsContact CB-CE2 3.48Å; F415-F435 HydrophobicContact CB-CG 4.48Å; F415-F435 HydrophobicContact CB-CZ 3.6Å; F415-F435 AromaticContact CD2-CD2 3.99Å; F415-F435 HydrophobicContact CD2-CD2 3.99Å; F415-F435 AromaticContact CD2-CE2 3.76Å; F415-F435 HydrophobicContact CD2-CE2 3.76Å; F415-F435 HydrophobicContact CG-CD2 4.33Å; F415-F435 AromaticContact CG-CE2 3.77Å; F415-F435 HydrophobicContact CG-CE2 3.77Å; F415-F435 HydrophobicContact CG-CZ 4.26Å; F415-F435 PolarHBondContact N-O 2.88Å; F415-F435 PolarHBondContact O-N 3Å; C417-F435 HydrophobicContact CB-CE1 3.89Å; F435-E439 VanDerWaalsContact CA-OE2 3.27Å; F435-E439 WeakPolarHBondContact CA-OE2 3.45Å; F435-I440 HydrophobicContact CD2-CD1 3.92Å; F435-I440 HydrophobicContact CD2-CG1 3.97Å; F435-I440 HydrophobicContact CE2-CD1 3.66Å; F435-I440 HydrophobicContact CE2-CG1 4Å
436	T	93.8	Very high	90.6	Very high	20 Å²	20	39.4 Å²	39.4	12%	0.123	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	158.4	-175.4	55.8	0	0	0	0	113.1	G413 L414 R438 E439 I440	G413-T436 CarbonylContact O-C 3.6Å; G413-T436 WeakPolarHBondContact O-CA 3.34Å; L414-T436 HydrophobicContact CD1-CG2 3.87Å; T436-R438 PolarHBondContact O-N 2.99Å; T436-E439 PolarHBondContact N-OE2 3.09Å; T436-E439 WeakPolarHBondContact O-CB 3.12Å; T436-E439 PolarHBondContact O-N 2.93Å; T436-E439 WeakPolarHBondContact OG1-CG 3.24Å; T436-E439 PolarHBondContact OG1-N 2.55Å; T436-E439 VanDerWaalsContact OG1-N 3.12Å; T436-E439 PolarHBondContact OG1-OE2 3.24Å; T436-I440 WeakPolarHBondContact O-CG1 3.42Å; T436-I440 PolarHBondContact O-N 2.82Å
437	D	91.1	Very high	88.5	Confident	20 Å²	20	43.6 Å²	43.6	11%	0.107	22%	0.218	C	C	.	.	H	α-helix	trans	-57.5	-35.1	166.6	62.7	-9.5	0	0	0	112.3	F319 G413 F415 I440 L441	F319-D437 HydrophobicContact CE2-CB 4.44Å; G413-D437 PolarHBondContact O-N 2.76Å; F415-D437 HydrophobicContact CE2-CB 4.07Å; D437-I440 WeakPolarHBondContact O-CB 3.49Å; D437-I440 PolarHBondContact O-N 2.88Å; D437-L441 WeakPolarHBondContact O-CB 3.45Å; D437-L441 WeakPolarHBondContact O-CG 3.31Å; D437-L441 PolarHBondContact O-N 3.31Å
438	R	90.6	Very high	85.9	Confident	165 Å²	165	48.6 Å²	48.6	62%	0.623	25%	0.252	S	S	*	.	H	α-helix	trans	-60.8	-43.8	173.2	-68	179.3	174.5	176.5	-2.3	112.8	E323 T436 L441 S442	E323-R438 IonicContact OE1-NH2 3.13Å; E323-R438 PolarHBondContact OE1-NH2 2.8Å; E323-R438 VanDerWaalsContact OE1-NH2 3.13Å; T436-R438 PolarHBondContact O-N 2.99Å; R438-L441 PolarHBondContact O-N 3.33Å; R438-S442 WeakPolarHBondContact O-CB 3.42Å; R438-S442 PolarHBondContact O-N 2.86Å; R438-S442 PolarHBondContact O-OG 2.94Å; R438-S442 VanDerWaalsContact O-OG 3.1Å
439	E	91.9	Very high	82.9	Confident	30 Å²	30	51.9 Å²	51.9	14%	0.14	28%	0.275	C	S	.	.	H	α-helix	trans	-58.9	-48.9	171.6	-79.4	164.8	91.5	0	0	110.7	W394 R433 F435 T436 L441 S442 H443	W394-E439 HydrophobicContact CH2-CB 3.65Å; W394-E439 HydrophobicContact CH2-CG 4.31Å; W394-E439 HydrophobicContact CZ2-CB 4.23Å; W394-E439 HydrophobicContact CZ3-CB 4.06Å; R433-E439 IonicContact NH2-OE1 3.62Å; R433-E439 PolarHBondContact NH2-OE1 2.87Å; F435-E439 VanDerWaalsContact CA-OE2 3.27Å; F435-E439 WeakPolarHBondContact CA-OE2 3.45Å; T436-E439 PolarHBondContact N-OE2 3.09Å; T436-E439 WeakPolarHBondContact O-CB 3.12Å; T436-E439 PolarHBondContact O-N 2.93Å; T436-E439 WeakPolarHBondContact OG1-CG 3.24Å; T436-E439 PolarHBondContact OG1-N 2.55Å; T436-E439 VanDerWaalsContact OG1-N 3.12Å; T436-E439 PolarHBondContact OG1-OE2 3.24Å; E439-L441 PolarHBondContact O-N 3.22Å; E439-S442 PolarHBondContact O-N 3.08Å; E439-S442 PolarHBondContact O-OG 2.95Å; E439-H443 PolarHBondContact O-CD2 3.17Å; E439-H443 VanDerWaalsContact O-CD2 3.26Å; E439-H443 PolarHBondContact O-N 3.45Å
440	I	91.7	Very high	79.7	Confident	5 Å²	5	54 Å²	54	3%	0.026	30%	0.295	C	S	.	.	H	α-helix	trans	-57.2	-50.4	178.4	-58.6	159	0	0	0	110.8	L363 I378 L380 W394 F415 F435 T436 D437 H443 L444	L363-I440 HydrophobicContact CD1-CD1 3.71Å; L363-I440 HydrophobicContact CD1-CG1 4.43Å; L363-I440 HydrophobicContact CD1-CG2 4.28Å; L363-I440 HydrophobicContact CD2-CD1 4.04Å; I378-I440 HydrophobicContact CG2-CG1 4.41Å; L380-I440 HydrophobicContact CB-CG2 4.3Å; L380-I440 HydrophobicContact CD2-CG2 4.34Å; W394-I440 HydrophobicContact CE3-CG1 4.1Å; W394-I440 HydrophobicContact CZ3-CG1 4.04Å; F415-I440 HydrophobicContact CD2-CD1 3.93Å; F415-I440 HydrophobicContact CE2-CD1 3.76Å; F415-I440 HydrophobicContact CZ-CD1 4.47Å; F435-I440 HydrophobicContact CD2-CD1 3.92Å; F435-I440 HydrophobicContact CD2-CG1 3.97Å; F435-I440 HydrophobicContact CE2-CD1 3.66Å; F435-I440 HydrophobicContact CE2-CG1 4Å; T436-I440 WeakPolarHBondContact O-CG1 3.42Å; T436-I440 PolarHBondContact O-N 2.82Å; D437-I440 WeakPolarHBondContact O-CB 3.49Å; D437-I440 PolarHBondContact O-N 2.88Å; I440-H443 PolarHBondContact O-N 3.29Å; I440-L444 WeakPolarHBondContact O-CG 3.43Å; I440-L444 PolarHBondContact O-N 2.84Å
441	L	91.1	Very high	76.6	Confident	31 Å²	31	59.9 Å²	59.9	16%	0.162	33%	0.333	C	S	.	.	H	α-helix	trans	-66.8	-40.5	-176.9	-73.1	173.8	0	0	0	112.9	W361 L380 D437 R438 E439 H443 L444 Q445	W361-L441 HydrophobicContact CH2-CD2 4.43Å; W361-L441 HydrophobicContact CZ3-CD2 4.06Å; L380-L441 HydrophobicContact CD2-CD2 4.39Å; D437-L441 WeakPolarHBondContact O-CB 3.45Å; D437-L441 WeakPolarHBondContact O-CG 3.31Å; D437-L441 PolarHBondContact O-N 3.31Å; R438-L441 PolarHBondContact O-N 3.33Å; E439-L441 PolarHBondContact O-N 3.22Å; L441-H443 VanDerWaalsContact C-N 3.33Å; L441-H443 PolarHBondContact O-N 2.86Å; L441-L444 HydrophobicContact CD2-CD1 4.43Å; L441-L444 WeakPolarHBondContact O-CB 3.43Å; L441-L444 PolarHBondContact O-N 3.28Å; L441-L444 VanDerWaalsContact O-N 3.13Å; L441-Q445 WeakPolarHBondContact O-CG 3.49Å; L441-Q445 PolarHBondContact O-N 2.57Å
442	S	89.6	Confident	73.8	Confident	64 Å²	64	63.4 Å²	63.4	45%	0.448	37%	0.369	S	S	.	.	H	α-helix	trans	-62.7	-39.1	177.7	64.6	0	0	0	0	112.2	R438 E439 L444 Q445 G446	R438-S442 WeakPolarHBondContact O-CB 3.42Å; R438-S442 PolarHBondContact O-N 2.86Å; R438-S442 PolarHBondContact O-OG 2.94Å; R438-S442 VanDerWaalsContact O-OG 3.1Å; E439-S442 PolarHBondContact O-N 3.08Å; E439-S442 PolarHBondContact O-OG 2.95Å; S442-L444 VanDerWaalsContact C-N 3.29Å; S442-L444 PolarHBondContact O-N 3.33Å; S442-Q445 PolarHBondContact O-N 3.44Å; S442-G446 PolarHBondContact O-N 2.83Å
443	H	86.4	Confident	70.6	Confident	87 Å²	87	75.1 Å²	75.1	40%	0.403	41%	0.413	S	S	.	.	H	α-helix	trans	-67	-26.4	174.5	-82.6	-66.7	0	0	0	113.7	W394 E439 I440 L441 H447	W394-H443 HydrophobicContact CB-CB 4.14Å; W394-H443 AromaticContact CD1-CD2 3.33Å; W394-H443 AromaticContact CD1-CE1 3.8Å; W394-H443 AromaticContact CD1-CG 3.38Å; W394-H443 AromaticContact CD1-ND1 3.67Å; W394-H443 AromaticContact CD1-NE2 3.59Å; W394-H443 AromaticContact CD2-CD2 3.8Å; W394-H443 AromaticContact CE2-CD2 3.38Å; W394-H443 AromaticContact CE2-NE2 3.6Å; W394-H443 HydrophobicContact CG-CB 4.02Å; W394-H443 AromaticContact CG-CD2 3.78Å; W394-H443 AromaticContact CG-CG 3.85Å; W394-H443 AromaticContact CZ2-CD2 3.94Å; W394-H443 AromaticContact NE1-CD2 3.08Å; W394-H443 PolarHBondContact NE1-CD2 3.38Å; W394-H443 AromaticContact NE1-CE1 3.57Å; W394-H443 AromaticContact NE1-CG 3.65Å; W394-H443 AromaticContact NE1-ND1 3.91Å; W394-H443 AromaticContact NE1-NE2 3.01Å; W394-H443 PolarHBondContact NE1-NE2 2.97Å; E439-H443 PolarHBondContact O-CD2 3.17Å; E439-H443 VanDerWaalsContact O-CD2 3.26Å; E439-H443 PolarHBondContact O-N 3.45Å; I440-H443 PolarHBondContact O-N 3.29Å; L441-H443 VanDerWaalsContact C-N 3.33Å; L441-H443 PolarHBondContact O-N 2.86Å; H443-H447 PolarHBondContact O-CD2 3.37Å
444	L	81.4	Confident	67.4	Low	49 Å²	49	80.6 Å²	80.6	26%	0.257	45%	0.445	S	S	.	.	H	α-helix	trans	-74.3	-41.4	171.3	-63.6	173.6	0	0	0	111.8	L380 I440 L441 S442	L380-L444 HydrophobicContact CB-CD1 4.26Å; L380-L444 HydrophobicContact CD2-CD1 3.53Å; I440-L444 WeakPolarHBondContact O-CG 3.43Å; I440-L444 PolarHBondContact O-N 2.84Å; L441-L444 HydrophobicContact CD2-CD1 4.43Å; L441-L444 WeakPolarHBondContact O-CB 3.43Å; L441-L444 PolarHBondContact O-N 3.28Å; L441-L444 VanDerWaalsContact O-N 3.13Å; S442-L444 VanDerWaalsContact C-N 3.29Å; S442-L444 PolarHBondContact O-N 3.33Å
445	Q	72.1	Confident	64.4	Low	120 Å²	120	86.7 Å²	86.7	56%	0.561	49%	0.485	S	S	*	.	H	α-helix	trans	-73	-37.8	-177.6	-68.5	179.7	9.9	0	0	113.5	L441 S442 H447 C448	L441-Q445 WeakPolarHBondContact O-CG 3.49Å; L441-Q445 PolarHBondContact O-N 2.57Å; S442-Q445 PolarHBondContact O-N 3.44Å; Q445-H447 PolarHBondContact O-N 2.84Å; Q445-C448 PolarHBondContact O-N 3Å
446	G	57.8	Low	61.5	Low	40 Å²	40	91 Å²	91	41%	0.412	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-17.6	179.8	0	0	0	0	0	114.8	S442	S442-G446 PolarHBondContact O-N 2.83Å
447	H	49.1	Very low	58.6	Low	144 Å²	144	98.9 Å²	98.9	67%	0.667	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	-19.1	173	-78.9	-54.7	0	0	0	114.5	H443 Q445	H443-H447 PolarHBondContact O-CD2 3.37Å; Q445-H447 PolarHBondContact O-N 2.84Å
448	C	39	Very low	55.9	Low	114 Å²	114	108.1 Å²	108.1	77%	0.77	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	-22.5	176.8	-68.6	0	0	0	0	113	Q445	Q445-C448 PolarHBondContact O-N 3Å
449	T	33.2	Very low	53.3	Low	110 Å²	110	109.8 Å²	109.8	68%	0.675	60%	0.602	S	S	*	*	S	Bend	trans	-97.3	8.2	-173.5	51.2	0	0	0	0	114.9	P451	T449-P451 VanDerWaalsContact C-CD 3.42Å; T449-P451 WeakPolarHBondContact O-CD 3.48Å
450	S	29.5	Very low	50.4	Low	93 Å²	93	113.8 Å²	113.8	65%	0.65	63%	0.633	S	S	*	*			trans	-111.2	77	-174.8	-69.9	0	0	0	0	114.8	G452	S450-G452 PolarHBondContact O-N 3.26Å
451	P	34.8	Very low	47.7	Very low	123 Å²	123	124.9 Å²	124.9	80%	0.799	69%	0.692	S	S	*	*			trans	-80	110.8	163.8	32.2	-30.1	0	0	0	110.7	T449	T449-P451 VanDerWaalsContact C-CD 3.42Å; T449-P451 WeakPolarHBondContact O-CD 3.48Å
452	G	39.7	Very low	45.6	Very low	74 Å²	74	129.6 Å²	129.6	76%	0.763	72%	0.719	S	S	*	*			trans	69.1	91.7	157.8	0	0	0	0	0	117.9	S450	S450-G452 PolarHBondContact O-N 3.26Å
453	R	30.9	Very low	43.2	Very low	253 Å²	253	133 Å²	133	96%	0.955	73%	0.733	S	S	*	*			trans	-118.9	107	153.9	-128.3	177.2	-175.8	175.1	1.4	109.6
454	N	29.3	Very low	40.8	Very low	144 Å²	144	135.6 Å²	135.6	77%	0.77	75%	0.751	S	S	*	*			trans	-64.8	128.2	-179.2	-80.3	-24	0	0	0	111.2	S456	N454-S456 VanDerWaalsContact C-N 3.28Å; N454-S456 PolarHBondContact O-N 2.73Å
455	P	34.8	Very low	38.4	Very low	134 Å²	134	140.6 Å²	140.6	87%	0.87	78%	0.78	S	S	*	*	S	Bend	trans	-82.2	71.7	175	34.1	-34.4	0	0	0	110.6
456	S	32.8	Very low	36.3	Very low	90 Å²	90	141.9 Å²	141.9	63%	0.629	79%	0.794	S	S	*	*			trans	-151.2	59.6	178.9	64	0	0	0	0	113.7	N454	N454-S456 VanDerWaalsContact C-N 3.28Å; N454-S456 PolarHBondContact O-N 2.73Å
457	Q	33.7	Very low	34.9	Very low	186 Å²	186	148.7 Å²	148.7	87%	0.869	82%	0.82	S	S	*	*			trans	-167.8	88.7	156.4	-110.6	165.8	22.7	0	0	111.1
458	F	35.2	Very low	33.9	Very low	215 Å²	215	149.1 Å²	149.1	94%	0.943	83%	0.83	S	S	*	*			trans	-155.7	83.3	150.2	-97.9	-67.6	0	0	0	108.8
459	K	35	Very low	33.5	Very low	200 Å²	200	151.8 Å²	151.8	87%	0.87	84%	0.835	S	S	*	*			trans	-140.4	147.9	158.1	-82.2	-167.4	174.7	-175.5	0	106.8
460	S	32.2	Very low	33.5	Very low	113 Å²	113	155.3 Å²	155.3	79%	0.79	85%	0.848	S	S	*	*			trans	72.3	114	-170.8	-43.5	0	0	0	0	112
461	N	34.5	Very low	33.9	Very low	238 Å²	238	160.9 Å²	160.9	100%	1.273	87%	0.866	S	S	*	*			cis	-129.8	0	26.9	-72.1	-28.7	0	0	0	113.3

Retrieved 461 of 461 residues in 324.5 ms (Link to these results)

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