A0A096MXT1_PAPAN Loading...

Endothelial lipase

Exerts both phospholipase and triglyceride lipase activities. More active as a phospholipase than a triglyceride lipase. Hydrolyzes triglycerides, both with short-chain fatty acyl groups (tributyrin) and long-chain fatty acyl groups (triolein) with similar levels of activity toward both types of substrates. Hydrolyzes high density lipoproteins (HDL) more efficiently than other lipoproteins.

AlphaFold DB , UniProt , Accession A0A096MXT1, Species PAPAN (Papio anubis, Olive baboon), Gene LIPG, Length 500 aa.

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.2	Very low	30.2	Very low	244 Å²	244	153.7 Å²	153.7	100%	1.202	82%	0.821	S	S	*	*				0	116	0	-77.5	163.8	76.2	0	0	108.4
2	S	29.2	Very low	30.2	Very low	102 Å²	102	150.7 Å²	150.7	71%	0.713	82%	0.821	S	S	*	*			trans	44.4	128.4	151.4	-106.5	0	0	0	0	123.9
3	N	28.9	Very low	30.4	Very low	143 Å²	143	150.5 Å²	150.5	77%	0.765	82%	0.818	S	S	*	*			trans	91.6	140.8	134.5	-62.1	-4.6	0	0	0	118.2
4	S	29.7	Very low	30.3	Very low	101 Å²	101	148.7 Å²	148.7	71%	0.706	82%	0.82	S	S	*	*			cis	179.9	129.3	-20.8	-88.4	0	0	0	0	103.6
5	V	29.2	Very low	30.3	Very low	129 Å²	129	146.6 Å²	146.6	78%	0.782	82%	0.818	S	S	*	*			trans	-122.6	127.8	169.3	177.1	0	0	0	0	107.1	L7	V5-L7 HydrophobicContact CG1-CD1 4.4Å
6	P	35.4	Very low	30.2	Very low	118 Å²	118	145.7 Å²	145.7	77%	0.766	82%	0.823	S	S	*	*			trans	-95.4	116.3	167.4	32.2	-22.8	0	0	0	110.3
7	L	29.8	Very low	30.1	Very low	150 Å²	150	149.4 Å²	149.4	79%	0.785	83%	0.828	S	S	*	*			trans	-88.7	127.7	151.9	-101.6	89.8	0	0	0	107.4	V5	V5-L7 HydrophobicContact CG1-CD1 4.4Å
8	L	29.3	Very low	30	Very low	177 Å²	177	147 Å²	147	93%	0.927	83%	0.831	S	S	*	*			trans	-100	110.7	167	-91.1	158.3	0	0	0	108.8
9	C	29.4	Very low	30	Very low	93 Å²	93	144.7 Å²	144.7	63%	0.628	83%	0.832	S	S	*	*			trans	-96.8	137.5	167.7	-86.4	0	0	0	0	110.6
10	F	29.7	Very low	29.8	Very low	197 Å²	197	141.5 Å²	141.5	86%	0.864	83%	0.832	S	S	*	*			trans	21.1	120.7	139.7	-73.5	-88.9	0	0	0	119.5
11	W	28.1	Very low	29.7	Very low	237 Å²	237	140.3 Å²	140.3	90%	0.898	83%	0.831	S	S	*	*			trans	-95.4	119.4	158.2	-90.9	35.6	0	0	0	110.3	L13	W11-L13 HydrophobicContact CE3-CD1 3.8Å; W11-L13 HydrophobicContact CZ3-CD1 3.97Å
12	S	30.8	Very low	30.2	Very low	117 Å²	117	134 Å²	134	82%	0.818	81%	0.809	S	S	*	*			trans	-102.3	134.4	153.4	-74.4	0	0	0	0	107.5
13	L	32.1	Very low	30.1	Very low	148 Å²	148	135.8 Å²	135.8	78%	0.775	82%	0.815	S	S	*	*			trans	-118.7	125.7	168.4	-125.3	84.3	0	0	0	110.7	W11	W11-L13 HydrophobicContact CE3-CD1 3.8Å; W11-L13 HydrophobicContact CZ3-CD1 3.97Å
14	C	29.6	Very low	30.5	Very low	126 Å²	126	134.7 Å²	134.7	85%	0.851	82%	0.816	S	S	*	*			trans	-72.5	156.1	177.4	-99.5	0	0	0	0	113.3
15	C	29.7	Very low	30.4	Very low	117 Å²	117	140.4 Å²	140.4	79%	0.791	83%	0.828	S	S	*	*			trans	-64.2	142.3	169.5	-66.2	0	0	0	0	112.9
16	C	28.8	Very low	30.3	Very low	132 Å²	132	137.5 Å²	137.5	89%	0.892	83%	0.825	S	S	*	*			trans	-106.8	123.4	162.1	-75.3	0	0	0	0	109.6
17	F	28.6	Very low	30.5	Very low	208 Å²	208	138.2 Å²	138.2	91%	0.912	83%	0.829	S	S	*	*			trans	-86.7	139.4	162.2	-83.6	-90.7	0	0	0	109.2
18	A	28.9	Very low	30.6	Very low	107 Å²	107	140.6 Å²	140.6	88%	0.884	84%	0.837	S	S	*	*			trans	-108.3	119.8	167.3	0	0	0	0	0	109.6
19	A	28.9	Very low	30.5	Very low	103 Å²	103	135.8 Å²	135.8	85%	0.851	83%	0.83	S	S	*	*			trans	-98.6	136.2	169.6	0	0	0	0	0	109.4
20	G	27	Very low	30.4	Very low	80 Å²	80	141 Å²	141	83%	0.825	85%	0.845	S	S	*	*			trans	-118.2	138.4	172.5	0	0	0	0	0	111
21	S	28.3	Very low	30.4	Very low	117 Å²	117	139.5 Å²	139.5	82%	0.818	85%	0.845	S	S	*	*			trans	-118.5	169.1	-177	-42.1	0	0	0	0	110.9
22	P	43.4	Very low	30.5	Very low	113 Å²	113	137.6 Å²	137.6	73%	0.734	85%	0.846	S	S	*	*			trans	-105.5	178.4	-140.7	41.3	-39.5	0	0	0	116.7
23	T	27.3	Very low	30.6	Very low	139 Å²	139	139 Å²	139	85%	0.853	84%	0.844	S	S	*	*			trans	174.3	168.6	147.1	38.3	0	0	0	0	111.2
24	P	36.6	Very low	30.6	Very low	120 Å²	120	141.3 Å²	141.3	78%	0.779	85%	0.851	S	S	*	*				-127.1	177.4	-81.6	30.4	-6.4	0	0	0	116.2
25	F	27	Very low	30.7	Very low	220 Å²	220	142 Å²	142	97%	0.965	85%	0.846	S	S	*	*			trans	-45.3	157.9	176.6	-76	-97.7	0	0	0	117.5
26	G	27.6	Very low	31.1	Very low	69 Å²	69	144.6 Å²	144.6	71%	0.711	85%	0.846	S	S	*	*			cis	-172.2	-151.9	13.7	0	0	0	0	0	109.3
27	P	39.8	Very low	31.2	Very low	132 Å²	132	147.6 Å²	147.6	86%	0.857	84%	0.844	S	S	*	*			cis	-125.6	-171.6	-6.7	41.7	-23.1	0	0	0	115.1
28	E	32.2	Very low	31.4	Very low	201 Å²	201	143.8 Å²	143.8	94%	0.939	84%	0.84	S	S	*	*			trans	-48	149	-168.6	-65.9	162.2	137.6	0	0	120.5
29	G	27.1	Very low	31.6	Very low	76 Å²	76	148.1 Å²	148.1	78%	0.784	84%	0.839	S	S	*	*			trans	-161	139.1	162.2	0	0	0	0	0	110.4
30	Q	27.5	Very low	31.9	Very low	203 Å²	203	147.3 Å²	147.3	95%	0.949	83%	0.832	S	S	*	*			trans	-76.3	160.3	-152.5	-77.1	161.3	-36.7	0	0	117.7
31	L	29.3	Very low	32.3	Very low	164 Å²	164	151 Å²	151	86%	0.859	83%	0.831	S	S	*	*			trans	-64.1	129.4	172.8	-157.2	89.4	0	0	0	112.2
32	E	30.1	Very low	32.7	Very low	197 Å²	197	153.8 Å²	153.8	92%	0.921	83%	0.832	S	S	*	*			trans	-128.4	130.1	151.3	-84.3	-170.1	161.6	0	0	109.8
33	D	32.7	Very low	32.3	Very low	146 Å²	146	154.2 Å²	154.2	78%	0.781	83%	0.832	S	S	*	*			trans	-99.5	102.4	-171.7	-170.2	14.3	0	0	0	108.1
34	E	32.2	Very low	32.8	Very low	197 Å²	197	156.2 Å²	156.2	92%	0.921	83%	0.832	S	S	*	*			trans	-98.5	86.8	167.5	-84.7	-142.9	135.7	0	0	111	H36	E34-H36 PolarHBondContact O-N 3.23Å
35	L	31.1	Very low	33.5	Very low	140 Å²	140	156.7 Å²	156.7	73%	0.733	83%	0.833	S	S	*	*			trans	-8.3	112.2	145.8	-164.8	70.4	0	0	0	116.8
36	H	37.8	Very low	35.1	Very low	173 Å²	173	154.8 Å²	154.8	80%	0.801	82%	0.824	S	S	*	*			trans	40.5	89.6	138.9	-69.7	71.8	0	0	0	118.5	E34	E34-H36 PolarHBondContact O-N 3.23Å
37	K	31.4	Very low	37.1	Very low	194 Å²	194	155 Å²	155	84%	0.843	81%	0.813	S	S	*	*			trans	-100.3	126.7	142.8	-82.9	177.1	179.5	168.4	0	108.8	K39	K37-K39 PolarHBondContact O-N 3.39Å
38	P	32.4	Very low	39.3	Very low	128 Å²	128	152.1 Å²	152.1	83%	0.831	80%	0.796	S	S	*	*			trans	-64.7	108.6	170.5	26	-28.5	0	0	0	107.3	A40	P38-A40 PolarHBondContact O-N 3.22Å
39	K	34.2	Very low	42.3	Very low	198 Å²	198	143.6 Å²	143.6	86%	0.861	76%	0.757	S	S	*	*			trans	-57.1	111	160.3	-94.9	179.6	175.4	176.1	0	105.4	K37 I41	K37-K39 PolarHBondContact O-N 3.39Å; K39-I41 PolarHBondContact O-N 2.94Å
40	A	34.4	Very low	45.5	Very low	87 Å²	87	145.5 Å²	145.5	72%	0.719	74%	0.741	S	S	*	*			trans	-48.1	115	164.1	0	0	0	0	0	106.5	P38 Q42	P38-A40 PolarHBondContact O-N 3.22Å; A40-Q42 PolarHBondContact O-N 3.22Å
41	I	36.9	Very low	48.8	Very low	156 Å²	156	136.4 Å²	136.4	80%	0.8	70%	0.698	S	S	*	*			trans	-60.3	99	166.1	-63.9	171.8	0	0	0	103.3	K39 T43	K39-I41 PolarHBondContact O-N 2.94Å; I41-T43 VanDerWaalsContact C-N 3.28Å; I41-T43 PolarHBondContact O-N 2.98Å
42	Q	35.6	Very low	52	Low	177 Å²	177	128.9 Å²	128.9	83%	0.827	66%	0.659	S	S	*	*			trans	-55.5	107.7	162.3	-73.2	-175.2	-0.1	0	0	104.1	A40 E44	A40-Q42 PolarHBondContact O-N 3.22Å; Q42-E44 VanDerWaalsContact C-N 3.34Å; Q42-E44 PolarHBondContact O-N 2.94Å
43	T	35.9	Very low	55.2	Low	122 Å²	122	119.7 Å²	119.7	75%	0.748	62%	0.616	S	S	*	*			trans	-59.8	106.6	172.2	-21.1	0	0	0	0	103.8	I41 V45	I41-T43 VanDerWaalsContact C-N 3.28Å; I41-T43 PolarHBondContact O-N 2.98Å; T43-V45 PolarHBondContact O-N 3.18Å
44	E	37.9	Very low	58.1	Low	181 Å²	181	113.9 Å²	113.9	85%	0.846	58%	0.583	S	S	*	*			trans	-51.8	108.2	173.1	-81	-174.9	161.4	0	0	106.4	Q42 K46	Q42-E44 VanDerWaalsContact C-N 3.34Å; Q42-E44 PolarHBondContact O-N 2.94Å; E44-K46 VanDerWaalsContact C-N 3.35Å; E44-K46 PolarHBondContact O-N 2.98Å
45	V	50.4	Low	60.8	Low	130 Å²	130	108.1 Å²	108.1	79%	0.788	56%	0.561	S	S	*	*			trans	-64.1	103.9	178.1	177.4	0	0	0	0	105	T43	T43-V45 PolarHBondContact O-N 3.18Å
46	K	61	Low	63.4	Low	180 Å²	180	103.3 Å²	103.3	78%	0.783	54%	0.54	S	S	*	.			trans	-52.8	129.5	178	-77.8	-176.9	177.8	179	0	108	E44 S48	E44-K46 VanDerWaalsContact C-N 3.35Å; E44-K46 PolarHBondContact O-N 2.98Å; K46-S48 PolarHBondContact O-N 3.17Å
47	P	69.6	Low	65.4	Low	73 Å²	73	99.9 Å²	99.9	47%	0.474	52%	0.522	S	S	.	.			trans	-53.7	119.6	176.3	17	-27.4	0	0	0	108.8	P125 L126	P47-P125 HydrophobicContact CB-CB 3.7Å; P47-L126 HydrophobicContact CB-CD2 3.96Å; P47-L126 HydrophobicContact CB-CG 4.29Å; P47-L126 HydrophobicContact CG-CD2 3.78Å
48	S	84.7	Confident	67.8	Low	72 Å²	72	94.5 Å²	94.5	50%	0.503	50%	0.503	S	S	.	.			trans	-110	146.8	-170.9	59.3	0	0	0	0	111.1	K46	K46-S48 PolarHBondContact O-N 3.17Å
49	V	95.6	Very high	69.9	Low	21 Å²	21	91.2 Å²	91.2	13%	0.127	48%	0.482	C	S	.	.			trans	-78.1	129.4	172.8	-179.8	0	0	0	0	108.3	F51 V121 D122 W123 L126 V141	V49-F51 HydrophobicContact CG1-CE2 4.33Å; V49-F51 HydrophobicContact CG1-CZ 4.11Å; V49-V121 HydrophobicContact CG1-CG1 3.59Å; V49-D122 WeakPolarHBondContact CA-O 3.17Å; V49-W123 HydrophobicContact CG2-CB 4.25Å; V49-L126 HydrophobicContact CG2-CD1 4.02Å; V49-V141 HydrophobicContact CG1-CG1 4.25Å; V49-V141 HydrophobicContact CG2-CB 4.24Å; V49-V141 HydrophobicContact CG2-CG1 3.97Å; V49-V141 HydrophobicContact CG2-CG2 3.92Å
50	R	95.6	Very high	72.1	Confident	116 Å²	116	89.5 Å²	89.5	44%	0.438	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	146.9	178.1	-55.6	-176.7	-69.6	-176.4	-5.3	110.4	Y65 D122	R50-Y65 HydrophobicContact CB-CD1 4.01Å; R50-Y65 HydrophobicContact CB-CE1 4.05Å; R50-D122 HydrophobicContact CB-CB 4.17Å; R50-D122 IonicContact CZ-OD2 3.19Å; R50-D122 PolarHBondContact N-O 2.64Å; R50-D122 IonicContact NE-OD2 3.02Å; R50-D122 PolarHBondContact NE-OD2 3.48Å; R50-D122 IonicContact NH2-OD2 2.65Å; R50-D122 PolarHBondContact NH2-OD2 3.12Å; R50-D122 PolarHBondContact O-N 2.63Å
51	F	96.9	Very high	74.4	Confident	12 Å²	12	89.5 Å²	89.5	5%	0.053	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	107.2	-178.8	-61.3	-87.4	0	0	0	108.7	V49 Y65 L66 F87 V119 V121 I145 M148	V49-F51 HydrophobicContact CG1-CE2 4.33Å; V49-F51 HydrophobicContact CG1-CZ 4.11Å; F51-Y65 CarbonylContact O-C 3.55Å; F51-Y65 WeakPolarHBondContact O-CA 3.07Å; F51-L66 HydrophobicContact CB-CB 4.04Å; F51-L66 PolarHBondContact O-N 3.31Å; F51-F87 HydrophobicContact CD1-CD1 4.41Å; F51-F87 HydrophobicContact CD1-CE1 4.02Å; F51-F87 HydrophobicContact CE1-CE1 4.36Å; F51-V119 HydrophobicContact CB-CG1 4Å; F51-V119 HydrophobicContact CD1-CG1 4.34Å; F51-V121 HydrophobicContact CD1-CG2 4.24Å; F51-V121 HydrophobicContact CE1-CG1 4.46Å; F51-V121 HydrophobicContact CE1-CG2 4.33Å; F51-I145 HydrophobicContact CE1-CB 4.42Å; F51-I145 HydrophobicContact CE1-CG1 4Å; F51-I145 HydrophobicContact CZ-CG1 4.4Å; F51-M148 HydrophobicContact CB-CE 4.07Å; F51-M148 HydrophobicContact CD1-CE 4.37Å; F51-M148 HydrophobicContact CD1-CG 4.2Å; F51-M148 HydrophobicContact CD2-CE 3.31Å; F51-M148 HydrophobicContact CE1-CB 3.9Å; F51-M148 HydrophobicContact CE1-CG 4.08Å; F51-M148 HydrophobicContact CE2-CB 4.1Å; F51-M148 HydrophobicContact CE2-CE 3.76Å; F51-M148 HydrophobicContact CE2-CG 4.44Å; F51-M148 HydrophobicContact CG-CE 3.66Å; F51-M148 HydrophobicContact CG-CG 4.41Å; F51-M148 HydrophobicContact CZ-CB 3.68Å; F51-M148 HydrophobicContact CZ-CE 4.44Å; F51-M148 HydrophobicContact CZ-CG 4.21Å
52	N	95.8	Very high	76.3	Confident	7 Å²	7	90.3 Å²	90.3	4%	0.037	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	105	-174.9	-175.2	-8.2	0	0	0	110.2	R54 G63 C64 Y65 V119 V120	N52-R54 PolarHBondContact O-N 2.04Å; N52-G63 WeakPolarHBondContact OD1-CA 3.46Å; N52-C64 PolarHBondContact OD1-N 2.7Å; N52-Y65 HydrophobicContact CB-CD1 4.04Å; N52-Y65 HydrophobicContact CB-CE1 3.82Å; N52-V119 CarbonylContact O-C 3.59Å; N52-V119 WeakPolarHBondContact O-CA 3.14Å; N52-V120 HydrophobicContact CB-CB 4.43Å; N52-V120 PolarHBondContact N-O 3.4Å; N52-V120 PolarHBondContact O-N 3.23Å
53	L	96.6	Very high	78.8	Confident	4 Å²	4	82.4 Å²	82.4	2%	0.021	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	116.2	172.1	-176.4	66.7	0	0	0	109.6	G63 C64 L66 C77 F79 N117 V119	L53-G63 WeakPolarHBondContact O-CA 3.13Å; L53-C64 WeakPolarHBondContact CB-O 3.26Å; L53-C64 PolarHBondContact N-O 3.21Å; L53-C64 PolarHBondContact O-N 2.76Å; L53-L66 HydrophobicContact CB-CD1 4.4Å; L53-L66 HydrophobicContact CB-CD2 4.28Å; L53-L66 HydrophobicContact CB-CG 4.25Å; L53-C77 HydrophobicContact CD2-CB 3.79Å; L53-C77 WeakPolarHBondContact CD2-O 2.67Å; L53-F79 HydrophobicContact CD1-CD2 4.18Å; L53-F79 HydrophobicContact CD2-CB 4.21Å; L53-F79 HydrophobicContact CD2-CD2 4.23Å; L53-N117 HydrophobicContact CD1-CB 3.9Å; L53-V119 HydrophobicContact CD1-CG2 3.86Å
54	R	94.8	Very high	81.5	Confident	23 Å²	23	78.5 Å²	78.5	9%	0.087	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	124.3	173.6	-61.7	-60	-160.3	157.7	4	109.1	N52 H61 V106 H110 V118 V120	N52-R54 PolarHBondContact O-N 2.04Å; R54-H61 PolarHBondContact NH1-O 2.99Å; R54-V106 HydrophobicContact CB-CG1 3.77Å; R54-V106 HydrophobicContact CG-CG1 3.92Å; R54-V106 HydrophobicContact CG-CG2 4.17Å; R54-H110 PolarHBondContact O-CE1 2.84Å; R54-H110 PolarHBondContact O-NE2 2.89Å; R54-H110 VanDerWaalsContact O-NE2 3.17Å; R54-V118 HydrophobicContact CB-CB 4.49Å; R54-V118 PolarHBondContact N-O 3.49Å; R54-V120 HydrophobicContact CG-CG2 3.8Å
55	T	87.3	Confident	84.1	Confident	76 Å²	76	74.8 Å²	74.8	47%	0.466	38%	0.384	S	S	.	.			trans	-107.7	-9.9	-179.5	52.7	0	0	0	0	112.4	H61	T55-H61 PolarHBondContact OG1-CD2 3.34Å; T55-H61 PolarHBondContact OG1-NE2 2.91Å
56	S	85.7	Confident	86.1	Confident	40 Å²	40	69 Å²	69	28%	0.28	35%	0.349	S	S	.	.			trans	-133.2	154.1	-175.8	-176.7	0	0	0	0	111.5	D58	S56-D58 VanDerWaalsContact C-N 3.28Å; S56-D58 WeakPolarHBondContact OG-CB 3.11Å; S56-D58 PolarHBondContact OG-N 3.37Å; S56-D58 VanDerWaalsContact OG-N 3.1Å
57	K	81.1	Confident	87.5	Confident	100 Å²	100	63 Å²	63	44%	0.435	33%	0.329	S	S	.	.	S	Bend	trans	-77.9	-17.1	170.2	-59.9	-175.8	-174.9	-172.1	0	112.6	H110 T111	K57-H110 HydrophobicContact CD-CB 4.4Å; K57-H110 HydrophobicContact CG-CB 3.78Å; K57-T111 WeakPolarHBondContact CE-OG1 3.27Å; K57-T111 PolarHBondContact NZ-OG1 3.26Å
58	D	81.8	Confident	88.3	Confident	81 Å²	81	62.6 Å²	62.6	43%	0.433	32%	0.323	S	S	.	.			trans	-71.1	120.1	-179.9	-176.6	-3.5	0	0	0	110	S56 E60 H61	S56-D58 VanDerWaalsContact C-N 3.28Å; S56-D58 WeakPolarHBondContact OG-CB 3.11Å; S56-D58 PolarHBondContact OG-N 3.37Å; S56-D58 VanDerWaalsContact OG-N 3.1Å; D58-E60 PolarHBondContact O-N 3.35Å; D58-E60 PolarHBondContact OD1-N 3.26Å; D58-H61 HydrophobicContact CB-CB 4.13Å; D58-H61 PolarHBondContact O-N 2.97Å
59	P	77	Confident	88.3	Confident	60 Å²	60	61.3 Å²	61.3	39%	0.39	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-29.7	178.4	24.3	-34.7	0	0	0	113.8	H61 H103	P59-H61 VanDerWaalsContact C-N 3.33Å; P59-H103 HydrophobicContact CB-CB 3.95Å; P59-H103 WeakPolarHBondContact CB-ND1 3.46Å
60	E	78.8	Confident	87.9	Confident	161 Å²	161	65.9 Å²	65.9	75%	0.752	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-13.5	-177.1	-58.8	-57.7	132.7	0	0	112.5	D58 E62	D58-E60 PolarHBondContact O-N 3.35Å; D58-E60 PolarHBondContact OD1-N 3.26Å; E60-E62 PolarHBondContact O-N 2.8Å
61	H	82.8	Confident	87.3	Confident	88 Å²	88	62.6 Å²	62.6	41%	0.407	34%	0.336	S	S	.	.	S	Bend	trans	-70	119.6	177.7	-166.8	71.5	0	0	0	110.3	R54 T55 D58 P59 G63	R54-H61 PolarHBondContact NH1-O 2.99Å; T55-H61 PolarHBondContact OG1-CD2 3.34Å; T55-H61 PolarHBondContact OG1-NE2 2.91Å; D58-H61 HydrophobicContact CB-CB 4.13Å; D58-H61 PolarHBondContact O-N 2.97Å; P59-H61 VanDerWaalsContact C-N 3.33Å; H61-G63 PolarHBondContact O-N 3.42Å
62	E	78.3	Confident	86.7	Confident	172 Å²	172	69 Å²	69	80%	0.804	37%	0.366	S	S	*	.			trans	-61.3	119.7	169.6	-69.4	-169.9	166.6	0	0	108.7	E60	E60-E62 PolarHBondContact O-N 2.8Å
63	G	87	Confident	86.3	Confident	11 Å²	11	70.2 Å²	70.2	11%	0.113	37%	0.374	C	S	.	.			trans	-77	178.1	174	0	0	0	0	0	111.5	N52 L53 H61	N52-G63 WeakPolarHBondContact OD1-CA 3.46Å; L53-G63 WeakPolarHBondContact O-CA 3.13Å; H61-G63 PolarHBondContact O-N 3.42Å
64	C	92.1	Very high	85.8	Confident	41 Å²	41	70.4 Å²	70.4	28%	0.277	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	128.5	-174.3	-169	0	0	0	0	110.9	N52 L53 C77	N52-C64 PolarHBondContact OD1-N 2.7Å; L53-C64 WeakPolarHBondContact CB-O 3.26Å; L53-C64 PolarHBondContact N-O 3.21Å; L53-C64 PolarHBondContact O-N 2.76Å; C64-C77 VanDerWaalsContact C-SG 3.58Å; C64-C77 HydrophobicContact CB-CB 3.57Å; C64-C77 WeakPolarHBondContact CB-SG 3.37Å; C64-C77 WeakPolarHBondContact SG-CA 3.2Å; C64-C77 WeakPolarHBondContact SG-CB 3.39Å; C64-C77 CovalentContact SG-SG 2.01Å; C64-C77 PolarHBondContact SG-SG 3.05Å
65	Y	93.5	Very high	85.5	Confident	102 Å²	102	76.3 Å²	76.3	40%	0.4	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	121.4	-173.8	-71.2	-86.5	0	0	0	112.3	R50 F51 N52	R50-Y65 HydrophobicContact CB-CD1 4.01Å; R50-Y65 HydrophobicContact CB-CE1 4.05Å; F51-Y65 CarbonylContact O-C 3.55Å; F51-Y65 WeakPolarHBondContact O-CA 3.07Å; N52-Y65 HydrophobicContact CB-CD1 4.04Å; N52-Y65 HydrophobicContact CB-CE1 3.82Å
66	L	92.9	Very high	85.6	Confident	8 Å²	8	78.9 Å²	78.9	4%	0.042	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	136	174.6	-51.7	-179.9	0	0	0	110.3	F51 L53 L74 C77 F79 V119 M148	F51-L66 HydrophobicContact CB-CB 4.04Å; F51-L66 PolarHBondContact O-N 3.31Å; L53-L66 HydrophobicContact CB-CD1 4.4Å; L53-L66 HydrophobicContact CB-CD2 4.28Å; L53-L66 HydrophobicContact CB-CG 4.25Å; L66-L74 HydrophobicContact CD1-CD1 4.25Å; L66-L74 HydrophobicContact CD2-CD1 3.87Å; L66-C77 HydrophobicContact CD2-CB 3.84Å; L66-F79 HydrophobicContact CD1-CD2 4.1Å; L66-F79 HydrophobicContact CD1-CE2 4.37Å; L66-V119 HydrophobicContact CD1-CG2 4.21Å; L66-M148 HydrophobicContact CB-CE 4.09Å
67	S	89.3	Confident	85.8	Confident	54 Å²	54	77.4 Å²	77.4	38%	0.378	41%	0.405	S	S	.	.			trans	-116.7	124.8	178.1	-66.8	0	0	0	0	110.6	G69 H70	S67-G69 PolarHBondContact O-N 3.06Å; S67-H70 PolarHBondContact O-N 2.81Å
68	L	87.6	Confident	86.3	Confident	65 Å²	65	75.4 Å²	75.4	34%	0.34	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	135.7	178	-172.3	145.2	0	0	0	110.5	H70 R147 M148 W151	L68-H70 VanDerWaalsContact C-N 3.26Å; L68-H70 PolarHBondContact O-N 2.62Å; L68-H70 PolarHBondContact O-ND1 3.4Å; L68-R147 HydrophobicContact CD1-CB 3.78Å; L68-M148 HydrophobicContact CB-CE 4.33Å; L68-W151 HydrophobicContact CG-CB 4.39Å; L68-W151 HydrophobicContact CG-CG 4.5Å
69	G	85.1	Confident	86.9	Confident	46 Å²	46	72.4 Å²	72.4	47%	0.474	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.8	-3.3	178.4	0	0	0	0	0	115.4	S67	S67-G69 PolarHBondContact O-N 3.06Å
70	H	85.4	Confident	87.8	Confident	116 Å²	116	72.6 Å²	72.6	54%	0.537	39%	0.393	S	S	.	.			trans	-117.6	110.6	-176.4	-61	80.2	0	0	0	110.2	S67 L68 P73 W151	S67-H70 PolarHBondContact O-N 2.81Å; L68-H70 VanDerWaalsContact C-N 3.26Å; L68-H70 PolarHBondContact O-N 2.62Å; L68-H70 PolarHBondContact O-ND1 3.4Å; H70-P73 HydrophobicContact CB-CG 4.08Å; H70-W151 WeakPolarHBondContact O-CH2 3.45Å
71	S	83.9	Confident	88.5	Confident	47 Å²	47	66.9 Å²	66.9	33%	0.329	37%	0.367	S	S	.	.	H	α-helix	trans	-70.9	-33	-179.2	-51.8	0	0	0	0	113.1	L74 E75 K155	S71-L74 VanDerWaalsContact O-CB 3.31Å; S71-L74 WeakPolarHBondContact O-CB 3.3Å; S71-L74 PolarHBondContact O-N 3Å; S71-E75 PolarHBondContact O-N 2.83Å; S71-E75 VanDerWaalsContact O-N 3.09Å; S71-K155 PolarHBondContact OG-NZ 3.11Å
72	Q	84.9	Confident	89.1	Confident	148 Å²	148	66.8 Å²	66.8	69%	0.692	37%	0.373	S	S	*	.	H	α-helix	trans	-56.2	-54.2	-178	-82.6	174.3	-23.3	0	0	112.8	L74 E75 D76	Q72-L74 PolarHBondContact O-N 2.84Å; Q72-L74 VanDerWaalsContact O-N 3.15Å; Q72-E75 PolarHBondContact O-N 2.84Å; Q72-E75 VanDerWaalsContact O-N 3.12Å; Q72-D76 WeakPolarHBondContact O-CB 3.46Å; Q72-D76 PolarHBondContact O-N 2.84Å
73	P	85.7	Confident	89.9	Confident	32 Å²	32	59.1 Å²	59.1	21%	0.208	34%	0.339	C	S	.	.	H	α-helix	trans	-56.5	-32.5	174.8	-28.2	35.4	0	0	0	114.1	H70 C77	H70-P73 HydrophobicContact CB-CG 4.08Å; P73-C77 WeakPolarHBondContact O-CB 3.4Å; P73-C77 PolarHBondContact O-N 2.94Å; P73-C77 PolarHBondContact O-SG 3.4Å
74	L	87.4	Confident	90.4	Very high	8 Å²	8	61.5 Å²	61.5	4%	0.042	35%	0.346	C	S	.	.	H	α-helix	trans	-68	-42.1	179.3	-168	68.1	0	0	0	111.7	L66 S71 Q72 G78 F79 M81 W151 L152	L66-L74 HydrophobicContact CD1-CD1 4.25Å; L66-L74 HydrophobicContact CD2-CD1 3.87Å; S71-L74 VanDerWaalsContact O-CB 3.31Å; S71-L74 WeakPolarHBondContact O-CB 3.3Å; S71-L74 PolarHBondContact O-N 3Å; Q72-L74 PolarHBondContact O-N 2.84Å; Q72-L74 VanDerWaalsContact O-N 3.15Å; L74-G78 PolarHBondContact O-N 2.85Å; L74-F79 HydrophobicContact CD1-CB 3.48Å; L74-F79 VanDerWaalsContact CD1-CB 3.48Å; L74-F79 HydrophobicContact CD1-CD1 3.86Å; L74-F79 HydrophobicContact CD1-CD2 3.98Å; L74-F79 HydrophobicContact CD1-CG 3.5Å; L74-F79 HydrophobicContact CG-CB 3.88Å; L74-F79 HydrophobicContact CG-CD1 4.35Å; L74-F79 HydrophobicContact CG-CG 4.24Å; L74-F79 WeakPolarHBondContact O-CB 3.24Å; L74-F79 PolarHBondContact O-N 3.4Å; L74-F79 VanDerWaalsContact O-N 3.13Å; L74-M81 HydrophobicContact CD2-CE 3.25Å; L74-M81 HydrophobicContact CD2-SD 4.35Å; L74-M81 HydrophobicContact CG-CE 4.33Å; L74-W151 HydrophobicContact CB-CH2 4.19Å; L74-W151 HydrophobicContact CD1-CZ3 4.41Å; L74-W151 HydrophobicContact CD2-CH2 3.79Å; L74-W151 HydrophobicContact CD2-CZ3 4.04Å; L74-W151 HydrophobicContact CG-CH2 4.45Å; L74-L152 HydrophobicContact CD1-CD2 4Å; L74-L152 HydrophobicContact CD2-CD2 3.91Å
75	E	87.4	Confident	90.7	Very high	146 Å²	146	59.6 Å²	59.6	68%	0.682	33%	0.333	S	S	*	.	H	α-helix	trans	-70.1	-46.5	175.6	-69.1	171.9	-157.2	0	0	111.6	S71 Q72 C77 G78	S71-E75 PolarHBondContact O-N 2.83Å; S71-E75 VanDerWaalsContact O-N 3.09Å; Q72-E75 PolarHBondContact O-N 2.84Å; Q72-E75 VanDerWaalsContact O-N 3.12Å; E75-C77 VanDerWaalsContact C-N 3.27Å; E75-C77 PolarHBondContact O-N 2.81Å; E75-G78 WeakPolarHBondContact O-CA 3.32Å; E75-G78 PolarHBondContact O-N 3.22Å
76	D	89.1	Confident	91	Very high	130 Å²	130	54.7 Å²	54.7	70%	0.695	31%	0.314	S	S	*	.	H	α-helix	trans	-61.2	-36.7	179.3	-67.4	-25	0	0	0	111.7	Q72 G78	Q72-D76 WeakPolarHBondContact O-CB 3.46Å; Q72-D76 PolarHBondContact O-N 2.84Å; D76-G78 PolarHBondContact O-N 3.26Å
77	C	91.2	Very high	91.2	Very high	10 Å²	10	54.3 Å²	54.3	7%	0.068	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-9.5	175	-64.4	0	0	0	0	113.3	L53 C64 L66 P73 E75	L53-C77 HydrophobicContact CD2-CB 3.79Å; L53-C77 WeakPolarHBondContact CD2-O 2.67Å; C64-C77 VanDerWaalsContact C-SG 3.58Å; C64-C77 HydrophobicContact CB-CB 3.57Å; C64-C77 WeakPolarHBondContact CB-SG 3.37Å; C64-C77 WeakPolarHBondContact SG-CA 3.2Å; C64-C77 WeakPolarHBondContact SG-CB 3.39Å; C64-C77 CovalentContact SG-SG 2.01Å; C64-C77 PolarHBondContact SG-SG 3.05Å; L66-C77 HydrophobicContact CD2-CB 3.84Å; P73-C77 WeakPolarHBondContact O-CB 3.4Å; P73-C77 PolarHBondContact O-N 2.94Å; P73-C77 PolarHBondContact O-SG 3.4Å; E75-C77 VanDerWaalsContact C-N 3.27Å; E75-C77 PolarHBondContact O-N 2.81Å
78	G	91.9	Very high	91.7	Very high	58 Å²	58	51.8 Å²	51.8	60%	0.598	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.6	32.4	-179.7	0	0	0	0	0	113.9	L74 E75 D76 N80	L74-G78 PolarHBondContact O-N 2.85Å; E75-G78 WeakPolarHBondContact O-CA 3.32Å; E75-G78 PolarHBondContact O-N 3.22Å; D76-G78 PolarHBondContact O-N 3.26Å; G78-N80 PolarHBondContact O-N 2.74Å
79	F	94.5	Very high	92.2	Very high	18 Å²	18	48.7 Å²	48.7	8%	0.079	28%	0.278	C	S	.	.			trans	-66.4	127.5	179.4	-172.5	-85	0	0	0	111.3	L53 L66 L74 M81 T85 N117 V119 L152 F158	L53-F79 HydrophobicContact CD1-CD2 4.18Å; L53-F79 HydrophobicContact CD2-CB 4.21Å; L53-F79 HydrophobicContact CD2-CD2 4.23Å; L66-F79 HydrophobicContact CD1-CD2 4.1Å; L66-F79 HydrophobicContact CD1-CE2 4.37Å; L74-F79 HydrophobicContact CD1-CB 3.48Å; L74-F79 VanDerWaalsContact CD1-CB 3.48Å; L74-F79 HydrophobicContact CD1-CD1 3.86Å; L74-F79 HydrophobicContact CD1-CD2 3.98Å; L74-F79 HydrophobicContact CD1-CG 3.5Å; L74-F79 HydrophobicContact CG-CB 3.88Å; L74-F79 HydrophobicContact CG-CD1 4.35Å; L74-F79 HydrophobicContact CG-CG 4.24Å; L74-F79 WeakPolarHBondContact O-CB 3.24Å; L74-F79 PolarHBondContact O-N 3.4Å; L74-F79 VanDerWaalsContact O-N 3.13Å; F79-M81 HydrophobicContact CD1-SD 3.89Å; F79-M81 HydrophobicContact CE1-SD 3.89Å; F79-T85 HydrophobicContact CE2-CG2 4.01Å; F79-T85 HydrophobicContact CZ-CG2 3.93Å; F79-N117 HydrophobicContact CD2-CB 4Å; F79-N117 HydrophobicContact CE2-CB 3.65Å; F79-N117 HydrophobicContact CZ-CB 4.21Å; F79-N117 WeakPolarHBondContact CZ-ND2 3.21Å; F79-V119 HydrophobicContact CE2-CG2 4.29Å; F79-L152 HydrophobicContact CE1-CD2 4.33Å; F79-L152 HydrophobicContact CZ-CD1 4.27Å; F79-F158 HydrophobicContact CE1-CD2 4.21Å; F79-F158 HydrophobicContact CE1-CE2 4.18Å; F79-F158 HydrophobicContact CZ-CE2 4.05Å
80	N	94.4	Very high	92.8	Very high	63 Å²	63	46.9 Å²	46.9	34%	0.337	26%	0.257	S	S	.	.			trans	-95.2	108.1	-179.4	-176.5	-15.2	0	0	0	111.4	G78 T82 A83 N117	G78-N80 PolarHBondContact O-N 2.74Å; N80-T82 VanDerWaalsContact C-N 3.27Å; N80-T82 PolarHBondContact O-N 2.69Å; N80-T82 PolarHBondContact OD1-N 2.9Å; N80-T82 VanDerWaalsContact OD1-N 3.11Å; N80-T82 PolarHBondContact OD1-OG1 2.83Å; N80-A83 HydrophobicContact CB-CB 3.8Å; N80-A83 PolarHBondContact O-N 2.83Å; N80-A83 PolarHBondContact OD1-N 2.87Å; N80-N117 PolarHBondContact N-OD1 2.8Å; N80-N117 PolarHBondContact O-ND2 2.93Å
81	M	93.9	Very high	93.3	Very high	41 Å²	41	41.4 Å²	41.4	20%	0.202	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-33.4	-177.1	-66.4	-60.3	-164.5	0	0	114.4	L74 F79 K155 D157 F158	L74-M81 HydrophobicContact CD2-CE 3.25Å; L74-M81 HydrophobicContact CD2-SD 4.35Å; L74-M81 HydrophobicContact CG-CE 4.33Å; F79-M81 HydrophobicContact CD1-SD 3.89Å; F79-M81 HydrophobicContact CE1-SD 3.89Å; M81-K155 HydrophobicContact CE-CB 3.58Å; M81-K155 HydrophobicContact CE-CG 3.68Å; M81-K155 HydrophobicContact SD-CB 4.3Å; M81-D157 HydrophobicContact CB-CB 4.39Å; M81-F158 HydrophobicContact SD-CB 4.29Å; M81-F158 HydrophobicContact SD-CD2 4.41Å
82	T	94.8	Very high	93.8	Very high	86 Å²	86	43 Å²	43	53%	0.528	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-17.4	-176.7	63.4	0	0	0	0	113.1	N80 D157	N80-T82 VanDerWaalsContact C-N 3.27Å; N80-T82 PolarHBondContact O-N 2.69Å; N80-T82 PolarHBondContact OD1-N 2.9Å; N80-T82 VanDerWaalsContact OD1-N 3.11Å; N80-T82 PolarHBondContact OD1-OG1 2.83Å; T82-D157 HydrophobicContact CG2-CB 3.87Å
83	A	96.1	Very high	94	Very high	11 Å²	11	36.2 Å²	36.2	9%	0.091	20%	0.2	C	C	.	.	S	Bend	trans	-81.6	157.7	-174	0	0	0	0	0	112.7	N80 T85 D115	N80-A83 HydrophobicContact CB-CB 3.8Å; N80-A83 PolarHBondContact O-N 2.83Å; N80-A83 PolarHBondContact OD1-N 2.87Å; A83-T85 PolarHBondContact O-N 3.01Å; A83-T85 PolarHBondContact O-OG1 2.75Å; A83-D115 WeakPolarHBondContact CB-O 3.22Å
84	K	97.4	Very high	93.8	Very high	62 Å²	62	39.8 Å²	39.8	27%	0.27	22%	0.215	S	C	.	.			trans	-58.3	135	169.3	-168.8	173.1	-179.4	177.9	0	109.9	F86 A116 N117 N162 Y321	K84-F86 HydrophobicContact CD-CE1 4.16Å; K84-F86 HydrophobicContact CD-CE2 3.98Å; K84-F86 HydrophobicContact CD-CZ 3.52Å; K84-F86 VanDerWaalsContact CE-CE1 3.5Å; K84-F86 HydrophobicContact CG-CE2 4.09Å; K84-F86 HydrophobicContact CG-CZ 4.04Å; K84-A116 HydrophobicContact CB-CB 4.35Å; K84-A116 CarbonylContact O-C 3.51Å; K84-A116 WeakPolarHBondContact O-CA 3.47Å; K84-A116 VanDerWaalsContact O-CB 3.23Å; K84-A116 WeakPolarHBondContact O-CB 3.47Å; K84-N117 PolarHBondContact O-N 2.62Å; K84-N162 WeakPolarHBondContact CG-O 3.38Å; K84-Y321 PolarHBondContact NZ-OH 3.24Å
85	T	98.4	Very high	93.7	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	120.1	-178.1	-60.7	0	0	0	0	110.5	F79 A83 F87 N117 V119 N162 V163 H164	F79-T85 HydrophobicContact CE2-CG2 4.01Å; F79-T85 HydrophobicContact CZ-CG2 3.93Å; A83-T85 PolarHBondContact O-N 3.01Å; A83-T85 PolarHBondContact O-OG1 2.75Å; T85-F87 HydrophobicContact CG2-CD2 3.91Å; T85-F87 HydrophobicContact CG2-CE2 3.4Å; T85-F87 HydrophobicContact CG2-CZ 4.11Å; T85-N117 WeakPolarHBondContact CA-O 3.25Å; T85-N117 HydrophobicContact CG2-CB 3.96Å; T85-N117 PolarHBondContact OG1-ND2 3.3Å; T85-V119 HydrophobicContact CG2-CG2 4.33Å; T85-N162 PolarHBondContact N-O 3.46Å; T85-V163 WeakPolarHBondContact O-CA 3.13Å; T85-H164 PolarHBondContact O-N 3.49Å
86	F	98.8	Very high	93.6	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	127.6	175.2	-62.4	-80.8	0	0	0	110.3	K84 L109 E113 A116 N117 V118 V119 H164 I166 Y321	K84-F86 HydrophobicContact CD-CE1 4.16Å; K84-F86 HydrophobicContact CD-CE2 3.98Å; K84-F86 HydrophobicContact CD-CZ 3.52Å; K84-F86 VanDerWaalsContact CE-CE1 3.5Å; K84-F86 HydrophobicContact CG-CE2 4.09Å; K84-F86 HydrophobicContact CG-CZ 4.04Å; F86-L109 HydrophobicContact CB-CD1 4.19Å; F86-L109 HydrophobicContact CD1-CD1 4.49Å; F86-L109 HydrophobicContact CD1-CD2 3.92Å; F86-L109 HydrophobicContact CD2-CD2 4.17Å; F86-L109 HydrophobicContact CE1-CD2 3.83Å; F86-L109 HydrophobicContact CE2-CD2 4.08Å; F86-L109 HydrophobicContact CG-CD1 4.2Å; F86-L109 HydrophobicContact CG-CD2 4.08Å; F86-L109 HydrophobicContact CZ-CD2 3.89Å; F86-E113 HydrophobicContact CE2-CB 4.05Å; F86-E113 HydrophobicContact CE2-CG 3.88Å; F86-E113 HydrophobicContact CZ-CG 3.94Å; F86-A116 HydrophobicContact CD2-CB 3.87Å; F86-A116 HydrophobicContact CE2-CB 3.62Å; F86-N117 PolarHBondContact N-O 2.77Å; F86-V118 HydrophobicContact CD2-CG2 4.33Å; F86-V119 PolarHBondContact O-N 2.93Å; F86-H164 WeakPolarHBondContact CA-O 3.48Å; F86-H164 HydrophobicContact CD1-CB 3.69Å; F86-H164 AromaticContact CD1-CG 3.92Å; F86-H164 AromaticContact CD1-ND1 3.87Å; F86-H164 HydrophobicContact CE1-CB 3.85Å; F86-H164 AromaticContact CE1-CG 3.91Å; F86-H164 AromaticContact CE1-ND1 3.43Å; F86-H164 WeakPolarHBondContact CE1-ND1 3.43Å; F86-I166 HydrophobicContact CD1-CD1 3.85Å; F86-Y321 AromaticContact CE1-CE2 3.81Å; F86-Y321 HydrophobicContact CE1-CE2 3.81Å; F86-Y321 AromaticContact CZ-CE2 3.75Å; F86-Y321 HydrophobicContact CZ-CE2 3.75Å
87	F	98.8	Very high	93.6	Very high	0 Å²	0	36 Å²	36	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	113.3	166.5	-72.1	-100.1	0	0	0	109	F51 T85 V119 V121 L149 L152 V163 H164 L165 I166	F51-F87 HydrophobicContact CD1-CD1 4.41Å; F51-F87 HydrophobicContact CD1-CE1 4.02Å; F51-F87 HydrophobicContact CE1-CE1 4.36Å; T85-F87 HydrophobicContact CG2-CD2 3.91Å; T85-F87 HydrophobicContact CG2-CE2 3.4Å; T85-F87 HydrophobicContact CG2-CZ 4.11Å; F87-V119 CarbonylContact C-O 3.51Å; F87-V119 VanDerWaalsContact CA-O 3.3Å; F87-V119 WeakPolarHBondContact CA-O 2.92Å; F87-V119 HydrophobicContact CD1-CB 3.83Å; F87-V119 HydrophobicContact CD1-CG1 3.8Å; F87-V119 HydrophobicContact CE1-CB 3.93Å; F87-V119 HydrophobicContact CE1-CG1 3.74Å; F87-V119 HydrophobicContact CE1-CG2 4.25Å; F87-V119 HydrophobicContact CG-CB 4.32Å; F87-V119 HydrophobicContact CZ-CB 4.49Å; F87-V119 HydrophobicContact CZ-CG2 4.39Å; F87-V121 HydrophobicContact CB-CG2 4.27Å; F87-V121 HydrophobicContact CD1-CG2 3.81Å; F87-L149 HydrophobicContact CD2-CD2 4.33Å; F87-L149 HydrophobicContact CE2-CD2 3.55Å; F87-L149 HydrophobicContact CZ-CD2 3.82Å; F87-L152 HydrophobicContact CZ-CD1 4.26Å; F87-V163 HydrophobicContact CD2-CG1 4.11Å; F87-V163 HydrophobicContact CE2-CG1 4.32Å; F87-H164 PolarHBondContact N-O 3.4Å; F87-L165 HydrophobicContact CB-CD2 3.63Å; F87-L165 HydrophobicContact CD2-CD2 3.81Å; F87-L165 HydrophobicContact CG-CD2 3.93Å; F87-I166 PolarHBondContact O-N 2.93Å
88	I	98.8	Very high	93.6	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	121.5	174.7	-55.4	171.4	0	0	0	108.2	W101 L105 V106 L109 V118 V119 V120 V121 I166	I88-W101 HydrophobicContact CG2-CH2 4.32Å; I88-W101 HydrophobicContact CG2-CZ3 3.97Å; I88-L105 HydrophobicContact CD1-CD2 4.08Å; I88-L105 HydrophobicContact CD1-CG 4Å; I88-L105 HydrophobicContact CG1-CD2 4.17Å; I88-L105 HydrophobicContact CG2-CD2 3.86Å; I88-V106 HydrophobicContact CD1-CG2 3.51Å; I88-L109 HydrophobicContact CD1-CD1 3.84Å; I88-L109 HydrophobicContact CG1-CD1 4.14Å; I88-V118 HydrophobicContact CD1-CG1 3.74Å; I88-V118 HydrophobicContact CG1-CG1 4.42Å; I88-V119 PolarHBondContact N-O 3.36Å; I88-V120 HydrophobicContact CD1-CG2 4.49Å; I88-V121 PolarHBondContact O-N 3.48Å; I88-I166 WeakPolarHBondContact CA-O 3.29Å
89	I	98.8	Very high	93.4	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	109.6	-174.1	-51.9	159.5	0	0	0	108.1	V121 I145 L165 I166 G167 Y168 V174 A175	I89-V121 HydrophobicContact CG1-CB 4.13Å; I89-V121 HydrophobicContact CG1-CG2 3.87Å; I89-I145 HydrophobicContact CD1-CD1 3.67Å; I89-I145 HydrophobicContact CG1-CD1 3.98Å; I89-L165 HydrophobicContact CD1-CB 4.31Å; I89-I166 PolarHBondContact N-O 2.78Å; I89-G167 WeakPolarHBondContact O-CA 3.25Å; I89-Y168 PolarHBondContact O-N 3.06Å; I89-V174 HydrophobicContact CD1-CG1 4.45Å; I89-V174 HydrophobicContact CG2-CB 3.87Å; I89-V174 HydrophobicContact CG2-CG1 3.65Å; I89-V174 HydrophobicContact CG2-CG2 4.48Å; I89-A175 HydrophobicContact CD1-CB 3.76Å
90	H	97.9	Very high	93.1	Very high	8 Å²	8	40.3 Å²	40.3	4%	0.037	22%	0.216	C	C	.	.			trans	-73	170.1	-180	69.3	84.4	0	0	0	112.5	F98 W101 L102 V121 W123 G171	H90-F98 AromaticContact CD2-CE1 3.5Å; H90-F98 VanDerWaalsContact CD2-CE1 3.5Å; H90-F98 WeakPolarHBondContact CD2-CE1 3.36Å; H90-F98 AromaticContact NE2-CE1 3.74Å; H90-W101 HydrophobicContact CB-CH2 3.99Å; H90-W101 HydrophobicContact CB-CZ2 3.91Å; H90-L102 HydrophobicContact CB-CD1 4.41Å; H90-V121 PolarHBondContact CD2-O 3.44Å; H90-W123 AromaticContact CD2-CD1 3.63Å; H90-W123 AromaticContact CD2-NE1 3.71Å; H90-W123 AromaticContact CE1-CD1 3.41Å; H90-W123 VanDerWaalsContact CE1-CD1 3.41Å; H90-W123 AromaticContact CE1-CE2 3.76Å; H90-W123 AromaticContact CE1-CG 3.84Å; H90-W123 AromaticContact CE1-NE1 3.33Å; H90-W123 PolarHBondContact CE1-NE1 3.01Å; H90-W123 VanDerWaalsContact CE1-NE1 3.33Å; H90-W123 AromaticContact CG-NE1 3.74Å; H90-W123 AromaticContact ND1-CD1 3.99Å; H90-W123 AromaticContact ND1-CE2 3.96Å; H90-W123 AromaticContact ND1-NE1 3.5Å; H90-W123 PolarHBondContact ND1-NE1 2.69Å; H90-W123 AromaticContact NE2-CD1 3.15Å; H90-W123 AromaticContact NE2-CG 3.78Å; H90-W123 PolarHBondContact NE2-N 2.95Å; H90-W123 VanDerWaalsContact NE2-N 3.18Å; H90-W123 AromaticContact NE2-NE1 3.49Å; H90-W123 PolarHBondContact NE2-NE1 3.37Å; H90-W123 VanDerWaalsContact O-CZ2 3.26Å; H90-W123 WeakPolarHBondContact O-CZ2 3.36Å; H90-W123 PolarHBondContact O-NE1 3.45Å; H90-G171 VanDerWaalsContact O-CA 3.3Å; H90-G171 WeakPolarHBondContact O-CA 3.1Å; H90-G171 PolarHBondContact O-N 2.83Å
91	G	95.8	Very high	93	Very high	2 Å²	2	37.5 Å²	37.5	2%	0.021	20%	0.2	C	C	.	.			trans	-97.1	-161	-179.5	0	0	0	0	0	114.6	Y168	G91-Y168 VanDerWaalsContact CA-O 3.3Å; G91-Y168 WeakPolarHBondContact CA-O 3.36Å; G91-Y168 PolarHBondContact N-O 3Å
92	W	94.4	Very high	93.1	Very high	81 Å²	81	35.6 Å²	35.6	31%	0.307	19%	0.191	S	C	.	.			trans	-63.4	144.5	170.5	-177	68.5	0	0	0	111.1	M94 Q129 Y131 L170	W92-M94 HydrophobicContact CE3-CG 4.3Å; W92-M94 HydrophobicContact CH2-CG 3.07Å; W92-M94 HydrophobicContact CH2-SD 3.55Å; W92-M94 VanDerWaalsContact CH2-SD 3.55Å; W92-M94 HydrophobicContact CZ2-CG 3.63Å; W92-M94 HydrophobicContact CZ3-CG 3.45Å; W92-M94 VanDerWaalsContact CZ3-CG 3.45Å; W92-M94 HydrophobicContact CZ3-SD 3.91Å; W92-Q129 PolarHBondContact NE1-O 2.89Å; W92-Y131 HydrophobicContact CD2-CD2 4.21Å; W92-Y131 HydrophobicContact CG-CD2 4.14Å; W92-L170 HydrophobicContact CB-CD1 3.7Å; W92-L170 HydrophobicContact CB-CG 4.13Å; W92-L170 HydrophobicContact CG-CD1 4.42Å
93	T	87.9	Confident	93	Very high	5 Å²	5	33.7 Å²	33.7	3%	0.031	18%	0.176	C	C	.	.			trans	-141.1	136.1	177.7	177.7	0	0	0	0	111.9	S95 G96 L124 A127 H128	T93-S95 PolarHBondContact OG1-N 3.3Å; T93-S95 PolarHBondContact OG1-OG 2.92Å; T93-G96 PolarHBondContact OG1-N 3.24Å; T93-L124 HydrophobicContact CG2-CD2 3.71Å; T93-A127 HydrophobicContact CG2-CB 4.28Å; T93-H128 HydrophobicContact CG2-CB 4.15Å; T93-H128 WeakPolarHBondContact O-CA 3.28Å; T93-H128 PolarHBondContact O-ND1 2.92Å
94	M	81.7	Confident	93	Very high	107 Å²	107	37.9 Å²	37.9	53%	0.527	19%	0.192	S	C	.	.	S	Bend	trans	-86.4	-19.1	172.9	-67.3	-175.8	70.5	0	0	113.4	W92 H128 T267	W92-M94 HydrophobicContact CE3-CG 4.3Å; W92-M94 HydrophobicContact CH2-CG 3.07Å; W92-M94 HydrophobicContact CH2-SD 3.55Å; W92-M94 VanDerWaalsContact CH2-SD 3.55Å; W92-M94 HydrophobicContact CZ2-CG 3.63Å; W92-M94 HydrophobicContact CZ3-CG 3.45Å; W92-M94 VanDerWaalsContact CZ3-CG 3.45Å; W92-M94 HydrophobicContact CZ3-SD 3.91Å; M94-H128 VanDerWaalsContact C-CE1 3.46Å; M94-H128 PolarHBondContact O-CE1 3.43Å; M94-H128 PolarHBondContact O-ND1 2.74Å; M94-T267 HydrophobicContact SD-CG2 3.79Å
95	S	84.8	Confident	93	Very high	66 Å²	66	34.9 Å²	34.9	46%	0.462	18%	0.179	S	C	.	.	S	Bend	trans	-96.6	-13.7	-175.1	55.8	0	0	0	0	113	T93 I97	T93-S95 PolarHBondContact OG1-N 3.3Å; T93-S95 PolarHBondContact OG1-OG 2.92Å; S95-I97 PolarHBondContact O-N 3.03Å; S95-I97 VanDerWaalsContact OG-CG1 3.25Å; S95-I97 WeakPolarHBondContact OG-CG1 3.45Å
96	G	86.9	Confident	92.9	Very high	25 Å²	25	35.2 Å²	35.2	26%	0.258	18%	0.181	S	C	.	.	S	Bend	trans	69.6	11.1	-176.4	0	0	0	0	0	114.1	T93	T93-G96 PolarHBondContact OG1-N 3.24Å
97	I	88.8	Confident	92.8	Very high	112 Å²	112	37.1 Å²	37.1	57%	0.574	19%	0.194	S	C	*	.	S	Bend	trans	-121.4	159.9	176.9	60.8	169.1	0	0	0	110.7	S95	S95-I97 PolarHBondContact O-N 3.03Å; S95-I97 VanDerWaalsContact OG-CG1 3.25Å; S95-I97 WeakPolarHBondContact OG-CG1 3.45Å
98	F	90.3	Very high	92.7	Very high	48 Å²	48	37.3 Å²	37.3	21%	0.211	20%	0.196	C	C	.	.			trans	-67.4	142.8	173.8	-65	-54.9	0	0	0	111.7	H90 L102 V120 D122 L124	H90-F98 AromaticContact CD2-CE1 3.5Å; H90-F98 VanDerWaalsContact CD2-CE1 3.5Å; H90-F98 WeakPolarHBondContact CD2-CE1 3.36Å; H90-F98 AromaticContact NE2-CE1 3.74Å; F98-L102 HydrophobicContact CB-CD1 4.37Å; F98-L102 HydrophobicContact CD1-CD1 3.63Å; F98-L102 HydrophobicContact CE1-CD1 4.14Å; F98-L102 HydrophobicContact CG-CD1 4.08Å; F98-V120 HydrophobicContact CE1-CG1 4.34Å; F98-V120 HydrophobicContact CZ-CG1 4.21Å; F98-D122 HydrophobicContact CZ-CB 3.8Å; F98-L124 HydrophobicContact CD1-CD1 3.97Å; F98-L124 HydrophobicContact CD1-CD2 4.07Å; F98-L124 HydrophobicContact CD1-CG 4.14Å; F98-L124 HydrophobicContact CD2-CD1 4.14Å; F98-L124 HydrophobicContact CE1-CD1 3.67Å; F98-L124 HydrophobicContact CE1-CD2 4.1Å; F98-L124 HydrophobicContact CE1-CG 3.72Å; F98-L124 HydrophobicContact CE2-CD1 3.86Å; F98-L124 HydrophobicContact CG-CD1 4.18Å; F98-L124 HydrophobicContact CZ-CD1 3.62Å; F98-L124 HydrophobicContact CZ-CG 4.06Å
99	E	87.6	Confident	92.6	Very high	27 Å²	27	37.3 Å²	37.3	13%	0.126	20%	0.196	C	C	.	.			trans	-85	151.1	175.4	-66.8	174.1	143.6	0	0	110.8	W101 L102 K271	E99-W101 VanDerWaalsContact CB-CD1 3.4Å; E99-W101 HydrophobicContact CB-CG 4.34Å; E99-W101 VanDerWaalsContact CB-NE1 3.32Å; E99-W101 PolarHBondContact O-N 3.22Å; E99-W101 VanDerWaalsContact O-N 3.1Å; E99-W101 PolarHBondContact OE2-NE1 2.95Å; E99-L102 WeakPolarHBondContact O-CB 3.27Å; E99-L102 PolarHBondContact O-N 3.15Å; E99-K271 WeakPolarHBondContact OE1-CE 3.45Å; E99-K271 IonicContact OE1-NZ 2.71Å; E99-K271 PolarHBondContact OE1-NZ 2.63Å
100	N	89.6	Confident	92.4	Very high	103 Å²	103	38.2 Å²	38.2	55%	0.551	20%	0.2	S	C	*	.	H	α-helix	trans	-59.9	-27.1	-173.6	-173.9	31	0	0	0	113.7	L102 H103 K104	N100-L102 PolarHBondContact O-N 3.33Å; N100-H103 PolarHBondContact O-N 3.36Å; N100-K104 WeakPolarHBondContact ND2-CE 3.32Å; N100-K104 PolarHBondContact ND2-NZ 3.5Å; N100-K104 PolarHBondContact O-N 3.36Å
101	W	92.6	Very high	92.3	Very high	4 Å²	4	41 Å²	41	2%	0.015	22%	0.218	C	C	.	.	H	α-helix	trans	-58.4	-29.9	177.2	68.4	-107.9	0	0	0	112.5	I88 H90 E99 K104 L105 Y168 V278	I88-W101 HydrophobicContact CG2-CH2 4.32Å; I88-W101 HydrophobicContact CG2-CZ3 3.97Å; H90-W101 HydrophobicContact CB-CH2 3.99Å; H90-W101 HydrophobicContact CB-CZ2 3.91Å; E99-W101 VanDerWaalsContact CB-CD1 3.4Å; E99-W101 HydrophobicContact CB-CG 4.34Å; E99-W101 VanDerWaalsContact CB-NE1 3.32Å; E99-W101 PolarHBondContact O-N 3.22Å; E99-W101 VanDerWaalsContact O-N 3.1Å; E99-W101 PolarHBondContact OE2-NE1 2.95Å; W101-K104 PolarHBondContact O-N 2.75Å; W101-L105 HydrophobicContact CZ3-CD2 4.19Å; W101-L105 PolarHBondContact O-N 3.46Å; W101-Y168 AromaticContact CE2-CD1 3.68Å; W101-Y168 AromaticContact CE2-CE1 3.98Å; W101-Y168 HydrophobicContact CH2-CD1 4.15Å; W101-Y168 HydrophobicContact CH2-CG 4.4Å; W101-Y168 AromaticContact CZ2-CD1 3.39Å; W101-Y168 HydrophobicContact CZ2-CD1 3.39Å; W101-Y168 HydrophobicContact CZ2-CE1 4.1Å; W101-Y168 HydrophobicContact CZ2-CG 4.05Å; W101-Y168 AromaticContact NE1-CD1 3.83Å; W101-Y168 AromaticContact NE1-CE1 3.62Å; W101-V278 HydrophobicContact CB-CB 4.41Å; W101-V278 HydrophobicContact CB-CG1 3.96Å; W101-V278 HydrophobicContact CD2-CG1 4.02Å; W101-V278 HydrophobicContact CD2-CG2 4.06Å; W101-V278 HydrophobicContact CE3-CB 4.41Å; W101-V278 HydrophobicContact CE3-CG1 3.56Å; W101-V278 HydrophobicContact CE3-CG2 4.05Å; W101-V278 HydrophobicContact CG-CG1 4.21Å; W101-V278 HydrophobicContact CG-CG2 4.35Å; W101-V278 HydrophobicContact CZ3-CG1 4.43Å
102	L	94.6	Very high	92.3	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-65.1	-46.1	-177.2	-175	153.1	0	0	0	110.8	H90 F98 E99 N100 K104 L105 V106 V120	H90-L102 HydrophobicContact CB-CD1 4.41Å; F98-L102 HydrophobicContact CB-CD1 4.37Å; F98-L102 HydrophobicContact CD1-CD1 3.63Å; F98-L102 HydrophobicContact CE1-CD1 4.14Å; F98-L102 HydrophobicContact CG-CD1 4.08Å; E99-L102 WeakPolarHBondContact O-CB 3.27Å; E99-L102 PolarHBondContact O-N 3.15Å; N100-L102 PolarHBondContact O-N 3.33Å; L102-K104 VanDerWaalsContact C-N 3.34Å; L102-K104 PolarHBondContact O-N 3.37Å; L102-L105 PolarHBondContact O-N 2.91Å; L102-V106 HydrophobicContact CD2-CG2 4.13Å; L102-V106 WeakPolarHBondContact O-CG2 2.95Å; L102-V106 PolarHBondContact O-N 2.03Å; L102-V120 HydrophobicContact CD1-CG1 3.9Å; L102-V120 HydrophobicContact CD2-CG1 4.22Å; L102-V120 HydrophobicContact CD2-CG2 3.9Å
103	H	93.8	Very high	92.3	Very high	47 Å²	47	42.7 Å²	42.7	22%	0.218	23%	0.226	C	C	.	.	H	α-helix	trans	-63.3	-41	176.9	-63.1	-78.9	0	0	0	111.9	P59 N100 L105 V106 S107	P59-H103 HydrophobicContact CB-CB 3.95Å; P59-H103 WeakPolarHBondContact CB-ND1 3.46Å; N100-H103 PolarHBondContact O-N 3.36Å; H103-L105 VanDerWaalsContact C-N 3.32Å; H103-L105 PolarHBondContact O-N 3.49Å; H103-V106 PolarHBondContact O-N 2.69Å; H103-S107 WeakPolarHBondContact O-CB 3.3Å; H103-S107 PolarHBondContact O-N 2.87Å
104	K	94.8	Very high	92.6	Very high	98 Å²	98	50.7 Å²	50.7	43%	0.426	26%	0.26	S	S	.	.	H	α-helix	trans	-61.3	-40.9	175	-66.7	176.5	-179	173.1	0	111.7	N100 W101 L102 A108	N100-K104 WeakPolarHBondContact ND2-CE 3.32Å; N100-K104 PolarHBondContact ND2-NZ 3.5Å; N100-K104 PolarHBondContact O-N 3.36Å; W101-K104 PolarHBondContact O-N 2.75Å; L102-K104 VanDerWaalsContact C-N 3.34Å; L102-K104 PolarHBondContact O-N 3.37Å; K104-A108 VanDerWaalsContact O-CB 3.29Å; K104-A108 WeakPolarHBondContact O-CB 3.44Å; K104-A108 PolarHBondContact O-N 2.77Å
105	L	97.4	Very high	93.2	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-67.3	-45.4	177.6	-180	59.1	0	0	0	112.3	I88 W101 L102 H103 S107 A108 L109 I166 F281 V282 L285	I88-L105 HydrophobicContact CD1-CD2 4.08Å; I88-L105 HydrophobicContact CD1-CG 4Å; I88-L105 HydrophobicContact CG1-CD2 4.17Å; I88-L105 HydrophobicContact CG2-CD2 3.86Å; W101-L105 HydrophobicContact CZ3-CD2 4.19Å; W101-L105 PolarHBondContact O-N 3.46Å; L102-L105 PolarHBondContact O-N 2.91Å; H103-L105 VanDerWaalsContact C-N 3.32Å; H103-L105 PolarHBondContact O-N 3.49Å; L105-S107 PolarHBondContact O-N 3.09Å; L105-A108 PolarHBondContact O-N 2.88Å; L105-L109 HydrophobicContact CD1-CD1 4.13Å; L105-L109 HydrophobicContact CD1-CG 4.22Å; L105-L109 HydrophobicContact CG-CD1 4.08Å; L105-L109 WeakPolarHBondContact O-CB 3.39Å; L105-L109 WeakPolarHBondContact O-CG 3.15Å; L105-L109 PolarHBondContact O-N 2.8Å; L105-I166 HydrophobicContact CD2-CG2 4.12Å; L105-F281 HydrophobicContact CD1-CD1 3.71Å; L105-F281 HydrophobicContact CD1-CE1 4.08Å; L105-V282 HydrophobicContact CB-CG2 4.12Å; L105-V282 HydrophobicContact CD1-CG2 3.96Å; L105-L285 HydrophobicContact CD1-CD1 3.84Å
106	V	96.9	Very high	93.7	Very high	7 Å²	7	49.3 Å²	49.3	4%	0.042	25%	0.251	C	S	.	.	H	α-helix	trans	-56.3	-50.4	174.7	168.8	0	0	0	0	110.7	R54 I88 L102 H103 A108 L109 H110 V118 V120	R54-V106 HydrophobicContact CB-CG1 3.77Å; R54-V106 HydrophobicContact CG-CG1 3.92Å; R54-V106 HydrophobicContact CG-CG2 4.17Å; I88-V106 HydrophobicContact CD1-CG2 3.51Å; L102-V106 HydrophobicContact CD2-CG2 4.13Å; L102-V106 WeakPolarHBondContact O-CG2 2.95Å; L102-V106 PolarHBondContact O-N 2.03Å; H103-V106 PolarHBondContact O-N 2.69Å; V106-A108 VanDerWaalsContact C-N 3.34Å; V106-A108 PolarHBondContact O-N 2.93Å; V106-L109 PolarHBondContact O-N 2.97Å; V106-H110 PolarHBondContact O-CD2 2.77Å; V106-H110 PolarHBondContact O-N 3.08Å; V106-V118 HydrophobicContact CB-CG1 4.49Å; V106-V118 HydrophobicContact CG1-CG1 4.31Å; V106-V118 HydrophobicContact CG2-CG1 4.1Å; V106-V120 HydrophobicContact CG2-CG2 3.89Å
107	S	96.1	Very high	94.3	Very high	40 Å²	40	48.6 Å²	48.6	28%	0.28	24%	0.242	S	C	.	.	H	α-helix	trans	-62.3	-40.2	179.9	-175.9	0	0	0	0	112.6	H103 L105 T111	H103-S107 WeakPolarHBondContact O-CB 3.3Å; H103-S107 PolarHBondContact O-N 2.87Å; L105-S107 PolarHBondContact O-N 3.09Å; S107-T111 WeakPolarHBondContact O-CB 3.49Å; S107-T111 PolarHBondContact O-N 2.85Å; S107-T111 PolarHBondContact O-OG1 3.45Å
108	A	97	Very high	94.7	Very high	3 Å²	3	43.3 Å²	43.3	3%	0.025	21%	0.214	C	C	.	.	H	α-helix	trans	-65	-41.6	175.8	0	0	0	0	0	112.2	K104 L105 V106 T111 R112 V282 L285 V286	K104-A108 VanDerWaalsContact O-CB 3.29Å; K104-A108 WeakPolarHBondContact O-CB 3.44Å; K104-A108 PolarHBondContact O-N 2.77Å; L105-A108 PolarHBondContact O-N 2.88Å; V106-A108 VanDerWaalsContact C-N 3.34Å; V106-A108 PolarHBondContact O-N 2.93Å; A108-T111 PolarHBondContact O-N 2.8Å; A108-R112 WeakPolarHBondContact O-CB 3.02Å; A108-R112 PolarHBondContact O-N 3.38Å; A108-V282 HydrophobicContact CB-CG1 3.98Å; A108-V282 HydrophobicContact CB-CG2 4.5Å; A108-L285 HydrophobicContact CB-CB 4.12Å; A108-L285 HydrophobicContact CB-CD1 3.76Å; A108-V286 HydrophobicContact CB-CG1 3.83Å
109	L	97.3	Very high	95.1	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-64.9	-49.1	177.1	-76.7	167.6	0	0	0	111.8	F86 I88 L105 V106 T111 R112 E113 V118 I166 L285	F86-L109 HydrophobicContact CB-CD1 4.19Å; F86-L109 HydrophobicContact CD1-CD1 4.49Å; F86-L109 HydrophobicContact CD1-CD2 3.92Å; F86-L109 HydrophobicContact CD2-CD2 4.17Å; F86-L109 HydrophobicContact CE1-CD2 3.83Å; F86-L109 HydrophobicContact CE2-CD2 4.08Å; F86-L109 HydrophobicContact CG-CD1 4.2Å; F86-L109 HydrophobicContact CG-CD2 4.08Å; F86-L109 HydrophobicContact CZ-CD2 3.89Å; I88-L109 HydrophobicContact CD1-CD1 3.84Å; I88-L109 HydrophobicContact CG1-CD1 4.14Å; L105-L109 HydrophobicContact CD1-CD1 4.13Å; L105-L109 HydrophobicContact CD1-CG 4.22Å; L105-L109 HydrophobicContact CG-CD1 4.08Å; L105-L109 WeakPolarHBondContact O-CB 3.39Å; L105-L109 WeakPolarHBondContact O-CG 3.15Å; L105-L109 PolarHBondContact O-N 2.8Å; V106-L109 PolarHBondContact O-N 2.97Å; L109-T111 PolarHBondContact O-N 3.42Å; L109-R112 PolarHBondContact O-N 2.03Å; L109-E113 PolarHBondContact O-N 3.46Å; L109-V118 HydrophobicContact CB-CG2 4.03Å; L109-V118 HydrophobicContact CD1-CG1 4.26Å; L109-I166 HydrophobicContact CD1-CD1 4.05Å; L109-I166 HydrophobicContact CD2-CD1 4.38Å; L109-L285 HydrophobicContact CD2-CD1 3.85Å; L109-L285 HydrophobicContact CD2-CD2 3.9Å; L109-L285 HydrophobicContact CG-CD1 3.91Å
110	H	94.9	Very high	95.6	Very high	19 Å²	19	39.8 Å²	39.8	9%	0.088	20%	0.199	C	C	.	.	H	α-helix	trans	-61.5	-26.6	175	-78	-54.8	0	0	0	113.4	R54 K57 V106	R54-H110 PolarHBondContact O-CE1 2.84Å; R54-H110 PolarHBondContact O-NE2 2.89Å; R54-H110 VanDerWaalsContact O-NE2 3.17Å; K57-H110 HydrophobicContact CD-CB 4.4Å; K57-H110 HydrophobicContact CG-CB 3.78Å; V106-H110 PolarHBondContact O-CD2 2.77Å; V106-H110 PolarHBondContact O-N 3.08Å
111	T	94.9	Very high	96	Very high	67 Å²	67	34.9 Å²	34.9	41%	0.411	17%	0.172	S	C	.	.	H	α-helix	trans	-77	-37.4	174.9	-59.9	0	0	0	0	111.6	K57 S107 A108 L109	K57-T111 WeakPolarHBondContact CE-OG1 3.27Å; K57-T111 PolarHBondContact NZ-OG1 3.26Å; S107-T111 WeakPolarHBondContact O-CB 3.49Å; S107-T111 PolarHBondContact O-N 2.85Å; S107-T111 PolarHBondContact O-OG1 3.45Å; A108-T111 PolarHBondContact O-N 2.8Å; L109-T111 PolarHBondContact O-N 3.42Å
112	R	95.5	Very high	96.2	Very high	61 Å²	61	34.8 Å²	34.8	23%	0.23	17%	0.172	C	C	.	.	H	α-helix	trans	-76.8	-44.3	179.7	179.9	60.6	169.2	157.7	-3.2	112.7	A108 L109 L285 Q288 Y321 N322	A108-R112 WeakPolarHBondContact O-CB 3.02Å; A108-R112 PolarHBondContact O-N 3.38Å; L109-R112 PolarHBondContact O-N 2.03Å; R112-L285 HydrophobicContact CB-CB 4.36Å; R112-L285 HydrophobicContact CB-CD2 3.93Å; R112-L285 HydrophobicContact CG-CD2 3.74Å; R112-Q288 VanDerWaalsContact NH1-NE2 3.12Å; R112-Y321 HydrophobicContact CG-CD1 4.06Å; R112-Y321 HydrophobicContact CG-CE1 3.84Å; R112-N322 PolarHBondContact NH2-OD1 3.28Å
113	E	95.9	Very high	96.3	Very high	58 Å²	58	34.8 Å²	34.8	27%	0.271	17%	0.172	S	C	.	.			trans	-125.7	93.6	-175	-60.9	-61.7	166	0	0	108.9	F86 L109 D115 A116 Y321	F86-E113 HydrophobicContact CE2-CB 4.05Å; F86-E113 HydrophobicContact CE2-CG 3.88Å; F86-E113 HydrophobicContact CZ-CG 3.94Å; L109-E113 PolarHBondContact O-N 3.46Å; E113-D115 VanDerWaalsContact C-N 3.32Å; E113-D115 PolarHBondContact O-N 3.29Å; E113-A116 HydrophobicContact CB-CB 3.57Å; E113-A116 PolarHBondContact O-N 3.13Å; E113-Y321 WeakPolarHBondContact CG-OH 3.23Å; E113-Y321 WeakPolarHBondContact OE1-CE1 2.92Å; E113-Y321 VanDerWaalsContact OE1-CZ 3.22Å; E113-Y321 PolarHBondContact OE1-OH 3.02Å
114	K	92.9	Very high	96.4	Very high	173 Å²	173	33.6 Å²	33.6	75%	0.752	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-33.2	-170.4	-66.3	-178.1	-178.9	177.6	0	113.5
115	D	94.1	Very high	96.5	Very high	133 Å²	133	31.5 Å²	31.5	71%	0.711	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.5	0.5	-174	-51.2	-48.9	0	0	0	112.6	A83 E113	A83-D115 WeakPolarHBondContact CB-O 3.22Å; E113-D115 VanDerWaalsContact C-N 3.32Å; E113-D115 PolarHBondContact O-N 3.29Å
116	A	96.9	Very high	96.4	Very high	11 Å²	11	32.2 Å²	32.2	9%	0.091	17%	0.168	C	C	.	.			trans	-78	145.7	-176.2	0	0	0	0	0	112.6	K84 F86 E113	K84-A116 HydrophobicContact CB-CB 4.35Å; K84-A116 CarbonylContact O-C 3.51Å; K84-A116 WeakPolarHBondContact O-CA 3.47Å; K84-A116 VanDerWaalsContact O-CB 3.23Å; K84-A116 WeakPolarHBondContact O-CB 3.47Å; F86-A116 HydrophobicContact CD2-CB 3.87Å; F86-A116 HydrophobicContact CE2-CB 3.62Å; E113-A116 HydrophobicContact CB-CB 3.57Å; E113-A116 PolarHBondContact O-N 3.13Å
117	N	97.8	Very high	96.3	Very high	10 Å²	10	31.9 Å²	31.9	5%	0.053	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	129	168.5	-52.6	-57.9	0	0	0	108.9	L53 F79 N80 K84 T85 F86	L53-N117 HydrophobicContact CD1-CB 3.9Å; F79-N117 HydrophobicContact CD2-CB 4Å; F79-N117 HydrophobicContact CE2-CB 3.65Å; F79-N117 HydrophobicContact CZ-CB 4.21Å; F79-N117 WeakPolarHBondContact CZ-ND2 3.21Å; N80-N117 PolarHBondContact N-OD1 2.8Å; N80-N117 PolarHBondContact O-ND2 2.93Å; K84-N117 PolarHBondContact O-N 2.62Å; T85-N117 WeakPolarHBondContact CA-O 3.25Å; T85-N117 HydrophobicContact CG2-CB 3.96Å; T85-N117 PolarHBondContact OG1-ND2 3.3Å; F86-N117 PolarHBondContact N-O 2.77Å
118	V	98	Very high	96.2	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	102.9	175.6	-177.2	0	0	0	0	108.8	R54 F86 I88 V106 L109	R54-V118 HydrophobicContact CB-CB 4.49Å; R54-V118 PolarHBondContact N-O 3.49Å; F86-V118 HydrophobicContact CD2-CG2 4.33Å; I88-V118 HydrophobicContact CD1-CG1 3.74Å; I88-V118 HydrophobicContact CG1-CG1 4.42Å; V106-V118 HydrophobicContact CB-CG1 4.49Å; V106-V118 HydrophobicContact CG1-CG1 4.31Å; V106-V118 HydrophobicContact CG2-CG1 4.1Å; L109-V118 HydrophobicContact CB-CG2 4.03Å; L109-V118 HydrophobicContact CD1-CG1 4.26Å
119	V	98.2	Very high	96	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	121	-177.5	-175.1	0	0	0	0	109.6	F51 N52 L53 L66 F79 T85 F86 F87 I88	F51-V119 HydrophobicContact CB-CG1 4Å; F51-V119 HydrophobicContact CD1-CG1 4.34Å; N52-V119 CarbonylContact O-C 3.59Å; N52-V119 WeakPolarHBondContact O-CA 3.14Å; L53-V119 HydrophobicContact CD1-CG2 3.86Å; L66-V119 HydrophobicContact CD1-CG2 4.21Å; F79-V119 HydrophobicContact CE2-CG2 4.29Å; T85-V119 HydrophobicContact CG2-CG2 4.33Å; F86-V119 PolarHBondContact O-N 2.93Å; F87-V119 CarbonylContact C-O 3.51Å; F87-V119 VanDerWaalsContact CA-O 3.3Å; F87-V119 WeakPolarHBondContact CA-O 2.92Å; F87-V119 HydrophobicContact CD1-CB 3.83Å; F87-V119 HydrophobicContact CD1-CG1 3.8Å; F87-V119 HydrophobicContact CE1-CB 3.93Å; F87-V119 HydrophobicContact CE1-CG1 3.74Å; F87-V119 HydrophobicContact CE1-CG2 4.25Å; F87-V119 HydrophobicContact CG-CB 4.32Å; F87-V119 HydrophobicContact CZ-CB 4.49Å; F87-V119 HydrophobicContact CZ-CG2 4.39Å; I88-V119 PolarHBondContact N-O 3.36Å
120	V	98.1	Very high	95.7	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.006	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	121.9	169.7	175.1	0	0	0	0	108.3	N52 R54 I88 F98 L102 V106 D122	N52-V120 HydrophobicContact CB-CB 4.43Å; N52-V120 PolarHBondContact N-O 3.4Å; N52-V120 PolarHBondContact O-N 3.23Å; R54-V120 HydrophobicContact CG-CG2 3.8Å; I88-V120 HydrophobicContact CD1-CG2 4.49Å; F98-V120 HydrophobicContact CE1-CG1 4.34Å; F98-V120 HydrophobicContact CZ-CG1 4.21Å; L102-V120 HydrophobicContact CD1-CG1 3.9Å; L102-V120 HydrophobicContact CD2-CG1 4.22Å; L102-V120 HydrophobicContact CD2-CG2 3.9Å; V106-V120 HydrophobicContact CG2-CG2 3.89Å; V120-D122 PolarHBondContact O-N 2.83Å
121	V	98.3	Very high	95.5	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	105.5	174.2	-176	0	0	0	0	108.4	V49 F51 F87 I88 I89 H90 V141 I145	V49-V121 HydrophobicContact CG1-CG1 3.59Å; F51-V121 HydrophobicContact CD1-CG2 4.24Å; F51-V121 HydrophobicContact CE1-CG1 4.46Å; F51-V121 HydrophobicContact CE1-CG2 4.33Å; F87-V121 HydrophobicContact CB-CG2 4.27Å; F87-V121 HydrophobicContact CD1-CG2 3.81Å; I88-V121 PolarHBondContact O-N 3.48Å; I89-V121 HydrophobicContact CG1-CB 4.13Å; I89-V121 HydrophobicContact CG1-CG2 3.87Å; H90-V121 PolarHBondContact CD2-O 3.44Å; V121-V141 HydrophobicContact CG1-CG1 4.35Å; V121-I145 HydrophobicContact CB-CD1 4.48Å; V121-I145 HydrophobicContact CG1-CD1 3.95Å; V121-I145 HydrophobicContact CG1-CG1 3.99Å; V121-I145 HydrophobicContact CG2-CD1 4.08Å; V121-I145 HydrophobicContact CG2-CG1 4.26Å
122	D	96.9	Very high	95.4	Very high	3 Å²	3	46.3 Å²	46.3	2%	0.016	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	107.8	176.7	178	7.7	0	0	0	109.9	V49 R50 F98 V120 L124	V49-D122 WeakPolarHBondContact CA-O 3.17Å; R50-D122 HydrophobicContact CB-CB 4.17Å; R50-D122 IonicContact CZ-OD2 3.19Å; R50-D122 PolarHBondContact N-O 2.64Å; R50-D122 IonicContact NE-OD2 3.02Å; R50-D122 PolarHBondContact NE-OD2 3.48Å; R50-D122 IonicContact NH2-OD2 2.65Å; R50-D122 PolarHBondContact NH2-OD2 3.12Å; R50-D122 PolarHBondContact O-N 2.63Å; F98-D122 HydrophobicContact CZ-CB 3.8Å; V120-D122 PolarHBondContact O-N 2.83Å; D122-L124 WeakPolarHBondContact OD1-CB 3.39Å; D122-L124 WeakPolarHBondContact OD1-CG 3.4Å; D122-L124 PolarHBondContact OD1-N 3.05Å
123	W	97.6	Very high	95.4	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.235	C	C	.	.			trans	-125.3	27.5	171.1	67.5	-71.4	0	0	0	110.8	V49 H90 P125 L126 A127 T138 V141 L170 V174	V49-W123 HydrophobicContact CG2-CB 4.25Å; H90-W123 AromaticContact CD2-CD1 3.63Å; H90-W123 AromaticContact CD2-NE1 3.71Å; H90-W123 AromaticContact CE1-CD1 3.41Å; H90-W123 VanDerWaalsContact CE1-CD1 3.41Å; H90-W123 AromaticContact CE1-CE2 3.76Å; H90-W123 AromaticContact CE1-CG 3.84Å; H90-W123 AromaticContact CE1-NE1 3.33Å; H90-W123 PolarHBondContact CE1-NE1 3.01Å; H90-W123 VanDerWaalsContact CE1-NE1 3.33Å; H90-W123 AromaticContact CG-NE1 3.74Å; H90-W123 AromaticContact ND1-CD1 3.99Å; H90-W123 AromaticContact ND1-CE2 3.96Å; H90-W123 AromaticContact ND1-NE1 3.5Å; H90-W123 PolarHBondContact ND1-NE1 2.69Å; H90-W123 AromaticContact NE2-CD1 3.15Å; H90-W123 AromaticContact NE2-CG 3.78Å; H90-W123 PolarHBondContact NE2-N 2.95Å; H90-W123 VanDerWaalsContact NE2-N 3.18Å; H90-W123 AromaticContact NE2-NE1 3.49Å; H90-W123 PolarHBondContact NE2-NE1 3.37Å; H90-W123 VanDerWaalsContact O-CZ2 3.26Å; H90-W123 WeakPolarHBondContact O-CZ2 3.36Å; H90-W123 PolarHBondContact O-NE1 3.45Å; W123-P125 VanDerWaalsContact C-CD 3.41Å; W123-P125 VanDerWaalsContact C-N 3.33Å; W123-L126 HydrophobicContact CE3-CB 3.79Å; W123-L126 CarbonylContact O-C 3.58Å; W123-L126 WeakPolarHBondContact O-CA 3.25Å; W123-L126 WeakPolarHBondContact O-CB 3.37Å; W123-L126 PolarHBondContact O-N 2.94Å; W123-A127 HydrophobicContact CD2-CB 3.81Å; W123-A127 HydrophobicContact CE3-CB 3.6Å; W123-A127 HydrophobicContact CH2-CB 3.68Å; W123-A127 HydrophobicContact CZ2-CB 3.88Å; W123-A127 VanDerWaalsContact CZ3-CA 3.4Å; W123-A127 HydrophobicContact CZ3-CB 3.54Å; W123-A127 PolarHBondContact O-N 3.19Å; W123-T138 HydrophobicContact CH2-CG2 4.38Å; W123-V141 HydrophobicContact CB-CG1 3.9Å; W123-V141 HydrophobicContact CB-CG2 3.81Å; W123-V141 HydrophobicContact CD2-CG1 4.29Å; W123-V141 HydrophobicContact CD2-CG2 3.91Å; W123-V141 HydrophobicContact CE3-CG2 3.66Å; W123-V141 HydrophobicContact CG-CG1 3.86Å; W123-V141 HydrophobicContact CG-CG2 4Å; W123-L170 HydrophobicContact CH2-CB 3.91Å; W123-L170 HydrophobicContact CH2-CD1 3.94Å; W123-L170 HydrophobicContact CZ2-CB 4.1Å; W123-V174 HydrophobicContact CZ2-CG2 4.37Å
124	L	95.8	Very high	95.4	Very high	21 Å²	21	43.7 Å²	43.7	11%	0.11	22%	0.222	C	C	.	.	H	α-helix	trans	-49.1	-43.8	-178.4	-73.6	169.6	0	0	0	113.7	T93 F98 D122 L126 A127 H128	T93-L124 HydrophobicContact CG2-CD2 3.71Å; F98-L124 HydrophobicContact CD1-CD1 3.97Å; F98-L124 HydrophobicContact CD1-CD2 4.07Å; F98-L124 HydrophobicContact CD1-CG 4.14Å; F98-L124 HydrophobicContact CD2-CD1 4.14Å; F98-L124 HydrophobicContact CE1-CD1 3.67Å; F98-L124 HydrophobicContact CE1-CD2 4.1Å; F98-L124 HydrophobicContact CE1-CG 3.72Å; F98-L124 HydrophobicContact CE2-CD1 3.86Å; F98-L124 HydrophobicContact CG-CD1 4.18Å; F98-L124 HydrophobicContact CZ-CD1 3.62Å; F98-L124 HydrophobicContact CZ-CG 4.06Å; D122-L124 WeakPolarHBondContact OD1-CB 3.39Å; D122-L124 WeakPolarHBondContact OD1-CG 3.4Å; D122-L124 PolarHBondContact OD1-N 3.05Å; L124-L126 PolarHBondContact O-N 3.11Å; L124-A127 PolarHBondContact O-N 2.96Å; L124-H128 VanDerWaalsContact O-CB 3.22Å; L124-H128 WeakPolarHBondContact O-CB 3.05Å; L124-H128 PolarHBondContact O-N 3.15Å
125	P	95.1	Very high	95.6	Very high	55 Å²	55	36 Å²	36	36%	0.357	19%	0.189	S	C	.	.	H	α-helix	trans	-62.2	-27.6	178.6	-24	35.5	0	0	0	113.9	P47 W123 Q129	P47-P125 HydrophobicContact CB-CB 3.7Å; W123-P125 VanDerWaalsContact C-CD 3.41Å; W123-P125 VanDerWaalsContact C-N 3.33Å; P125-Q129 PolarHBondContact O-NE2 3.13Å
126	L	96.4	Very high	95.7	Very high	15 Å²	15	34.5 Å²	34.5	8%	0.079	18%	0.181	C	C	.	.	H	α-helix	trans	-92.2	-26.2	179.6	-65.9	175.7	0	0	0	112.2	P47 V49 W123 L124 N137 V141	P47-L126 HydrophobicContact CB-CD2 3.96Å; P47-L126 HydrophobicContact CB-CG 4.29Å; P47-L126 HydrophobicContact CG-CD2 3.78Å; V49-L126 HydrophobicContact CG2-CD1 4.02Å; W123-L126 HydrophobicContact CE3-CB 3.79Å; W123-L126 CarbonylContact O-C 3.58Å; W123-L126 WeakPolarHBondContact O-CA 3.25Å; W123-L126 WeakPolarHBondContact O-CB 3.37Å; W123-L126 PolarHBondContact O-N 2.94Å; L124-L126 PolarHBondContact O-N 3.11Å; L126-N137 HydrophobicContact CB-CB 4.06Å; L126-N137 PolarHBondContact O-ND2 2.8Å; L126-V141 HydrophobicContact CB-CG2 4.48Å; L126-V141 HydrophobicContact CD1-CG2 3.72Å
127	A	94.9	Very high	95.7	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-82	-32.4	176.1	0	0	0	0	0	112.7	T93 W123 L124 Q129	T93-A127 HydrophobicContact CG2-CB 4.28Å; W123-A127 HydrophobicContact CD2-CB 3.81Å; W123-A127 HydrophobicContact CE3-CB 3.6Å; W123-A127 HydrophobicContact CH2-CB 3.68Å; W123-A127 HydrophobicContact CZ2-CB 3.88Å; W123-A127 VanDerWaalsContact CZ3-CA 3.4Å; W123-A127 HydrophobicContact CZ3-CB 3.54Å; W123-A127 PolarHBondContact O-N 3.19Å; L124-A127 PolarHBondContact O-N 2.96Å; A127-Q129 PolarHBondContact O-N 3.1Å; A127-Q129 VanDerWaalsContact O-N 3.09Å
128	H	93.9	Very high	95.7	Very high	86 Å²	86	35.2 Å²	35.2	40%	0.398	18%	0.183	S	C	.	.	S	Bend	trans	-86.3	60.3	177.6	-172.4	49.7	0	0	0	110.8	T93 M94 L124	T93-H128 HydrophobicContact CG2-CB 4.15Å; T93-H128 WeakPolarHBondContact O-CA 3.28Å; T93-H128 PolarHBondContact O-ND1 2.92Å; M94-H128 VanDerWaalsContact C-CE1 3.46Å; M94-H128 PolarHBondContact O-CE1 3.43Å; M94-H128 PolarHBondContact O-ND1 2.74Å; L124-H128 VanDerWaalsContact O-CB 3.22Å; L124-H128 WeakPolarHBondContact O-CB 3.05Å; L124-H128 PolarHBondContact O-N 3.15Å
129	Q	92.6	Very high	95.7	Very high	91 Å²	91	42.5 Å²	42.5	43%	0.425	21%	0.211	S	C	.	.	S	Bend	trans	-130.6	176.1	177.2	-62.3	-61.3	-29.7	0	0	108.8	W92 P125 A127 Y131 D133	W92-Q129 PolarHBondContact NE1-O 2.89Å; P125-Q129 PolarHBondContact O-NE2 3.13Å; A127-Q129 PolarHBondContact O-N 3.1Å; A127-Q129 VanDerWaalsContact O-N 3.09Å; Q129-Y131 PolarHBondContact O-N 2.84Å; Q129-D133 HydrophobicContact CB-CB 3.96Å
130	L	91.2	Very high	95.7	Very high	127 Å²	127	46.4 Å²	46.4	67%	0.665	23%	0.234	S	C	*	.			trans	-52.8	142.8	165.4	-65.1	175.5	0	0	0	109.2	T132 D133 A134	L130-T132 PolarHBondContact O-N 2.92Å; L130-T132 VanDerWaalsContact O-N 3.12Å; L130-D133 WeakPolarHBondContact O-CA 3.43Å; L130-D133 WeakPolarHBondContact O-CB 3.08Å; L130-D133 PolarHBondContact O-N 2.79Å; L130-A134 PolarHBondContact O-N 3.26Å
131	Y	90.6	Very high	95.7	Very high	59 Å²	59	46.3 Å²	46.3	23%	0.231	23%	0.234	C	C	.	.	H	α-helix	trans	-53.6	-41.2	-171.6	-178.6	-96.2	0	0	0	112.7	W92 Q129 D133 A134 V135 L170 P197 M198	W92-Y131 HydrophobicContact CD2-CD2 4.21Å; W92-Y131 HydrophobicContact CG-CD2 4.14Å; Q129-Y131 PolarHBondContact O-N 2.84Å; Y131-D133 VanDerWaalsContact C-N 3.33Å; Y131-D133 PolarHBondContact O-N 3.43Å; Y131-A134 PolarHBondContact O-N 3.29Å; Y131-V135 HydrophobicContact CD1-CG2 3.92Å; Y131-V135 HydrophobicContact CE1-CG2 3.48Å; Y131-V135 VanDerWaalsContact CE1-CG2 3.48Å; Y131-V135 HydrophobicContact CE2-CG2 4.38Å; Y131-V135 WeakPolarHBondContact O-CB 3.02Å; Y131-V135 VanDerWaalsContact O-CG2 3.24Å; Y131-V135 WeakPolarHBondContact O-CG2 3.14Å; Y131-V135 PolarHBondContact O-N 2.75Å; Y131-L170 HydrophobicContact CE2-CD2 4.27Å; Y131-P197 HydrophobicContact CE1-CB 3.76Å; Y131-P197 PolarHBondContact OH-O 2.9Å; Y131-M198 HydrophobicContact CE1-CG 4.5Å; Y131-M198 HydrophobicContact CE1-SD 4.44Å
132	T	93.8	Very high	95.7	Very high	68 Å²	68	46.3 Å²	46.3	42%	0.417	23%	0.234	S	C	.	.	H	α-helix	trans	-61.4	-38.5	176.8	50	0	0	0	0	113.1	L130 N136 M198	L130-T132 PolarHBondContact O-N 2.92Å; L130-T132 VanDerWaalsContact O-N 3.12Å; T132-N136 PolarHBondContact O-N 2.85Å; T132-N136 PolarHBondContact O-ND2 2.73Å; T132-M198 HydrophobicContact CG2-SD 3.95Å
133	D	95.3	Very high	95.8	Very high	65 Å²	65	50.8 Å²	50.8	35%	0.348	26%	0.255	S	S	.	.	H	α-helix	trans	-73.8	-41.8	178.9	-60.9	-28.7	0	0	0	110.3	Q129 L130 Y131 V135 N136 N137	Q129-D133 HydrophobicContact CB-CB 3.96Å; L130-D133 WeakPolarHBondContact O-CA 3.43Å; L130-D133 WeakPolarHBondContact O-CB 3.08Å; L130-D133 PolarHBondContact O-N 2.79Å; Y131-D133 VanDerWaalsContact C-N 3.33Å; Y131-D133 PolarHBondContact O-N 3.43Å; D133-V135 VanDerWaalsContact C-N 3.31Å; D133-V135 PolarHBondContact O-N 2.97Å; D133-N136 PolarHBondContact O-N 2.71Å; D133-N136 VanDerWaalsContact O-N 3.16Å; D133-N137 WeakPolarHBondContact O-CB 3.34Å; D133-N137 PolarHBondContact O-N 2.86Å; D133-N137 PolarHBondContact O-ND2 2.68Å
134	A	95.7	Very high	95.8	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-60.3	-40.7	173.3	0	0	0	0	0	111.9	L130 Y131 N137 T138 L170	L130-A134 PolarHBondContact O-N 3.26Å; Y131-A134 PolarHBondContact O-N 3.29Å; A134-N137 PolarHBondContact O-N 2.88Å; A134-T138 WeakPolarHBondContact O-CG2 3.34Å; A134-T138 PolarHBondContact O-N 3.38Å; A134-L170 HydrophobicContact CB-CD1 3.77Å
135	V	95.8	Very high	95.9	Very high	11 Å²	11	51.4 Å²	51.4	7%	0.067	26%	0.261	C	S	.	.	H	α-helix	trans	-58.3	-49.2	172	166.8	0	0	0	0	110.6	Y131 D133 N137 T138 L170 M198 F199	Y131-V135 HydrophobicContact CD1-CG2 3.92Å; Y131-V135 HydrophobicContact CE1-CG2 3.48Å; Y131-V135 VanDerWaalsContact CE1-CG2 3.48Å; Y131-V135 HydrophobicContact CE2-CG2 4.38Å; Y131-V135 WeakPolarHBondContact O-CB 3.02Å; Y131-V135 VanDerWaalsContact O-CG2 3.24Å; Y131-V135 WeakPolarHBondContact O-CG2 3.14Å; Y131-V135 PolarHBondContact O-N 2.75Å; D133-V135 VanDerWaalsContact C-N 3.31Å; D133-V135 PolarHBondContact O-N 2.97Å; V135-N137 VanDerWaalsContact C-N 3.28Å; V135-N137 PolarHBondContact O-N 2.97Å; V135-T138 WeakPolarHBondContact O-CB 3.42Å; V135-T138 WeakPolarHBondContact O-CG2 3.24Å; V135-T138 PolarHBondContact O-N 2.84Å; V135-T138 VanDerWaalsContact O-N 3.15Å; V135-T138 PolarHBondContact O-OG1 2.78Å; V135-L170 HydrophobicContact CG2-CD2 3.83Å; V135-M198 HydrophobicContact CB-SD 4.12Å; V135-M198 HydrophobicContact CG1-CB 4.08Å; V135-M198 HydrophobicContact CG1-CE 4.13Å; V135-M198 HydrophobicContact CG1-SD 3.99Å; V135-M198 HydrophobicContact CG2-SD 4.04Å; V135-F199 HydrophobicContact CG1-CE2 4.02Å; V135-F199 HydrophobicContact CG1-CZ 3.88Å; V135-F199 HydrophobicContact CG2-CE2 4.01Å
136	N	96.4	Very high	96.1	Very high	102 Å²	102	48.8 Å²	48.8	55%	0.545	24%	0.244	S	C	.	.	H	α-helix	trans	-62.5	-36.8	178.3	-72.5	-30.4	0	0	0	112.4	T132 D133 T138	T132-N136 PolarHBondContact O-N 2.85Å; T132-N136 PolarHBondContact O-ND2 2.73Å; D133-N136 PolarHBondContact O-N 2.71Å; D133-N136 VanDerWaalsContact O-N 3.16Å; N136-T138 PolarHBondContact O-N 3.22Å
137	N	97.8	Very high	96.1	Very high	34 Å²	34	54.6 Å²	54.6	18%	0.182	27%	0.265	C	S	.	.	H	α-helix	trans	-66.1	-24.2	177.8	-70	-26.5	0	0	0	112.8	L126 D133 A134 V135 R139 V140 V141	L126-N137 HydrophobicContact CB-CB 4.06Å; L126-N137 PolarHBondContact O-ND2 2.8Å; D133-N137 WeakPolarHBondContact O-CB 3.34Å; D133-N137 PolarHBondContact O-N 2.86Å; D133-N137 PolarHBondContact O-ND2 2.68Å; A134-N137 PolarHBondContact O-N 2.88Å; V135-N137 VanDerWaalsContact C-N 3.28Å; V135-N137 PolarHBondContact O-N 2.97Å; N137-R139 PolarHBondContact O-N 3.07Å; N137-R139 VanDerWaalsContact O-N 3.14Å; N137-V140 WeakPolarHBondContact O-CA 3.33Å; N137-V140 WeakPolarHBondContact O-CB 3.22Å; N137-V140 PolarHBondContact O-N 3.36Å; N137-V141 WeakPolarHBondContact O-CG2 3.24Å; N137-V141 PolarHBondContact O-N 2.9Å
138	T	98.4	Very high	96.2	Very high	1 Å²	1	54.6 Å²	54.6	1%	0.006	27%	0.265	C	S	.	.	H	α-helix	trans	-54.5	-37.9	-179.2	60.6	0	0	0	0	113	W123 A134 V135 N136 V141 G142 L170 V174 Y177 F199	W123-T138 HydrophobicContact CH2-CG2 4.38Å; A134-T138 WeakPolarHBondContact O-CG2 3.34Å; A134-T138 PolarHBondContact O-N 3.38Å; V135-T138 WeakPolarHBondContact O-CB 3.42Å; V135-T138 WeakPolarHBondContact O-CG2 3.24Å; V135-T138 PolarHBondContact O-N 2.84Å; V135-T138 VanDerWaalsContact O-N 3.15Å; V135-T138 PolarHBondContact O-OG1 2.78Å; N136-T138 PolarHBondContact O-N 3.22Å; T138-V141 PolarHBondContact O-N 3.39Å; T138-G142 PolarHBondContact O-N 3.39Å; T138-L170 HydrophobicContact CG2-CB 3.96Å; T138-L170 HydrophobicContact CG2-CD1 4.31Å; T138-L170 HydrophobicContact CG2-CD2 4.21Å; T138-L170 HydrophobicContact CG2-CG 4.41Å; T138-V174 HydrophobicContact CG2-CG2 3.83Å; T138-Y177 WeakPolarHBondContact OG1-CE2 3.47Å; T138-F199 HydrophobicContact CG2-CZ 4.35Å
139	R	97.7	Very high	96.4	Very high	154 Å²	154	50.5 Å²	50.5	58%	0.581	25%	0.246	S	C	*	.	H	α-helix	trans	-67.2	-39.8	176.7	-172	177.6	179.3	-121.3	-2.4	112.2	N137 G142 H143 Y177 F181	N137-R139 PolarHBondContact O-N 3.07Å; N137-R139 VanDerWaalsContact O-N 3.14Å; R139-G142 PolarHBondContact O-N 3.03Å; R139-H143 PolarHBondContact O-N 3.36Å; R139-Y177 HydrophobicContact CB-CD2 4.33Å; R139-Y177 HydrophobicContact CB-CE1 4.4Å; R139-Y177 HydrophobicContact CB-CE2 4.21Å; R139-Y177 HydrophobicContact CB-CG 4.5Å; R139-Y177 HydrophobicContact CG-CD1 4.25Å; R139-Y177 HydrophobicContact CG-CE1 4.24Å; R139-F181 HydrophobicContact CG-CE2 3.91Å; R139-F181 HydrophobicContact CG-CZ 3.86Å
140	V	97.4	Very high	96.7	Very high	81 Å²	81	47.3 Å²	47.3	49%	0.491	23%	0.232	S	C	.	.	H	α-helix	trans	-66.5	-42	177.9	-180	0	0	0	0	110.8	N137 H143 S144	N137-V140 WeakPolarHBondContact O-CA 3.33Å; N137-V140 WeakPolarHBondContact O-CB 3.22Å; N137-V140 PolarHBondContact O-N 3.36Å; V140-H143 PolarHBondContact O-N 2.88Å; V140-S144 PolarHBondContact O-N 2.89Å; V140-S144 VanDerWaalsContact O-N 3.07Å; V140-S144 PolarHBondContact O-OG 2.79Å; V140-S144 VanDerWaalsContact O-OG 3.06Å
141	V	98.5	Very high	96.9	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-67	-44.6	176.8	-177.2	0	0	0	0	110.5	V49 V121 W123 L126 N137 T138 H143 S144 I145 V174	V49-V141 HydrophobicContact CG1-CG1 4.25Å; V49-V141 HydrophobicContact CG2-CB 4.24Å; V49-V141 HydrophobicContact CG2-CG1 3.97Å; V49-V141 HydrophobicContact CG2-CG2 3.92Å; V121-V141 HydrophobicContact CG1-CG1 4.35Å; W123-V141 HydrophobicContact CB-CG1 3.9Å; W123-V141 HydrophobicContact CB-CG2 3.81Å; W123-V141 HydrophobicContact CD2-CG1 4.29Å; W123-V141 HydrophobicContact CD2-CG2 3.91Å; W123-V141 HydrophobicContact CE3-CG2 3.66Å; W123-V141 HydrophobicContact CG-CG1 3.86Å; W123-V141 HydrophobicContact CG-CG2 4Å; L126-V141 HydrophobicContact CB-CG2 4.48Å; L126-V141 HydrophobicContact CD1-CG2 3.72Å; N137-V141 WeakPolarHBondContact O-CG2 3.24Å; N137-V141 PolarHBondContact O-N 2.9Å; T138-V141 PolarHBondContact O-N 3.39Å; V141-H143 VanDerWaalsContact C-N 3.27Å; V141-H143 PolarHBondContact O-N 3.26Å; V141-S144 WeakPolarHBondContact O-CA 3.35Å; V141-S144 WeakPolarHBondContact O-CB 3.02Å; V141-S144 PolarHBondContact O-N 3.05Å; V141-I145 HydrophobicContact CG1-CD1 4.34Å; V141-I145 WeakPolarHBondContact O-CG1 3.44Å; V141-I145 PolarHBondContact O-N 2.99Å; V141-V174 HydrophobicContact CB-CG1 3.93Å; V141-V174 HydrophobicContact CB-CG2 4.24Å; V141-V174 HydrophobicContact CG1-CG1 3.53Å; V141-V174 HydrophobicContact CG1-CG2 4.4Å
142	G	98.5	Very high	97.1	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-56.5	-42.7	175.7	0	0	0	0	0	112	T138 R139 S144 I145 A146 A178	T138-G142 PolarHBondContact O-N 3.39Å; R139-G142 PolarHBondContact O-N 3.03Å; G142-S144 PolarHBondContact O-N 3.26Å; G142-I145 PolarHBondContact O-N 3.33Å; G142-A146 WeakPolarHBondContact O-CB 3.39Å; G142-A146 PolarHBondContact O-N 3.1Å; G142-A178 WeakPolarHBondContact O-CA 3.43Å
143	H	97.9	Very high	97.2	Very high	97 Å²	97	39.4 Å²	39.4	45%	0.449	19%	0.188	S	C	.	.	H	α-helix	trans	-63	-39.5	174.5	-169.8	69.5	0	0	0	112.8	R139 V140 V141 A146 R147 F181	R139-H143 PolarHBondContact O-N 3.36Å; V140-H143 PolarHBondContact O-N 2.88Å; V141-H143 VanDerWaalsContact C-N 3.27Å; V141-H143 PolarHBondContact O-N 3.26Å; H143-A146 PolarHBondContact O-N 3.4Å; H143-R147 WeakPolarHBondContact O-CG 3.39Å; H143-R147 PolarHBondContact O-N 3.43Å; H143-F181 HydrophobicContact CB-CD2 3.97Å; H143-F181 HydrophobicContact CB-CE2 4.25Å
144	S	97.9	Very high	97.1	Very high	33 Å²	33	43 Å²	43	23%	0.231	20%	0.202	C	C	.	.	H	α-helix	trans	-62.2	-42.9	175.7	-57.7	0	0	0	0	112.3	V140 V141 G142 R147 M148	V140-S144 PolarHBondContact O-N 2.89Å; V140-S144 VanDerWaalsContact O-N 3.07Å; V140-S144 PolarHBondContact O-OG 2.79Å; V140-S144 VanDerWaalsContact O-OG 3.06Å; V141-S144 WeakPolarHBondContact O-CA 3.35Å; V141-S144 WeakPolarHBondContact O-CB 3.02Å; V141-S144 PolarHBondContact O-N 3.05Å; G142-S144 PolarHBondContact O-N 3.26Å; S144-R147 PolarHBondContact O-N 3.42Å; S144-M148 PolarHBondContact O-N 2.84Å; S144-M148 VanDerWaalsContact O-N 3.14Å
145	I	98.4	Very high	96.7	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-64.9	-44.9	176	-60.1	170.7	0	0	0	110.4	F51 I89 V121 V141 G142 R147 M148 L149 V174 A178	F51-I145 HydrophobicContact CE1-CB 4.42Å; F51-I145 HydrophobicContact CE1-CG1 4Å; F51-I145 HydrophobicContact CZ-CG1 4.4Å; I89-I145 HydrophobicContact CD1-CD1 3.67Å; I89-I145 HydrophobicContact CG1-CD1 3.98Å; V121-I145 HydrophobicContact CB-CD1 4.48Å; V121-I145 HydrophobicContact CG1-CD1 3.95Å; V121-I145 HydrophobicContact CG1-CG1 3.99Å; V121-I145 HydrophobicContact CG2-CD1 4.08Å; V121-I145 HydrophobicContact CG2-CG1 4.26Å; V141-I145 HydrophobicContact CG1-CD1 4.34Å; V141-I145 WeakPolarHBondContact O-CG1 3.44Å; V141-I145 PolarHBondContact O-N 2.99Å; G142-I145 PolarHBondContact O-N 3.33Å; I145-R147 VanDerWaalsContact C-N 3.28Å; I145-R147 PolarHBondContact O-N 2.99Å; I145-M148 WeakPolarHBondContact O-CB 3.24Å; I145-M148 PolarHBondContact O-N 2.86Å; I145-L149 HydrophobicContact CG2-CD1 4.17Å; I145-L149 HydrophobicContact CG2-CG 4.36Å; I145-L149 WeakPolarHBondContact O-CG 3.27Å; I145-L149 PolarHBondContact O-N 3.01Å; I145-V174 HydrophobicContact CD1-CG1 3.51Å; I145-A178 HydrophobicContact CB-CB 3.82Å; I145-A178 HydrophobicContact CD1-CB 4.44Å; I145-A178 HydrophobicContact CG2-CB 3.79Å
146	A	98.4	Very high	96.2	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.008	25%	0.249	C	C	.	.	H	α-helix	trans	-58.6	-41.7	178.4	0	0	0	0	0	111.7	G142 H143 M148 L149 D150 F181 V182	G142-A146 WeakPolarHBondContact O-CB 3.39Å; G142-A146 PolarHBondContact O-N 3.1Å; H143-A146 PolarHBondContact O-N 3.4Å; A146-M148 VanDerWaalsContact C-N 3.34Å; A146-M148 PolarHBondContact O-N 3.46Å; A146-L149 PolarHBondContact O-N 3.28Å; A146-D150 WeakPolarHBondContact O-CB 3.39Å; A146-D150 PolarHBondContact O-N 3.35Å; A146-F181 HydrophobicContact CB-CB 3.58Å; A146-V182 HydrophobicContact CB-CB 4.29Å
147	R	97.8	Very high	95.9	Very high	136 Å²	136	53.6 Å²	53.6	51%	0.513	26%	0.256	S	S	.	.	H	α-helix	trans	-63.8	-36.4	174.7	-72.9	-173.2	67.3	-173.4	-0.1	113.3	L68 H143 S144 I145 W151	L68-R147 HydrophobicContact CD1-CB 3.78Å; H143-R147 WeakPolarHBondContact O-CG 3.39Å; H143-R147 PolarHBondContact O-N 3.43Å; S144-R147 PolarHBondContact O-N 3.42Å; I145-R147 VanDerWaalsContact C-N 3.28Å; I145-R147 PolarHBondContact O-N 2.99Å; R147-W151 WeakPolarHBondContact O-CB 3.45Å; R147-W151 PolarHBondContact O-N 3.13Å
148	M	96.9	Very high	95.8	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-65.3	-46.2	173.8	176.6	61.8	82.7	0	0	110.8	F51 L66 L68 S144 I145 A146 W151 L152	F51-M148 HydrophobicContact CB-CE 4.07Å; F51-M148 HydrophobicContact CD1-CE 4.37Å; F51-M148 HydrophobicContact CD1-CG 4.2Å; F51-M148 HydrophobicContact CD2-CE 3.31Å; F51-M148 HydrophobicContact CE1-CB 3.9Å; F51-M148 HydrophobicContact CE1-CG 4.08Å; F51-M148 HydrophobicContact CE2-CB 4.1Å; F51-M148 HydrophobicContact CE2-CE 3.76Å; F51-M148 HydrophobicContact CE2-CG 4.44Å; F51-M148 HydrophobicContact CG-CE 3.66Å; F51-M148 HydrophobicContact CG-CG 4.41Å; F51-M148 HydrophobicContact CZ-CB 3.68Å; F51-M148 HydrophobicContact CZ-CE 4.44Å; F51-M148 HydrophobicContact CZ-CG 4.21Å; L66-M148 HydrophobicContact CB-CE 4.09Å; L68-M148 HydrophobicContact CB-CE 4.33Å; S144-M148 PolarHBondContact O-N 2.84Å; S144-M148 VanDerWaalsContact O-N 3.14Å; I145-M148 WeakPolarHBondContact O-CB 3.24Å; I145-M148 PolarHBondContact O-N 2.86Å; A146-M148 VanDerWaalsContact C-N 3.34Å; A146-M148 PolarHBondContact O-N 3.46Å; M148-W151 PolarHBondContact O-N 3.36Å; M148-W151 HydrophobicContact SD-CE3 3.63Å; M148-W151 HydrophobicContact SD-CZ3 3.91Å; M148-L152 HydrophobicContact CG-CD1 4.19Å; M148-L152 WeakPolarHBondContact O-CG 2.98Å; M148-L152 PolarHBondContact O-N 3.06Å; M148-L152 HydrophobicContact SD-CD1 4.41Å; M148-L152 HydrophobicContact SD-CG 4.34Å
149	L	97.9	Very high	95.7	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-62.9	-42.2	176.5	-66	175.7	0	0	0	112	F87 I145 A146 W151 L152 Q153 F158 L160 V163 L165 V182 V186	F87-L149 HydrophobicContact CD2-CD2 4.33Å; F87-L149 HydrophobicContact CE2-CD2 3.55Å; F87-L149 HydrophobicContact CZ-CD2 3.82Å; I145-L149 HydrophobicContact CG2-CD1 4.17Å; I145-L149 HydrophobicContact CG2-CG 4.36Å; I145-L149 WeakPolarHBondContact O-CG 3.27Å; I145-L149 PolarHBondContact O-N 3.01Å; A146-L149 PolarHBondContact O-N 3.28Å; L149-W151 VanDerWaalsContact C-N 3.3Å; L149-W151 PolarHBondContact O-N 3.16Å; L149-L152 PolarHBondContact O-N 3.49Å; L149-Q153 WeakPolarHBondContact O-CG 3.31Å; L149-Q153 PolarHBondContact O-N 2.71Å; L149-F158 HydrophobicContact CD2-CZ 4.31Å; L149-L160 HydrophobicContact CB-CD2 4.15Å; L149-V163 HydrophobicContact CD1-CG1 4.45Å; L149-V163 HydrophobicContact CD2-CG1 3.98Å; L149-V163 HydrophobicContact CD2-CG2 4.05Å; L149-L165 HydrophobicContact CD1-CD2 4.42Å; L149-V182 HydrophobicContact CB-CG2 3.7Å; L149-V182 HydrophobicContact CD1-CG2 4.27Å; L149-V186 HydrophobicContact CD1-CG1 3.91Å
150	D	97.6	Very high	95.7	Very high	24 Å²	24	47.9 Å²	47.9	13%	0.128	24%	0.239	C	C	.	.	H	α-helix	trans	-58.5	-40.1	173.7	-82.1	0.4	0	0	0	112.4	A146 Q153 E154 V182 K183	A146-D150 WeakPolarHBondContact O-CB 3.39Å; A146-D150 PolarHBondContact O-N 3.35Å; D150-Q153 WeakPolarHBondContact O-CG 3.41Å; D150-Q153 PolarHBondContact OD1-NE2 3.47Å; D150-E154 WeakPolarHBondContact O-CG 3.24Å; D150-V182 VanDerWaalsContact OD1-CG2 3.24Å; D150-V182 WeakPolarHBondContact OD1-CG2 3.47Å; D150-K183 PolarHBondContact OD1-N 2.91Å
151	W	96.1	Very high	95.7	Very high	21 Å²	21	50.3 Å²	50.3	8%	0.08	25%	0.245	C	C	.	.	H	α-helix	trans	-72.7	-36.5	176	173.5	69.1	0	0	0	112.7	L68 H70 L74 R147 M148 L149 E154	L68-W151 HydrophobicContact CG-CB 4.39Å; L68-W151 HydrophobicContact CG-CG 4.5Å; H70-W151 WeakPolarHBondContact O-CH2 3.45Å; L74-W151 HydrophobicContact CB-CH2 4.19Å; L74-W151 HydrophobicContact CD1-CZ3 4.41Å; L74-W151 HydrophobicContact CD2-CH2 3.79Å; L74-W151 HydrophobicContact CD2-CZ3 4.04Å; L74-W151 HydrophobicContact CG-CH2 4.45Å; R147-W151 WeakPolarHBondContact O-CB 3.45Å; R147-W151 PolarHBondContact O-N 3.13Å; M148-W151 PolarHBondContact O-N 3.36Å; M148-W151 HydrophobicContact SD-CE3 3.63Å; M148-W151 HydrophobicContact SD-CZ3 3.91Å; L149-W151 VanDerWaalsContact C-N 3.3Å; L149-W151 PolarHBondContact O-N 3.16Å; W151-E154 WeakPolarHBondContact O-CB 3.16Å; W151-E154 PolarHBondContact O-N 3.23Å
152	L	95.3	Very high	95.7	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-66.4	-38.8	176.4	-71.4	171	0	0	0	111.8	L74 F79 F87 M148 L149 E154 K155 F158	L74-L152 HydrophobicContact CD1-CD2 4Å; L74-L152 HydrophobicContact CD2-CD2 3.91Å; F79-L152 HydrophobicContact CE1-CD2 4.33Å; F79-L152 HydrophobicContact CZ-CD1 4.27Å; F87-L152 HydrophobicContact CZ-CD1 4.26Å; M148-L152 HydrophobicContact CG-CD1 4.19Å; M148-L152 WeakPolarHBondContact O-CG 2.98Å; M148-L152 PolarHBondContact O-N 3.06Å; M148-L152 HydrophobicContact SD-CD1 4.41Å; M148-L152 HydrophobicContact SD-CG 4.34Å; L149-L152 PolarHBondContact O-N 3.49Å; L152-E154 PolarHBondContact O-N 3.4Å; L152-K155 VanDerWaalsContact O-CB 3.3Å; L152-K155 WeakPolarHBondContact O-CB 3.23Å; L152-K155 PolarHBondContact O-N 2.98Å; L152-F158 HydrophobicContact CB-CD1 3.72Å; L152-F158 HydrophobicContact CB-CD2 4.18Å; L152-F158 HydrophobicContact CB-CE1 3.61Å; L152-F158 HydrophobicContact CB-CE2 4.11Å; L152-F158 HydrophobicContact CB-CG 3.98Å; L152-F158 HydrophobicContact CB-CZ 3.81Å; L152-F158 HydrophobicContact CD1-CE1 4.47Å; L152-F158 HydrophobicContact CD1-CE2 4.06Å; L152-F158 HydrophobicContact CD1-CZ 3.87Å; L152-F158 HydrophobicContact CG-CZ 4.48Å; L152-F158 WeakPolarHBondContact O-CB 3.33Å
153	Q	94.9	Very high	95.7	Very high	67 Å²	67	53 Å²	53	31%	0.313	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-13.4	176.7	66	169.7	-56.9	0	0	114.3	L149 D150 K155 F158 K183	L149-Q153 WeakPolarHBondContact O-CG 3.31Å; L149-Q153 PolarHBondContact O-N 2.71Å; D150-Q153 WeakPolarHBondContact O-CG 3.41Å; D150-Q153 PolarHBondContact OD1-NE2 3.47Å; Q153-K155 PolarHBondContact O-N 2.65Å; Q153-F158 HydrophobicContact CB-CD1 4.22Å; Q153-K183 PolarHBondContact NE2-O 2.5Å; Q153-K183 PolarHBondContact OE1-O 2.89Å
154	E	93.1	Very high	95.7	Very high	140 Å²	140	48.5 Å²	48.5	65%	0.654	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-9.8	170	-69.6	170.9	-178.2	0	0	112.1	D150 W151 L152	D150-E154 WeakPolarHBondContact O-CG 3.24Å; W151-E154 WeakPolarHBondContact O-CB 3.16Å; W151-E154 PolarHBondContact O-N 3.23Å; L152-E154 PolarHBondContact O-N 3.4Å
155	K	88.8	Confident	95.8	Very high	61 Å²	61	46.9 Å²	46.9	27%	0.265	23%	0.227	S	C	.	.	S	Bend	trans	-95.6	143.5	177.9	-51.2	-62.1	-171.8	172.4	0	110	S71 M81 L152 Q153	S71-K155 PolarHBondContact OG-NZ 3.11Å; M81-K155 HydrophobicContact CE-CB 3.58Å; M81-K155 HydrophobicContact CE-CG 3.68Å; M81-K155 HydrophobicContact SD-CB 4.3Å; L152-K155 VanDerWaalsContact O-CB 3.3Å; L152-K155 WeakPolarHBondContact O-CB 3.23Å; L152-K155 PolarHBondContact O-N 2.98Å; Q153-K155 PolarHBondContact O-N 2.65Å
156	D	84.6	Confident	95.8	Very high	145 Å²	145	47 Å²	47	78%	0.775	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.5	147.4	176.2	-63.4	-40.9	0	0	0	110.8	F158	D156-F158 PolarHBondContact O-N 2.85Å; D156-F158 VanDerWaalsContact O-N 3.12Å
157	D	89.3	Confident	95.8	Very high	130 Å²	130	46.9 Å²	46.9	70%	0.695	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.9	-7.5	177	-53.8	-42.2	0	0	0	118	M81 T82	M81-D157 HydrophobicContact CB-CB 4.39Å; T82-D157 HydrophobicContact CG2-CB 3.87Å
158	F	95.6	Very high	95.9	Very high	18 Å²	18	40.7 Å²	40.7	8%	0.079	20%	0.203	C	C	.	.			trans	-80.1	123.9	174.4	-172.6	-96.3	0	0	0	111.7	F79 M81 L149 L152 Q153 D156 L160 V163	F79-F158 HydrophobicContact CE1-CD2 4.21Å; F79-F158 HydrophobicContact CE1-CE2 4.18Å; F79-F158 HydrophobicContact CZ-CE2 4.05Å; M81-F158 HydrophobicContact SD-CB 4.29Å; M81-F158 HydrophobicContact SD-CD2 4.41Å; L149-F158 HydrophobicContact CD2-CZ 4.31Å; L152-F158 HydrophobicContact CB-CD1 3.72Å; L152-F158 HydrophobicContact CB-CD2 4.18Å; L152-F158 HydrophobicContact CB-CE1 3.61Å; L152-F158 HydrophobicContact CB-CE2 4.11Å; L152-F158 HydrophobicContact CB-CG 3.98Å; L152-F158 HydrophobicContact CB-CZ 3.81Å; L152-F158 HydrophobicContact CD1-CE1 4.47Å; L152-F158 HydrophobicContact CD1-CE2 4.06Å; L152-F158 HydrophobicContact CD1-CZ 3.87Å; L152-F158 HydrophobicContact CG-CZ 4.48Å; L152-F158 WeakPolarHBondContact O-CB 3.33Å; Q153-F158 HydrophobicContact CB-CD1 4.22Å; D156-F158 PolarHBondContact O-N 2.85Å; D156-F158 VanDerWaalsContact O-N 3.12Å; F158-L160 HydrophobicContact CE1-CD2 4.13Å; F158-V163 HydrophobicContact CE1-CG2 4.07Å; F158-V163 HydrophobicContact CE2-CG2 4.41Å; F158-V163 HydrophobicContact CZ-CG2 3.55Å
159	S	96.9	Very high	95.9	Very high	34 Å²	34	41.1 Å²	41.1	24%	0.238	21%	0.206	C	C	.	.			trans	-118.6	130.8	178.4	-175.9	0	0	0	0	111.7	E161 N162	S159-E161 WeakPolarHBondContact CB-OE1 3.39Å; S159-E161 PolarHBondContact O-N 3.2Å; S159-E161 VanDerWaalsContact OG-CD 3.23Å; S159-E161 WeakPolarHBondContact OG-CG 3.27Å; S159-E161 PolarHBondContact OG-N 2.83Å; S159-E161 PolarHBondContact OG-OE1 3.26Å; S159-N162 WeakPolarHBondContact O-CB 3.39Å; S159-N162 PolarHBondContact O-N 3.24Å; S159-N162 VanDerWaalsContact O-N 3.08Å
160	L	98.1	Very high	95.9	Very high	17 Å²	17	41.1 Å²	41.1	9%	0.089	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-62.3	-23.9	175.1	-68.4	175.8	0	0	0	112.4	L149 F158 N162 V163 V182 K183 T185 V186 G187	L149-L160 HydrophobicContact CB-CD2 4.15Å; F158-L160 HydrophobicContact CE1-CD2 4.13Å; L160-N162 PolarHBondContact O-N 2.9Å; L160-V163 HydrophobicContact CD2-CG2 4.43Å; L160-V163 WeakPolarHBondContact O-CB 3.34Å; L160-V163 PolarHBondContact O-N 3.11Å; L160-V182 HydrophobicContact CD1-CG2 4.11Å; L160-V182 HydrophobicContact CD2-CG2 4.03Å; L160-K183 WeakPolarHBondContact CD1-O 3.38Å; L160-T185 WeakPolarHBondContact CB-O 3.37Å; L160-V186 HydrophobicContact CD2-CG1 4.34Å; L160-V186 CarbonylContact O-C 3.14Å; L160-V186 WeakPolarHBondContact O-CA 3.32Å; L160-G187 PolarHBondContact O-N 3.37Å
161	E	97.6	Very high	95.9	Very high	133 Å²	133	40 Å²	40	62%	0.621	20%	0.2	S	C	*	.	G	3₁₀ helix	trans	-64.7	-25.2	176.2	85.4	-159.8	129.5	0	0	112.4	S159 V163 G187	S159-E161 WeakPolarHBondContact CB-OE1 3.39Å; S159-E161 PolarHBondContact O-N 3.2Å; S159-E161 VanDerWaalsContact OG-CD 3.23Å; S159-E161 WeakPolarHBondContact OG-CG 3.27Å; S159-E161 PolarHBondContact OG-N 2.83Å; S159-E161 PolarHBondContact OG-OE1 3.26Å; E161-V163 VanDerWaalsContact C-N 3.29Å; E161-G187 WeakPolarHBondContact O-CA 3.48Å
162	N	97.5	Very high	96.1	Very high	56 Å²	56	39 Å²	39	30%	0.299	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-85.8	-1.4	177.2	-73.8	-25.3	0	0	0	112.7	K84 T85 S159 L160	K84-N162 WeakPolarHBondContact CG-O 3.38Å; T85-N162 PolarHBondContact N-O 3.46Å; S159-N162 WeakPolarHBondContact O-CB 3.39Å; S159-N162 PolarHBondContact O-N 3.24Å; S159-N162 VanDerWaalsContact O-N 3.08Å; L160-N162 PolarHBondContact O-N 2.9Å
163	V	98.7	Very high	96.2	Very high	1 Å²	1	39 Å²	39	1%	0.006	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	128.1	179.3	178.7	0	0	0	0	110.6	T85 F87 L149 F158 L160 E161 L165 V186 G187 R188	T85-V163 WeakPolarHBondContact O-CA 3.13Å; F87-V163 HydrophobicContact CD2-CG1 4.11Å; F87-V163 HydrophobicContact CE2-CG1 4.32Å; L149-V163 HydrophobicContact CD1-CG1 4.45Å; L149-V163 HydrophobicContact CD2-CG1 3.98Å; L149-V163 HydrophobicContact CD2-CG2 4.05Å; F158-V163 HydrophobicContact CE1-CG2 4.07Å; F158-V163 HydrophobicContact CE2-CG2 4.41Å; F158-V163 HydrophobicContact CZ-CG2 3.55Å; L160-V163 HydrophobicContact CD2-CG2 4.43Å; L160-V163 WeakPolarHBondContact O-CB 3.34Å; L160-V163 PolarHBondContact O-N 3.11Å; E161-V163 VanDerWaalsContact C-N 3.29Å; V163-L165 HydrophobicContact CG1-CD2 3.62Å; V163-L165 HydrophobicContact CG1-CG 4.22Å; V163-V186 HydrophobicContact CB-CB 4.32Å; V163-V186 HydrophobicContact CB-CG1 4.27Å; V163-V186 HydrophobicContact CG1-CB 4.31Å; V163-V186 HydrophobicContact CG1-CG1 4.06Å; V163-G187 PolarHBondContact O-N 2.91Å; V163-R188 PolarHBondContact O-N 2.82Å; V163-R188 VanDerWaalsContact O-N 3.08Å
164	H	98.9	Very high	96.4	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	106.5	172.2	-172.8	174.3	0	0	0	110.3	T85 F86 F87 R188 T190	T85-H164 PolarHBondContact O-N 3.49Å; F86-H164 WeakPolarHBondContact CA-O 3.48Å; F86-H164 HydrophobicContact CD1-CB 3.69Å; F86-H164 AromaticContact CD1-CG 3.92Å; F86-H164 AromaticContact CD1-ND1 3.87Å; F86-H164 HydrophobicContact CE1-CB 3.85Å; F86-H164 AromaticContact CE1-CG 3.91Å; F86-H164 AromaticContact CE1-ND1 3.43Å; F86-H164 WeakPolarHBondContact CE1-ND1 3.43Å; F87-H164 PolarHBondContact N-O 3.4Å; H164-R188 CarbonylContact C-O 3.56Å; H164-R188 VanDerWaalsContact CA-O 3.29Å; H164-R188 WeakPolarHBondContact CA-O 3.06Å; H164-R188 HydrophobicContact CB-CB 4.37Å; H164-R188 VanDerWaalsContact CE1-CD 3.49Å; H164-R188 WeakPolarHBondContact CE1-CD 3.39Å; H164-T190 PolarHBondContact CE1-OG1 2.95Å; H164-T190 PolarHBondContact NE2-OG1 3.08Å
165	L	98.9	Very high	96.7	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	126.2	174	-46.2	-179	0	0	0	109.7	F87 I89 L149 V163 A175 A178 V186 R188 I189 T190	F87-L165 HydrophobicContact CB-CD2 3.63Å; F87-L165 HydrophobicContact CD2-CD2 3.81Å; F87-L165 HydrophobicContact CG-CD2 3.93Å; I89-L165 HydrophobicContact CD1-CB 4.31Å; L149-L165 HydrophobicContact CD1-CD2 4.42Å; V163-L165 HydrophobicContact CG1-CD2 3.62Å; V163-L165 HydrophobicContact CG1-CG 4.22Å; L165-A175 HydrophobicContact CB-CB 3.95Å; L165-A175 HydrophobicContact CD1-CB 4.29Å; L165-A178 HydrophobicContact CD1-CB 4.02Å; L165-V186 HydrophobicContact CD1-CG2 4.32Å; L165-R188 PolarHBondContact N-O 3.2Å; L165-I189 HydrophobicContact CB-CG1 4.08Å; L165-I189 HydrophobicContact CD1-CD1 4.43Å; L165-I189 HydrophobicContact CD1-CG1 4.11Å; L165-I189 HydrophobicContact CG-CG1 4.32Å; L165-I189 CarbonylContact O-C 3.48Å; L165-I189 VanDerWaalsContact O-CA 3.29Å; L165-I189 WeakPolarHBondContact O-CA 3.4Å; L165-T190 PolarHBondContact O-N 2.88Å
166	I	98.9	Very high	97.2	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.005	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	104.8	178.5	-57.5	169.1	0	0	0	107.4	F86 F87 I88 I89 L105 L109 L192 F281	F86-I166 HydrophobicContact CD1-CD1 3.85Å; F87-I166 PolarHBondContact O-N 2.93Å; I88-I166 WeakPolarHBondContact CA-O 3.29Å; I89-I166 PolarHBondContact N-O 2.78Å; L105-I166 HydrophobicContact CD2-CG2 4.12Å; L109-I166 HydrophobicContact CD1-CD1 4.05Å; L109-I166 HydrophobicContact CD2-CD1 4.38Å; I166-L192 HydrophobicContact CG2-CD1 3.52Å; I166-L192 HydrophobicContact CG2-CG 4.14Å; I166-F281 HydrophobicContact CD1-CE1 3.78Å; I166-F281 HydrophobicContact CD1-CZ 3.95Å; I166-F281 HydrophobicContact CG1-CZ 4.44Å
167	G	98.8	Very high	97.8	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	130.1	-176.2	0	0	0	0	0	112.3	I89 G171 T190 L192	I89-G167 WeakPolarHBondContact O-CA 3.25Å; G167-G171 VanDerWaalsContact CA-C 3.46Å; G167-G171 WeakPolarHBondContact CA-O 3.34Å; G167-T190 PolarHBondContact N-O 3.36Å; G167-L192 PolarHBondContact O-N 3.37Å
168	Y	98.5	Very high	98.3	Very high	5 Å²	5	14.1 Å²	14.1	2%	0.02	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	133.6	175.1	169	-117.6	0	0	0	111.2	I89 G91 W101 L170 G171 L192 H274 E275 V278	I89-Y168 PolarHBondContact O-N 3.06Å; G91-Y168 VanDerWaalsContact CA-O 3.3Å; G91-Y168 WeakPolarHBondContact CA-O 3.36Å; G91-Y168 PolarHBondContact N-O 3Å; W101-Y168 AromaticContact CE2-CD1 3.68Å; W101-Y168 AromaticContact CE2-CE1 3.98Å; W101-Y168 HydrophobicContact CH2-CD1 4.15Å; W101-Y168 HydrophobicContact CH2-CG 4.4Å; W101-Y168 AromaticContact CZ2-CD1 3.39Å; W101-Y168 HydrophobicContact CZ2-CD1 3.39Å; W101-Y168 HydrophobicContact CZ2-CE1 4.1Å; W101-Y168 HydrophobicContact CZ2-CG 4.05Å; W101-Y168 AromaticContact NE1-CD1 3.83Å; W101-Y168 AromaticContact NE1-CE1 3.62Å; Y168-L170 PolarHBondContact O-N 2.83Å; Y168-G171 VanDerWaalsContact O-CA 3.32Å; Y168-G171 WeakPolarHBondContact O-CA 3.37Å; Y168-G171 PolarHBondContact O-N 2.81Å; Y168-L192 WeakPolarHBondContact CA-O 3.43Å; Y168-L192 HydrophobicContact CD2-CB 4.25Å; Y168-L192 WeakPolarHBondContact CD2-O 3.33Å; Y168-H274 AromaticContact CE2-CD2 3.84Å; Y168-H274 AromaticContact CZ-CD2 3.55Å; Y168-H274 PolarHBondContact OH-CD2 3.35Å; Y168-E275 WeakPolarHBondContact OH-CG 3.28Å; Y168-V278 HydrophobicContact CD2-CG2 3.6Å; Y168-V278 HydrophobicContact CE2-CG2 4.05Å; Y168-V278 HydrophobicContact CG-CG2 3.97Å
169	S	97.1	Very high	98.4	Very high	9 Å²	9	13.5 Å²	13.5	6%	0.063	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.9	-122.5	176.8	-170.3	0	0	0	0	112	G171 A172 L192 D193 A195 H274	S169-G171 PolarHBondContact O-N 2.75Å; S169-A172 WeakPolarHBondContact O-CB 3.36Å; S169-A172 PolarHBondContact O-N 3.13Å; S169-A172 VanDerWaalsContact O-N 3.13Å; S169-L192 PolarHBondContact N-O 3.47Å; S169-D193 WeakPolarHBondContact CA-O 3.46Å; S169-A195 PolarHBondContact O-N 3.5Å; S169-H274 WeakPolarHBondContact CB-NE2 3.42Å; S169-H274 PolarHBondContact OG-NE2 3.12Å
170	L	98.4	Very high	98.4	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-55.2	-32.2	170.8	-71.1	-170.4	0	0	0	113.1	W92 W123 Y131 A134 V135 T138 Y168 A172 H173 V174 A195 F199	W92-L170 HydrophobicContact CB-CD1 3.7Å; W92-L170 HydrophobicContact CB-CG 4.13Å; W92-L170 HydrophobicContact CG-CD1 4.42Å; W123-L170 HydrophobicContact CH2-CB 3.91Å; W123-L170 HydrophobicContact CH2-CD1 3.94Å; W123-L170 HydrophobicContact CZ2-CB 4.1Å; Y131-L170 HydrophobicContact CE2-CD2 4.27Å; A134-L170 HydrophobicContact CB-CD1 3.77Å; V135-L170 HydrophobicContact CG2-CD2 3.83Å; T138-L170 HydrophobicContact CG2-CB 3.96Å; T138-L170 HydrophobicContact CG2-CD1 4.31Å; T138-L170 HydrophobicContact CG2-CD2 4.21Å; T138-L170 HydrophobicContact CG2-CG 4.41Å; Y168-L170 PolarHBondContact O-N 2.83Å; L170-A172 PolarHBondContact O-N 3.23Å; L170-H173 PolarHBondContact O-N 3.45Å; L170-H173 VanDerWaalsContact O-N 3.09Å; L170-V174 PolarHBondContact O-N 2.9Å; L170-V174 VanDerWaalsContact O-N 3.09Å; L170-A195 HydrophobicContact CD2-CB 3.77Å; L170-A195 HydrophobicContact CG-CB 4.48Å; L170-F199 HydrophobicContact CD2-CD2 4.5Å; L170-F199 HydrophobicContact CD2-CE2 3.54Å; L170-F199 HydrophobicContact CD2-CZ 4.23Å
171	G	98.7	Very high	98.5	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-62	-25.5	178	0	0	0	0	0	113.8	H90 G167 Y168 S169 V174 A175	H90-G171 VanDerWaalsContact O-CA 3.3Å; H90-G171 WeakPolarHBondContact O-CA 3.1Å; H90-G171 PolarHBondContact O-N 2.83Å; G167-G171 VanDerWaalsContact CA-C 3.46Å; G167-G171 WeakPolarHBondContact CA-O 3.34Å; Y168-G171 VanDerWaalsContact O-CA 3.32Å; Y168-G171 WeakPolarHBondContact O-CA 3.37Å; Y168-G171 PolarHBondContact O-N 2.81Å; S169-G171 PolarHBondContact O-N 2.75Å; G171-V174 WeakPolarHBondContact O-CB 3.28Å; G171-V174 PolarHBondContact O-N 3.47Å; G171-A175 WeakPolarHBondContact O-CB 3.42Å; G171-A175 PolarHBondContact O-N 2.76Å
172	A	98.8	Very high	98.5	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-66.6	-39.5	173.6	0	0	0	0	0	111.9	S169 L170 A175 G176 P194 L208	S169-A172 WeakPolarHBondContact O-CB 3.36Å; S169-A172 PolarHBondContact O-N 3.13Å; S169-A172 VanDerWaalsContact O-N 3.13Å; L170-A172 PolarHBondContact O-N 3.23Å; A172-A175 WeakPolarHBondContact O-CB 2.84Å; A172-A175 PolarHBondContact O-N 3.27Å; A172-G176 PolarHBondContact O-N 2.89Å; A172-G176 VanDerWaalsContact O-N 3.08Å; A172-P194 HydrophobicContact CB-CB 3.62Å; A172-P194 HydrophobicContact CB-CG 3.72Å; A172-L208 HydrophobicContact CB-CD2 4.32Å
173	H	98.8	Very high	98.5	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-72.6	-36.6	174.7	-58.9	-74.6	0	0	0	111.5	L170 A175 G176 Y177 A195 F199 R207 L208	L170-H173 PolarHBondContact O-N 3.45Å; L170-H173 VanDerWaalsContact O-N 3.09Å; H173-A175 VanDerWaalsContact C-N 3.29Å; H173-A175 PolarHBondContact O-N 3.46Å; H173-G176 PolarHBondContact O-N 2.93Å; H173-Y177 HydrophobicContact CB-CE2 4.4Å; H173-Y177 WeakPolarHBondContact O-CD2 3.5Å; H173-Y177 PolarHBondContact O-N 2.94Å; H173-A195 PolarHBondContact NE2-N 2.94Å; H173-A195 PolarHBondContact NE2-O 3.31Å; H173-F199 HydrophobicContact CB-CD1 4.25Å; H173-F199 HydrophobicContact CB-CE1 3.67Å; H173-F199 HydrophobicContact CB-CE2 4.5Å; H173-F199 HydrophobicContact CB-CZ 3.81Å; H173-F199 AromaticContact CD2-CD2 3.63Å; H173-F199 AromaticContact CD2-CE2 3.67Å; H173-F199 AromaticContact CD2-CG 3.8Å; H173-F199 AromaticContact CD2-CZ 3.85Å; H173-F199 AromaticContact CE1-CD1 3.72Å; H173-F199 AromaticContact CE1-CG 3.5Å; H173-F199 AromaticContact CG-CD1 3.61Å; H173-F199 AromaticContact CG-CE1 3.51Å; H173-F199 AromaticContact CG-CG 3.88Å; H173-F199 AromaticContact CG-CZ 3.72Å; H173-F199 AromaticContact ND1-CD1 3.41Å; H173-F199 WeakPolarHBondContact ND1-CD1 3.18Å; H173-F199 AromaticContact ND1-CE1 3.77Å; H173-F199 AromaticContact ND1-CG 3.69Å; H173-F199 AromaticContact NE2-CD2 3.65Å; H173-F199 AromaticContact NE2-CG 3.59Å; H173-R207 WeakPolarHBondContact ND1-CA 3.14Å; H173-R207 WeakPolarHBondContact ND1-CB 3.25Å; H173-L208 PolarHBondContact ND1-N 2.9Å
174	V	98.9	Very high	98.4	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-56.1	-44.9	170.1	173.2	0	0	0	0	111	I89 W123 T138 V141 I145 L170 G171 Y177 A178	I89-V174 HydrophobicContact CD1-CG1 4.45Å; I89-V174 HydrophobicContact CG2-CB 3.87Å; I89-V174 HydrophobicContact CG2-CG1 3.65Å; I89-V174 HydrophobicContact CG2-CG2 4.48Å; W123-V174 HydrophobicContact CZ2-CG2 4.37Å; T138-V174 HydrophobicContact CG2-CG2 3.83Å; V141-V174 HydrophobicContact CB-CG1 3.93Å; V141-V174 HydrophobicContact CB-CG2 4.24Å; V141-V174 HydrophobicContact CG1-CG1 3.53Å; V141-V174 HydrophobicContact CG1-CG2 4.4Å; I145-V174 HydrophobicContact CD1-CG1 3.51Å; L170-V174 PolarHBondContact O-N 2.9Å; L170-V174 VanDerWaalsContact O-N 3.09Å; G171-V174 WeakPolarHBondContact O-CB 3.28Å; G171-V174 PolarHBondContact O-N 3.47Å; V174-Y177 PolarHBondContact O-N 2.71Å; V174-A178 WeakPolarHBondContact O-CB 3.41Å; V174-A178 PolarHBondContact O-N 3.06Å
175	A	98.9	Very high	98.3	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-61.2	-43.5	175.7	0	0	0	0	0	112	I89 L165 G171 A172 H173 A178 G179 I189	I89-A175 HydrophobicContact CD1-CB 3.76Å; L165-A175 HydrophobicContact CB-CB 3.95Å; L165-A175 HydrophobicContact CD1-CB 4.29Å; G171-A175 WeakPolarHBondContact O-CB 3.42Å; G171-A175 PolarHBondContact O-N 2.76Å; A172-A175 WeakPolarHBondContact O-CB 2.84Å; A172-A175 PolarHBondContact O-N 3.27Å; H173-A175 VanDerWaalsContact C-N 3.29Å; H173-A175 PolarHBondContact O-N 3.46Å; A175-A178 PolarHBondContact O-N 2.84Å; A175-G179 PolarHBondContact O-N 3.38Å; A175-I189 HydrophobicContact CB-CG2 3.8Å
176	G	98.8	Very high	98.3	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.01	12%	0.117	C	C	.	.	H	α-helix	trans	-60.5	-47.3	174.9	0	0	0	0	0	113	A172 H173 A178 G179 N180 D212	A172-G176 PolarHBondContact O-N 2.89Å; A172-G176 VanDerWaalsContact O-N 3.08Å; H173-G176 PolarHBondContact O-N 2.93Å; G176-A178 VanDerWaalsContact C-N 3.32Å; G176-A178 PolarHBondContact O-N 3.06Å; G176-G179 PolarHBondContact O-N 3.48Å; G176-N180 WeakPolarHBondContact O-CB 3.48Å; G176-N180 PolarHBondContact O-N 3.39Å; G176-D212 WeakPolarHBondContact CA-OD2 3.43Å
177	Y	98.8	Very high	98.3	Very high	20 Å²	20	21.4 Å²	21.4	8%	0.078	12%	0.123	C	C	.	.	H	α-helix	trans	-59.6	-41.5	173.8	-73.7	-56.3	0	0	0	112.5	T138 R139 H173 V174 N180 F181 F199 H205 K206	T138-Y177 WeakPolarHBondContact OG1-CE2 3.47Å; R139-Y177 HydrophobicContact CB-CD2 4.33Å; R139-Y177 HydrophobicContact CB-CE1 4.4Å; R139-Y177 HydrophobicContact CB-CE2 4.21Å; R139-Y177 HydrophobicContact CB-CG 4.5Å; R139-Y177 HydrophobicContact CG-CD1 4.25Å; R139-Y177 HydrophobicContact CG-CE1 4.24Å; H173-Y177 HydrophobicContact CB-CE2 4.4Å; H173-Y177 WeakPolarHBondContact O-CD2 3.5Å; H173-Y177 PolarHBondContact O-N 2.94Å; V174-Y177 PolarHBondContact O-N 2.71Å; Y177-N180 PolarHBondContact O-N 3.4Å; Y177-F181 HydrophobicContact CD1-CE2 4.18Å; Y177-F181 HydrophobicContact CD1-CZ 4.14Å; Y177-F181 HydrophobicContact CG-CE2 4.38Å; Y177-F181 WeakPolarHBondContact O-CB 3.34Å; Y177-F181 WeakPolarHBondContact O-CD2 3.38Å; Y177-F181 VanDerWaalsContact O-CG 3.23Å; Y177-F181 WeakPolarHBondContact O-CG 3.21Å; Y177-F181 PolarHBondContact O-N 3.28Å; Y177-F199 HydrophobicContact CE2-CE1 4.46Å; Y177-H205 WeakPolarHBondContact CE1-O 3.46Å; Y177-K206 WeakPolarHBondContact OH-CA 3.31Å; Y177-K206 PolarHBondContact OH-O 3.05Å
178	A	98.8	Very high	98.3	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-62.2	-45.5	176.8	0	0	0	0	0	111.8	G142 I145 L165 V174 A175 G176 N180 F181 V182	G142-A178 WeakPolarHBondContact O-CA 3.43Å; I145-A178 HydrophobicContact CB-CB 3.82Å; I145-A178 HydrophobicContact CD1-CB 4.44Å; I145-A178 HydrophobicContact CG2-CB 3.79Å; L165-A178 HydrophobicContact CD1-CB 4.02Å; V174-A178 WeakPolarHBondContact O-CB 3.41Å; V174-A178 PolarHBondContact O-N 3.06Å; A175-A178 PolarHBondContact O-N 2.84Å; G176-A178 VanDerWaalsContact C-N 3.32Å; G176-A178 PolarHBondContact O-N 3.06Å; A178-N180 VanDerWaalsContact C-N 3.33Å; A178-N180 PolarHBondContact O-N 3.4Å; A178-F181 PolarHBondContact O-N 2.77Å; A178-V182 WeakPolarHBondContact O-CB 3.46Å; A178-V182 PolarHBondContact O-N 3.43Å
179	G	98.4	Very high	98.3	Very high	6 Å²	6	22.4 Å²	22.4	6%	0.062	13%	0.127	C	C	.	.	H	α-helix	trans	-64.1	-33	176.8	0	0	0	0	0	114	A175 G176 V182 D212	A175-G179 PolarHBondContact O-N 3.38Å; G176-G179 PolarHBondContact O-N 3.48Å; G179-V182 WeakPolarHBondContact O-CG1 3.38Å; G179-D212 CarbonylContact C-O 3.55Å; G179-D212 WeakPolarHBondContact CA-O 3.07Å
180	N	97.3	Very high	98.4	Very high	66 Å²	66	22 Å²	22	35%	0.353	12%	0.124	S	C	.	.	H	α-helix	trans	-75.2	-36.1	174.8	-174.4	-13.9	0	0	0	112.6	G176 Y177 A178	G176-N180 WeakPolarHBondContact O-CB 3.48Å; G176-N180 PolarHBondContact O-N 3.39Å; Y177-N180 PolarHBondContact O-N 3.4Å; A178-N180 VanDerWaalsContact C-N 3.33Å; A178-N180 PolarHBondContact O-N 3.4Å
181	F	98.2	Very high	98.4	Very high	61 Å²	61	22 Å²	22	27%	0.268	12%	0.124	S	C	.	.	H	α-helix	trans	-85.6	-20.5	-176.4	-64.7	-35.1	0	0	0	115.1	R139 H143 A146 Y177 A178	R139-F181 HydrophobicContact CG-CE2 3.91Å; R139-F181 HydrophobicContact CG-CZ 3.86Å; H143-F181 HydrophobicContact CB-CD2 3.97Å; H143-F181 HydrophobicContact CB-CE2 4.25Å; A146-F181 HydrophobicContact CB-CB 3.58Å; Y177-F181 HydrophobicContact CD1-CE2 4.18Å; Y177-F181 HydrophobicContact CD1-CZ 4.14Å; Y177-F181 HydrophobicContact CG-CE2 4.38Å; Y177-F181 WeakPolarHBondContact O-CB 3.34Å; Y177-F181 WeakPolarHBondContact O-CD2 3.38Å; Y177-F181 VanDerWaalsContact O-CG 3.23Å; Y177-F181 WeakPolarHBondContact O-CG 3.21Å; Y177-F181 PolarHBondContact O-N 3.28Å; A178-F181 PolarHBondContact O-N 2.77Å
182	V	98.1	Very high	98.4	Very high	9 Å²	9	22 Å²	22	6%	0.055	12%	0.124	C	C	.	.	S	Bend	trans	-69	145.6	-178.9	71.1	0	0	0	0	110.6	A146 L149 D150 L160 A178 G179 G184 V186	A146-V182 HydrophobicContact CB-CB 4.29Å; L149-V182 HydrophobicContact CB-CG2 3.7Å; L149-V182 HydrophobicContact CD1-CG2 4.27Å; D150-V182 VanDerWaalsContact OD1-CG2 3.24Å; D150-V182 WeakPolarHBondContact OD1-CG2 3.47Å; L160-V182 HydrophobicContact CD1-CG2 4.11Å; L160-V182 HydrophobicContact CD2-CG2 4.03Å; A178-V182 WeakPolarHBondContact O-CB 3.46Å; A178-V182 PolarHBondContact O-N 3.43Å; G179-V182 WeakPolarHBondContact O-CG1 3.38Å; V182-G184 PolarHBondContact O-N 3.04Å; V182-V186 HydrophobicContact CG1-CG1 4.2Å
183	K	97.6	Very high	98.4	Very high	143 Å²	143	22 Å²	22	62%	0.622	12%	0.124	S	C	*	.	S	Bend	trans	-77.1	95.6	173.4	-63.1	172.1	-168.2	167.8	0	109.3	D150 Q153 L160	D150-K183 PolarHBondContact OD1-N 2.91Å; Q153-K183 PolarHBondContact NE2-O 2.5Å; Q153-K183 PolarHBondContact OE1-O 2.89Å; L160-K183 WeakPolarHBondContact CD1-O 3.38Å
184	G	96.9	Very high	98.4	Very high	50 Å²	50	22 Å²	22	52%	0.515	12%	0.124	S	C	.	.	S	Bend	trans	126.4	-156.2	-177.7	0	0	0	0	0	110.9	V182	V182-G184 PolarHBondContact O-N 3.04Å
185	T	97.9	Very high	98.3	Very high	66 Å²	66	22 Å²	22	41%	0.405	12%	0.124	S	C	.	.			trans	-133.9	126.2	-179.5	-55.5	0	0	0	0	109	L160 D214	L160-T185 WeakPolarHBondContact CB-O 3.37Å; T185-D214 HydrophobicContact CG2-CB 4.35Å; T185-D214 VanDerWaalsContact CG2-N 3.33Å; T185-D214 WeakPolarHBondContact CG2-OD1 3.49Å
186	V	98.4	Very high	98	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.125	C	C	.	.	B	Isolated β-bridge	trans	-74.1	148	174.4	-62.9	0	0	0	0	110.5	L149 L160 V163 L165 V182 R188 I189 A213 D214	L149-V186 HydrophobicContact CD1-CG1 3.91Å; L160-V186 HydrophobicContact CD2-CG1 4.34Å; L160-V186 CarbonylContact O-C 3.14Å; L160-V186 WeakPolarHBondContact O-CA 3.32Å; V163-V186 HydrophobicContact CB-CB 4.32Å; V163-V186 HydrophobicContact CB-CG1 4.27Å; V163-V186 HydrophobicContact CG1-CB 4.31Å; V163-V186 HydrophobicContact CG1-CG1 4.06Å; L165-V186 HydrophobicContact CD1-CG2 4.32Å; V182-V186 HydrophobicContact CG1-CG1 4.2Å; V186-R188 PolarHBondContact O-N 3.45Å; V186-I189 HydrophobicContact CG2-CD1 4.25Å; V186-I189 HydrophobicContact CG2-CG1 4.07Å; V186-A213 HydrophobicContact CG2-CB 3.58Å; V186-A213 WeakPolarHBondContact O-CA 3.35Å; V186-A213 WeakPolarHBondContact O-CB 3.22Å; V186-D214 PolarHBondContact O-N 2.73Å
187	G	98.3	Very high	97.7	Very high	13 Å²	13	24.5 Å²	24.5	13%	0.134	14%	0.141	C	C	.	.	S	Bend	trans	-63.7	-39.6	-175.9	0	0	0	0	0	113.7	L160 E161 V163 D214 F215	L160-G187 PolarHBondContact O-N 3.37Å; E161-G187 WeakPolarHBondContact O-CA 3.48Å; V163-G187 PolarHBondContact O-N 2.91Å; G187-D214 WeakPolarHBondContact O-CB 3.34Å; G187-F215 PolarHBondContact O-N 2.75Å
188	R	98.7	Very high	97.5	Very high	26 Å²	26	28.8 Å²	28.8	10%	0.098	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	142.4	-179.5	-169.1	172.6	175.1	-177.4	-6.4	114.8	V163 H164 L165 V186 F215 D217 G320 Y321	V163-R188 PolarHBondContact O-N 2.82Å; V163-R188 VanDerWaalsContact O-N 3.08Å; H164-R188 CarbonylContact C-O 3.56Å; H164-R188 VanDerWaalsContact CA-O 3.29Å; H164-R188 WeakPolarHBondContact CA-O 3.06Å; H164-R188 HydrophobicContact CB-CB 4.37Å; H164-R188 VanDerWaalsContact CE1-CD 3.49Å; H164-R188 WeakPolarHBondContact CE1-CD 3.39Å; L165-R188 PolarHBondContact N-O 3.2Å; V186-R188 PolarHBondContact O-N 3.45Å; R188-F215 CarbonylContact C-O 3.41Å; R188-F215 VanDerWaalsContact CA-O 3.23Å; R188-F215 WeakPolarHBondContact CA-O 3.32Å; R188-F215 HydrophobicContact CG-CB 4.46Å; R188-F215 HydrophobicContact CG-CD1 3.94Å; R188-F215 WeakPolarHBondContact CG-O 3.39Å; R188-D217 IonicContact CZ-OD1 3.99Å; R188-D217 IonicContact CZ-OD2 2.69Å; R188-D217 IonicContact NE-OD1 4Å; R188-D217 PolarHBondContact NE-OD1 3.28Å; R188-D217 IonicContact NE-OD2 3.54Å; R188-D217 IonicContact NH2-OD1 2.74Å; R188-D217 PolarHBondContact NH2-OD1 3.08Å; R188-D217 VanDerWaalsContact NH2-OD1 3.09Å; R188-D217 IonicContact NH2-OD2 3.82Å; R188-D217 PolarHBondContact NH2-OD2 3.22Å; R188-G320 PolarHBondContact NH2-O 2.92Å; R188-Y321 PolarHBondContact NH1-O 2.77Å
189	I	98.9	Very high	97.3	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	130.6	161.9	-63	165.3	0	0	0	109.3	L165 A175 V186 L208 D212 A213 F215 V216 D217	L165-I189 HydrophobicContact CB-CG1 4.08Å; L165-I189 HydrophobicContact CD1-CD1 4.43Å; L165-I189 HydrophobicContact CD1-CG1 4.11Å; L165-I189 HydrophobicContact CG-CG1 4.32Å; L165-I189 CarbonylContact O-C 3.48Å; L165-I189 VanDerWaalsContact O-CA 3.29Å; L165-I189 WeakPolarHBondContact O-CA 3.4Å; A175-I189 HydrophobicContact CB-CG2 3.8Å; V186-I189 HydrophobicContact CG2-CD1 4.25Å; V186-I189 HydrophobicContact CG2-CG1 4.07Å; I189-L208 HydrophobicContact CB-CD1 4.42Å; I189-L208 HydrophobicContact CD1-CD1 4.27Å; I189-L208 HydrophobicContact CG2-CD1 3.65Å; I189-D212 HydrophobicContact CD1-CB 3.63Å; I189-D212 WeakPolarHBondContact CD1-O 3.22Å; I189-A213 HydrophobicContact CB-CB 4.25Å; I189-A213 HydrophobicContact CD1-CB 3.71Å; I189-A213 HydrophobicContact CG1-CB 3.7Å; I189-F215 PolarHBondContact N-O 2.85Å; I189-V216 HydrophobicContact CB-CG1 4.44Å; I189-V216 HydrophobicContact CB-CG2 4.28Å; I189-V216 VanDerWaalsContact O-CA 3.27Å; I189-V216 WeakPolarHBondContact O-CA 3.39Å; I189-D217 PolarHBondContact O-N 3.06Å
190	T	98.9	Very high	97.2	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	119.9	166	-59.9	0	0	0	0	110.1	H164 L165 G167 L192 D217 F281	H164-T190 PolarHBondContact CE1-OG1 2.95Å; H164-T190 PolarHBondContact NE2-OG1 3.08Å; L165-T190 PolarHBondContact O-N 2.88Å; G167-T190 PolarHBondContact N-O 3.36Å; T190-L192 HydrophobicContact CG2-CD2 3.72Å; T190-L192 HydrophobicContact CG2-CG 4.3Å; T190-D217 CarbonylContact C-O 3.53Å; T190-D217 VanDerWaalsContact CA-O 3.26Å; T190-D217 WeakPolarHBondContact CA-O 3.11Å; T190-D217 PolarHBondContact OG1-OD1 2.75Å; T190-D217 PolarHBondContact OG1-OD2 3.3Å; T190-F281 HydrophobicContact CG2-CD2 3.84Å; T190-F281 HydrophobicContact CG2-CE2 3.71Å
191	G	98.8	Very high	97	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	115.6	172.9	0	0	0	0	0	111.1	D217 V218 L219	G191-D217 PolarHBondContact N-O 2.77Å; G191-V218 WeakPolarHBondContact O-CA 3.17Å; G191-L219 PolarHBondContact O-N 3.41Å
192	L	98.8	Very high	96.9	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	100.2	177	-55.6	176.6	0	0	0	108.4	I166 G167 Y168 S169 T190 L219 A277 V278 F281	I166-L192 HydrophobicContact CG2-CD1 3.52Å; I166-L192 HydrophobicContact CG2-CG 4.14Å; G167-L192 PolarHBondContact O-N 3.37Å; Y168-L192 WeakPolarHBondContact CA-O 3.43Å; Y168-L192 HydrophobicContact CD2-CB 4.25Å; Y168-L192 WeakPolarHBondContact CD2-O 3.33Å; S169-L192 PolarHBondContact N-O 3.47Å; T190-L192 HydrophobicContact CG2-CD2 3.72Å; T190-L192 HydrophobicContact CG2-CG 4.3Å; L192-L219 HydrophobicContact CD2-CD1 3.86Å; L192-A277 HydrophobicContact CB-CB 3.99Å; L192-V278 HydrophobicContact CB-CG2 4.38Å; L192-V278 HydrophobicContact CD1-CB 4.41Å; L192-V278 HydrophobicContact CD1-CG2 4.01Å; L192-F281 HydrophobicContact CD1-CB 4.45Å; L192-F281 HydrophobicContact CD2-CB 3.78Å; L192-F281 HydrophobicContact CD2-CD2 4.06Å; L192-F281 HydrophobicContact CD2-CG 4.09Å
193	D	98	Very high	96.8	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	21%	0.209	C	C	.	.	S	Bend	trans	42.4	66.6	-173.8	-151.6	39	0	0	0	112.9	S169 L219 H220 T221 Y222 H274 A277	S169-D193 WeakPolarHBondContact CA-O 3.46Å; D193-L219 WeakPolarHBondContact CA-O 3.34Å; D193-L219 PolarHBondContact N-O 2.89Å; D193-H220 WeakPolarHBondContact OD1-CA 3.34Å; D193-T221 PolarHBondContact OD1-N 2.76Å; D193-Y222 PolarHBondContact OD1-N 2.8Å; D193-Y222 VanDerWaalsContact OD1-N 3.16Å; D193-Y222 WeakPolarHBondContact OD2-CB 3.46Å; D193-Y222 PolarHBondContact OD2-N 2.74Å; D193-H274 PolarHBondContact O-CE1 3.16Å; D193-H274 IonicContact OD2-CE1 3.57Å; D193-H274 IonicContact OD2-CG 3.7Å; D193-H274 IonicContact OD2-ND1 2.69Å; D193-H274 PolarHBondContact OD2-ND1 3.09Å; D193-A277 HydrophobicContact CB-CB 3.8Å
194	P	98.5	Very high	96.6	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	19%	0.192	C	C	.	.			trans	-54.2	144.6	-178.1	-20.9	31	0	0	0	111.5	A172 G196 L208 V218 G231 I232 V236	A172-P194 HydrophobicContact CB-CB 3.62Å; A172-P194 HydrophobicContact CB-CG 3.72Å; P194-G196 PolarHBondContact O-N 2.83Å; P194-L208 HydrophobicContact CG-CD2 4.19Å; P194-V218 HydrophobicContact CG-CG1 3.55Å; P194-G231 CarbonylContact O-C 3.56Å; P194-G231 WeakPolarHBondContact O-CA 3.46Å; P194-I232 HydrophobicContact CB-CG2 3.8Å; P194-I232 HydrophobicContact CG-CG2 4.16Å; P194-I232 PolarHBondContact O-N 2.61Å; P194-V236 HydrophobicContact CG-CG2 4.3Å
195	A	96.4	Very high	96.5	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.192	C	C	.	.	B	Isolated β-bridge	trans	-63.6	134.1	-176.9	0	0	0	0	0	112.5	S169 L170 H173 F199 I230	S169-A195 PolarHBondContact O-N 3.5Å; L170-A195 HydrophobicContact CD2-CB 3.77Å; L170-A195 HydrophobicContact CG-CB 4.48Å; H173-A195 PolarHBondContact NE2-N 2.94Å; H173-A195 PolarHBondContact NE2-O 3.31Å; A195-F199 HydrophobicContact CB-CD2 4.19Å; A195-F199 HydrophobicContact CB-CE2 4.42Å; A195-F199 WeakPolarHBondContact O-CB 3.39Å; A195-I230 CarbonylContact C-O 3.58Å; A195-I230 WeakPolarHBondContact CA-O 3.38Å
196	G	94.2	Very high	96.4	Very high	3 Å²	3	36.2 Å²	36.2	3%	0.031	20%	0.201	C	C	.	.			trans	-83.3	-51.5	176.9	0	0	0	0	0	113.8	P194 M198 F199 E200 I230	P194-G196 PolarHBondContact O-N 2.83Å; G196-M198 PolarHBondContact O-N 2.88Å; G196-F199 PolarHBondContact O-N 3.42Å; G196-E200 WeakPolarHBondContact O-CB 3.39Å; G196-E200 PolarHBondContact O-N 2.83Å; G196-I230 PolarHBondContact N-O 2.91Å
197	P	92.2	Very high	96.4	Very high	51 Å²	51	37.4 Å²	37.4	33%	0.331	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	130.9	-176	-24.8	33.7	0	0	0	112.3	Y131 F199 I230	Y131-P197 HydrophobicContact CE1-CB 3.76Å; Y131-P197 PolarHBondContact OH-O 2.9Å; P197-F199 WeakPolarHBondContact O-CD2 3.35Å; P197-F199 PolarHBondContact O-N 2.85Å; P197-F199 VanDerWaalsContact O-N 3.17Å; P197-I230 WeakPolarHBondContact CD-O 3.44Å
198	M	93.1	Very high	96.4	Very high	110 Å²	110	36.8 Å²	36.8	54%	0.542	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.5	-5.7	-174.2	-51.7	-177.2	68.3	0	0	116.8	Y131 T132 V135 G196	Y131-M198 HydrophobicContact CE1-CG 4.5Å; Y131-M198 HydrophobicContact CE1-SD 4.44Å; T132-M198 HydrophobicContact CG2-SD 3.95Å; V135-M198 HydrophobicContact CB-SD 4.12Å; V135-M198 HydrophobicContact CG1-CB 4.08Å; V135-M198 HydrophobicContact CG1-CE 4.13Å; V135-M198 HydrophobicContact CG1-SD 3.99Å; V135-M198 HydrophobicContact CG2-SD 4.04Å; G196-M198 PolarHBondContact O-N 2.88Å
199	F	96.5	Very high	96.3	Very high	3 Å²	3	35.6 Å²	35.6	1%	0.013	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.9	-24.8	176.1	-64.6	-77.9	0	0	0	113.8	V135 T138 L170 H173 Y177 A195 G196 P197 G201 A202 K206 R207 I232	V135-F199 HydrophobicContact CG1-CE2 4.02Å; V135-F199 HydrophobicContact CG1-CZ 3.88Å; V135-F199 HydrophobicContact CG2-CE2 4.01Å; T138-F199 HydrophobicContact CG2-CZ 4.35Å; L170-F199 HydrophobicContact CD2-CD2 4.5Å; L170-F199 HydrophobicContact CD2-CE2 3.54Å; L170-F199 HydrophobicContact CD2-CZ 4.23Å; H173-F199 HydrophobicContact CB-CD1 4.25Å; H173-F199 HydrophobicContact CB-CE1 3.67Å; H173-F199 HydrophobicContact CB-CE2 4.5Å; H173-F199 HydrophobicContact CB-CZ 3.81Å; H173-F199 AromaticContact CD2-CD2 3.63Å; H173-F199 AromaticContact CD2-CE2 3.67Å; H173-F199 AromaticContact CD2-CG 3.8Å; H173-F199 AromaticContact CD2-CZ 3.85Å; H173-F199 AromaticContact CE1-CD1 3.72Å; H173-F199 AromaticContact CE1-CG 3.5Å; H173-F199 AromaticContact CG-CD1 3.61Å; H173-F199 AromaticContact CG-CE1 3.51Å; H173-F199 AromaticContact CG-CG 3.88Å; H173-F199 AromaticContact CG-CZ 3.72Å; H173-F199 AromaticContact ND1-CD1 3.41Å; H173-F199 WeakPolarHBondContact ND1-CD1 3.18Å; H173-F199 AromaticContact ND1-CE1 3.77Å; H173-F199 AromaticContact ND1-CG 3.69Å; H173-F199 AromaticContact NE2-CD2 3.65Å; H173-F199 AromaticContact NE2-CG 3.59Å; Y177-F199 HydrophobicContact CE2-CE1 4.46Å; A195-F199 HydrophobicContact CB-CD2 4.19Å; A195-F199 HydrophobicContact CB-CE2 4.42Å; A195-F199 WeakPolarHBondContact O-CB 3.39Å; G196-F199 PolarHBondContact O-N 3.42Å; P197-F199 WeakPolarHBondContact O-CD2 3.35Å; P197-F199 PolarHBondContact O-N 2.85Å; P197-F199 VanDerWaalsContact O-N 3.17Å; F199-G201 PolarHBondContact O-N 3.05Å; F199-A202 WeakPolarHBondContact O-CB 3.46Å; F199-A202 PolarHBondContact O-N 2.8Å; F199-K206 VanDerWaalsContact CD1-O 3.29Å; F199-K206 WeakPolarHBondContact CD1-O 3.31Å; F199-K206 WeakPolarHBondContact CE1-O 3.28Å; F199-R207 HydrophobicContact CB-CB 4.43Å; F199-R207 HydrophobicContact CD1-CB 3.92Å; F199-I232 HydrophobicContact CB-CD1 4.26Å
200	E	95.3	Very high	96.2	Very high	79 Å²	79	36.5 Å²	36.5	37%	0.369	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	125.5	174.2	-173.5	65.5	-118.3	0	0	110.1	G196 A202 I232 Q233 M234	G196-E200 WeakPolarHBondContact O-CB 3.39Å; G196-E200 PolarHBondContact O-N 2.83Å; E200-A202 PolarHBondContact O-N 3.39Å; E200-A202 VanDerWaalsContact O-N 3.17Å; E200-I232 VanDerWaalsContact OE2-CG1 3.29Å; E200-I232 WeakPolarHBondContact OE2-CG1 3.48Å; E200-Q233 WeakPolarHBondContact OE2-CA 3.46Å; E200-Q233 WeakPolarHBondContact OE2-CB 3.33Å; E200-Q233 PolarHBondContact OE2-N 3.32Å; E200-M234 WeakPolarHBondContact OE1-CB 3.14Å; E200-M234 WeakPolarHBondContact OE1-CG 3.42Å; E200-M234 PolarHBondContact OE1-N 3.1Å; E200-M234 PolarHBondContact OE2-N 3.38Å
201	G	93.6	Very high	96.1	Very high	66 Å²	66	42.3 Å²	42.3	68%	0.68	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.2	2.8	-173.9	0	0	0	0	0	115.1	F199 M234	F199-G201 PolarHBondContact O-N 3.05Å; G201-M234 PolarHBondContact N-SD 3.17Å; G201-M234 VanDerWaalsContact N-SD 3.39Å
202	A	95.3	Very high	96.1	Very high	22 Å²	22	42.5 Å²	42.5	18%	0.182	23%	0.233	C	C	.	.			trans	-66.3	151.7	174.2	0	0	0	0	0	111.1	F199 E200 K206 R207	F199-A202 WeakPolarHBondContact O-CB 3.46Å; F199-A202 PolarHBondContact O-N 2.8Å; E200-A202 PolarHBondContact O-N 3.39Å; E200-A202 VanDerWaalsContact O-N 3.17Å; A202-K206 HydrophobicContact CB-CB 4.43Å; A202-R207 PolarHBondContact O-NE 3.33Å
203	D	95.8	Very high	96	Very high	89 Å²	89	42.7 Å²	42.7	48%	0.476	24%	0.235	S	C	.	.			trans	-55.6	148.4	176.2	-175.1	-96.4	0	0	0	111.5	H205 K206 R207	D203-H205 PolarHBondContact O-N 2.72Å; D203-H205 VanDerWaalsContact O-N 3.09Å; D203-H205 IonicContact OD1-CD2 3.27Å; D203-H205 PolarHBondContact OD1-CD2 2.83Å; D203-H205 VanDerWaalsContact OD1-CD2 3.3Å; D203-H205 IonicContact OD1-CG 3.76Å; D203-H205 PolarHBondContact OD1-N 2.79Å; D203-K206 HydrophobicContact CB-CD 4.49Å; D203-K206 HydrophobicContact CB-CG 4.45Å; D203-K206 PolarHBondContact O-N 2.94Å; D203-R207 WeakPolarHBondContact O-CG 3.34Å
204	I	94.2	Very high	96	Very high	49 Å²	49	46.6 Å²	46.6	25%	0.251	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-54.1	-33	-176.1	-166.1	170.3	0	0	0	113	K206 D211	I204-K206 VanDerWaalsContact C-N 3.29Å; I204-K206 PolarHBondContact O-N 3.07Å; I204-D211 VanDerWaalsContact CD1-OD2 3.31Å; I204-D211 WeakPolarHBondContact CD1-OD2 3.36Å
205	H	95	Very high	96	Very high	114 Å²	114	47.3 Å²	47.3	53%	0.528	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-82.9	-1.1	179.5	-56.1	-60	0	0	0	114.4	Y177 D203	Y177-H205 WeakPolarHBondContact CE1-O 3.46Å; D203-H205 PolarHBondContact O-N 2.72Å; D203-H205 VanDerWaalsContact O-N 3.09Å; D203-H205 IonicContact OD1-CD2 3.27Å; D203-H205 PolarHBondContact OD1-CD2 2.83Å; D203-H205 VanDerWaalsContact OD1-CD2 3.3Å; D203-H205 IonicContact OD1-CG 3.76Å; D203-H205 PolarHBondContact OD1-N 2.79Å
206	K	96.2	Very high	96.1	Very high	136 Å²	136	47.3 Å²	47.3	59%	0.591	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-113.4	14.4	-178.1	-64.2	-174.1	179.4	-179.7	0	113.1	Y177 F199 A202 D203 I204	Y177-K206 WeakPolarHBondContact OH-CA 3.31Å; Y177-K206 PolarHBondContact OH-O 3.05Å; F199-K206 VanDerWaalsContact CD1-O 3.29Å; F199-K206 WeakPolarHBondContact CD1-O 3.31Å; F199-K206 WeakPolarHBondContact CE1-O 3.28Å; A202-K206 HydrophobicContact CB-CB 4.43Å; D203-K206 HydrophobicContact CB-CD 4.49Å; D203-K206 HydrophobicContact CB-CG 4.45Å; D203-K206 PolarHBondContact O-N 2.94Å; I204-K206 VanDerWaalsContact C-N 3.29Å; I204-K206 PolarHBondContact O-N 3.07Å
207	R	97.7	Very high	96.3	Very high	25 Å²	25	47.2 Å²	47.2	9%	0.094	26%	0.257	C	S	.	.	S	Bend	trans	-158.3	176.9	179.6	54.7	169.6	176.2	76.4	2	109.4	H173 F199 A202 D203	H173-R207 WeakPolarHBondContact ND1-CA 3.14Å; H173-R207 WeakPolarHBondContact ND1-CB 3.25Å; F199-R207 HydrophobicContact CB-CB 4.43Å; F199-R207 HydrophobicContact CD1-CB 3.92Å; A202-R207 PolarHBondContact O-NE 3.33Å; D203-R207 WeakPolarHBondContact O-CG 3.34Å
208	L	98.6	Very high	96.6	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.242	C	C	.	.			trans	-57	138.2	164.9	-178	61.5	0	0	0	110.3	A172 H173 I189 P194 D212 V216 V218 V236	A172-L208 HydrophobicContact CB-CD2 4.32Å; H173-L208 PolarHBondContact ND1-N 2.9Å; I189-L208 HydrophobicContact CB-CD1 4.42Å; I189-L208 HydrophobicContact CD1-CD1 4.27Å; I189-L208 HydrophobicContact CG2-CD1 3.65Å; P194-L208 HydrophobicContact CG-CD2 4.19Å; L208-D212 WeakPolarHBondContact CA-OD2 3.34Å; L208-V216 HydrophobicContact CD1-CG1 3.93Å; L208-V216 HydrophobicContact CD2-CG1 4.18Å; L208-V216 HydrophobicContact CG-CG1 4.12Å; L208-V218 HydrophobicContact CD2-CG2 4.06Å; L208-V236 HydrophobicContact CB-CG2 4.39Å; L208-V236 HydrophobicContact CD2-CG2 4.11Å; L208-V236 HydrophobicContact CG-CG2 4.32Å; L208-V236 WeakPolarHBondContact O-CB 3.43Å
209	S	97.4	Very high	96.8	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.007	22%	0.216	C	C	.	.			trans	-144.5	161.6	179.1	90	0	0	0	0	112.2	D211 D212 V216 V236	S209-D211 PolarHBondContact O-N 2.91Å; S209-D211 PolarHBondContact OG-N 2.83Å; S209-D211 VanDerWaalsContact OG-N 3.13Å; S209-D212 PolarHBondContact N-OD2 3.38Å; S209-D212 PolarHBondContact O-N 3.07Å; S209-D212 VanDerWaalsContact OG-CG 3.24Å; S209-D212 PolarHBondContact OG-OD1 2.86Å; S209-D212 PolarHBondContact OG-OD2 2.95Å; S209-V216 WeakPolarHBondContact O-CG2 3.46Å; S209-V236 CarbonylContact C-O 3.55Å; S209-V236 VanDerWaalsContact C-O 3.23Å; S209-V236 VanDerWaalsContact CA-O 3.28Å; S209-V236 WeakPolarHBondContact CA-O 3.28Å
210	P	96.5	Very high	96.9	Very high	19 Å²	19	39.5 Å²	39.5	12%	0.123	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-63.5	-20.2	173.6	-18.8	32.1	0	0	0	113.7	D212 V236 H238	P210-D212 VanDerWaalsContact C-N 3.3Å; P210-V236 VanDerWaalsContact CD-O 3.31Å; P210-V236 WeakPolarHBondContact CD-O 3.44Å; P210-H238 PolarHBondContact O-CE1 2.84Å
211	D	95.8	Very high	96.9	Very high	121 Å²	121	35.7 Å²	35.7	65%	0.647	20%	0.198	S	C	*	.	G	3₁₀ helix	trans	-82.9	-9.5	-176.6	-59.7	-31.7	0	0	0	112.4	I204 S209 A213	I204-D211 VanDerWaalsContact CD1-OD2 3.31Å; I204-D211 WeakPolarHBondContact CD1-OD2 3.36Å; S209-D211 PolarHBondContact O-N 2.91Å; S209-D211 PolarHBondContact OG-N 2.83Å; S209-D211 VanDerWaalsContact OG-N 3.13Å; D211-A213 VanDerWaalsContact C-N 3.3Å; D211-A213 PolarHBondContact O-N 2.95Å
212	D	98.3	Very high	96.9	Very high	4 Å²	4	33 Å²	33	2%	0.021	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-79	-11.2	-174.3	-55.7	-18.2	0	0	0	113.1	G176 G179 I189 L208 S209 P210	G176-D212 WeakPolarHBondContact CA-OD2 3.43Å; G179-D212 CarbonylContact C-O 3.55Å; G179-D212 WeakPolarHBondContact CA-O 3.07Å; I189-D212 HydrophobicContact CD1-CB 3.63Å; I189-D212 WeakPolarHBondContact CD1-O 3.22Å; L208-D212 WeakPolarHBondContact CA-OD2 3.34Å; S209-D212 PolarHBondContact N-OD2 3.38Å; S209-D212 PolarHBondContact O-N 3.07Å; S209-D212 VanDerWaalsContact OG-CG 3.24Å; S209-D212 PolarHBondContact OG-OD1 2.86Å; S209-D212 PolarHBondContact OG-OD2 2.95Å; P210-D212 VanDerWaalsContact C-N 3.3Å
213	A	98.3	Very high	96.5	Very high	5 Å²	5	32.6 Å²	32.6	4%	0.041	16%	0.163	C	C	.	.	B	Isolated β-bridge	trans	-158.3	165.8	178.3	0	0	0	0	0	112.1	V186 I189 D211 F215 V216 H238	V186-A213 HydrophobicContact CG2-CB 3.58Å; V186-A213 WeakPolarHBondContact O-CA 3.35Å; V186-A213 WeakPolarHBondContact O-CB 3.22Å; I189-A213 HydrophobicContact CB-CB 4.25Å; I189-A213 HydrophobicContact CD1-CB 3.71Å; I189-A213 HydrophobicContact CG1-CB 3.7Å; D211-A213 VanDerWaalsContact C-N 3.3Å; D211-A213 PolarHBondContact O-N 2.95Å; A213-F215 PolarHBondContact O-N 3.42Å; A213-V216 HydrophobicContact CB-CG2 3.85Å; A213-H238 PolarHBondContact O-CE1 3.5Å
214	D	97.3	Very high	95.8	Very high	81 Å²	81	36.2 Å²	36.2	43%	0.433	17%	0.17	S	C	.	.	S	Bend	trans	-59.3	-34.8	173.2	-84.6	-27.6	0	0	0	111.6	T185 V186 G187 K325	T185-D214 HydrophobicContact CG2-CB 4.35Å; T185-D214 VanDerWaalsContact CG2-N 3.33Å; T185-D214 WeakPolarHBondContact CG2-OD1 3.49Å; V186-D214 PolarHBondContact O-N 2.73Å; G187-D214 WeakPolarHBondContact O-CB 3.34Å; D214-K325 VanDerWaalsContact O-CD 3.27Å; D214-K325 WeakPolarHBondContact O-CD 3.33Å; D214-K325 WeakPolarHBondContact O-CE 3.37Å; D214-K325 PolarHBondContact O-NZ 3.06Å
215	F	97.9	Very high	94.3	Very high	16 Å²	16	34.2 Å²	34.2	7%	0.07	16%	0.16	C	C	.	.			trans	-141.3	132	172.8	179.7	-134	0	0	0	111.4	G187 R188 I189 A213 D217 H238 I239 A323 K324 K325	G187-F215 PolarHBondContact O-N 2.75Å; R188-F215 CarbonylContact C-O 3.41Å; R188-F215 VanDerWaalsContact CA-O 3.23Å; R188-F215 WeakPolarHBondContact CA-O 3.32Å; R188-F215 HydrophobicContact CG-CB 4.46Å; R188-F215 HydrophobicContact CG-CD1 3.94Å; R188-F215 WeakPolarHBondContact CG-O 3.39Å; I189-F215 PolarHBondContact N-O 2.85Å; A213-F215 PolarHBondContact O-N 3.42Å; F215-D217 HydrophobicContact CE1-CB 4.05Å; F215-D217 HydrophobicContact CE2-CB 4.26Å; F215-D217 HydrophobicContact CZ-CB 3.7Å; F215-H238 HydrophobicContact CD2-CB 4.03Å; F215-H238 HydrophobicContact CE2-CB 4.11Å; F215-I239 HydrophobicContact CE2-CD1 4.24Å; F215-I239 HydrophobicContact CE2-CG1 4.03Å; F215-I239 HydrophobicContact CE2-CG2 4.42Å; F215-I239 HydrophobicContact CZ-CD1 3.72Å; F215-I239 HydrophobicContact CZ-CG1 3.96Å; F215-A323 HydrophobicContact CE1-CB 4.4Å; F215-A323 WeakPolarHBondContact CE1-O 3.08Å; F215-A323 HydrophobicContact CZ-CB 4.35Å; F215-K324 VanDerWaalsContact CZ-C 3.46Å; F215-K325 HydrophobicContact CB-CB 4.33Å; F215-K325 HydrophobicContact CD2-CB 3.54Å; F215-K325 HydrophobicContact CD2-CD 4.47Å; F215-K325 HydrophobicContact CD2-CG 3.88Å; F215-K325 VanDerWaalsContact CE2-CA 3.48Å; F215-K325 HydrophobicContact CE2-CB 4Å; F215-K325 HydrophobicContact CE2-CG 4.47Å; F215-K325 HydrophobicContact CG-CB 3.94Å
216	V	98.3	Very high	92.6	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	116.4	179.4	-175	0	0	0	0	108.2	I189 L208 S209 A213 V218 H238 I239	I189-V216 HydrophobicContact CB-CG1 4.44Å; I189-V216 HydrophobicContact CB-CG2 4.28Å; I189-V216 VanDerWaalsContact O-CA 3.27Å; I189-V216 WeakPolarHBondContact O-CA 3.39Å; L208-V216 HydrophobicContact CD1-CG1 3.93Å; L208-V216 HydrophobicContact CD2-CG1 4.18Å; L208-V216 HydrophobicContact CG-CG1 4.12Å; S209-V216 WeakPolarHBondContact O-CG2 3.46Å; A213-V216 HydrophobicContact CB-CG2 3.85Å; V216-V218 HydrophobicContact CG1-CG2 4.19Å; V216-H238 PolarHBondContact N-ND1 3.44Å; V216-H238 WeakPolarHBondContact O-CB 3.44Å; V216-H238 PolarHBondContact O-N 3.24Å; V216-I239 PolarHBondContact O-N 3.25Å
217	D	98.4	Very high	90.9	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	136.2	176	65	-61.9	0	0	0	111.4	R188 I189 T190 G191 F215 I239	R188-D217 IonicContact CZ-OD1 3.99Å; R188-D217 IonicContact CZ-OD2 2.69Å; R188-D217 IonicContact NE-OD1 4Å; R188-D217 PolarHBondContact NE-OD1 3.28Å; R188-D217 IonicContact NE-OD2 3.54Å; R188-D217 IonicContact NH2-OD1 2.74Å; R188-D217 PolarHBondContact NH2-OD1 3.08Å; R188-D217 VanDerWaalsContact NH2-OD1 3.09Å; R188-D217 IonicContact NH2-OD2 3.82Å; R188-D217 PolarHBondContact NH2-OD2 3.22Å; I189-D217 PolarHBondContact O-N 3.06Å; T190-D217 CarbonylContact C-O 3.53Å; T190-D217 VanDerWaalsContact CA-O 3.26Å; T190-D217 WeakPolarHBondContact CA-O 3.11Å; T190-D217 PolarHBondContact OG1-OD1 2.75Å; T190-D217 PolarHBondContact OG1-OD2 3.3Å; G191-D217 PolarHBondContact N-O 2.77Å; F215-D217 HydrophobicContact CE1-CB 4.05Å; F215-D217 HydrophobicContact CE2-CB 4.26Å; F215-D217 HydrophobicContact CZ-CB 3.7Å; D217-I239 HydrophobicContact CB-CD1 3.77Å; D217-I239 HydrophobicContact CB-CG1 3.5Å
218	V	98.8	Very high	89.5	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.006	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	131.9	-170.3	-169.2	0	0	0	0	110.4	G191 P194 L208 V216 H220 V236 I239 I241	G191-V218 WeakPolarHBondContact O-CA 3.17Å; P194-V218 HydrophobicContact CG-CG1 3.55Å; L208-V218 HydrophobicContact CD2-CG2 4.06Å; V216-V218 HydrophobicContact CG1-CG2 4.19Å; V218-H220 VanDerWaalsContact CG1-NE2 3.33Å; V218-H220 WeakPolarHBondContact CG1-NE2 3.39Å; V218-V236 HydrophobicContact CG1-CG2 4.14Å; V218-V236 HydrophobicContact CG2-CG2 3.9Å; V218-I239 PolarHBondContact N-O 2.77Å; V218-I241 PolarHBondContact O-N 2.87Å
219	L	98.6	Very high	88.5	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.005	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	120.6	169.7	-68.7	174.8	0	0	0	108.6	G191 L192 D193 I241 P243 A277 L280 F281	G191-L219 PolarHBondContact O-N 3.41Å; L192-L219 HydrophobicContact CD2-CD1 3.86Å; D193-L219 WeakPolarHBondContact CA-O 3.34Å; D193-L219 PolarHBondContact N-O 2.89Å; L219-I241 HydrophobicContact CD2-CB 3.95Å; L219-I241 HydrophobicContact CD2-CD1 4.22Å; L219-I241 HydrophobicContact CD2-CG2 3.98Å; L219-P243 HydrophobicContact CD2-CG 4.38Å; L219-A277 HydrophobicContact CB-CB 3.95Å; L219-A277 WeakPolarHBondContact CD1-O 3.43Å; L219-L280 HydrophobicContact CD1-CB 4.16Å; L219-F281 HydrophobicContact CD1-CB 4.38Å
220	H	97.9	Very high	88.1	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.213	C	C	.	.			trans	-108.9	108	178	-62.8	-97.3	0	0	0	109.3	D193 V218 T223 I232 M234 D240 I241 Y242 P243 G246	D193-H220 WeakPolarHBondContact OD1-CA 3.34Å; V218-H220 VanDerWaalsContact CG1-NE2 3.33Å; V218-H220 WeakPolarHBondContact CG1-NE2 3.39Å; H220-T223 HydrophobicContact CB-CG2 3.62Å; H220-I232 PolarHBondContact ND1-O 3.09Å; H220-M234 PolarHBondContact CE1-O 3.01Å; H220-D240 IonicContact NE2-OD1 2.71Å; H220-D240 PolarHBondContact NE2-OD1 2.86Å; H220-I241 PolarHBondContact N-O 3.42Å; H220-Y242 HydrophobicContact CB-CD1 3.45Å; H220-Y242 VanDerWaalsContact CB-CD1 3.45Å; H220-Y242 HydrophobicContact CB-CE1 3.62Å; H220-Y242 HydrophobicContact CB-CG 4.1Å; H220-Y242 AromaticContact CD2-CE1 3.84Å; H220-Y242 AromaticContact CD2-CZ 3.72Å; H220-Y242 AromaticContact CG-CD1 3.9Å; H220-Y242 AromaticContact CG-CE1 3.55Å; H220-Y242 AromaticContact CG-CZ 3.91Å; H220-Y242 AromaticContact ND1-CE1 3.93Å; H220-Y242 AromaticContact NE2-CZ 3.95Å; H220-P243 VanDerWaalsContact O-CD 3.24Å; H220-P243 WeakPolarHBondContact O-CD 3.38Å; H220-G246 WeakPolarHBondContact O-CA 3.19Å
221	T	96	Very high	87.9	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.207	C	C	.	.	S	Bend	trans	-117.8	-15.3	-173.3	52.3	0	0	0	0	114	D193 P243 G246 Q249 E273 R276 A277 L280	D193-T221 PolarHBondContact OD1-N 2.76Å; T221-P243 HydrophobicContact CG2-CB 4.46Å; T221-P243 HydrophobicContact CG2-CG 3.97Å; T221-G246 CarbonylContact C-O 3.57Å; T221-Q249 WeakPolarHBondContact O-CG 3.24Å; T221-Q249 PolarHBondContact O-NE2 3.36Å; T221-E273 WeakPolarHBondContact CB-O 3.35Å; T221-E273 PolarHBondContact OG1-O 2.93Å; T221-R276 HydrophobicContact CG2-CB 4.28Å; T221-R276 HydrophobicContact CG2-CG 4.2Å; T221-A277 HydrophobicContact CG2-CB 4.01Å; T221-A277 PolarHBondContact OG1-N 2.92Å; T221-L280 HydrophobicContact CG2-CD1 3.96Å
222	Y	91.9	Very high	87.9	Confident	10 Å²	10	33 Å²	33	4%	0.039	18%	0.176	C	C	.	.			trans	-138.8	51.9	-179.8	-161.3	-144.6	0	0	0	114.8	D193 I230 G231 G246 V270 E273 H274	D193-Y222 PolarHBondContact OD1-N 2.8Å; D193-Y222 VanDerWaalsContact OD1-N 3.16Å; D193-Y222 WeakPolarHBondContact OD2-CB 3.46Å; D193-Y222 PolarHBondContact OD2-N 2.74Å; Y222-I230 HydrophobicContact CD1-CB 3.66Å; Y222-I230 HydrophobicContact CD1-CD1 4.27Å; Y222-I230 HydrophobicContact CD1-CG1 4.01Å; Y222-I230 HydrophobicContact CE1-CB 3.9Å; Y222-I230 HydrophobicContact CE1-CD1 3.71Å; Y222-I230 HydrophobicContact CE1-CG1 3.69Å; Y222-I230 PolarHBondContact O-N 3.39Å; Y222-G231 WeakPolarHBondContact O-CA 3.44Å; Y222-G231 PolarHBondContact O-N 3.17Å; Y222-G246 PolarHBondContact N-O 2.94Å; Y222-V270 HydrophobicContact CE1-CG1 4.06Å; Y222-V270 WeakPolarHBondContact CE1-O 3.42Å; Y222-E273 HydrophobicContact CD1-CB 4.37Å; Y222-E273 HydrophobicContact CD2-CB 3.28Å; Y222-E273 HydrophobicContact CD2-CG 3.8Å; Y222-E273 HydrophobicContact CE2-CB 3.8Å; Y222-E273 HydrophobicContact CE2-CG 3.96Å; Y222-E273 HydrophobicContact CG-CB 3.61Å; Y222-H274 HydrophobicContact CD1-CB 4.25Å
223	T	88.5	Confident	87.7	Confident	13 Å²	13	36.7 Å²	36.7	8%	0.08	19%	0.193	C	C	.	.	S	Bend	trans	-76.8	-24.7	-175.7	64.1	0	0	0	0	114.2	H220 S229 I232 Q233 Y242 G246	H220-T223 HydrophobicContact CB-CG2 3.62Å; T223-S229 WeakPolarHBondContact O-CB 3.48Å; T223-S229 PolarHBondContact O-OG 3.37Å; T223-I232 WeakPolarHBondContact CG2-O 3.49Å; T223-Q233 VanDerWaalsContact O-CG 3.23Å; T223-Q233 WeakPolarHBondContact O-CG 3.36Å; T223-Q233 PolarHBondContact O-NE2 3.4Å; T223-Y242 HydrophobicContact CG2-CD1 4.22Å; T223-Y242 HydrophobicContact CG2-CE1 4.17Å; T223-G246 WeakPolarHBondContact CB-O 3.46Å; T223-G246 WeakPolarHBondContact CG2-O 3.33Å; T223-G246 PolarHBondContact N-O 2.94Å; T223-G246 PolarHBondContact OG1-O 3.41Å
224	R	80.8	Confident	87.6	Confident	165 Å²	165	38.5 Å²	38.5	62%	0.623	20%	0.201	S	C	*	.			trans	-169.9	108.8	175.4	-173.4	171.2	176.6	149.8	-0.4	110.8	L228 D247	R224-L228 CarbonylContact C-O 3.51Å; R224-L228 WeakPolarHBondContact CA-O 3.18Å; R224-D247 WeakPolarHBondContact O-CA 3.35Å; R224-D247 WeakPolarHBondContact O-CB 3.3Å
225	S	62.7	Low	87.5	Confident	7 Å²	7	36.1 Å²	36.1	5%	0.049	19%	0.19	C	C	.	.	B	Isolated β-bridge	trans	-135.4	130.1	174.1	-167.6	0	0	0	0	110.1	G227 L228	S225-G227 PolarHBondContact O-N 2.88Å; S225-L228 PolarHBondContact N-O 2.72Å; S225-L228 PolarHBondContact O-N 2.81Å; S225-L228 VanDerWaalsContact O-O 3.12Å
226	F	58.4	Low	87.5	Confident	158 Å²	158	35.3 Å²	35.3	69%	0.693	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.8	30.4	-178.9	-57.6	-76.2	0	0	0	115.4	L228 L254	F226-L228 VanDerWaalsContact C-N 3.33Å; F226-L254 HydrophobicContact CE1-CD1 4.47Å; F226-L254 HydrophobicContact CZ-CD1 4.2Å; F226-L254 HydrophobicContact CZ-CD2 4.36Å; F226-L254 HydrophobicContact CZ-CG 4.2Å
227	G	60.2	Low	87.4	Confident	73 Å²	73	35.3 Å²	35.3	75%	0.753	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.8	-2.8	-179.2	0	0	0	0	0	115.2	S225	S225-G227 PolarHBondContact O-N 2.88Å
228	L	68.4	Low	87.4	Confident	90 Å²	90	37 Å²	37	47%	0.471	20%	0.195	S	C	.	.	B	Isolated β-bridge	trans	-101.3	144	172.5	-168.2	67.4	0	0	0	110.5	R224 S225 F226 I230	R224-L228 CarbonylContact C-O 3.51Å; R224-L228 WeakPolarHBondContact CA-O 3.18Å; S225-L228 PolarHBondContact N-O 2.72Å; S225-L228 PolarHBondContact O-N 2.81Å; S225-L228 VanDerWaalsContact O-O 3.12Å; F226-L228 VanDerWaalsContact C-N 3.33Å; L228-I230 HydrophobicContact CD2-CD1 4.11Å; L228-I230 HydrophobicContact CD2-CG1 4.09Å; L228-I230 HydrophobicContact CG-CG1 4.21Å
229	S	78.5	Confident	87.3	Confident	30 Å²	30	37 Å²	37	21%	0.21	19%	0.194	C	C	.	.			trans	-129.5	109.7	176.3	-178.1	0	0	0	0	107.4	T223 G231 Q233	T223-S229 WeakPolarHBondContact O-CB 3.48Å; T223-S229 PolarHBondContact O-OG 3.37Å; S229-G231 PolarHBondContact OG-O 2.96Å; S229-Q233 PolarHBondContact OG-NE2 3.08Å; S229-Q233 VanDerWaalsContact OG-NE2 3.08Å
230	I	87.8	Confident	87.2	Confident	40 Å²	40	37 Å²	37	21%	0.205	19%	0.194	C	C	.	.			trans	-100.8	-38.8	175.4	-59	-165.7	0	0	0	110.5	A195 G196 P197 Y222 L228 V270	A195-I230 CarbonylContact C-O 3.58Å; A195-I230 WeakPolarHBondContact CA-O 3.38Å; G196-I230 PolarHBondContact N-O 2.91Å; P197-I230 WeakPolarHBondContact CD-O 3.44Å; Y222-I230 HydrophobicContact CD1-CB 3.66Å; Y222-I230 HydrophobicContact CD1-CD1 4.27Å; Y222-I230 HydrophobicContact CD1-CG1 4.01Å; Y222-I230 HydrophobicContact CE1-CB 3.9Å; Y222-I230 HydrophobicContact CE1-CD1 3.71Å; Y222-I230 HydrophobicContact CE1-CG1 3.69Å; Y222-I230 PolarHBondContact O-N 3.39Å; L228-I230 HydrophobicContact CD2-CD1 4.11Å; L228-I230 HydrophobicContact CD2-CG1 4.09Å; L228-I230 HydrophobicContact CG-CG1 4.21Å; I230-V270 HydrophobicContact CD1-CG1 3.15Å; I230-V270 HydrophobicContact CG1-CG1 4.47Å
231	G	93.4	Very high	87.2	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-76.9	151.1	167.9	0	0	0	0	0	111.6	P194 Y222 S229	P194-G231 CarbonylContact O-C 3.56Å; P194-G231 WeakPolarHBondContact O-CA 3.46Å; Y222-G231 WeakPolarHBondContact O-CA 3.44Å; Y222-G231 PolarHBondContact O-N 3.17Å; S229-G231 PolarHBondContact OG-O 2.96Å
232	I	95.3	Very high	87.3	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.196	C	C	.	.			trans	-70.6	136.2	174.2	-161.7	168.1	0	0	0	110.3	P194 F199 E200 H220 T223 M234 V236	P194-I232 HydrophobicContact CB-CG2 3.8Å; P194-I232 HydrophobicContact CG-CG2 4.16Å; P194-I232 PolarHBondContact O-N 2.61Å; F199-I232 HydrophobicContact CB-CD1 4.26Å; E200-I232 VanDerWaalsContact OE2-CG1 3.29Å; E200-I232 WeakPolarHBondContact OE2-CG1 3.48Å; H220-I232 PolarHBondContact ND1-O 3.09Å; T223-I232 WeakPolarHBondContact CG2-O 3.49Å; I232-M234 HydrophobicContact CD1-CG 3.7Å; I232-M234 HydrophobicContact CD1-SD 4.23Å; I232-M234 HydrophobicContact CG1-CG 3.73Å; I232-V236 HydrophobicContact CD1-CG1 3.8Å; I232-V236 HydrophobicContact CG2-CG2 4.31Å
233	Q	94.9	Very high	87.6	Confident	80 Å²	80	37 Å²	37	37%	0.374	19%	0.194	S	C	.	.			trans	-88.2	-40.8	-178.3	-57	-176.2	22.1	0	0	111.4	E200 T223 S229 Y242	E200-Q233 WeakPolarHBondContact OE2-CA 3.46Å; E200-Q233 WeakPolarHBondContact OE2-CB 3.33Å; E200-Q233 PolarHBondContact OE2-N 3.32Å; T223-Q233 VanDerWaalsContact O-CG 3.23Å; T223-Q233 WeakPolarHBondContact O-CG 3.36Å; T223-Q233 PolarHBondContact O-NE2 3.4Å; S229-Q233 PolarHBondContact OG-NE2 3.08Å; S229-Q233 VanDerWaalsContact OG-NE2 3.08Å; Q233-Y242 PolarHBondContact O-OH 3.11Å
234	M	94.7	Very high	87.9	Confident	44 Å²	44	36.8 Å²	36.8	22%	0.217	19%	0.193	C	C	.	.	S	Bend	trans	-65.2	145	-179.5	63.8	179.5	-61.2	0	0	111.8	E200 G201 H220 I232 V236	E200-M234 WeakPolarHBondContact OE1-CB 3.14Å; E200-M234 WeakPolarHBondContact OE1-CG 3.42Å; E200-M234 PolarHBondContact OE1-N 3.1Å; E200-M234 PolarHBondContact OE2-N 3.38Å; G201-M234 PolarHBondContact N-SD 3.17Å; G201-M234 VanDerWaalsContact N-SD 3.39Å; H220-M234 PolarHBondContact CE1-O 3.01Å; I232-M234 HydrophobicContact CD1-CG 3.7Å; I232-M234 HydrophobicContact CD1-SD 4.23Å; I232-M234 HydrophobicContact CG1-CG 3.73Å; M234-V236 HydrophobicContact CG-CG1 3.99Å; M234-V236 PolarHBondContact O-N 3.5Å
235	P	96.4	Very high	88.5	Confident	30 Å²	30	29.4 Å²	29.4	20%	0.195	17%	0.168	C	C	.	.			trans	-67.3	130.9	172.6	28.4	-33.5	0	0	0	110	D240 N331	P235-D240 VanDerWaalsContact CA-CG 3.47Å; P235-D240 VanDerWaalsContact CA-OD1 3.25Å; P235-D240 WeakPolarHBondContact CA-OD1 3.45Å; P235-D240 HydrophobicContact CB-CB 3.97Å; P235-D240 WeakPolarHBondContact CB-OD2 3.5Å; P235-N331 HydrophobicContact CB-CB 4.16Å
236	V	97.3	Very high	89.9	Confident	0 Å²	0	29 Å²	29	0%	0	17%	0.165	C	C	.	.			trans	-127.4	-0.5	-177.4	-63.3	0	0	0	0	113.8	P194 L208 S209 P210 V218 I232 M234 D240	P194-V236 HydrophobicContact CG-CG2 4.3Å; L208-V236 HydrophobicContact CB-CG2 4.39Å; L208-V236 HydrophobicContact CD2-CG2 4.11Å; L208-V236 HydrophobicContact CG-CG2 4.32Å; L208-V236 WeakPolarHBondContact O-CB 3.43Å; S209-V236 CarbonylContact C-O 3.55Å; S209-V236 VanDerWaalsContact C-O 3.23Å; S209-V236 VanDerWaalsContact CA-O 3.28Å; S209-V236 WeakPolarHBondContact CA-O 3.28Å; P210-V236 VanDerWaalsContact CD-O 3.31Å; P210-V236 WeakPolarHBondContact CD-O 3.44Å; V218-V236 HydrophobicContact CG1-CG2 4.14Å; V218-V236 HydrophobicContact CG2-CG2 3.9Å; I232-V236 HydrophobicContact CD1-CG1 3.8Å; I232-V236 HydrophobicContact CG2-CG2 4.31Å; M234-V236 HydrophobicContact CG-CG1 3.99Å; M234-V236 PolarHBondContact O-N 3.5Å; V236-D240 PolarHBondContact N-OD1 2.99Å
237	G	97	Very high	91.2	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	15%	0.146	C	C	.	.	S	Bend	trans	-113.9	-178.9	175.4	0	0	0	0	0	114.5	I239 D240 N331	G237-I239 VanDerWaalsContact C-N 3.32Å; G237-D240 PolarHBondContact N-OD1 3.49Å; G237-N331 PolarHBondContact O-ND2 3.44Å; G237-N331 PolarHBondContact O-OD1 2.99Å
238	H	97	Very high	92.4	Very high	36 Å²	36	24.3 Å²	24.3	17%	0.167	13%	0.127	C	C	.	.	S	Bend	trans	-67.5	-38.6	166	-67.9	93.4	0	0	0	110.9	P210 A213 F215 V216 K325 S332	P210-H238 PolarHBondContact O-CE1 2.84Å; A213-H238 PolarHBondContact O-CE1 3.5Å; F215-H238 HydrophobicContact CD2-CB 4.03Å; F215-H238 HydrophobicContact CE2-CB 4.11Å; V216-H238 PolarHBondContact N-ND1 3.44Å; V216-H238 WeakPolarHBondContact O-CB 3.44Å; V216-H238 PolarHBondContact O-N 3.24Å; H238-K325 VanDerWaalsContact NE2-CE 3.34Å; H238-K325 WeakPolarHBondContact NE2-CE 3.18Å; H238-K325 PolarHBondContact NE2-NZ 3.34Å; H238-S332 PolarHBondContact O-N 3.37Å
239	I	96.6	Very high	93.5	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	136.9	169.1	67.4	172.4	0	0	0	109.3	F215 V216 D217 V218 G237 I241 A323 M326	F215-I239 HydrophobicContact CE2-CD1 4.24Å; F215-I239 HydrophobicContact CE2-CG1 4.03Å; F215-I239 HydrophobicContact CE2-CG2 4.42Å; F215-I239 HydrophobicContact CZ-CD1 3.72Å; F215-I239 HydrophobicContact CZ-CG1 3.96Å; V216-I239 PolarHBondContact O-N 3.25Å; D217-I239 HydrophobicContact CB-CD1 3.77Å; D217-I239 HydrophobicContact CB-CG1 3.5Å; V218-I239 PolarHBondContact N-O 2.77Å; G237-I239 VanDerWaalsContact C-N 3.32Å; I239-I241 HydrophobicContact CD1-CD1 4.07Å; I239-A323 HydrophobicContact CD1-CB 3.78Å; I239-M326 HydrophobicContact CG2-CG 4.03Å; I239-M326 HydrophobicContact CG2-SD 3.89Å
240	D	97.6	Very high	94.1	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	109.3	-178.8	-58.4	-90.1	0	0	0	107.3	H220 P235 V236 G237 Y242 S332 K333 M334	H220-D240 IonicContact NE2-OD1 2.71Å; H220-D240 PolarHBondContact NE2-OD1 2.86Å; P235-D240 VanDerWaalsContact CA-CG 3.47Å; P235-D240 VanDerWaalsContact CA-OD1 3.25Å; P235-D240 WeakPolarHBondContact CA-OD1 3.45Å; P235-D240 HydrophobicContact CB-CB 3.97Å; P235-D240 WeakPolarHBondContact CB-OD2 3.5Å; V236-D240 PolarHBondContact N-OD1 2.99Å; G237-D240 PolarHBondContact N-OD1 3.49Å; D240-Y242 HydrophobicContact CB-CE2 3.72Å; D240-Y242 WeakPolarHBondContact O-CD2 3.23Å; D240-S332 PolarHBondContact N-O 3.32Å; D240-K333 CarbonylContact O-C 3.46Å; D240-K333 WeakPolarHBondContact O-CA 3.4Å; D240-M334 PolarHBondContact O-N 3.02Å
241	I	98.3	Very high	94	Very high	1 Å²	1	21 Å²	21	1%	0.005	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	129.3	-174.9	-60.8	157.6	0	0	0	107.8	V218 L219 H220 I239 P243 A294 I319 M334 L336	V218-I241 PolarHBondContact O-N 2.87Å; L219-I241 HydrophobicContact CD2-CB 3.95Å; L219-I241 HydrophobicContact CD2-CD1 4.22Å; L219-I241 HydrophobicContact CD2-CG2 3.98Å; H220-I241 PolarHBondContact N-O 3.42Å; I239-I241 HydrophobicContact CD1-CD1 4.07Å; I241-P243 HydrophobicContact CG2-CG 4.3Å; I241-P243 VanDerWaalsContact O-CD 3.3Å; I241-P243 WeakPolarHBondContact O-CD 3.29Å; I241-A294 HydrophobicContact CG1-CB 4.15Å; I241-A294 HydrophobicContact CG2-CB 3.81Å; I241-I319 HydrophobicContact CD1-CB 4.22Å; I241-I319 HydrophobicContact CD1-CG2 4.06Å; I241-I319 HydrophobicContact CG2-CG2 4.08Å; I241-M334 CarbonylContact C-O 3.55Å; I241-M334 WeakPolarHBondContact CA-O 3.27Å; I241-M334 HydrophobicContact CG1-CB 4.04Å; I241-L336 HydrophobicContact CG2-CD2 3.49Å; I241-L336 VanDerWaalsContact CG2-CD2 3.49Å
242	Y	97.9	Very high	93.4	Very high	9 Å²	9	21.4 Å²	21.4	4%	0.035	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	81.1	-178.7	-62.9	-98.7	0	0	0	109.5	H220 T223 Q233 D240 N244 G245 K333 M334 Y335	H220-Y242 HydrophobicContact CB-CD1 3.45Å; H220-Y242 VanDerWaalsContact CB-CD1 3.45Å; H220-Y242 HydrophobicContact CB-CE1 3.62Å; H220-Y242 HydrophobicContact CB-CG 4.1Å; H220-Y242 AromaticContact CD2-CE1 3.84Å; H220-Y242 AromaticContact CD2-CZ 3.72Å; H220-Y242 AromaticContact CG-CD1 3.9Å; H220-Y242 AromaticContact CG-CE1 3.55Å; H220-Y242 AromaticContact CG-CZ 3.91Å; H220-Y242 AromaticContact ND1-CE1 3.93Å; H220-Y242 AromaticContact NE2-CZ 3.95Å; T223-Y242 HydrophobicContact CG2-CD1 4.22Å; T223-Y242 HydrophobicContact CG2-CE1 4.17Å; Q233-Y242 PolarHBondContact O-OH 3.11Å; D240-Y242 HydrophobicContact CB-CE2 3.72Å; D240-Y242 WeakPolarHBondContact O-CD2 3.23Å; Y242-N244 PolarHBondContact O-N 3.22Å; Y242-G245 PolarHBondContact O-N 2.8Å; Y242-G245 VanDerWaalsContact O-N 3.12Å; Y242-K333 HydrophobicContact CE2-CB 4.19Å; Y242-K333 HydrophobicContact CE2-CD 4.12Å; Y242-K333 HydrophobicContact CE2-CG 3.96Å; Y242-M334 PolarHBondContact N-O 3.07Å; Y242-Y335 HydrophobicContact CD2-CE1 4.16Å; Y242-Y335 HydrophobicContact CG-CE1 4.02Å
243	P	97.7	Very high	91.8	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.6	130.9	175.8	-20.1	32.1	0	0	0	111	L219 H220 T221 I241 G245 G246 Q249 L280 L336 T338	L219-P243 HydrophobicContact CD2-CG 4.38Å; H220-P243 VanDerWaalsContact O-CD 3.24Å; H220-P243 WeakPolarHBondContact O-CD 3.38Å; T221-P243 HydrophobicContact CG2-CB 4.46Å; T221-P243 HydrophobicContact CG2-CG 3.97Å; I241-P243 HydrophobicContact CG2-CG 4.3Å; I241-P243 VanDerWaalsContact O-CD 3.3Å; I241-P243 WeakPolarHBondContact O-CD 3.29Å; P243-G245 PolarHBondContact O-N 3.26Å; P243-G245 VanDerWaalsContact O-N 3.07Å; P243-G246 WeakPolarHBondContact O-CA 3.26Å; P243-G246 PolarHBondContact O-N 2.77Å; P243-Q249 PolarHBondContact O-NE2 3.12Å; P243-L280 HydrophobicContact CB-CD1 3.82Å; P243-L280 HydrophobicContact CG-CD1 3.51Å; P243-L336 HydrophobicContact CB-CD2 3.94Å; P243-L336 HydrophobicContact CG-CD2 3.94Å; P243-T338 HydrophobicContact CB-CG2 4.14Å
244	N	95.8	Very high	89.8	Confident	9 Å²	9	23.7 Å²	23.7	5%	0.048	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.7	9.4	-178.4	-53.2	-68.1	0	0	0	115.7	Y242 F248 Q249 P250 L336 K337 T338	Y242-N244 PolarHBondContact O-N 3.22Å; N244-F248 WeakPolarHBondContact CB-O 3.44Å; N244-Q249 PolarHBondContact ND2-OE1 3.41Å; N244-P250 VanDerWaalsContact CG-CD 3.43Å; N244-P250 WeakPolarHBondContact ND2-CD 3.48Å; N244-L336 WeakPolarHBondContact CA-O 3.42Å; N244-L336 PolarHBondContact N-O 3.32Å; N244-K337 WeakPolarHBondContact OD1-CA 3.47Å; N244-T338 PolarHBondContact ND2-OG1 2.95Å; N244-T338 PolarHBondContact OD1-N 3.42Å
245	G	93.3	Very high	87.6	Confident	10 Å²	10	29.5 Å²	29.5	10%	0.103	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	109.5	-14.1	-171.1	0	0	0	0	0	112.9	Y242 P243 D247 S300	Y242-G245 PolarHBondContact O-N 2.8Å; Y242-G245 VanDerWaalsContact O-N 3.12Å; P243-G245 PolarHBondContact O-N 3.26Å; P243-G245 VanDerWaalsContact O-N 3.07Å; G245-D247 VanDerWaalsContact C-N 3.25Å; G245-S300 WeakPolarHBondContact CA-OG 3.32Å
246	G	91.5	Very high	85.3	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.191	C	C	.	.	S	Bend	trans	81.4	-3.5	-179.6	0	0	0	0	0	114.4	H220 T221 Y222 T223 P243	H220-G246 WeakPolarHBondContact O-CA 3.19Å; T221-G246 CarbonylContact C-O 3.57Å; Y222-G246 PolarHBondContact N-O 2.94Å; T223-G246 WeakPolarHBondContact CB-O 3.46Å; T223-G246 WeakPolarHBondContact CG2-O 3.33Å; T223-G246 PolarHBondContact N-O 2.94Å; T223-G246 PolarHBondContact OG1-O 3.41Å; P243-G246 WeakPolarHBondContact O-CA 3.26Å; P243-G246 PolarHBondContact O-N 2.77Å
247	D	85.4	Confident	82.8	Confident	54 Å²	54	33.6 Å²	33.6	29%	0.289	20%	0.2	S	C	.	.	S	Bend	trans	-88.7	-54.8	-178.3	47.5	-20.4	0	0	0	112	R224 G245	R224-D247 WeakPolarHBondContact O-CA 3.35Å; R224-D247 WeakPolarHBondContact O-CB 3.3Å; G245-D247 VanDerWaalsContact C-N 3.25Å
248	F	84.9	Confident	80.4	Confident	78 Å²	78	40.5 Å²	40.5	34%	0.342	24%	0.236	S	C	.	.			trans	-131.6	137.4	-175.8	179.2	-97.9	0	0	0	111.5	N244	N244-F248 WeakPolarHBondContact CB-O 3.44Å
249	Q	91.9	Very high	78	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	25%	0.245	C	C	.	.			trans	-106.4	130	-179.7	-55.3	-54	-47.1	0	0	111.2	T221 P243 N244 G251 C252 E273 R276	T221-Q249 WeakPolarHBondContact O-CG 3.24Å; T221-Q249 PolarHBondContact O-NE2 3.36Å; P243-Q249 PolarHBondContact O-NE2 3.12Å; N244-Q249 PolarHBondContact ND2-OE1 3.41Å; Q249-G251 PolarHBondContact O-N 3.06Å; Q249-C252 WeakPolarHBondContact O-CB 3.24Å; Q249-C252 PolarHBondContact O-N 3.16Å; Q249-C252 VanDerWaalsContact O-N 3.1Å; Q249-E273 HydrophobicContact CB-CG 4.12Å; Q249-E273 HydrophobicContact CG-CB 4.1Å; Q249-E273 HydrophobicContact CG-CG 4.15Å; Q249-R276 HydrophobicContact CB-CB 4.32Å; Q249-R276 HydrophobicContact CB-CG 4.02Å; Q249-R276 HydrophobicContact CG-CB 3.92Å; Q249-R276 HydrophobicContact CG-CG 3.77Å
250	P	91.2	Very high	75.5	Confident	31 Å²	31	40.7 Å²	40.7	20%	0.201	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	135	176.5	-26.9	35.8	0	0	0	111.8	N244 R276 A340	N244-P250 VanDerWaalsContact CG-CD 3.43Å; N244-P250 WeakPolarHBondContact ND2-CD 3.48Å; P250-R276 PolarHBondContact O-NH2 3.27Å; P250-A340 HydrophobicContact CB-CB 4.08Å; P250-A340 VanDerWaalsContact O-CA 3.31Å; P250-A340 WeakPolarHBondContact O-CA 3.4Å
251	G	86.1	Confident	72.9	Confident	60 Å²	60	46.8 Å²	46.8	62%	0.619	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.3	-6.9	-176.9	0	0	0	0	0	115.3	Q249	Q249-G251 PolarHBondContact O-N 3.06Å
252	C	80.1	Confident	70.5	Confident	7 Å²	7	50.6 Å²	50.6	5%	0.047	31%	0.309	C	S	.	.			trans	-101	26.3	177.4	-62.3	0	0	0	0	113.4	Q249 C272 E273	Q249-C252 WeakPolarHBondContact O-CB 3.24Å; Q249-C252 PolarHBondContact O-N 3.16Å; Q249-C252 VanDerWaalsContact O-N 3.1Å; C252-C272 WeakPolarHBondContact CA-SG 3.29Å; C252-C272 HydrophobicContact CB-CB 3.63Å; C252-C272 WeakPolarHBondContact CB-SG 3.23Å; C252-C272 WeakPolarHBondContact SG-CB 3.17Å; C252-C272 PolarHBondContact SG-O 3.41Å; C252-C272 CovalentContact SG-SG 2.05Å; C252-C272 PolarHBondContact SG-SG 3.4Å; C252-E273 HydrophobicContact CB-CG 3.66Å
253	G	63.2	Low	68.1	Low	28 Å²	28	59.7 Å²	59.7	29%	0.289	34%	0.344	S	S	.	.	S	Bend	trans	-97.9	162.6	-174.1	0	0	0	0	0	115.9	N255 D256	G253-N255 PolarHBondContact O-N 3.25Å; G253-D256 PolarHBondContact O-N 3.28Å
254	L	52.7	Low	65.3	Low	100 Å²	100	62.8 Å²	62.8	52%	0.524	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-37.3	-9.2	-171.4	-67.4	162.3	0	0	0	121.2	F226 D256 V257	F226-L254 HydrophobicContact CE1-CD1 4.47Å; F226-L254 HydrophobicContact CZ-CD1 4.2Å; F226-L254 HydrophobicContact CZ-CD2 4.36Å; F226-L254 HydrophobicContact CZ-CG 4.2Å; L254-D256 PolarHBondContact O-N 2.68Å; L254-V257 HydrophobicContact CB-CB 4.34Å; L254-V257 HydrophobicContact CB-CG2 4.45Å; L254-V257 HydrophobicContact CD2-CB 3.72Å; L254-V257 HydrophobicContact CD2-CG1 3.86Å; L254-V257 HydrophobicContact CD2-CG2 3.59Å; L254-V257 HydrophobicContact CG-CG2 4.43Å; L254-V257 WeakPolarHBondContact O-CB 3.35Å; L254-V257 PolarHBondContact O-N 2.91Å
255	N	47.6	Very low	63	Low	167 Å²	167	64 Å²	64	89%	0.893	38%	0.384	S	S	*	.	H	α-helix	trans	-63.7	-21.6	171.2	-76.9	-8.1	0	0	0	111.7	G253	G253-N255 PolarHBondContact O-N 3.25Å
256	D	47.9	Very low	60.8	Low	85 Å²	85	68.6 Å²	68.6	46%	0.455	41%	0.405	S	S	.	.	H	α-helix	trans	-84.8	-16.5	171.4	-143.8	3.7	0	0	0	112.8	G253 L254 S260 V269	G253-D256 PolarHBondContact O-N 3.28Å; L254-D256 PolarHBondContact O-N 2.68Å; D256-S260 WeakPolarHBondContact O-CA 3.45Å; D256-S260 WeakPolarHBondContact O-CB 3.05Å; D256-S260 PolarHBondContact O-N 2.89Å; D256-S260 PolarHBondContact O-OG 3.37Å; D256-V269 HydrophobicContact CB-CG2 4.1Å
257	V	44.9	Very low	58.9	Low	30 Å²	30	71.8 Å²	71.8	18%	0.182	42%	0.424	C	S	.	.	H	α-helix	trans	-80.5	-38.8	-175.3	171.6	0	0	0	0	112.4	L254 G259 S260 M261 V269	L254-V257 HydrophobicContact CB-CB 4.34Å; L254-V257 HydrophobicContact CB-CG2 4.45Å; L254-V257 HydrophobicContact CD2-CB 3.72Å; L254-V257 HydrophobicContact CD2-CG1 3.86Å; L254-V257 HydrophobicContact CD2-CG2 3.59Å; L254-V257 HydrophobicContact CG-CG2 4.43Å; L254-V257 WeakPolarHBondContact O-CB 3.35Å; L254-V257 PolarHBondContact O-N 2.91Å; V257-G259 VanDerWaalsContact C-N 3.33Å; V257-S260 PolarHBondContact O-N 3.03Å; V257-M261 HydrophobicContact CG1-CE 4.01Å; V257-M261 HydrophobicContact CG1-CG 4.04Å; V257-M261 HydrophobicContact CG1-SD 3.69Å; V257-M261 WeakPolarHBondContact O-CB 3.38Å; V257-M261 WeakPolarHBondContact O-CG 3.44Å; V257-M261 PolarHBondContact O-N 2.86Å; V257-V269 HydrophobicContact CG2-CB 4.4Å; V257-V269 HydrophobicContact CG2-CG1 3.64Å; V257-V269 HydrophobicContact CG2-CG2 4.16Å
258	L	46.5	Very low	57.2	Low	145 Å²	145	74.9 Å²	74.9	76%	0.759	44%	0.437	S	S	*	.	H	α-helix	trans	-70.3	-34.2	177.4	-156.2	75.2	0	0	0	111.5	A262	L258-A262 PolarHBondContact O-N 3.32Å
259	G	46.9	Very low	55.6	Low	35 Å²	35	72 Å²	72	36%	0.361	43%	0.426	S	S	.	.	H	α-helix	trans	-68.4	-49.9	169.8	0	0	0	0	0	111.8	V257 M261 A262 Y263	V257-G259 VanDerWaalsContact C-N 3.33Å; G259-M261 PolarHBondContact O-N 3.28Å; G259-A262 WeakPolarHBondContact O-CB 3.42Å; G259-A262 PolarHBondContact O-N 3.43Å; G259-A262 VanDerWaalsContact O-N 3.08Å; G259-Y263 VanDerWaalsContact O-CD2 3.26Å; G259-Y263 WeakPolarHBondContact O-CD2 3.48Å; G259-Y263 PolarHBondContact O-N 2.96Å
260	S	43.3	Very low	54.1	Low	5 Å²	5	73.9 Å²	73.9	4%	0.035	44%	0.437	C	S	.	.	H	α-helix	trans	-69.9	-29	-177.1	-63.1	0	0	0	0	114.1	D256 V257 A262 Y263 G264 T265 V269	D256-S260 WeakPolarHBondContact O-CA 3.45Å; D256-S260 WeakPolarHBondContact O-CB 3.05Å; D256-S260 PolarHBondContact O-N 2.89Å; D256-S260 PolarHBondContact O-OG 3.37Å; V257-S260 PolarHBondContact O-N 3.03Å; S260-A262 VanDerWaalsContact C-N 3.32Å; S260-Y263 PolarHBondContact O-N 3.39Å; S260-G264 PolarHBondContact O-N 3.15Å; S260-T265 WeakPolarHBondContact CA-OG1 3.4Å; S260-T265 WeakPolarHBondContact CB-OG1 3.38Å; S260-T265 PolarHBondContact O-N 3.42Å; S260-T265 PolarHBondContact O-OG1 3.44Å; S260-T265 PolarHBondContact OG-OG1 2.87Å; S260-V269 WeakPolarHBondContact OG-CG2 3.15Å
261	M	44.9	Very low	53.4	Low	128 Å²	128	75.3 Å²	75.3	63%	0.631	44%	0.441	S	S	*	.	H	α-helix	trans	-68.7	-30.9	170.4	-77.4	179.1	154.6	0	0	112.3	V257 G259	V257-M261 HydrophobicContact CG1-CE 4.01Å; V257-M261 HydrophobicContact CG1-CG 4.04Å; V257-M261 HydrophobicContact CG1-SD 3.69Å; V257-M261 WeakPolarHBondContact O-CB 3.38Å; V257-M261 WeakPolarHBondContact O-CG 3.44Å; V257-M261 PolarHBondContact O-N 2.86Å; G259-M261 PolarHBondContact O-N 3.28Å
262	A	47.3	Very low	53.3	Low	81 Å²	81	74.4 Å²	74.4	67%	0.669	42%	0.424	S	S	*	.	H	α-helix	trans	-75.3	-25.4	175.6	0	0	0	0	0	112.7	L258 G259 S260	L258-A262 PolarHBondContact O-N 3.32Å; G259-A262 WeakPolarHBondContact O-CB 3.42Å; G259-A262 PolarHBondContact O-N 3.43Å; G259-A262 VanDerWaalsContact O-N 3.08Å; S260-A262 VanDerWaalsContact C-N 3.32Å
263	Y	46.3	Very low	53.8	Low	201 Å²	201	74.3 Å²	74.3	79%	0.788	42%	0.423	S	S	*	.	H	α-helix	trans	-107.4	-0.7	-178.6	-71.9	-74.8	0	0	0	115	G259 S260	G259-Y263 VanDerWaalsContact O-CD2 3.26Å; G259-Y263 WeakPolarHBondContact O-CD2 3.48Å; G259-Y263 PolarHBondContact O-N 2.96Å; S260-Y263 PolarHBondContact O-N 3.39Å
264	G	38.7	Very low	55.1	Low	64 Å²	64	73.5 Å²	73.5	66%	0.66	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.6	17.7	179.4	0	0	0	0	0	114.9	S260 I266	S260-G264 PolarHBondContact O-N 3.15Å; G264-I266 PolarHBondContact O-N 2.94Å
265	T	49	Very low	57.1	Low	35 Å²	35	70.4 Å²	70.4	22%	0.215	40%	0.395	C	S	.	.			trans	-99	38.2	-174.6	53.3	0	0	0	0	113.1	S260 T267 E268	S260-T265 WeakPolarHBondContact CA-OG1 3.4Å; S260-T265 WeakPolarHBondContact CB-OG1 3.38Å; S260-T265 PolarHBondContact O-N 3.42Å; S260-T265 PolarHBondContact O-OG1 3.44Å; S260-T265 PolarHBondContact OG-OG1 2.87Å; T265-T267 PolarHBondContact O-N 3.14Å; T265-E268 PolarHBondContact O-N 2.87Å
266	I	47.6	Very low	59.3	Low	106 Å²	106	63.2 Å²	63.2	54%	0.544	36%	0.355	S	S	.	.	H	α-helix	trans	-52.5	-27.8	175.9	-64.1	172.1	0	0	0	111.4	G264 V270	G264-I266 PolarHBondContact O-N 2.94Å; I266-V270 HydrophobicContact CG2-CG2 4.48Å; I266-V270 WeakPolarHBondContact O-CG2 3.48Å; I266-V270 PolarHBondContact O-N 2.71Å
267	T	50.5	Low	61.7	Low	67 Å²	67	59.1 Å²	59.1	41%	0.411	33%	0.333	S	S	.	.	H	α-helix	trans	-67.8	-28.4	177.4	47.8	0	0	0	0	114.6	M94 T265 K271	M94-T267 HydrophobicContact SD-CG2 3.79Å; T265-T267 PolarHBondContact O-N 3.14Å; T267-K271 VanDerWaalsContact O-CG 3.25Å; T267-K271 WeakPolarHBondContact O-CG 3.47Å; T267-K271 PolarHBondContact O-N 2.85Å
268	E	50.4	Low	64.2	Low	120 Å²	120	57.7 Å²	57.7	56%	0.561	33%	0.325	S	S	*	.	H	α-helix	trans	-78.2	-40.1	-179.2	-69.5	-175.2	154.5	0	0	111.9	T265 V270 K271 C272	T265-E268 PolarHBondContact O-N 2.87Å; E268-V270 VanDerWaalsContact C-N 3.32Å; E268-V270 PolarHBondContact O-N 2.88Å; E268-K271 PolarHBondContact O-N 3.43Å; E268-K271 VanDerWaalsContact O-N 3.15Å; E268-C272 PolarHBondContact O-N 3.48Å
269	V	51.4	Low	66.6	Low	18 Å²	18	53 Å²	53	11%	0.109	30%	0.298	C	S	.	.	H	α-helix	trans	-62	-43.2	176.5	-177.5	0	0	0	0	110.8	D256 V257 S260 K271 C272	D256-V269 HydrophobicContact CB-CG2 4.1Å; V257-V269 HydrophobicContact CG2-CB 4.4Å; V257-V269 HydrophobicContact CG2-CG1 3.64Å; V257-V269 HydrophobicContact CG2-CG2 4.16Å; S260-V269 WeakPolarHBondContact OG-CG2 3.15Å; V269-K271 PolarHBondContact O-N 2.79Å; V269-C272 PolarHBondContact O-N 2.88Å
270	V	60	Low	69.1	Low	39 Å²	39	51.3 Å²	51.3	24%	0.236	28%	0.281	C	S	.	.	H	α-helix	trans	-65.7	-21.1	179.9	172.3	0	0	0	0	112.6	Y222 I230 I266 E268	Y222-V270 HydrophobicContact CE1-CG1 4.06Å; Y222-V270 WeakPolarHBondContact CE1-O 3.42Å; I230-V270 HydrophobicContact CD1-CG1 3.15Å; I230-V270 HydrophobicContact CG1-CG1 4.47Å; I266-V270 HydrophobicContact CG2-CG2 4.48Å; I266-V270 WeakPolarHBondContact O-CG2 3.48Å; I266-V270 PolarHBondContact O-N 2.71Å; E268-V270 VanDerWaalsContact C-N 3.32Å; E268-V270 PolarHBondContact O-N 2.88Å
271	K	76.4	Confident	71.7	Confident	61 Å²	61	51 Å²	51	27%	0.265	28%	0.279	S	S	.	.	H	α-helix	trans	-84.1	-24.8	177.6	-75.3	175.5	-178.2	-157	0	113.6	E99 T267 E268 V269 E273 H274 E275	E99-K271 WeakPolarHBondContact OE1-CE 3.45Å; E99-K271 IonicContact OE1-NZ 2.71Å; E99-K271 PolarHBondContact OE1-NZ 2.63Å; T267-K271 VanDerWaalsContact O-CG 3.25Å; T267-K271 WeakPolarHBondContact O-CG 3.47Å; T267-K271 PolarHBondContact O-N 2.85Å; E268-K271 PolarHBondContact O-N 3.43Å; E268-K271 VanDerWaalsContact O-N 3.15Å; V269-K271 PolarHBondContact O-N 2.79Å; K271-E273 PolarHBondContact O-N 3.07Å; K271-H274 PolarHBondContact O-N 3.13Å; K271-H274 VanDerWaalsContact O-N 3.14Å; K271-E275 HydrophobicContact CB-CG 4.48Å; K271-E275 WeakPolarHBondContact O-CB 3.4Å; K271-E275 PolarHBondContact O-N 2.9Å
272	C	84.7	Confident	74.2	Confident	41 Å²	41	45.5 Å²	45.5	28%	0.277	25%	0.253	S	S	.	.	H	α-helix	trans	-59.5	-50.4	-172.6	-176.9	0	0	0	0	112.5	C252 E268 V269 H274 R276	C252-C272 WeakPolarHBondContact CA-SG 3.29Å; C252-C272 HydrophobicContact CB-CB 3.63Å; C252-C272 WeakPolarHBondContact CB-SG 3.23Å; C252-C272 WeakPolarHBondContact SG-CB 3.17Å; C252-C272 PolarHBondContact SG-O 3.41Å; C252-C272 CovalentContact SG-SG 2.05Å; C252-C272 PolarHBondContact SG-SG 3.4Å; E268-C272 PolarHBondContact O-N 3.48Å; V269-C272 PolarHBondContact O-N 2.88Å; C272-H274 VanDerWaalsContact C-N 3.3Å; C272-H274 PolarHBondContact O-N 3.22Å; C272-R276 PolarHBondContact O-N 3.24Å; C272-R276 VanDerWaalsContact O-N 3.12Å
273	E	89.5	Confident	76.6	Confident	4 Å²	4	41.8 Å²	41.8	2%	0.019	22%	0.222	C	C	.	.	H	α-helix	trans	-66.7	-34	177	-65.9	99.1	137.3	0	0	112.2	T221 Y222 Q249 C252 K271 R276	T221-E273 WeakPolarHBondContact CB-O 3.35Å; T221-E273 PolarHBondContact OG1-O 2.93Å; Y222-E273 HydrophobicContact CD1-CB 4.37Å; Y222-E273 HydrophobicContact CD2-CB 3.28Å; Y222-E273 HydrophobicContact CD2-CG 3.8Å; Y222-E273 HydrophobicContact CE2-CB 3.8Å; Y222-E273 HydrophobicContact CE2-CG 3.96Å; Y222-E273 HydrophobicContact CG-CB 3.61Å; Q249-E273 HydrophobicContact CB-CG 4.12Å; Q249-E273 HydrophobicContact CG-CB 4.1Å; Q249-E273 HydrophobicContact CG-CG 4.15Å; C252-E273 HydrophobicContact CB-CG 3.66Å; K271-E273 PolarHBondContact O-N 3.07Å; E273-R276 WeakPolarHBondContact O-CB 3.48Å
274	H	91.6	Very high	79.1	Confident	12 Å²	12	32.8 Å²	32.8	6%	0.056	19%	0.188	C	C	.	.	H	α-helix	trans	-68.7	-50.9	179.9	-161	43.9	0	0	0	111.2	Y168 S169 D193 Y222 K271 C272 R276 A277	Y168-H274 AromaticContact CE2-CD2 3.84Å; Y168-H274 AromaticContact CZ-CD2 3.55Å; Y168-H274 PolarHBondContact OH-CD2 3.35Å; S169-H274 WeakPolarHBondContact CB-NE2 3.42Å; S169-H274 PolarHBondContact OG-NE2 3.12Å; D193-H274 PolarHBondContact O-CE1 3.16Å; D193-H274 IonicContact OD2-CE1 3.57Å; D193-H274 IonicContact OD2-CG 3.7Å; D193-H274 IonicContact OD2-ND1 2.69Å; D193-H274 PolarHBondContact OD2-ND1 3.09Å; Y222-H274 HydrophobicContact CD1-CB 4.25Å; K271-H274 PolarHBondContact O-N 3.13Å; K271-H274 VanDerWaalsContact O-N 3.14Å; C272-H274 VanDerWaalsContact C-N 3.3Å; C272-H274 PolarHBondContact O-N 3.22Å; H274-R276 PolarHBondContact O-N 3.05Å; H274-A277 PolarHBondContact O-N 3.4Å
275	E	93	Very high	81.8	Confident	35 Å²	35	29.8 Å²	29.8	16%	0.164	16%	0.157	C	C	.	.	H	α-helix	trans	-68	-17.8	177.9	-71	-171.4	-158.4	0	0	113	Y168 K271 A277 V278 H279	Y168-E275 WeakPolarHBondContact OH-CG 3.28Å; K271-E275 HydrophobicContact CB-CG 4.48Å; K271-E275 WeakPolarHBondContact O-CB 3.4Å; K271-E275 PolarHBondContact O-N 2.9Å; E275-A277 PolarHBondContact O-N 2.96Å; E275-A277 VanDerWaalsContact O-N 3.15Å; E275-V278 WeakPolarHBondContact O-CB 3.18Å; E275-V278 PolarHBondContact O-N 2.79Å; E275-H279 PolarHBondContact O-N 3.02Å
276	R	95.6	Very high	84.1	Confident	15 Å²	15	31 Å²	31	6%	0.057	16%	0.164	C	C	.	.	H	α-helix	trans	-54.5	-35.1	176.5	-178.2	57.9	61	129.2	1.3	112.4	T221 Q249 P250 C272 E273 H274 V278 H279 L280 R339 A340 F344	T221-R276 HydrophobicContact CG2-CB 4.28Å; T221-R276 HydrophobicContact CG2-CG 4.2Å; Q249-R276 HydrophobicContact CB-CB 4.32Å; Q249-R276 HydrophobicContact CB-CG 4.02Å; Q249-R276 HydrophobicContact CG-CB 3.92Å; Q249-R276 HydrophobicContact CG-CG 3.77Å; P250-R276 PolarHBondContact O-NH2 3.27Å; C272-R276 PolarHBondContact O-N 3.24Å; C272-R276 VanDerWaalsContact O-N 3.12Å; E273-R276 WeakPolarHBondContact O-CB 3.48Å; H274-R276 PolarHBondContact O-N 3.05Å; R276-V278 VanDerWaalsContact C-N 3.28Å; R276-V278 PolarHBondContact O-N 3.26Å; R276-H279 PolarHBondContact O-N 2.94Å; R276-L280 HydrophobicContact CG-CD1 3.94Å; R276-L280 HydrophobicContact CG-CG 4.14Å; R276-L280 WeakPolarHBondContact O-CB 3.45Å; R276-L280 WeakPolarHBondContact O-CG 3.37Å; R276-L280 PolarHBondContact O-N 3.39Å; R276-R339 PolarHBondContact NH1-O 3.33Å; R276-A340 VanDerWaalsContact CZ-O 3.31Å; R276-A340 PolarHBondContact NH1-O 3.46Å; R276-A340 PolarHBondContact NH2-O 3.43Å; R276-F344 VanDerWaalsContact NH1-CD1 3.32Å
277	A	97.4	Very high	86.3	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-58.7	-41.5	176.1	0	0	0	0	0	111.9	L192 D193 L219 T221 H274 E275 L280 F281	L192-A277 HydrophobicContact CB-CB 3.99Å; D193-A277 HydrophobicContact CB-CB 3.8Å; L219-A277 HydrophobicContact CB-CB 3.95Å; L219-A277 WeakPolarHBondContact CD1-O 3.43Å; T221-A277 HydrophobicContact CG2-CB 4.01Å; T221-A277 PolarHBondContact OG1-N 2.92Å; H274-A277 PolarHBondContact O-N 3.4Å; E275-A277 PolarHBondContact O-N 2.96Å; E275-A277 VanDerWaalsContact O-N 3.15Å; A277-L280 PolarHBondContact O-N 2.8Å; A277-F281 PolarHBondContact O-N 3.46Å; A277-F281 VanDerWaalsContact O-N 3.07Å
278	V	97.8	Very high	88.2	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-64.3	-47	175.6	-174.1	0	0	0	0	110.7	W101 Y168 L192 E275 R276 L280 F281 V282	W101-V278 HydrophobicContact CB-CB 4.41Å; W101-V278 HydrophobicContact CB-CG1 3.96Å; W101-V278 HydrophobicContact CD2-CG1 4.02Å; W101-V278 HydrophobicContact CD2-CG2 4.06Å; W101-V278 HydrophobicContact CE3-CB 4.41Å; W101-V278 HydrophobicContact CE3-CG1 3.56Å; W101-V278 HydrophobicContact CE3-CG2 4.05Å; W101-V278 HydrophobicContact CG-CG1 4.21Å; W101-V278 HydrophobicContact CG-CG2 4.35Å; W101-V278 HydrophobicContact CZ3-CG1 4.43Å; Y168-V278 HydrophobicContact CD2-CG2 3.6Å; Y168-V278 HydrophobicContact CE2-CG2 4.05Å; Y168-V278 HydrophobicContact CG-CG2 3.97Å; L192-V278 HydrophobicContact CB-CG2 4.38Å; L192-V278 HydrophobicContact CD1-CB 4.41Å; L192-V278 HydrophobicContact CD1-CG2 4.01Å; E275-V278 WeakPolarHBondContact O-CB 3.18Å; E275-V278 PolarHBondContact O-N 2.79Å; R276-V278 VanDerWaalsContact C-N 3.28Å; R276-V278 PolarHBondContact O-N 3.26Å; V278-L280 VanDerWaalsContact C-N 3.34Å; V278-L280 PolarHBondContact O-N 3.15Å; V278-F281 WeakPolarHBondContact O-CB 3.44Å; V278-F281 PolarHBondContact O-N 2.75Å; V278-F281 VanDerWaalsContact O-N 3.13Å; V278-V282 HydrophobicContact CG1-CG2 4.36Å; V278-V282 WeakPolarHBondContact O-CG2 3.48Å; V278-V282 PolarHBondContact O-N 3.1Å
279	H	97.2	Very high	90.1	Very high	45 Å²	45	28.9 Å²	28.9	21%	0.208	15%	0.152	C	C	.	.	H	α-helix	trans	-63.6	-37.2	179.8	-68	-45	0	0	0	113.2	E275 R276 F281 V282 D283 F344	E275-H279 PolarHBondContact O-N 3.02Å; R276-H279 PolarHBondContact O-N 2.94Å; H279-F281 VanDerWaalsContact C-N 3.34Å; H279-V282 PolarHBondContact O-N 2.98Å; H279-D283 WeakPolarHBondContact O-CB 3.36Å; H279-D283 PolarHBondContact O-N 2.9Å; H279-F344 HydrophobicContact CB-CE2 3.82Å; H279-F344 HydrophobicContact CB-CZ 3.93Å; H279-F344 WeakPolarHBondContact O-CE2 3.14Å
280	L	98.2	Very high	91.8	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-65.1	-37.7	173.1	-72	170.2	0	0	0	112	L219 T221 P243 R276 A277 V278 S284 I319 T338 F344	L219-L280 HydrophobicContact CD1-CB 4.16Å; T221-L280 HydrophobicContact CG2-CD1 3.96Å; P243-L280 HydrophobicContact CB-CD1 3.82Å; P243-L280 HydrophobicContact CG-CD1 3.51Å; R276-L280 HydrophobicContact CG-CD1 3.94Å; R276-L280 HydrophobicContact CG-CG 4.14Å; R276-L280 WeakPolarHBondContact O-CB 3.45Å; R276-L280 WeakPolarHBondContact O-CG 3.37Å; R276-L280 PolarHBondContact O-N 3.39Å; A277-L280 PolarHBondContact O-N 2.8Å; V278-L280 VanDerWaalsContact C-N 3.34Å; V278-L280 PolarHBondContact O-N 3.15Å; L280-S284 PolarHBondContact O-N 3.38Å; L280-S284 VanDerWaalsContact O-N 3.14Å; L280-I319 HydrophobicContact CD2-CD1 4.37Å; L280-T338 HydrophobicContact CD2-CG2 3.94Å; L280-F344 HydrophobicContact CD2-CB 3.73Å; L280-F344 HydrophobicContact CD2-CD2 3.73Å; L280-F344 HydrophobicContact CD2-CG 3.76Å; L280-F344 HydrophobicContact CG-CD2 4.47Å
281	F	98.4	Very high	93.3	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-67.2	-44.7	174.2	-166.8	-90.7	0	0	0	111.5	L105 I166 T190 L192 L219 A277 V278 H279 D283 S284 L285 Y321	L105-F281 HydrophobicContact CD1-CD1 3.71Å; L105-F281 HydrophobicContact CD1-CE1 4.08Å; I166-F281 HydrophobicContact CD1-CE1 3.78Å; I166-F281 HydrophobicContact CD1-CZ 3.95Å; I166-F281 HydrophobicContact CG1-CZ 4.44Å; T190-F281 HydrophobicContact CG2-CD2 3.84Å; T190-F281 HydrophobicContact CG2-CE2 3.71Å; L192-F281 HydrophobicContact CD1-CB 4.45Å; L192-F281 HydrophobicContact CD2-CB 3.78Å; L192-F281 HydrophobicContact CD2-CD2 4.06Å; L192-F281 HydrophobicContact CD2-CG 4.09Å; L219-F281 HydrophobicContact CD1-CB 4.38Å; A277-F281 PolarHBondContact O-N 3.46Å; A277-F281 VanDerWaalsContact O-N 3.07Å; V278-F281 WeakPolarHBondContact O-CB 3.44Å; V278-F281 PolarHBondContact O-N 2.75Å; V278-F281 VanDerWaalsContact O-N 3.13Å; H279-F281 VanDerWaalsContact C-N 3.34Å; F281-D283 VanDerWaalsContact C-N 3.32Å; F281-D283 PolarHBondContact O-N 2.9Å; F281-S284 WeakPolarHBondContact O-CB 3.47Å; F281-S284 PolarHBondContact O-N 3.38Å; F281-S284 VanDerWaalsContact O-N 3.15Å; F281-S284 PolarHBondContact O-OG 3.19Å; F281-L285 HydrophobicContact CD1-CD1 3.93Å; F281-L285 HydrophobicContact CD1-CG 4.35Å; F281-L285 HydrophobicContact CE1-CD1 3.86Å; F281-L285 HydrophobicContact CE1-CD2 4.4Å; F281-L285 HydrophobicContact CE1-CG 4.2Å; F281-L285 PolarHBondContact O-N 3.08Å; F281-Y321 HydrophobicContact CZ-CD2 4.16Å
282	V	98	Very high	94.2	Very high	12 Å²	12	30 Å²	30	7%	0.073	16%	0.157	C	C	.	.	H	α-helix	trans	-58.1	-43.7	174.3	169.6	0	0	0	0	111.5	L105 A108 V278 H279 S284 L285 V286 M342	L105-V282 HydrophobicContact CB-CG2 4.12Å; L105-V282 HydrophobicContact CD1-CG2 3.96Å; A108-V282 HydrophobicContact CB-CG1 3.98Å; A108-V282 HydrophobicContact CB-CG2 4.5Å; V278-V282 HydrophobicContact CG1-CG2 4.36Å; V278-V282 WeakPolarHBondContact O-CG2 3.48Å; V278-V282 PolarHBondContact O-N 3.1Å; H279-V282 PolarHBondContact O-N 2.98Å; V282-S284 VanDerWaalsContact C-N 3.3Å; V282-S284 PolarHBondContact O-N 3.39Å; V282-L285 WeakPolarHBondContact O-CB 3.33Å; V282-L285 PolarHBondContact O-N 3.26Å; V282-V286 PolarHBondContact O-N 3.34Å; V282-V286 VanDerWaalsContact O-N 3.16Å; V282-M342 HydrophobicContact CG1-CE 4.49Å
283	D	97.6	Very high	94.6	Very high	3 Å²	3	30.8 Å²	30.8	2%	0.016	16%	0.156	C	C	.	.	H	α-helix	trans	-57.3	-42.5	175.3	-177.8	68.9	0	0	0	112.4	H279 F281 L285 V286 N287 M342 P343 F344	H279-D283 WeakPolarHBondContact O-CB 3.36Å; H279-D283 PolarHBondContact O-N 2.9Å; F281-D283 VanDerWaalsContact C-N 3.32Å; F281-D283 PolarHBondContact O-N 2.9Å; D283-L285 PolarHBondContact O-N 3.09Å; D283-V286 PolarHBondContact O-N 3.26Å; D283-N287 WeakPolarHBondContact O-CB 3.23Å; D283-N287 PolarHBondContact O-N 3.46Å; D283-N287 PolarHBondContact OD1-ND2 2.77Å; D283-M342 HydrophobicContact CB-CE 3.97Å; D283-M342 HydrophobicContact CB-CG 4.33Å; D283-M342 HydrophobicContact CB-SD 4.4Å; D283-M342 WeakPolarHBondContact OD1-CG 3.12Å; D283-P343 WeakPolarHBondContact OD1-CA 3.37Å; D283-F344 HydrophobicContact CB-CD2 3.58Å; D283-F344 HydrophobicContact CB-CE2 4.07Å; D283-F344 PolarHBondContact OD1-N 2.87Å
284	S	97.5	Very high	95	Very high	11 Å²	11	30.6 Å²	30.6	8%	0.077	16%	0.155	C	C	.	.	H	α-helix	trans	-66.2	-22.3	177	79.7	0	0	0	0	114.5	L280 F281 V282 I319 G320 Y321	L280-S284 PolarHBondContact O-N 3.38Å; L280-S284 VanDerWaalsContact O-N 3.14Å; F281-S284 WeakPolarHBondContact O-CB 3.47Å; F281-S284 PolarHBondContact O-N 3.38Å; F281-S284 VanDerWaalsContact O-N 3.15Å; F281-S284 PolarHBondContact O-OG 3.19Å; V282-S284 VanDerWaalsContact C-N 3.3Å; V282-S284 PolarHBondContact O-N 3.39Å; S284-I319 WeakPolarHBondContact CB-O 3.36Å; S284-G320 WeakPolarHBondContact OG-CA 3.44Å; S284-Y321 PolarHBondContact OG-N 3.22Å
285	L	96.9	Very high	95.3	Very high	1 Å²	1	30 Å²	30	1%	0.005	15%	0.152	C	C	.	.	H	α-helix	trans	-80.5	-43	176.4	-69.7	168	0	0	0	111.4	L105 A108 L109 R112 F281 V282 D283 Y321	L105-L285 HydrophobicContact CD1-CD1 3.84Å; A108-L285 HydrophobicContact CB-CB 4.12Å; A108-L285 HydrophobicContact CB-CD1 3.76Å; L109-L285 HydrophobicContact CD2-CD1 3.85Å; L109-L285 HydrophobicContact CD2-CD2 3.9Å; L109-L285 HydrophobicContact CG-CD1 3.91Å; R112-L285 HydrophobicContact CB-CB 4.36Å; R112-L285 HydrophobicContact CB-CD2 3.93Å; R112-L285 HydrophobicContact CG-CD2 3.74Å; F281-L285 HydrophobicContact CD1-CD1 3.93Å; F281-L285 HydrophobicContact CD1-CG 4.35Å; F281-L285 HydrophobicContact CE1-CD1 3.86Å; F281-L285 HydrophobicContact CE1-CD2 4.4Å; F281-L285 HydrophobicContact CE1-CG 4.2Å; F281-L285 PolarHBondContact O-N 3.08Å; V282-L285 WeakPolarHBondContact O-CB 3.33Å; V282-L285 PolarHBondContact O-N 3.26Å; D283-L285 PolarHBondContact O-N 3.09Å; L285-Y321 HydrophobicContact CD2-CD1 3.97Å; L285-Y321 HydrophobicContact CD2-CD2 3.52Å; L285-Y321 HydrophobicContact CD2-CE2 4.21Å; L285-Y321 HydrophobicContact CD2-CG 3.4Å; L285-Y321 HydrophobicContact CG-CG 4.49Å
286	V	95.6	Very high	95.4	Very high	60 Å²	60	30.8 Å²	30.8	36%	0.364	16%	0.156	S	C	.	.	H	α-helix	trans	-93.7	-33.9	-170.7	-53	0	0	0	0	113.5	A108 V282 D283 Q288 M342	A108-V286 HydrophobicContact CB-CG1 3.83Å; V282-V286 PolarHBondContact O-N 3.34Å; V282-V286 VanDerWaalsContact O-N 3.16Å; D283-V286 PolarHBondContact O-N 3.26Å; V286-Q288 PolarHBondContact O-N 2.69Å; V286-M342 HydrophobicContact CG2-CE 3.06Å
287	N	93.8	Very high	95.4	Very high	36 Å²	36	30.6 Å²	30.6	19%	0.193	16%	0.157	C	C	.	.			trans	-97.5	64	-176.8	-68.2	-52.2	0	0	0	111.8	D283 D289 K290 M342	D283-N287 WeakPolarHBondContact O-CB 3.23Å; D283-N287 PolarHBondContact O-N 3.46Å; D283-N287 PolarHBondContact OD1-ND2 2.77Å; N287-D289 VanDerWaalsContact C-N 3.31Å; N287-D289 PolarHBondContact O-N 3.2Å; N287-K290 CarbonylContact O-C 3.41Å; N287-K290 PolarHBondContact O-N 3.16Å; N287-M342 VanDerWaalsContact ND2-CE 3.28Å; N287-M342 WeakPolarHBondContact ND2-CE 3.39Å
288	Q	91.1	Very high	95.1	Very high	98 Å²	98	35.3 Å²	35.3	46%	0.458	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-29.2	-174	-58.6	173.4	29.4	0	0	113.5	R112 V286 K290	R112-Q288 VanDerWaalsContact NH1-NE2 3.12Å; V286-Q288 PolarHBondContact O-N 2.69Å; Q288-K290 VanDerWaalsContact C-N 3.29Å
289	D	89.8	Confident	94.7	Very high	116 Å²	116	38 Å²	38	62%	0.62	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-20.5	177.1	64	-47.4	0	0	0	112.5	N287 P291	N287-D289 VanDerWaalsContact C-N 3.31Å; N287-D289 PolarHBondContact O-N 3.2Å; D289-P291 WeakPolarHBondContact O-CD 3.39Å
290	K	87.5	Confident	94.5	Very high	97 Å²	97	36.9 Å²	36.9	42%	0.422	20%	0.197	S	C	.	.	S	Bend	trans	-125.8	58.1	-175.2	-71.5	173.8	-170	179.4	0	111.9	N287 Q288 S292 R345	N287-K290 CarbonylContact O-C 3.41Å; N287-K290 PolarHBondContact O-N 3.16Å; Q288-K290 VanDerWaalsContact C-N 3.29Å; K290-S292 PolarHBondContact O-N 2.79Å; K290-R345 WeakPolarHBondContact O-CD 3.37Å
291	P	90.8	Very high	94.2	Very high	36 Å²	36	41 Å²	41	23%	0.234	22%	0.219	C	C	.	.			trans	-66.6	134.6	-176.3	28.4	-35	0	0	0	111.5	D289 F293 R345	D289-P291 WeakPolarHBondContact O-CD 3.39Å; P291-F293 HydrophobicContact CB-CZ 4.41Å; P291-F293 HydrophobicContact CG-CE2 4.08Å; P291-F293 HydrophobicContact CG-CZ 3.98Å; P291-R345 PolarHBondContact O-NH1 3.07Å
292	S	95.6	Very high	94	Very high	9 Å²	9	46.2 Å²	46.2	6%	0.063	24%	0.239	C	C	.	.			trans	-82.9	143.2	172.3	-69.5	0	0	0	0	111	K290 S318 I319 R345	K290-S292 PolarHBondContact O-N 2.79Å; S292-S318 WeakPolarHBondContact O-CA 3.33Å; S292-I319 VanDerWaalsContact CB-CD1 3.48Å; S292-I319 PolarHBondContact O-N 3.04Å; S292-I319 VanDerWaalsContact O-N 3.11Å; S292-R345 WeakPolarHBondContact OG-CA 3.4Å; S292-R345 WeakPolarHBondContact OG-CB 3.33Å
293	F	94.3	Very high	93.9	Very high	56 Å²	56	45.7 Å²	45.7	25%	0.246	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	137.6	179.6	-63.8	-78.9	0	0	0	111.2	P291 F295 N317 L336	P291-F293 HydrophobicContact CB-CZ 4.41Å; P291-F293 HydrophobicContact CG-CE2 4.08Å; P291-F293 HydrophobicContact CG-CZ 3.98Å; F293-F295 HydrophobicContact CB-CZ 4.46Å; F293-N317 CarbonylContact C-O 3.59Å; F293-N317 WeakPolarHBondContact CA-O 3.42Å; F293-L336 WeakPolarHBondContact O-CB 3.28Å
294	A	97.3	Very high	93.7	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	147.2	170	0	0	0	0	0	110.6	I241 C316 N317 I319 M334 Y335 L336	I241-A294 HydrophobicContact CG1-CB 4.15Å; I241-A294 HydrophobicContact CG2-CB 3.81Å; A294-C316 CarbonylContact O-C 3.51Å; A294-C316 WeakPolarHBondContact O-CA 3.14Å; A294-C316 WeakPolarHBondContact O-CB 3.36Å; A294-N317 PolarHBondContact N-O 3.42Å; A294-N317 PolarHBondContact O-N 2.98Å; A294-I319 HydrophobicContact CB-CG2 3.76Å; A294-M334 HydrophobicContact CB-CB 3.72Å; A294-M334 HydrophobicContact CB-SD 4.42Å; A294-Y335 WeakPolarHBondContact CA-O 3.43Å; A294-L336 HydrophobicContact CB-CD2 4.09Å
295	F	97.2	Very high	93.5	Very high	1 Å²	1	48.3 Å²	48.3	0%	0.004	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	129.7	-177.3	-56.9	-84.8	0	0	0	110.7	F293 C297 F303 C308 L309 C316 M334 Y335 H348	F293-F295 HydrophobicContact CB-CZ 4.46Å; F295-C297 PolarHBondContact O-N 3.01Å; F295-F303 HydrophobicContact CD2-CE2 4.07Å; F295-C308 WeakPolarHBondContact CB-O 3.29Å; F295-L309 HydrophobicContact CD1-CD2 4.4Å; F295-L309 HydrophobicContact CD2-CD2 3.61Å; F295-L309 HydrophobicContact CE1-CD2 4.45Å; F295-L309 HydrophobicContact CE2-CD2 3.67Å; F295-L309 HydrophobicContact CG-CD2 4Å; F295-L309 HydrophobicContact CZ-CD2 4.1Å; F295-C316 HydrophobicContact CD1-CB 3.69Å; F295-C316 HydrophobicContact CE1-CB 4Å; F295-M334 CarbonylContact O-C 3.58Å; F295-M334 VanDerWaalsContact O-CA 3.28Å; F295-M334 WeakPolarHBondContact O-CA 3.33Å; F295-Y335 PolarHBondContact N-O 2.89Å; F295-Y335 PolarHBondContact O-N 2.74Å; F295-H348 HydrophobicContact CE2-CB 4.31Å; F295-H348 AromaticContact CE2-ND1 3.85Å
296	Q	95.8	Very high	93.3	Very high	51 Å²	51	48.3 Å²	48.3	24%	0.238	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	127.7	177	-167.8	-178.3	15.3	0	0	110.4	R315 N328 S332 K333 M334	Q296-R315 HydrophobicContact CB-CB 4.27Å; Q296-R315 WeakPolarHBondContact CB-O 3.46Å; Q296-R315 PolarHBondContact N-O 3.24Å; Q296-N328 PolarHBondContact NE2-ND2 3.05Å; Q296-S332 PolarHBondContact NE2-OG 2.94Å; Q296-K333 WeakPolarHBondContact CA-O 3.43Å; Q296-M334 HydrophobicContact CB-CE 3.85Å; Q296-M334 HydrophobicContact CB-CG 4.39Å
297	C	95.1	Very high	93.3	Very high	10 Å²	10	48.6 Å²	48.6	7%	0.068	24%	0.244	C	C	.	.			trans	-146.7	158.5	176.6	-152.7	0	0	0	0	110.2	F295 D299 R302 F303 C308 K333 Y335	F295-C297 PolarHBondContact O-N 3.01Å; C297-D299 PolarHBondContact SG-O 2.9Å; C297-R302 VanDerWaalsContact SG-CB 3.58Å; C297-F303 HydrophobicContact CB-CB 4.29Å; C297-F303 PolarHBondContact SG-N 3.02Å; C297-C308 VanDerWaalsContact CA-SG 3.58Å; C297-C308 HydrophobicContact CB-CB 3.46Å; C297-C308 VanDerWaalsContact CB-CB 3.46Å; C297-C308 WeakPolarHBondContact CB-SG 3.33Å; C297-C308 WeakPolarHBondContact SG-CB 3.49Å; C297-C308 CovalentContact SG-SG 2.03Å; C297-C308 PolarHBondContact SG-SG 3.29Å; C297-K333 PolarHBondContact N-O 3.46Å; C297-Y335 HydrophobicContact CB-CD2 3.54Å; C297-Y335 HydrophobicContact CB-CE2 3.81Å
298	T	92.1	Very high	93.4	Very high	100 Å²	100	47.8 Å²	47.8	61%	0.613	24%	0.241	S	C	*	.	S	Bend	trans	-74.1	-32.2	178.5	48.5	0	0	0	0	112.4	R302	T298-R302 WeakPolarHBondContact OG1-CD 3.47Å
299	D	89.9	Confident	93.6	Very high	55 Å²	55	43.2 Å²	43.2	29%	0.294	22%	0.22	S	C	.	.	S	Bend	trans	-158.3	160.2	-175.4	62	90.4	0	0	0	110.8	C297 N301 R302 F303	C297-D299 PolarHBondContact SG-O 2.9Å; D299-N301 PolarHBondContact O-N 2.76Å; D299-N301 WeakPolarHBondContact OD1-CB 3.38Å; D299-N301 PolarHBondContact OD1-N 2.85Å; D299-N301 VanDerWaalsContact OD1-N 3.13Å; D299-R302 WeakPolarHBondContact OD1-CG 3.33Å; D299-R302 PolarHBondContact OD1-N 2.81Å; D299-R302 WeakPolarHBondContact OD2-CD 3.47Å; D299-R302 VanDerWaalsContact OD2-CG 3.24Å; D299-R302 WeakPolarHBondContact OD2-CG 3.35Å; D299-F303 PolarHBondContact O-N 3.17Å
300	S	91.8	Very high	93.8	Very high	22 Å²	22	39.2 Å²	39.2	15%	0.154	20%	0.201	C	C	.	.	H	α-helix	trans	-63	-37.9	-178.4	-175	0	0	0	0	112.4	G245 R302 F303 K304	G245-S300 WeakPolarHBondContact CA-OG 3.32Å; S300-R302 PolarHBondContact O-N 3Å; S300-F303 WeakPolarHBondContact O-CA 3.49Å; S300-F303 WeakPolarHBondContact O-CB 3.21Å; S300-F303 PolarHBondContact O-N 3.3Å; S300-F303 VanDerWaalsContact O-N 3.1Å; S300-K304 WeakPolarHBondContact O-CG 3.43Å; S300-K304 PolarHBondContact O-N 3.41Å
301	N	92.3	Very high	94.1	Very high	86 Å²	86	36.4 Å²	36.4	46%	0.46	19%	0.193	S	C	.	.	H	α-helix	trans	-65.1	-41.2	-176.8	-71	-9.7	0	0	0	111.7	D299 F303 K304 K305 V387	D299-N301 PolarHBondContact O-N 2.76Å; D299-N301 WeakPolarHBondContact OD1-CB 3.38Å; D299-N301 PolarHBondContact OD1-N 2.85Å; D299-N301 VanDerWaalsContact OD1-N 3.13Å; N301-F303 VanDerWaalsContact C-N 3.29Å; N301-F303 PolarHBondContact O-N 2.9Å; N301-K304 PolarHBondContact O-N 3.23Å; N301-K305 WeakPolarHBondContact O-CG 3.45Å; N301-K305 PolarHBondContact O-N 3.41Å; N301-V387 HydrophobicContact CB-CG1 4.16Å
302	R	94.7	Very high	94.1	Very high	110 Å²	110	43.5 Å²	43.5	42%	0.415	22%	0.215	S	C	.	.	H	α-helix	trans	-64.8	-33.8	173.9	-72.2	-176.6	77.2	134.8	6.1	112.9	C297 T298 D299 S300 I307	C297-R302 VanDerWaalsContact SG-CB 3.58Å; T298-R302 WeakPolarHBondContact OG1-CD 3.47Å; D299-R302 WeakPolarHBondContact OD1-CG 3.33Å; D299-R302 PolarHBondContact OD1-N 2.81Å; D299-R302 WeakPolarHBondContact OD2-CD 3.47Å; D299-R302 VanDerWaalsContact OD2-CG 3.24Å; D299-R302 WeakPolarHBondContact OD2-CG 3.35Å; S300-R302 PolarHBondContact O-N 3Å; R302-I307 HydrophobicContact CB-CD1 4.35Å; R302-I307 HydrophobicContact CG-CD1 4.33Å; R302-I307 WeakPolarHBondContact O-CB 3.47Å; R302-I307 PolarHBondContact O-N 3.06Å; R302-I307 VanDerWaalsContact O-N 3.13Å
303	F	95.7	Very high	93.7	Very high	1 Å²	1	52.2 Å²	52.2	0%	0.004	25%	0.252	C	S	.	.	H	α-helix	trans	-67.5	-46	172.6	174.5	-102.3	0	0	0	111.3	F295 C297 D299 S300 N301 K305 G306 C308 L309 Y335 L336 K337 H348 L399	F295-F303 HydrophobicContact CD2-CE2 4.07Å; C297-F303 HydrophobicContact CB-CB 4.29Å; C297-F303 PolarHBondContact SG-N 3.02Å; D299-F303 PolarHBondContact O-N 3.17Å; S300-F303 WeakPolarHBondContact O-CA 3.49Å; S300-F303 WeakPolarHBondContact O-CB 3.21Å; S300-F303 PolarHBondContact O-N 3.3Å; S300-F303 VanDerWaalsContact O-N 3.1Å; N301-F303 VanDerWaalsContact C-N 3.29Å; N301-F303 PolarHBondContact O-N 2.9Å; F303-K305 PolarHBondContact O-N 3Å; F303-G306 WeakPolarHBondContact O-CA 3.02Å; F303-G306 PolarHBondContact O-N 3.48Å; F303-C308 HydrophobicContact CD2-CB 4.41Å; F303-L309 HydrophobicContact CE2-CD2 3.99Å; F303-Y335 HydrophobicContact CB-CD2 4.27Å; F303-Y335 HydrophobicContact CB-CG 4.06Å; F303-Y335 HydrophobicContact CD1-CG 4.36Å; F303-Y335 HydrophobicContact CG-CG 4.14Å; F303-L336 VanDerWaalsContact CZ-CA 3.46Å; F303-K337 HydrophobicContact CE1-CG 4.14Å; F303-H348 AromaticContact CZ-CD2 3.94Å; F303-L399 HydrophobicContact CD1-CD2 4.14Å; F303-L399 HydrophobicContact CE1-CD2 3.63Å; F303-L399 HydrophobicContact CE2-CD2 4.38Å; F303-L399 HydrophobicContact CZ-CD2 3.75Å
304	K	93.4	Very high	93.3	Very high	31 Å²	31	53.9 Å²	53.9	14%	0.135	26%	0.263	C	S	.	.	H	α-helix	trans	-59.6	-29.5	175.8	-68.5	178.6	-178.4	-174.5	0	113.1	S300 N301 G306 V387 L399	S300-K304 WeakPolarHBondContact O-CG 3.43Å; S300-K304 PolarHBondContact O-N 3.41Å; N301-K304 PolarHBondContact O-N 3.23Å; K304-G306 PolarHBondContact O-N 3.41Å; K304-V387 HydrophobicContact CB-CG2 3.64Å; K304-L399 WeakPolarHBondContact O-CB 3.47Å; K304-L399 PolarHBondContact O-N 3.32Å
305	K	92.3	Very high	93.1	Very high	39 Å²	39	60.3 Å²	60.3	17%	0.17	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-0.4	168.9	-66.9	177.9	-166.8	175.6	0	114.6	N301 F303 I307 V387 E388 T397 F398	N301-K305 WeakPolarHBondContact O-CG 3.45Å; N301-K305 PolarHBondContact O-N 3.41Å; F303-K305 PolarHBondContact O-N 3Å; K305-I307 VanDerWaalsContact C-N 3.26Å; K305-I307 HydrophobicContact CB-CD1 3.92Å; K305-I307 HydrophobicContact CB-CG1 3.9Å; K305-I307 HydrophobicContact CD-CD1 3.97Å; K305-I307 PolarHBondContact O-N 2.92Å; K305-V387 HydrophobicContact CG-CB 3.95Å; K305-V387 HydrophobicContact CG-CG1 4.36Å; K305-V387 HydrophobicContact CG-CG2 4.11Å; K305-E388 VanDerWaalsContact CE-CD 3.44Å; K305-E388 WeakPolarHBondContact CE-OE1 3.5Å; K305-E388 WeakPolarHBondContact CE-OE2 3.13Å; K305-E388 IonicContact NZ-OE1 3.71Å; K305-E388 PolarHBondContact NZ-OE1 3.17Å; K305-E388 IonicContact NZ-OE2 3.3Å; K305-E388 PolarHBondContact NZ-OE2 3.11Å; K305-T397 CarbonylContact O-C 3.55Å; K305-T397 WeakPolarHBondContact O-CB 3.24Å; K305-T397 WeakPolarHBondContact O-CG2 3.39Å; K305-T397 VanDerWaalsContact O-O 3.04Å; K305-F398 CarbonylContact O-C 3.5Å; K305-F398 PolarHBondContact O-N 2.94Å
306	G	93.7	Very high	92.9	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.1	14.1	-179	0	0	0	0	0	114.1	F303 K304 C308 Q350	F303-G306 WeakPolarHBondContact O-CA 3.02Å; F303-G306 PolarHBondContact O-N 3.48Å; K304-G306 PolarHBondContact O-N 3.41Å; G306-C308 VanDerWaalsContact C-N 3.32Å; G306-C308 PolarHBondContact O-N 3.19Å; G306-Q350 WeakPolarHBondContact O-CB 3.46Å; G306-Q350 VanDerWaalsContact O-CD 3.3Å; G306-Q350 VanDerWaalsContact O-CG 3.25Å; G306-Q350 WeakPolarHBondContact O-CG 3.35Å; G306-Q350 PolarHBondContact O-NE2 3.43Å
307	I	94.8	Very high	92.9	Very high	67 Å²	67	59.7 Å²	59.7	34%	0.344	29%	0.287	S	S	.	.			trans	-69.9	-33.2	-175.7	-61.4	170.8	0	0	0	111.2	R302 K305	R302-I307 HydrophobicContact CB-CD1 4.35Å; R302-I307 HydrophobicContact CG-CD1 4.33Å; R302-I307 WeakPolarHBondContact O-CB 3.47Å; R302-I307 PolarHBondContact O-N 3.06Å; R302-I307 VanDerWaalsContact O-N 3.13Å; K305-I307 VanDerWaalsContact C-N 3.26Å; K305-I307 HydrophobicContact CB-CD1 3.92Å; K305-I307 HydrophobicContact CB-CG1 3.9Å; K305-I307 HydrophobicContact CD-CD1 3.97Å; K305-I307 PolarHBondContact O-N 2.92Å
308	C	95.6	Very high	92.9	Very high	18 Å²	18	60.3 Å²	60.3	12%	0.122	29%	0.292	C	S	.	.			trans	-105.3	73.5	-169.6	-64.8	0	0	0	0	112.5	F295 C297 F303 G306	F295-C308 WeakPolarHBondContact CB-O 3.29Å; C297-C308 VanDerWaalsContact CA-SG 3.58Å; C297-C308 HydrophobicContact CB-CB 3.46Å; C297-C308 VanDerWaalsContact CB-CB 3.46Å; C297-C308 WeakPolarHBondContact CB-SG 3.33Å; C297-C308 WeakPolarHBondContact SG-CB 3.49Å; C297-C308 CovalentContact SG-SG 2.03Å; C297-C308 PolarHBondContact SG-SG 3.29Å; F303-C308 HydrophobicContact CD2-CB 4.41Å; G306-C308 VanDerWaalsContact C-N 3.32Å; G306-C308 PolarHBondContact O-N 3.19Å
309	L	96.2	Very high	93.1	Very high	3 Å²	3	55.8 Å²	55.8	2%	0.016	26%	0.264	C	S	.	.			trans	-126.1	35.1	174.9	-65.4	-174.9	0	0	0	112.8	F295 F303 H348 Q350 L399 K452 Q457	F295-L309 HydrophobicContact CD1-CD2 4.4Å; F295-L309 HydrophobicContact CD2-CD2 3.61Å; F295-L309 HydrophobicContact CE1-CD2 4.45Å; F295-L309 HydrophobicContact CE2-CD2 3.67Å; F295-L309 HydrophobicContact CG-CD2 4Å; F295-L309 HydrophobicContact CZ-CD2 4.1Å; F303-L309 HydrophobicContact CE2-CD2 3.99Å; L309-H348 HydrophobicContact CD1-CB 4.05Å; L309-H348 HydrophobicContact CD2-CB 3.73Å; L309-Q350 HydrophobicContact CD1-CB 3.69Å; L309-Q350 HydrophobicContact CG-CB 4.47Å; L309-L399 HydrophobicContact CD1-CD1 3.97Å; L309-L399 HydrophobicContact CD2-CD1 4.12Å; L309-L399 HydrophobicContact CG-CD1 4.36Å; L309-K452 PolarHBondContact O-NZ 2.8Å; L309-Q457 PolarHBondContact O-NE2 2.92Å
310	S	93.6	Very high	93.4	Very high	31 Å²	31	53.1 Å²	53.1	22%	0.217	25%	0.25	C	C	.	.			trans	-104.9	134.8	-178.6	-163.6	0	0	0	0	112.2	R312 R315	S310-R312 PolarHBondContact OG-N 2.77Å; S310-R315 CarbonylContact O-C 3.59Å; S310-R315 VanDerWaalsContact O-C 3.23Å; S310-R315 WeakPolarHBondContact O-CB 3.49Å
311	C	93.3	Very high	93.6	Very high	38 Å²	38	53 Å²	53	26%	0.257	25%	0.246	S	C	.	.			trans	-95.5	-0.1	170.6	-72.8	0	0	0	0	114.1	K313 N314 C316 Q457	C311-K313 PolarHBondContact O-N 3.05Å; C311-N314 PolarHBondContact O-N 2.8Å; C311-C316 WeakPolarHBondContact CA-SG 3.5Å; C311-C316 HydrophobicContact CB-CB 3.94Å; C311-C316 WeakPolarHBondContact CB-SG 3.31Å; C311-C316 WeakPolarHBondContact SG-CB 3.48Å; C311-C316 CovalentContact SG-SG 2.03Å; C311-C316 PolarHBondContact SG-SG 2.9Å; C311-Q457 HydrophobicContact CB-CG 4.05Å; C311-Q457 VanDerWaalsContact N-OE1 3.12Å
312	R	90.8	Very high	93.8	Very high	185 Å²	185	51.2 Å²	51.2	70%	0.698	24%	0.237	S	C	*	.	G	3₁₀ helix	trans	-64.5	138.9	-178.2	-68.8	-176.7	177	-170.5	-4.1	109.9	S310 N314 R315	S310-R312 PolarHBondContact OG-N 2.77Å; R312-N314 VanDerWaalsContact C-N 3.3Å; R312-N314 PolarHBondContact O-N 2.98Å; R312-R315 WeakPolarHBondContact O-CB 3.39Å; R312-R315 VanDerWaalsContact O-CG 3.25Å; R312-R315 WeakPolarHBondContact O-CG 3.44Å; R312-R315 PolarHBondContact O-N 2.81Å
313	K	87.6	Confident	93.9	Very high	192 Å²	192	46.2 Å²	46.2	84%	0.835	22%	0.219	S	C	*	.	G	3₁₀ helix	trans	54.7	43	180	-54.2	-176.1	178.5	-173.3	0	112.6	C311 R315	C311-K313 PolarHBondContact O-N 3.05Å; K313-R315 PolarHBondContact O-N 2.99Å
314	N	86.1	Confident	93.7	Very high	91 Å²	91	53.4 Å²	53.4	49%	0.487	25%	0.25	S	S	.	.	G	3₁₀ helix	trans	60.9	23.7	179.7	-53.6	-27	0	0	0	114.7	C311 R312 C316 M326	C311-N314 PolarHBondContact O-N 2.8Å; R312-N314 VanDerWaalsContact C-N 3.3Å; R312-N314 PolarHBondContact O-N 2.98Å; N314-C316 PolarHBondContact O-N 2.92Å; N314-C316 VanDerWaalsContact O-N 3.08Å; N314-M326 HydrophobicContact CB-CE 4.21Å; N314-M326 WeakPolarHBondContact O-CE 3.32Å
315	R	92.4	Very high	93.6	Very high	135 Å²	135	57.4 Å²	57.4	51%	0.509	27%	0.268	S	S	.	.			trans	-71	4.7	175	-73.2	-176.9	-178	-159.3	1	114.1	Q296 S310 R312 K313	Q296-R315 HydrophobicContact CB-CB 4.27Å; Q296-R315 WeakPolarHBondContact CB-O 3.46Å; Q296-R315 PolarHBondContact N-O 3.24Å; S310-R315 CarbonylContact O-C 3.59Å; S310-R315 VanDerWaalsContact O-C 3.23Å; S310-R315 WeakPolarHBondContact O-CB 3.49Å; R312-R315 WeakPolarHBondContact O-CB 3.39Å; R312-R315 VanDerWaalsContact O-CG 3.25Å; R312-R315 WeakPolarHBondContact O-CG 3.44Å; R312-R315 PolarHBondContact O-N 2.81Å; K313-R315 PolarHBondContact O-N 2.99Å
316	C	94.6	Very high	93.3	Very high	23 Å²	23	56.2 Å²	56.2	16%	0.155	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	155.9	166.6	79.5	0	0	0	0	109.6	A294 F295 C311 N314	A294-C316 CarbonylContact O-C 3.51Å; A294-C316 WeakPolarHBondContact O-CA 3.14Å; A294-C316 WeakPolarHBondContact O-CB 3.36Å; F295-C316 HydrophobicContact CD1-CB 3.69Å; F295-C316 HydrophobicContact CE1-CB 4Å; C311-C316 WeakPolarHBondContact CA-SG 3.5Å; C311-C316 HydrophobicContact CB-CB 3.94Å; C311-C316 WeakPolarHBondContact CB-SG 3.31Å; C311-C316 WeakPolarHBondContact SG-CB 3.48Å; C311-C316 CovalentContact SG-SG 2.03Å; C311-C316 PolarHBondContact SG-SG 2.9Å; N314-C316 PolarHBondContact O-N 2.92Å; N314-C316 VanDerWaalsContact O-N 3.08Å
317	N	95.6	Very high	92.5	Very high	16 Å²	16	67.8 Å²	67.8	9%	0.086	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	156.4	-179	-148.8	-22.8	0	0	0	109.8	F293 A294 K324 M334	F293-N317 CarbonylContact C-O 3.59Å; F293-N317 WeakPolarHBondContact CA-O 3.42Å; A294-N317 PolarHBondContact N-O 3.42Å; A294-N317 PolarHBondContact O-N 2.98Å; N317-K324 PolarHBondContact ND2-O 3.14Å; N317-K324 PolarHBondContact OD1-N 3.31Å; N317-K324 VanDerWaalsContact OD1-N 3.15Å; N317-M334 HydrophobicContact CB-CE 3.93Å; N317-M334 HydrophobicContact CB-SD 3.72Å
318	S	95.4	Very high	91.5	Very high	23 Å²	23	68.4 Å²	68.4	16%	0.161	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	149.5	167.1	-63.7	0	0	0	0	109.6	S292 A323	S292-S318 WeakPolarHBondContact O-CA 3.33Å; S318-A323 WeakPolarHBondContact O-CA 3.42Å; S318-A323 WeakPolarHBondContact O-CB 3.18Å
319	I	95.2	Very high	90.1	Very high	5 Å²	5	77.8 Å²	77.8	3%	0.026	35%	0.349	C	S	.	.			trans	-90.3	156.3	171.9	75.3	175.7	0	0	0	110.8	I241 L280 S284 S292 A294 L336	I241-I319 HydrophobicContact CD1-CB 4.22Å; I241-I319 HydrophobicContact CD1-CG2 4.06Å; I241-I319 HydrophobicContact CG2-CG2 4.08Å; L280-I319 HydrophobicContact CD2-CD1 4.37Å; S284-I319 WeakPolarHBondContact CB-O 3.36Å; S292-I319 VanDerWaalsContact CB-CD1 3.48Å; S292-I319 PolarHBondContact O-N 3.04Å; S292-I319 VanDerWaalsContact O-N 3.11Å; A294-I319 HydrophobicContact CB-CG2 3.76Å; I319-L336 HydrophobicContact CD1-CD1 3.86Å; I319-L336 HydrophobicContact CG2-CD1 3.95Å; I319-L336 HydrophobicContact CG2-CD2 4.2Å
320	G	96	Very high	89.3	Confident	0 Å²	0	87.8 Å²	87.8	0%	0	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	65.7	-135.2	174.7	0	0	0	0	0	113.3	R188 S284 N322 A323	R188-G320 PolarHBondContact NH2-O 2.92Å; S284-G320 WeakPolarHBondContact OG-CA 3.44Å; G320-N322 VanDerWaalsContact C-N 3.31Å; G320-N322 PolarHBondContact O-N 2.8Å; G320-N322 VanDerWaalsContact O-N 3.16Å; G320-A323 WeakPolarHBondContact O-CB 3.05Å; G320-A323 PolarHBondContact O-N 2.93Å
321	Y	97.4	Very high	88.8	Confident	18 Å²	18	89.7 Å²	89.7	7%	0.071	39%	0.394	C	S	.	.	G	3₁₀ helix	trans	-55.3	-41.1	-167	-170.6	-112.5	0	0	0	114.3	K84 F86 R112 E113 R188 F281 S284 L285 A323	K84-Y321 PolarHBondContact NZ-OH 3.24Å; F86-Y321 AromaticContact CE1-CE2 3.81Å; F86-Y321 HydrophobicContact CE1-CE2 3.81Å; F86-Y321 AromaticContact CZ-CE2 3.75Å; F86-Y321 HydrophobicContact CZ-CE2 3.75Å; R112-Y321 HydrophobicContact CG-CD1 4.06Å; R112-Y321 HydrophobicContact CG-CE1 3.84Å; E113-Y321 WeakPolarHBondContact CG-OH 3.23Å; E113-Y321 WeakPolarHBondContact OE1-CE1 2.92Å; E113-Y321 VanDerWaalsContact OE1-CZ 3.22Å; E113-Y321 PolarHBondContact OE1-OH 3.02Å; R188-Y321 PolarHBondContact NH1-O 2.77Å; F281-Y321 HydrophobicContact CZ-CD2 4.16Å; S284-Y321 PolarHBondContact OG-N 3.22Å; L285-Y321 HydrophobicContact CD2-CD1 3.97Å; L285-Y321 HydrophobicContact CD2-CD2 3.52Å; L285-Y321 HydrophobicContact CD2-CE2 4.21Å; L285-Y321 HydrophobicContact CD2-CG 3.4Å; L285-Y321 HydrophobicContact CG-CG 4.49Å; Y321-A323 VanDerWaalsContact C-N 3.29Å; Y321-A323 PolarHBondContact O-N 3.46Å
322	N	96.1	Very high	88.8	Confident	50 Å²	50	87.9 Å²	87.9	27%	0.267	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-86.8	6.4	-177.5	-65.5	-37.5	0	0	0	113.8	R112 G320	R112-N322 PolarHBondContact NH2-OD1 3.28Å; G320-N322 VanDerWaalsContact C-N 3.31Å; G320-N322 PolarHBondContact O-N 2.8Å; G320-N322 VanDerWaalsContact O-N 3.16Å
323	A	95.8	Very high	89	Confident	5 Å²	5	82.5 Å²	82.5	4%	0.041	36%	0.364	C	S	.	.			trans	-61.9	142	175.5	0	0	0	0	0	111.4	F215 I239 S318 G320 Y321	F215-A323 HydrophobicContact CE1-CB 4.4Å; F215-A323 WeakPolarHBondContact CE1-O 3.08Å; F215-A323 HydrophobicContact CZ-CB 4.35Å; I239-A323 HydrophobicContact CD1-CB 3.78Å; S318-A323 WeakPolarHBondContact O-CA 3.42Å; S318-A323 WeakPolarHBondContact O-CB 3.18Å; G320-A323 WeakPolarHBondContact O-CB 3.05Å; G320-A323 PolarHBondContact O-N 2.93Å; Y321-A323 VanDerWaalsContact C-N 3.29Å; Y321-A323 PolarHBondContact O-N 3.46Å
324	K	92.9	Very high	89.4	Confident	151 Å²	151	73.3 Å²	73.3	66%	0.657	32%	0.324	S	S	*	.			trans	-122.6	143.8	-175.2	-63.2	-177.5	-179	-178.9	0	112.3	F215 N317 M326	F215-K324 VanDerWaalsContact CZ-C 3.46Å; N317-K324 PolarHBondContact ND2-O 3.14Å; N317-K324 PolarHBondContact OD1-N 3.31Å; N317-K324 VanDerWaalsContact OD1-N 3.15Å; K324-M326 PolarHBondContact O-N 2.85Å
325	K	89.4	Confident	90	Very high	116 Å²	116	69.5 Å²	69.5	50%	0.504	30%	0.303	S	S	.	.			trans	-57.5	127.9	172.5	-169.9	173.3	-173.5	165.9	0	110.5	D214 F215 H238	D214-K325 VanDerWaalsContact O-CD 3.27Å; D214-K325 WeakPolarHBondContact O-CD 3.33Å; D214-K325 WeakPolarHBondContact O-CE 3.37Å; D214-K325 PolarHBondContact O-NZ 3.06Å; F215-K325 HydrophobicContact CB-CB 4.33Å; F215-K325 HydrophobicContact CD2-CB 3.54Å; F215-K325 HydrophobicContact CD2-CD 4.47Å; F215-K325 HydrophobicContact CD2-CG 3.88Å; F215-K325 VanDerWaalsContact CE2-CA 3.48Å; F215-K325 HydrophobicContact CE2-CB 4Å; F215-K325 HydrophobicContact CE2-CG 4.47Å; F215-K325 HydrophobicContact CG-CB 3.94Å; H238-K325 VanDerWaalsContact NE2-CE 3.34Å; H238-K325 WeakPolarHBondContact NE2-CE 3.18Å; H238-K325 PolarHBondContact NE2-NZ 3.34Å
326	M	86.4	Confident	90.3	Very high	14 Å²	14	63.1 Å²	63.1	7%	0.069	28%	0.279	C	S	.	.			trans	-88.5	145.8	175.1	-65.7	-179.7	55.6	0	0	110.1	I239 N314 K324 N328 M334	I239-M326 HydrophobicContact CG2-CG 4.03Å; I239-M326 HydrophobicContact CG2-SD 3.89Å; N314-M326 HydrophobicContact CB-CE 4.21Å; N314-M326 WeakPolarHBondContact O-CE 3.32Å; K324-M326 PolarHBondContact O-N 2.85Å; M326-N328 PolarHBondContact O-N 2.95Å; M326-M334 HydrophobicContact CE-CE 4.09Å; M326-M334 HydrophobicContact SD-CE 3.39Å; M326-M334 WeakPolarHBondContact SD-CE 3.45Å; M326-M334 HydrophobicContact SD-SD 4.28Å
327	R	76.9	Confident	90.4	Very high	243 Å²	243	63 Å²	63	92%	0.917	28%	0.275	S	S	*	.	S	Bend	trans	-69.2	8.7	176.1	-65.4	-175.3	178.3	178.1	-1.2	114.3
328	N	73.6	Confident	90.5	Very high	79 Å²	79	62.3 Å²	62.3	42%	0.422	27%	0.272	S	S	.	.			trans	-78.1	137.3	-178.3	-83	-14.5	0	0	0	110.4	Q296 M326 R330 S332	Q296-N328 PolarHBondContact NE2-ND2 3.05Å; M326-N328 PolarHBondContact O-N 2.95Å; N328-R330 PolarHBondContact O-N 3.17Å; N328-S332 PolarHBondContact ND2-OG 2.86Å
329	K	67.4	Low	90.5	Very high	216 Å²	216	64.3 Å²	64.3	94%	0.939	28%	0.276	S	S	*	.	S	Bend	trans	-76.1	-7.3	173.4	-67.2	-169.7	175.4	-171.2	0	114.1
330	R	78.1	Confident	90.4	Very high	213 Å²	213	66.2 Å²	66.2	80%	0.804	29%	0.293	S	S	*	.	S	Bend	trans	-120.7	148.2	-178.3	-66.2	-175.2	-178.7	-178.7	-0.2	109.8	N328 S332	N328-R330 PolarHBondContact O-N 3.17Å; R330-S332 PolarHBondContact O-N 2.94Å; R330-S332 PolarHBondContact O-OG 3Å
331	N	84.1	Confident	90.2	Very high	70 Å²	70	68 Å²	68	37%	0.374	31%	0.311	S	S	.	.			trans	-53.3	132.6	173.4	-64.2	-2.3	0	0	0	110.1	P235 G237	P235-N331 HydrophobicContact CB-CB 4.16Å; G237-N331 PolarHBondContact O-ND2 3.44Å; G237-N331 PolarHBondContact O-OD1 2.99Å
332	S	92	Very high	89.9	Confident	1 Å²	1	71.2 Å²	71.2	1%	0.007	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	103.3	-174.4	-66	0	0	0	0	109.9	H238 D240 Q296 N328 R330	H238-S332 PolarHBondContact O-N 3.37Å; D240-S332 PolarHBondContact N-O 3.32Å; Q296-S332 PolarHBondContact NE2-OG 2.94Å; N328-S332 PolarHBondContact ND2-OG 2.86Å; R330-S332 PolarHBondContact O-N 2.94Å; R330-S332 PolarHBondContact O-OG 3Å
333	K	95.6	Very high	89.9	Confident	71 Å²	71	71 Å²	71	31%	0.309	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	128.6	170.4	-61.7	-167.7	177.6	-169	0	110.5	D240 Y242 Q296 C297 Y335	D240-K333 CarbonylContact O-C 3.46Å; D240-K333 WeakPolarHBondContact O-CA 3.4Å; Y242-K333 HydrophobicContact CE2-CB 4.19Å; Y242-K333 HydrophobicContact CE2-CD 4.12Å; Y242-K333 HydrophobicContact CE2-CG 3.96Å; Q296-K333 WeakPolarHBondContact CA-O 3.43Å; C297-K333 PolarHBondContact N-O 3.46Å; K333-Y335 HydrophobicContact CB-CE2 4.09Å
334	M	97.1	Very high	89.9	Confident	0 Å²	0	71.2 Å²	71.2	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	151.4	-178.7	-56.7	-167.9	131.3	0	0	110.8	D240 I241 Y242 A294 F295 Q296 N317 M326	D240-M334 PolarHBondContact O-N 3.02Å; I241-M334 CarbonylContact C-O 3.55Å; I241-M334 WeakPolarHBondContact CA-O 3.27Å; I241-M334 HydrophobicContact CG1-CB 4.04Å; Y242-M334 PolarHBondContact N-O 3.07Å; A294-M334 HydrophobicContact CB-CB 3.72Å; A294-M334 HydrophobicContact CB-SD 4.42Å; F295-M334 CarbonylContact O-C 3.58Å; F295-M334 VanDerWaalsContact O-CA 3.28Å; F295-M334 WeakPolarHBondContact O-CA 3.33Å; Q296-M334 HydrophobicContact CB-CE 3.85Å; Q296-M334 HydrophobicContact CB-CG 4.39Å; N317-M334 HydrophobicContact CB-CE 3.93Å; N317-M334 HydrophobicContact CB-SD 3.72Å; M326-M334 HydrophobicContact CE-CE 4.09Å; M326-M334 HydrophobicContact SD-CE 3.39Å; M326-M334 WeakPolarHBondContact SD-CE 3.45Å; M326-M334 HydrophobicContact SD-SD 4.28Å
335	Y	98	Very high	90	Very high	11 Å²	11	65.9 Å²	65.9	4%	0.043	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	150.6	-174.8	-58.2	-91.1	0	0	0	110.5	Y242 A294 F295 C297 F303 K333	Y242-Y335 HydrophobicContact CD2-CE1 4.16Å; Y242-Y335 HydrophobicContact CG-CE1 4.02Å; A294-Y335 WeakPolarHBondContact CA-O 3.43Å; F295-Y335 PolarHBondContact N-O 2.89Å; F295-Y335 PolarHBondContact O-N 2.74Å; C297-Y335 HydrophobicContact CB-CD2 3.54Å; C297-Y335 HydrophobicContact CB-CE2 3.81Å; F303-Y335 HydrophobicContact CB-CD2 4.27Å; F303-Y335 HydrophobicContact CB-CG 4.06Å; F303-Y335 HydrophobicContact CD1-CG 4.36Å; F303-Y335 HydrophobicContact CG-CG 4.14Å; K333-Y335 HydrophobicContact CB-CE2 4.09Å
336	L	98	Very high	90.4	Very high	1 Å²	1	60.5 Å²	60.5	1%	0.005	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	164.1	171.3	71	165.3	0	0	0	109	I241 P243 N244 F293 A294 F303 I319 T338	I241-L336 HydrophobicContact CG2-CD2 3.49Å; I241-L336 VanDerWaalsContact CG2-CD2 3.49Å; P243-L336 HydrophobicContact CB-CD2 3.94Å; P243-L336 HydrophobicContact CG-CD2 3.94Å; N244-L336 WeakPolarHBondContact CA-O 3.42Å; N244-L336 PolarHBondContact N-O 3.32Å; F293-L336 WeakPolarHBondContact O-CB 3.28Å; A294-L336 HydrophobicContact CB-CD2 4.09Å; F303-L336 VanDerWaalsContact CZ-CA 3.46Å; I319-L336 HydrophobicContact CD1-CD1 3.86Å; I319-L336 HydrophobicContact CG2-CD1 3.95Å; I319-L336 HydrophobicContact CG2-CD2 4.2Å; L336-T338 HydrophobicContact CD1-CG2 3.93Å; L336-T338 HydrophobicContact CG-CG2 4.07Å
337	K	97.4	Very high	90.9	Very high	19 Å²	19	61.2 Å²	61.2	8%	0.083	28%	0.284	C	S	.	.			trans	-96.8	157.2	161.3	-69	-71.5	-172	169.5	0	109	N244 F303 V346 H348 E385 L399 Y401	N244-K337 WeakPolarHBondContact OD1-CA 3.47Å; F303-K337 HydrophobicContact CE1-CG 4.14Å; K337-V346 HydrophobicContact CB-CG2 3.91Å; K337-V346 WeakPolarHBondContact O-CG2 3.3Å; K337-H348 PolarHBondContact N-NE2 3.48Å; K337-E385 IonicContact NZ-OE2 3.53Å; K337-L399 HydrophobicContact CG-CD2 4.04Å; K337-Y401 HydrophobicContact CB-CD1 4.12Å; K337-Y401 HydrophobicContact CB-CD2 3.89Å; K337-Y401 HydrophobicContact CB-CE1 4.38Å; K337-Y401 HydrophobicContact CB-CE2 4.17Å; K337-Y401 HydrophobicContact CB-CG 3.86Å; K337-Y401 HydrophobicContact CD-CD1 4.26Å; K337-Y401 HydrophobicContact CD-CE1 3.87Å; K337-Y401 HydrophobicContact CG-CD1 3.67Å; K337-Y401 HydrophobicContact CG-CD2 4.35Å; K337-Y401 HydrophobicContact CG-CE1 3.81Å; K337-Y401 HydrophobicContact CG-CE2 4.47Å; K337-Y401 HydrophobicContact CG-CG 3.95Å
338	T	97.2	Very high	91.8	Very high	3 Å²	3	49.8 Å²	49.8	2%	0.018	24%	0.241	C	C	.	.			trans	-139.1	164.1	175.7	72.1	0	0	0	0	110.8	P243 N244 L280 L336 F344	P243-T338 HydrophobicContact CB-CG2 4.14Å; N244-T338 PolarHBondContact ND2-OG1 2.95Å; N244-T338 PolarHBondContact OD1-N 3.42Å; L280-T338 HydrophobicContact CD2-CG2 3.94Å; L336-T338 HydrophobicContact CD1-CG2 3.93Å; L336-T338 HydrophobicContact CG-CG2 4.07Å; T338-F344 WeakPolarHBondContact CA-O 3.48Å
339	R	95.4	Very high	93	Very high	65 Å²	65	46.5 Å²	46.5	25%	0.245	22%	0.222	C	C	.	.			trans	-73.8	167.3	170.1	-57.2	-179.1	55.3	-152.8	17.9	111.6	R276 G341 P343 F344 R345 V346 E403	R276-R339 PolarHBondContact NH1-O 3.33Å; R339-G341 WeakPolarHBondContact CB-O 3.41Å; R339-P343 VanDerWaalsContact CD-O 3.28Å; R339-P343 WeakPolarHBondContact CD-O 3.29Å; R339-P343 PolarHBondContact NH1-O 2.8Å; R339-F344 PolarHBondContact N-O 3.02Å; R339-R345 WeakPolarHBondContact CD-O 3.41Å; R339-R345 WeakPolarHBondContact CG-O 3.22Å; R339-V346 HydrophobicContact CG-CG1 3.43Å; R339-V346 VanDerWaalsContact CG-CG1 3.43Å; R339-E403 HydrophobicContact CG-CB 4.21Å; R339-E403 HydrophobicContact CG-CG 3.78Å; R339-E403 WeakPolarHBondContact CG-OE1 3.43Å; R339-E403 IonicContact CZ-OE2 3.36Å; R339-E403 VanDerWaalsContact CZ-OE2 3.23Å; R339-E403 IonicContact NE-OE1 3.09Å; R339-E403 IonicContact NE-OE2 3.95Å; R339-E403 PolarHBondContact NE-OE2 3.38Å; R339-E403 IonicContact NH2-OE2 2.74Å; R339-E403 PolarHBondContact NH2-OE2 3.26Å
340	A	93.3	Very high	94.4	Very high	45 Å²	45	37.4 Å²	37.4	37%	0.372	18%	0.183	S	C	.	.	S	Bend	trans	-72.2	-34	173.1	0	0	0	0	0	112.9	P250 R276	P250-A340 HydrophobicContact CB-CB 4.08Å; P250-A340 VanDerWaalsContact O-CA 3.31Å; P250-A340 WeakPolarHBondContact O-CA 3.4Å; R276-A340 VanDerWaalsContact CZ-O 3.31Å; R276-A340 PolarHBondContact NH1-O 3.46Å; R276-A340 PolarHBondContact NH2-O 3.43Å
341	G	91.7	Very high	95.3	Very high	37 Å²	37	27.3 Å²	27.3	38%	0.381	15%	0.145	S	C	.	.	S	Bend	trans	-124.8	165.1	-179.7	0	0	0	0	0	113.1	R339 P343 F344	R339-G341 WeakPolarHBondContact CB-O 3.41Å; G341-P343 CarbonylContact O-C 3.57Å; G341-P343 VanDerWaalsContact O-O 3.09Å; G341-F344 VanDerWaalsContact C-CD1 3.4Å; G341-F344 WeakPolarHBondContact O-CD1 3.39Å
342	M	91.9	Very high	95.8	Very high	86 Å²	86	27.6 Å²	27.6	42%	0.424	14%	0.143	S	C	.	.	S	Bend	trans	-77.9	140.8	179.2	-169.1	173.5	171.7	0	0	111	V282 D283 V286 N287 F344	V282-M342 HydrophobicContact CG1-CE 4.49Å; D283-M342 HydrophobicContact CB-CE 3.97Å; D283-M342 HydrophobicContact CB-CG 4.33Å; D283-M342 HydrophobicContact CB-SD 4.4Å; D283-M342 WeakPolarHBondContact OD1-CG 3.12Å; V286-M342 HydrophobicContact CG2-CE 3.06Å; N287-M342 VanDerWaalsContact ND2-CE 3.28Å; N287-M342 WeakPolarHBondContact ND2-CE 3.39Å; M342-F344 HydrophobicContact CB-CD2 4.28Å; M342-F344 HydrophobicContact CB-CE1 4.23Å; M342-F344 HydrophobicContact CB-CE2 3.8Å; M342-F344 HydrophobicContact CB-CZ 3.78Å; M342-F344 HydrophobicContact CG-CD2 4.3Å; M342-F344 HydrophobicContact CG-CE2 4.02Å; M342-F344 HydrophobicContact CG-CZ 4.5Å; M342-F344 VanDerWaalsContact N-CE1 3.34Å; M342-F344 HydrophobicContact SD-CE2 4.43Å
343	P	95.1	Very high	95.9	Very high	45 Å²	45	27.7 Å²	27.7	29%	0.292	14%	0.144	S	C	.	.	S	Bend	cis	-67.9	138.3	-2.7	28.3	-34.7	0	0	0	111.8	D283 R339 G341 R345	D283-P343 WeakPolarHBondContact OD1-CA 3.37Å; R339-P343 VanDerWaalsContact CD-O 3.28Å; R339-P343 WeakPolarHBondContact CD-O 3.29Å; R339-P343 PolarHBondContact NH1-O 2.8Å; G341-P343 CarbonylContact O-C 3.57Å; G341-P343 VanDerWaalsContact O-O 3.09Å; P343-R345 PolarHBondContact O-N 3.24Å
344	F	96.1	Very high	95.7	Very high	9 Å²	9	25.9 Å²	25.9	4%	0.039	14%	0.136	C	C	.	.			trans	-85.5	-8.2	-168.3	-65.6	-63.9	0	0	0	115	R276 H279 L280 D283 T338 R339 G341 M342	R276-F344 VanDerWaalsContact NH1-CD1 3.32Å; H279-F344 HydrophobicContact CB-CE2 3.82Å; H279-F344 HydrophobicContact CB-CZ 3.93Å; H279-F344 WeakPolarHBondContact O-CE2 3.14Å; L280-F344 HydrophobicContact CD2-CB 3.73Å; L280-F344 HydrophobicContact CD2-CD2 3.73Å; L280-F344 HydrophobicContact CD2-CG 3.76Å; L280-F344 HydrophobicContact CG-CD2 4.47Å; D283-F344 HydrophobicContact CB-CD2 3.58Å; D283-F344 HydrophobicContact CB-CE2 4.07Å; D283-F344 PolarHBondContact OD1-N 2.87Å; T338-F344 WeakPolarHBondContact CA-O 3.48Å; R339-F344 PolarHBondContact N-O 3.02Å; G341-F344 VanDerWaalsContact C-CD1 3.4Å; G341-F344 WeakPolarHBondContact O-CD1 3.39Å; M342-F344 HydrophobicContact CB-CD2 4.28Å; M342-F344 HydrophobicContact CB-CE1 4.23Å; M342-F344 HydrophobicContact CB-CE2 3.8Å; M342-F344 HydrophobicContact CB-CZ 3.78Å; M342-F344 HydrophobicContact CG-CD2 4.3Å; M342-F344 HydrophobicContact CG-CE2 4.02Å; M342-F344 HydrophobicContact CG-CZ 4.5Å; M342-F344 VanDerWaalsContact N-CE1 3.34Å; M342-F344 HydrophobicContact SD-CE2 4.43Å
345	R	96.1	Very high	95.3	Very high	39 Å²	39	25.9 Å²	25.9	15%	0.147	14%	0.136	C	C	.	.			trans	-58.5	140.4	-177.2	177.8	177.4	164.7	125.6	-10.3	112.2	K290 P291 S292 R339 P343 Y347	K290-R345 WeakPolarHBondContact O-CD 3.37Å; P291-R345 PolarHBondContact O-NH1 3.07Å; S292-R345 WeakPolarHBondContact OG-CA 3.4Å; S292-R345 WeakPolarHBondContact OG-CB 3.33Å; R339-R345 WeakPolarHBondContact CD-O 3.41Å; R339-R345 WeakPolarHBondContact CG-O 3.22Å; P343-R345 PolarHBondContact O-N 3.24Å; R345-Y347 PolarHBondContact NH2-OH 3.12Å
346	V	96.4	Very high	94.7	Very high	4 Å²	4	27.4 Å²	27.4	2%	0.024	14%	0.143	C	C	.	.			trans	-131.5	166.5	166.5	-58.4	0	0	0	0	109.8	K337 R339 Y401 T402	K337-V346 HydrophobicContact CB-CG2 3.91Å; K337-V346 WeakPolarHBondContact O-CG2 3.3Å; R339-V346 HydrophobicContact CG-CG1 3.43Å; R339-V346 VanDerWaalsContact CG-CG1 3.43Å; V346-Y401 HydrophobicContact CB-CD2 4.39Å; V346-Y401 HydrophobicContact CG1-CD2 4.35Å; V346-Y401 HydrophobicContact CG2-CD2 4.28Å; V346-T402 CarbonylContact C-O 3.49Å; V346-T402 WeakPolarHBondContact CA-O 3.43Å; V346-T402 WeakPolarHBondContact CB-O 3.24Å
347	Y	96.6	Very high	93.9	Very high	29 Å²	29	27.8 Å²	27.8	11%	0.114	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	132.3	174.1	-64.2	-88.1	0	0	0	110.6	R345 Y401 T402 E404 D405 E455	R345-Y347 PolarHBondContact NH2-OH 3.12Å; Y347-Y401 WeakPolarHBondContact O-CA 3.44Å; Y347-Y401 WeakPolarHBondContact O-CB 3.5Å; Y347-T402 PolarHBondContact N-O 3.34Å; Y347-T402 PolarHBondContact O-N 2.79Å; Y347-T402 VanDerWaalsContact O-N 3.11Å; Y347-E404 WeakPolarHBondContact CD2-O 3.29Å; Y347-D405 HydrophobicContact CE2-CB 3.76Å; Y347-E455 HydrophobicContact CD1-CB 4.45Å; Y347-E455 HydrophobicContact CD1-CG 4.03Å
348	H	97.6	Very high	92.6	Very high	3 Å²	3	34.1 Å²	34.1	1%	0.014	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	132	-175.7	-55.9	82	0	0	0	111.4	F295 F303 L309 K337 L399 G454 E455	F295-H348 HydrophobicContact CE2-CB 4.31Å; F295-H348 AromaticContact CE2-ND1 3.85Å; F303-H348 AromaticContact CZ-CD2 3.94Å; L309-H348 HydrophobicContact CD1-CB 4.05Å; L309-H348 HydrophobicContact CD2-CB 3.73Å; K337-H348 PolarHBondContact N-NE2 3.48Å; H348-L399 HydrophobicContact CB-CD1 4.3Å; H348-G454 PolarHBondContact O-N 2.76Å; H348-E455 IonicContact CE1-OE1 3.23Å; H348-E455 IonicContact CG-OE1 3.52Å; H348-E455 VanDerWaalsContact N-CD 3.31Å; H348-E455 PolarHBondContact N-OE1 2.88Å; H348-E455 VanDerWaalsContact N-OE1 3.1Å; H348-E455 PolarHBondContact N-OE2 3.18Å; H348-E455 IonicContact ND1-OE1 2.87Å; H348-E455 PolarHBondContact ND1-OE1 2.83Å
349	Y	97.3	Very high	91.3	Very high	9 Å²	9	39.9 Å²	39.9	4%	0.035	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	124	179.1	-60	-85.7	0	0	0	110.1	L372 V400 T402 L409 V451 K452	Y349-L372 HydrophobicContact CD2-CD1 4.24Å; Y349-V400 WeakPolarHBondContact CA-O 3.48Å; Y349-V400 PolarHBondContact N-O 3.5Å; Y349-V400 PolarHBondContact O-N 3.14Å; Y349-T402 HydrophobicContact CE2-CG2 3.89Å; Y349-L409 HydrophobicContact CD1-CD1 3.95Å; Y349-L409 HydrophobicContact CE1-CD1 3.81Å; Y349-L409 HydrophobicContact CE1-CG 4.3Å; Y349-V451 HydrophobicContact CD1-CG1 3.89Å; Y349-V451 HydrophobicContact CG-CG1 4.43Å; Y349-K452 CarbonylContact C-O 3.54Å; Y349-K452 WeakPolarHBondContact CA-O 3.16Å
350	Q	97.3	Very high	89.6	Confident	26 Å²	26	44.7 Å²	44.7	12%	0.121	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	117.1	166.4	167.4	-178.8	80.3	0	0	107.4	G306 L309 K352 T397 V451 K452	G306-Q350 WeakPolarHBondContact O-CB 3.46Å; G306-Q350 VanDerWaalsContact O-CD 3.3Å; G306-Q350 VanDerWaalsContact O-CG 3.25Å; G306-Q350 WeakPolarHBondContact O-CG 3.35Å; G306-Q350 PolarHBondContact O-NE2 3.43Å; L309-Q350 HydrophobicContact CD1-CB 3.69Å; L309-Q350 HydrophobicContact CG-CB 4.47Å; Q350-K352 HydrophobicContact CG-CG 4.31Å; Q350-T397 HydrophobicContact CG-CG2 3.62Å; Q350-V451 CarbonylContact O-C 3.52Å; Q350-V451 VanDerWaalsContact O-CA 3.28Å; Q350-V451 WeakPolarHBondContact O-CA 2.96Å; Q350-K452 HydrophobicContact CB-CB 4.23Å; Q350-K452 PolarHBondContact N-O 3.43Å; Q350-K452 PolarHBondContact O-N 3.24Å
351	M	96.4	Very high	88	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	122.3	175	-63.6	-166.6	67.2	0	0	110.1	V370 L372 T397 F398 V400 I412 I449 V451	M351-V370 HydrophobicContact CE-CG2 3.97Å; M351-V370 HydrophobicContact SD-CG1 4.31Å; M351-V370 HydrophobicContact SD-CG2 4.21Å; M351-L372 HydrophobicContact CE-CD2 4.4Å; M351-L372 HydrophobicContact SD-CD2 4.3Å; M351-T397 CarbonylContact O-C 3.51Å; M351-T397 WeakPolarHBondContact O-CA 3.39Å; M351-F398 PolarHBondContact N-O 2.05Å; M351-F398 PolarHBondContact O-N 3.36Å; M351-V400 HydrophobicContact CB-CG2 4.4Å; M351-V400 HydrophobicContact CG-CB 4.27Å; M351-V400 HydrophobicContact CG-CG2 3.84Å; M351-V400 HydrophobicContact SD-CB 3.99Å; M351-V400 HydrophobicContact SD-CG1 4.38Å; M351-V400 HydrophobicContact SD-CG2 3.43Å; M351-V400 WeakPolarHBondContact SD-CG2 3.43Å; M351-I412 HydrophobicContact CE-CD1 3.96Å; M351-I412 HydrophobicContact CE-CG2 4.07Å; M351-I449 HydrophobicContact CE-CD1 4.49Å; M351-I449 HydrophobicContact CE-CG2 3.47Å; M351-I449 VanDerWaalsContact CE-CG2 3.47Å; M351-V451 HydrophobicContact CE-CG2 4.17Å; M351-V451 HydrophobicContact CG-CG2 4.21Å
352	K	95.9	Very high	86.5	Confident	76 Å²	76	45.2 Å²	45.2	33%	0.33	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	116.7	175	-69	-173.3	178	-161.9	0	109.6	Q350 T395 N396 T397 R450	Q350-K352 HydrophobicContact CG-CG 4.31Å; K352-T395 HydrophobicContact CB-CG2 3.94Å; K352-N396 WeakPolarHBondContact CA-O 3.11Å; K352-T397 HydrophobicContact CG-CG2 3.83Å; K352-R450 HydrophobicContact CB-CB 4.19Å; K352-R450 PolarHBondContact N-O 3.36Å; K352-R450 PolarHBondContact O-N 2.92Å
353	I	93.9	Very high	85.1	Confident	3 Å²	3	48.1 Å²	48.1	2%	0.015	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	122.4	-176.7	-53.5	-177.5	0	0	0	107.5	V355 L384 N396 F398 L414 I446 I449	I353-V355 HydrophobicContact CG2-CG2 4.12Å; I353-L384 HydrophobicContact CD1-CD1 3.95Å; I353-N396 PolarHBondContact N-O 3.22Å; I353-N396 PolarHBondContact O-N 3.04Å; I353-F398 HydrophobicContact CB-CE2 4.18Å; I353-F398 HydrophobicContact CD1-CD2 4.08Å; I353-F398 HydrophobicContact CD1-CE2 4.05Å; I353-F398 HydrophobicContact CG1-CD2 4.23Å; I353-F398 HydrophobicContact CG1-CE2 4.2Å; I353-L414 HydrophobicContact CD1-CD1 4.37Å; I353-I446 HydrophobicContact CG2-CB 4.48Å; I353-I446 HydrophobicContact CG2-CD1 3.89Å; I353-I446 HydrophobicContact CG2-CG1 4.1Å; I353-I446 HydrophobicContact CG2-CG2 3.55Å; I353-I449 HydrophobicContact CD1-CD1 4.4Å; I353-I449 HydrophobicContact CG1-CG1 4.2Å; I353-I449 HydrophobicContact CG1-CG2 4.25Å
354	H	91.1	Very high	83.8	Confident	33 Å²	33	47 Å²	47	15%	0.153	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	116.6	172.5	-166.1	91.9	0	0	0	108.8	F356 A394 T395	H354-F356 AromaticContact CD2-CD1 3.66Å; H354-F356 AromaticContact CD2-CD2 3.68Å; H354-F356 AromaticContact CD2-CE1 3.26Å; H354-F356 WeakPolarHBondContact CD2-CE1 3.36Å; H354-F356 AromaticContact CD2-CE2 3.3Å; H354-F356 WeakPolarHBondContact CD2-CE2 3.49Å; H354-F356 AromaticContact CD2-CG 3.86Å; H354-F356 AromaticContact CD2-CZ 3.07Å; H354-F356 WeakPolarHBondContact CD2-CZ 3.38Å; H354-F356 AromaticContact NE2-CD1 3.63Å; H354-F356 AromaticContact NE2-CE1 3.17Å; H354-F356 WeakPolarHBondContact NE2-CE1 3.41Å; H354-F356 AromaticContact NE2-CZ 3.46Å; H354-F356 WeakPolarHBondContact NE2-CZ 3.38Å; H354-A394 WeakPolarHBondContact CA-O 3.39Å; H354-T395 PolarHBondContact ND1-OG1 3.41Å
355	V	88.6	Confident	82.7	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.006	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	115.8	-174.9	-178.8	0	0	0	0	108.2	I353 I390 N393 A394 L444	I353-V355 HydrophobicContact CG2-CG2 4.12Å; V355-I390 HydrophobicContact CG2-CG2 4.2Å; V355-N393 WeakPolarHBondContact O-CA 3.42Å; V355-N393 PolarHBondContact O-N 3.42Å; V355-A394 PolarHBondContact N-O 2.95Å; V355-L444 HydrophobicContact CG1-CB 4.21Å; V355-L444 HydrophobicContact CG1-CD1 4.13Å; V355-L444 HydrophobicContact CG1-CD2 3.94Å; V355-L444 HydrophobicContact CG1-CG 4.32Å
356	F	85.9	Confident	81.9	Confident	43 Å²	43	52.2 Å²	52.2	19%	0.189	26%	0.257	C	S	.	.	B	Isolated β-bridge	trans	-99.6	138.4	175.3	-62	-81.2	0	0	0	110.3	H354 N445 R447	H354-F356 AromaticContact CD2-CD1 3.66Å; H354-F356 AromaticContact CD2-CD2 3.68Å; H354-F356 AromaticContact CD2-CE1 3.26Å; H354-F356 WeakPolarHBondContact CD2-CE1 3.36Å; H354-F356 AromaticContact CD2-CE2 3.3Å; H354-F356 WeakPolarHBondContact CD2-CE2 3.49Å; H354-F356 AromaticContact CD2-CG 3.86Å; H354-F356 AromaticContact CD2-CZ 3.07Å; H354-F356 WeakPolarHBondContact CD2-CZ 3.38Å; H354-F356 AromaticContact NE2-CD1 3.63Å; H354-F356 AromaticContact NE2-CE1 3.17Å; H354-F356 WeakPolarHBondContact NE2-CE1 3.41Å; H354-F356 AromaticContact NE2-CZ 3.46Å; H354-F356 WeakPolarHBondContact NE2-CZ 3.38Å; F356-N445 HydrophobicContact CB-CB 3.93Å; F356-N445 PolarHBondContact N-O 3.3Å; F356-N445 PolarHBondContact O-N 2.87Å; F356-R447 HydrophobicContact CD2-CG 4.36Å; F356-R447 HydrophobicContact CE2-CG 4.07Å
357	S	81.2	Confident	81.5	Confident	8 Å²	8	54.7 Å²	54.7	6%	0.056	27%	0.273	C	S	.	.			trans	-129	120.8	168.7	-169.9	0	0	0	0	109.9	K359 N393	S357-K359 PolarHBondContact OG-O 2.9Å; S357-N393 PolarHBondContact N-OD1 3.49Å; S357-N393 PolarHBondContact O-OD1 2.8Å
358	Y	70.6	Confident	81.2	Confident	152 Å²	152	53.5 Å²	53.5	60%	0.596	27%	0.268	S	S	*	.	S	Bend	trans	-85.4	-13.4	178.2	-60.5	-69.9	0	0	0	113	N445 R447	Y358-N445 WeakPolarHBondContact CD2-ND2 3.42Å; Y358-N445 HydrophobicContact CE2-CB 4.01Å; Y358-N445 VanDerWaalsContact CE2-CG 3.46Å; Y358-N445 WeakPolarHBondContact CE2-ND2 3.33Å; Y358-R447 PolarHBondContact OH-NH2 3.29Å
359	K	69	Low	81.1	Confident	125 Å²	125	56.4 Å²	56.4	54%	0.543	28%	0.279	S	S	.	.	S	Bend	trans	-113.8	139.3	173.1	-64.7	178.7	-177.9	171.5	0	107.8	S357 M361	S357-K359 PolarHBondContact OG-O 2.9Å; K359-M361 HydrophobicContact CB-CE 3.91Å; K359-M361 HydrophobicContact CB-CG 4.03Å; K359-M361 HydrophobicContact CD-CE 4.19Å; K359-M361 HydrophobicContact CG-CE 4.46Å; K359-M361 PolarHBondContact O-N 3.49Å
360	N	58.6	Low	81	Confident	166 Å²	166	56 Å²	56	89%	0.888	28%	0.278	S	S	*	.			trans	-73.4	76.9	171.2	-150.7	18	0	0	0	107.7
361	M	60	Low	81	Confident	32 Å²	32	55.1 Å²	55.1	16%	0.158	27%	0.274	C	S	.	.			trans	-74.9	134.5	171	-54.4	-169.5	-166.3	0	0	105.3	K359 I364 Q392 R442 E443	K359-M361 HydrophobicContact CB-CE 3.91Å; K359-M361 HydrophobicContact CB-CG 4.03Å; K359-M361 HydrophobicContact CD-CE 4.19Å; K359-M361 HydrophobicContact CG-CE 4.46Å; K359-M361 PolarHBondContact O-N 3.49Å; M361-I364 HydrophobicContact CB-CD1 3.56Å; M361-I364 HydrophobicContact CB-CG1 4.14Å; M361-I364 HydrophobicContact CG-CD1 4.22Å; M361-I364 HydrophobicContact SD-CD1 3.76Å; M361-Q392 PolarHBondContact O-NE2 3.47Å; M361-R442 HydrophobicContact SD-CB 4.5Å; M361-E443 HydrophobicContact CE-CB 4.27Å; M361-E443 VanDerWaalsContact CE-O 3.3Å; M361-E443 WeakPolarHBondContact CE-O 3.49Å
362	G	61.8	Low	81.1	Confident	60 Å²	60	55.1 Å²	55.1	62%	0.619	27%	0.274	S	S	*	.			trans	-59.4	-154.8	178.6	0	0	0	0	0	113.1	I364 Q392	G362-I364 PolarHBondContact O-N 3.09Å; G362-Q392 PolarHBondContact O-NE2 2.98Å
363	E	60.8	Low	81.1	Confident	147 Å²	147	54.2 Å²	54.2	69%	0.687	27%	0.269	S	S	*	.			trans	-61.2	111.3	179.4	-64.3	-171.6	161.7	0	0	110.9	R389	E363-R389 IonicContact OE1-CZ 3.5Å; E363-R389 IonicContact OE1-NH1 3.41Å; E363-R389 PolarHBondContact OE1-NH1 2.81Å; E363-R389 IonicContact OE1-NH2 2.63Å; E363-R389 PolarHBondContact OE1-NH2 3.36Å; E363-R389 IonicContact OE2-NH1 3.45Å; E363-R389 IonicContact OE2-NH2 2.64Å
364	I	68.4	Low	81.2	Confident	23 Å²	23	54.6 Å²	54.6	12%	0.118	27%	0.274	C	S	.	.			trans	-106.8	126.6	171.3	-55	175.5	0	0	0	107.5	M361 G362 P366 W416 L444	M361-I364 HydrophobicContact CB-CD1 3.56Å; M361-I364 HydrophobicContact CB-CG1 4.14Å; M361-I364 HydrophobicContact CG-CD1 4.22Å; M361-I364 HydrophobicContact SD-CD1 3.76Å; G362-I364 PolarHBondContact O-N 3.09Å; I364-P366 HydrophobicContact CG2-CB 4.27Å; I364-P366 HydrophobicContact CG2-CG 4.41Å; I364-P366 VanDerWaalsContact O-CD 3.31Å; I364-P366 WeakPolarHBondContact O-CD 3.47Å; I364-W416 HydrophobicContact CG2-CH2 4.18Å; I364-W416 HydrophobicContact CG2-CZ2 3.87Å; I364-L444 HydrophobicContact CD1-CD2 4.38Å
365	E	72.8	Confident	81.4	Confident	152 Å²	152	56.8 Å²	56.8	71%	0.71	29%	0.29	S	S	*	.			trans	-110.2	84.7	168.7	-66.1	179.7	161.6	0	0	107.8
366	P	80.4	Confident	81.8	Confident	4 Å²	4	62.1 Å²	62.1	3%	0.026	32%	0.318	C	S	.	.			trans	-79.7	139.8	-178.5	34.3	-34.3	0	0	0	110.1	I364 F368 I386 I390 W416 L444	I364-P366 HydrophobicContact CG2-CB 4.27Å; I364-P366 HydrophobicContact CG2-CG 4.41Å; I364-P366 VanDerWaalsContact O-CD 3.31Å; I364-P366 WeakPolarHBondContact O-CD 3.47Å; P366-F368 HydrophobicContact CB-CD2 4.38Å; P366-F368 HydrophobicContact CB-CE1 4.31Å; P366-F368 HydrophobicContact CB-CE2 3.88Å; P366-F368 HydrophobicContact CB-CZ 3.83Å; P366-F368 HydrophobicContact CG-CD2 4.11Å; P366-F368 HydrophobicContact CG-CE2 3.48Å; P366-F368 VanDerWaalsContact CG-CE2 3.48Å; P366-F368 HydrophobicContact CG-CZ 3.85Å; P366-I386 WeakPolarHBondContact O-CD1 3.41Å; P366-I390 HydrophobicContact CG-CD1 3.6Å; P366-W416 HydrophobicContact CB-CD2 4.23Å; P366-W416 VanDerWaalsContact CB-CE2 3.47Å; P366-W416 HydrophobicContact CB-CH2 4.48Å; P366-W416 HydrophobicContact CB-CZ2 3.63Å; P366-L444 HydrophobicContact CG-CD1 4.43Å
367	T	87.1	Confident	82.2	Confident	57 Å²	57	61.5 Å²	61.5	35%	0.35	32%	0.321	S	S	.	.			trans	-94.5	111.1	167.7	-42.4	0	0	0	0	108.7	Y369 E417	T367-Y369 HydrophobicContact CG2-CE2 3.97Å; T367-E417 WeakPolarHBondContact CB-OE2 3.3Å; T367-E417 HydrophobicContact CG2-CB 4.4Å; T367-E417 WeakPolarHBondContact CG2-OE2 3.38Å; T367-E417 WeakPolarHBondContact O-CB 3.37Å; T367-E417 PolarHBondContact O-N 3.25Å; T367-E417 PolarHBondContact OG1-OE2 2.92Å
368	F	91.1	Very high	82.9	Confident	3 Å²	3	65.2 Å²	65.2	1%	0.013	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	141.1	176.6	-68.4	-58.4	0	0	0	111.2	P366 L384 I390 L414 T415 W416 L444 I472	P366-F368 HydrophobicContact CB-CD2 4.38Å; P366-F368 HydrophobicContact CB-CE1 4.31Å; P366-F368 HydrophobicContact CB-CE2 3.88Å; P366-F368 HydrophobicContact CB-CZ 3.83Å; P366-F368 HydrophobicContact CG-CD2 4.11Å; P366-F368 HydrophobicContact CG-CE2 3.48Å; P366-F368 VanDerWaalsContact CG-CE2 3.48Å; P366-F368 HydrophobicContact CG-CZ 3.85Å; F368-L384 HydrophobicContact CB-CB 4.17Å; F368-L384 HydrophobicContact CB-CD1 3.74Å; F368-L384 HydrophobicContact CB-CG 4.1Å; F368-L384 PolarHBondContact O-N 3.13Å; F368-I390 HydrophobicContact CD2-CD1 3.96Å; F368-I390 HydrophobicContact CE2-CD1 3.69Å; F368-L414 HydrophobicContact CB-CD1 4.12Å; F368-L414 HydrophobicContact CD1-CD1 4.35Å; F368-L414 HydrophobicContact CD1-CG 4.44Å; F368-L414 HydrophobicContact CG-CD1 4.35Å; F368-T415 CarbonylContact C-O 3.58Å; F368-T415 WeakPolarHBondContact CA-O 3.41Å; F368-W416 HydrophobicContact CD1-CB 4.01Å; F368-W416 HydrophobicContact CD1-CG 4.24Å; F368-W416 HydrophobicContact CE1-CB 3.92Å; F368-W416 HydrophobicContact CE1-CD2 4.11Å; F368-W416 HydrophobicContact CE1-CE3 4.35Å; F368-W416 AromaticContact CE1-CG 3.93Å; F368-W416 HydrophobicContact CE1-CG 3.93Å; F368-L444 HydrophobicContact CZ-CD1 3.87Å; F368-I472 HydrophobicContact CE1-CD1 4.35Å; F368-I472 HydrophobicContact CE1-CG2 4.35Å
369	Y	94.8	Very high	84.1	Confident	64 Å²	64	58.4 Å²	58.4	25%	0.251	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	155.4	164.9	-52.2	-98.8	0	0	0	110.3	T367 T381 L382 P383 T415 E417	T367-Y369 HydrophobicContact CG2-CE2 3.97Å; Y369-T381 VanDerWaalsContact CB-CG2 3.49Å; Y369-T381 HydrophobicContact CD1-CG2 4.05Å; Y369-T381 HydrophobicContact CG-CG2 4Å; Y369-L382 CarbonylContact C-O 3.55Å; Y369-L382 VanDerWaalsContact CA-O 3.28Å; Y369-L382 WeakPolarHBondContact CA-O 3.49Å; Y369-P383 HydrophobicContact CD1-CB 3.86Å; Y369-P383 HydrophobicContact CE1-CB 3.88Å; Y369-T415 WeakPolarHBondContact CB-OG1 3.47Å; Y369-T415 PolarHBondContact N-O 3.24Å; Y369-T415 PolarHBondContact O-N 3.49Å; Y369-T415 PolarHBondContact O-OG1 3.15Å; Y369-E417 HydrophobicContact CE2-CB 3.91Å; Y369-E417 HydrophobicContact CE2-CG 4.15Å; Y369-E417 PolarHBondContact OH-OE1 3.24Å
370	V	96.3	Very high	85.3	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	138.9	-180	69.7	0	0	0	0	110.9	M351 L372 L382 L384 V400 I412 Q413	M351-V370 HydrophobicContact CE-CG2 3.97Å; M351-V370 HydrophobicContact SD-CG1 4.31Å; M351-V370 HydrophobicContact SD-CG2 4.21Å; V370-L372 HydrophobicContact CG2-CD2 3.85Å; V370-L372 HydrophobicContact CG2-CG 4.5Å; V370-L382 HydrophobicContact CG1-CB 3.99Å; V370-L382 PolarHBondContact N-O 2.81Å; V370-L382 PolarHBondContact O-N 3.14Å; V370-L384 HydrophobicContact CB-CD2 4.2Å; V370-L384 HydrophobicContact CG1-CD2 3.67Å; V370-L384 HydrophobicContact CG1-CG 4.44Å; V370-V400 HydrophobicContact CG1-CG1 3.97Å; V370-V400 HydrophobicContact CG1-CG2 4.2Å; V370-I412 HydrophobicContact CG2-CG2 3.47Å; V370-I412 VanDerWaalsContact CG2-CG2 3.47Å; V370-Q413 CarbonylContact C-O 3.49Å; V370-Q413 VanDerWaalsContact CA-O 3.29Å; V370-Q413 WeakPolarHBondContact CA-O 3.47Å; V370-Q413 WeakPolarHBondContact CG2-O 3.49Å
371	T	97	Very high	86.9	Confident	9 Å²	9	55.1 Å²	55.1	6%	0.055	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	125.8	168.5	-42.2	0	0	0	0	108.1	Y373 S379 Q413	T371-Y373 HydrophobicContact CG2-CE2 3.8Å; T371-S379 WeakPolarHBondContact CG2-O 3.3Å; T371-Q413 PolarHBondContact N-O 3.06Å; T371-Q413 PolarHBondContact O-N 2.75Å; T371-Q413 PolarHBondContact OG1-OE1 3.25Å
372	L	97.1	Very high	88.5	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	124.1	-178.5	-59.2	-179.6	0	0	0	109.3	Y349 M351 V370 D378 S379 V400 L406 L409 I412	Y349-L372 HydrophobicContact CD2-CD1 4.24Å; M351-L372 HydrophobicContact CE-CD2 4.4Å; M351-L372 HydrophobicContact SD-CD2 4.3Å; V370-L372 HydrophobicContact CG2-CD2 3.85Å; V370-L372 HydrophobicContact CG2-CG 4.5Å; L372-D378 WeakPolarHBondContact O-CA 3.48Å; L372-S379 PolarHBondContact N-OG 3.43Å; L372-S379 PolarHBondContact O-N 2.75Å; L372-V400 HydrophobicContact CD1-CG1 4.13Å; L372-L406 HydrophobicContact CB-CD1 3.6Å; L372-L406 HydrophobicContact CD1-CD1 3.98Å; L372-L406 HydrophobicContact CG-CD1 4.46Å; L372-L409 HydrophobicContact CB-CD2 3.93Å; L372-L409 HydrophobicContact CD1-CD2 4.41Å; L372-I412 HydrophobicContact CD2-CD1 4.2Å; L372-I412 HydrophobicContact CD2-CG1 3.9Å; L372-I412 HydrophobicContact CD2-CG2 4.12Å
373	Y	96.8	Very high	90	Very high	57 Å²	57	55.4 Å²	55.4	22%	0.224	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	126.7	179.3	-64.7	-92.9	0	0	0	110.2	T371 D378 L409 L410 K411 Q413 W479	T371-Y373 HydrophobicContact CG2-CE2 3.8Å; Y373-D378 VanDerWaalsContact CA-OD1 3.23Å; Y373-D378 WeakPolarHBondContact CA-OD1 3.45Å; Y373-D378 HydrophobicContact CD1-CB 4.09Å; Y373-D378 WeakPolarHBondContact CD1-OD1 3.46Å; Y373-D378 WeakPolarHBondContact CD1-OD2 3.3Å; Y373-D378 HydrophobicContact CE1-CB 4.41Å; Y373-L409 CarbonylContact O-C 3.44Å; Y373-L410 PolarHBondContact O-N 3.19Å; Y373-K411 HydrophobicContact CD2-CB 4.25Å; Y373-K411 HydrophobicContact CG-CB 4.44Å; Y373-K411 PolarHBondContact N-O 3.14Å; Y373-K411 PolarHBondContact O-N 3.46Å; Y373-Q413 HydrophobicContact CE2-CB 3.93Å; Y373-Q413 PolarHBondContact OH-OE1 3.45Å; Y373-W479 HydrophobicContact CD2-CZ3 4.07Å; Y373-W479 AromaticContact CE2-CH2 3.8Å; Y373-W479 HydrophobicContact CE2-CH2 3.8Å; Y373-W479 AromaticContact CE2-CZ3 3.49Å; Y373-W479 HydrophobicContact CE2-CZ3 3.49Å; Y373-W479 VanDerWaalsContact CE2-CZ3 3.49Å; Y373-W479 AromaticContact CZ-CH2 3.81Å; Y373-W479 AromaticContact CZ-CZ3 3.91Å
374	G	95.8	Very high	91.4	Very high	11 Å²	11	48.8 Å²	48.8	11%	0.113	26%	0.263	C	S	.	.			trans	-115.8	-178.1	-172.3	0	0	0	0	0	113.9	A377 D378 L406	G374-A377 VanDerWaalsContact CA-O 3.24Å; G374-A377 WeakPolarHBondContact CA-O 3.32Å; G374-A377 PolarHBondContact N-O 2.6Å; G374-A377 VanDerWaalsContact N-O 3.11Å; G374-D378 PolarHBondContact N-OD1 3.15Å; G374-L406 CarbonylContact C-O 3.54Å; G374-L406 WeakPolarHBondContact CA-O 3.48Å
375	T	95.9	Very high	92.2	Very high	79 Å²	79	51.6 Å²	51.6	49%	0.485	28%	0.276	S	S	.	.	S	Bend	trans	-81.5	-31.4	170.2	50.6	0	0	0	0	112.4	L406 D408 L410	T375-L406 PolarHBondContact N-O 3.4Å; T375-D408 HydrophobicContact CG2-CB 3.83Å; T375-D408 PolarHBondContact N-O 2.9Å; T375-D408 PolarHBondContact OG1-N 3.5Å; T375-L410 HydrophobicContact CG2-CD1 4.11Å; T375-L410 HydrophobicContact CG2-CD2 3.93Å; T375-L410 HydrophobicContact CG2-CG 4.12Å
376	N	95.6	Very high	92.6	Very high	112 Å²	112	47.3 Å²	47.3	60%	0.599	26%	0.257	S	S	*	.	S	Bend	trans	-100.4	-39	-172.5	-63.3	5.1	0	0	0	111.5	D405 L406	N376-D405 WeakPolarHBondContact CB-O 3.35Å; N376-L406 PolarHBondContact N-O 2.9Å; N376-L406 VanDerWaalsContact N-O 3.13Å
377	A	95.3	Very high	92.4	Very high	30 Å²	30	49.1 Å²	49.1	25%	0.248	27%	0.269	C	S	.	.			trans	-156.8	165.9	-178.8	0	0	0	0	0	110.2	G374 L406	G374-A377 VanDerWaalsContact CA-O 3.24Å; G374-A377 WeakPolarHBondContact CA-O 3.32Å; G374-A377 PolarHBondContact N-O 2.6Å; G374-A377 VanDerWaalsContact N-O 3.11Å; A377-L406 HydrophobicContact CB-CD2 4.36Å; A377-L406 WeakPolarHBondContact O-CD2 3.46Å
378	D	95.8	Very high	92	Very high	86 Å²	86	52.2 Å²	52.2	46%	0.46	28%	0.279	S	S	.	.	B	Isolated β-bridge	trans	-108.1	149.2	171.2	-61.9	-29.4	0	0	0	109.7	L372 Y373 G374	L372-D378 WeakPolarHBondContact O-CA 3.48Å; Y373-D378 VanDerWaalsContact CA-OD1 3.23Å; Y373-D378 WeakPolarHBondContact CA-OD1 3.45Å; Y373-D378 HydrophobicContact CD1-CB 4.09Å; Y373-D378 WeakPolarHBondContact CD1-OD1 3.46Å; Y373-D378 WeakPolarHBondContact CD1-OD2 3.3Å; Y373-D378 HydrophobicContact CE1-CB 4.41Å; G374-D378 PolarHBondContact N-OD1 3.15Å
379	S	95.6	Very high	91.4	Very high	9 Å²	9	60 Å²	60	6%	0.063	31%	0.308	C	S	.	.			trans	-79	155.3	175.1	79.3	0	0	0	0	111.1	T371 L372	T371-S379 WeakPolarHBondContact CG2-O 3.3Å; L372-S379 PolarHBondContact N-OG 3.43Å; L372-S379 PolarHBondContact O-N 2.75Å
380	Q	93.9	Very high	90.8	Very high	142 Å²	142	58 Å²	58	66%	0.664	30%	0.302	S	S	*	.			trans	-60.6	169.7	157.6	67.7	-173.8	24.6	0	0	111	L382	Q380-L382 HydrophobicContact CG-CD2 3.73Å; Q380-L382 HydrophobicContact CG-CG 4.46Å; Q380-L382 WeakPolarHBondContact O-CG 3.17Å; Q380-L382 PolarHBondContact O-N 3.37Å
381	T	93.4	Very high	90.1	Very high	81 Å²	81	64.1 Å²	64.1	50%	0.497	33%	0.33	S	S	.	.			trans	-67.4	113.7	171.9	-55.4	0	0	0	0	109.7	Y369	Y369-T381 VanDerWaalsContact CB-CG2 3.49Å; Y369-T381 HydrophobicContact CD1-CG2 4.05Å; Y369-T381 HydrophobicContact CG-CG2 4Å
382	L	93.6	Very high	89.5	Confident	13 Å²	13	66.5 Å²	66.5	7%	0.068	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	127.9	-175.6	-59.8	169.6	0	0	0	110.3	Y369 V370 Q380 V400	Y369-L382 CarbonylContact C-O 3.55Å; Y369-L382 VanDerWaalsContact CA-O 3.28Å; Y369-L382 WeakPolarHBondContact CA-O 3.49Å; V370-L382 HydrophobicContact CG1-CB 3.99Å; V370-L382 PolarHBondContact N-O 2.81Å; V370-L382 PolarHBondContact O-N 3.14Å; Q380-L382 HydrophobicContact CG-CD2 3.73Å; Q380-L382 HydrophobicContact CG-CG 4.46Å; Q380-L382 WeakPolarHBondContact O-CG 3.17Å; Q380-L382 PolarHBondContact O-N 3.37Å; L382-V400 HydrophobicContact CB-CG1 4.34Å; L382-V400 HydrophobicContact CD1-CG1 3.52Å
383	P	91.9	Very high	89	Confident	85 Å²	85	71.1 Å²	71.1	55%	0.552	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.9	140.7	173.3	29.2	-33.4	0	0	0	110.9	Y369 E385	Y369-P383 HydrophobicContact CD1-CB 3.86Å; Y369-P383 HydrophobicContact CE1-CB 3.88Å; P383-E385 PolarHBondContact O-N 3.13Å
384	L	89.8	Confident	88.5	Confident	7 Å²	7	69.2 Å²	69.2	4%	0.037	36%	0.362	C	S	.	.			trans	-85.5	107.1	168.4	-62.1	-171	0	0	0	109.1	I353 F368 V370 I386 F398 V400 L414	I353-L384 HydrophobicContact CD1-CD1 3.95Å; F368-L384 HydrophobicContact CB-CB 4.17Å; F368-L384 HydrophobicContact CB-CD1 3.74Å; F368-L384 HydrophobicContact CB-CG 4.1Å; F368-L384 PolarHBondContact O-N 3.13Å; V370-L384 HydrophobicContact CB-CD2 4.2Å; V370-L384 HydrophobicContact CG1-CD2 3.67Å; V370-L384 HydrophobicContact CG1-CG 4.44Å; L384-I386 PolarHBondContact O-N 3.12Å; L384-I386 VanDerWaalsContact O-N 3.16Å; L384-F398 HydrophobicContact CB-CD1 4.27Å; L384-F398 HydrophobicContact CB-CG 4.5Å; L384-F398 HydrophobicContact CD1-CD2 4.34Å; L384-F398 HydrophobicContact CD1-CG 4.39Å; L384-F398 HydrophobicContact CD2-CB 4.36Å; L384-V400 HydrophobicContact CD2-CG2 3.3Å; L384-L414 HydrophobicContact CD1-CD1 3.98Å
385	E	86.1	Confident	88.3	Confident	82 Å²	82	72.5 Å²	72.5	38%	0.383	38%	0.379	S	S	.	.			trans	-66.4	112.5	177.6	-169.9	-177.6	167.1	0	0	110.4	K337 P383 V387	K337-E385 IonicContact NZ-OE2 3.53Å; P383-E385 PolarHBondContact O-N 3.13Å; E385-V387 HydrophobicContact CG-CG2 4.36Å; E385-V387 PolarHBondContact O-N 2.99Å
386	I	82.3	Confident	88.1	Confident	62 Å²	62	69.5 Å²	69.5	32%	0.318	36%	0.361	S	S	.	.			trans	-90.5	93.9	177.6	-62.4	171.3	0	0	0	108.1	P366 L384 E388 I390 F398	P366-I386 WeakPolarHBondContact O-CD1 3.41Å; L384-I386 PolarHBondContact O-N 3.12Å; L384-I386 VanDerWaalsContact O-N 3.16Å; I386-E388 WeakPolarHBondContact CG2-O 3.05Å; I386-I390 HydrophobicContact CD1-CD1 3.74Å; I386-I390 HydrophobicContact CD1-CG1 4.18Å; I386-I390 HydrophobicContact CG1-CD1 4.22Å; I386-I390 HydrophobicContact CG1-CG1 4.42Å; I386-I390 HydrophobicContact CG2-CG1 4.15Å; I386-F398 HydrophobicContact CG1-CE1 4.17Å
387	V	76.2	Confident	88.1	Confident	43 Å²	43	65.8 Å²	65.8	26%	0.261	34%	0.342	S	S	.	.	S	Bend	trans	-73.2	-36	179.8	-177.1	0	0	0	0	111.6	N301 K304 K305 E385	N301-V387 HydrophobicContact CB-CG1 4.16Å; K304-V387 HydrophobicContact CB-CG2 3.64Å; K305-V387 HydrophobicContact CG-CB 3.95Å; K305-V387 HydrophobicContact CG-CG1 4.36Å; K305-V387 HydrophobicContact CG-CG2 4.11Å; E385-V387 HydrophobicContact CG-CG2 4.36Å; E385-V387 PolarHBondContact O-N 2.99Å
388	E	77	Confident	88.1	Confident	121 Å²	121	64.8 Å²	64.8	57%	0.565	33%	0.332	S	S	*	.	S	Bend	trans	-133.4	160.9	176.4	-83	175.8	-159.6	0	0	109.4	K305 I386 I390	K305-E388 VanDerWaalsContact CE-CD 3.44Å; K305-E388 WeakPolarHBondContact CE-OE1 3.5Å; K305-E388 WeakPolarHBondContact CE-OE2 3.13Å; K305-E388 IonicContact NZ-OE1 3.71Å; K305-E388 PolarHBondContact NZ-OE1 3.17Å; K305-E388 IonicContact NZ-OE2 3.3Å; K305-E388 PolarHBondContact NZ-OE2 3.11Å; I386-E388 WeakPolarHBondContact CG2-O 3.05Å; E388-I390 PolarHBondContact O-N 3.09Å
389	R	80	Confident	88.1	Confident	166 Å²	166	61.1 Å²	61.1	63%	0.626	31%	0.312	S	S	*	.	P	Polyproline II helix	trans	-51.1	139	179.6	-64.7	174.7	174.4	-157.9	-13.4	111.1	E363 E391	E363-R389 IonicContact OE1-CZ 3.5Å; E363-R389 IonicContact OE1-NH1 3.41Å; E363-R389 PolarHBondContact OE1-NH1 2.81Å; E363-R389 IonicContact OE1-NH2 2.63Å; E363-R389 PolarHBondContact OE1-NH2 3.36Å; E363-R389 IonicContact OE2-NH1 3.45Å; E363-R389 IonicContact OE2-NH2 2.64Å; R389-E391 PolarHBondContact O-N 3.38Å
390	I	81.4	Confident	88.1	Confident	23 Å²	23	60.8 Å²	60.8	12%	0.118	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-72	119.1	174.7	-65.2	-169.3	0	0	0	108.7	V355 P366 F368 I386 E388 F398	V355-I390 HydrophobicContact CG2-CG2 4.2Å; P366-I390 HydrophobicContact CG-CD1 3.6Å; F368-I390 HydrophobicContact CD2-CD1 3.96Å; F368-I390 HydrophobicContact CE2-CD1 3.69Å; I386-I390 HydrophobicContact CD1-CD1 3.74Å; I386-I390 HydrophobicContact CD1-CG1 4.18Å; I386-I390 HydrophobicContact CG1-CD1 4.22Å; I386-I390 HydrophobicContact CG1-CG1 4.42Å; I386-I390 HydrophobicContact CG2-CG1 4.15Å; E388-I390 PolarHBondContact O-N 3.09Å; I390-F398 HydrophobicContact CD1-CE1 4.41Å; I390-F398 HydrophobicContact CD1-CZ 4.05Å; I390-F398 HydrophobicContact CG1-CZ 4.39Å
391	E	82.1	Confident	88.2	Confident	128 Å²	128	58 Å²	58	60%	0.598	29%	0.294	S	S	*	.	P	Polyproline II helix	trans	-77.1	127.9	174.8	-69.8	-179.9	-175.4	0	0	110	R389 A394 N396	R389-E391 PolarHBondContact O-N 3.38Å; E391-A394 HydrophobicContact CB-CB 3.54Å; E391-N396 PolarHBondContact N-OD1 2.93Å; E391-N396 PolarHBondContact O-ND2 3.47Å
392	Q	83.4	Confident	88.4	Confident	59 Å²	59	54.5 Å²	54.5	28%	0.276	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	144.6	173.8	-60.8	-177.5	23	0	0	110.3	M361 G362 A394	M361-Q392 PolarHBondContact O-NE2 3.47Å; G362-Q392 PolarHBondContact O-NE2 2.98Å; Q392-A394 PolarHBondContact O-N 2.81Å
393	N	86.1	Confident	88.4	Confident	97 Å²	97	57.8 Å²	57.8	52%	0.519	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.1	26.4	-176.2	-57.6	-35	0	0	0	113.7	V355 S357	V355-N393 WeakPolarHBondContact O-CA 3.42Å; V355-N393 PolarHBondContact O-N 3.42Å; S357-N393 PolarHBondContact N-OD1 3.49Å; S357-N393 PolarHBondContact O-OD1 2.8Å
394	A	87.6	Confident	88.4	Confident	18 Å²	18	58.7 Å²	58.7	15%	0.149	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	167.1	-177.4	0	0	0	0	0	112	H354 V355 E391 Q392 N396	H354-A394 WeakPolarHBondContact CA-O 3.39Å; V355-A394 PolarHBondContact N-O 2.95Å; E391-A394 HydrophobicContact CB-CB 3.54Å; Q392-A394 PolarHBondContact O-N 2.81Å; A394-N396 PolarHBondContact O-ND2 3.44Å
395	T	91.1	Very high	88.6	Confident	79 Å²	79	61.9 Å²	61.9	49%	0.485	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	108.9	176.3	-50.4	0	0	0	0	109.9	K352 H354	K352-T395 HydrophobicContact CB-CG2 3.94Å; H354-T395 PolarHBondContact ND1-OG1 3.41Å
396	N	92.3	Very high	89.1	Confident	17 Å²	17	58 Å²	58	9%	0.091	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	142.8	176.6	-62.5	-81.7	0	0	0	109.5	K352 I353 E391 A394 F398	K352-N396 WeakPolarHBondContact CA-O 3.11Å; I353-N396 PolarHBondContact N-O 3.22Å; I353-N396 PolarHBondContact O-N 3.04Å; E391-N396 PolarHBondContact N-OD1 2.93Å; E391-N396 PolarHBondContact O-ND2 3.47Å; A394-N396 PolarHBondContact O-ND2 3.44Å; N396-F398 HydrophobicContact CB-CE2 3.67Å; N396-F398 HydrophobicContact CB-CZ 3.62Å
397	T	94.6	Very high	89.6	Confident	33 Å²	33	56.2 Å²	56.2	20%	0.202	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	134.1	-179.2	-48.7	0	0	0	0	109.4	K305 Q350 M351 K352	K305-T397 CarbonylContact O-C 3.55Å; K305-T397 WeakPolarHBondContact O-CB 3.24Å; K305-T397 WeakPolarHBondContact O-CG2 3.39Å; K305-T397 VanDerWaalsContact O-O 3.04Å; Q350-T397 HydrophobicContact CG-CG2 3.62Å; M351-T397 CarbonylContact O-C 3.51Å; M351-T397 WeakPolarHBondContact O-CA 3.39Å; K352-T397 HydrophobicContact CG-CG2 3.83Å
398	F	95.1	Very high	90.4	Very high	9 Å²	9	56.9 Å²	56.9	4%	0.039	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	144.2	-178.4	-52.7	-82	0	0	0	109.6	K305 M351 I353 L384 I386 I390 N396	K305-F398 CarbonylContact O-C 3.5Å; K305-F398 PolarHBondContact O-N 2.94Å; M351-F398 PolarHBondContact N-O 2.05Å; M351-F398 PolarHBondContact O-N 3.36Å; I353-F398 HydrophobicContact CB-CE2 4.18Å; I353-F398 HydrophobicContact CD1-CD2 4.08Å; I353-F398 HydrophobicContact CD1-CE2 4.05Å; I353-F398 HydrophobicContact CG1-CD2 4.23Å; I353-F398 HydrophobicContact CG1-CE2 4.2Å; L384-F398 HydrophobicContact CB-CD1 4.27Å; L384-F398 HydrophobicContact CB-CG 4.5Å; L384-F398 HydrophobicContact CD1-CD2 4.34Å; L384-F398 HydrophobicContact CD1-CG 4.39Å; L384-F398 HydrophobicContact CD2-CB 4.36Å; I386-F398 HydrophobicContact CG1-CE1 4.17Å; I390-F398 HydrophobicContact CD1-CE1 4.41Å; I390-F398 HydrophobicContact CD1-CZ 4.05Å; I390-F398 HydrophobicContact CG1-CZ 4.39Å; N396-F398 HydrophobicContact CB-CE2 3.67Å; N396-F398 HydrophobicContact CB-CZ 3.62Å
399	L	96.4	Very high	91.3	Very high	9 Å²	9	51.4 Å²	51.4	5%	0.047	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	128.1	162.7	-177	64.3	0	0	0	108.2	F303 K304 L309 K337 H348	F303-L399 HydrophobicContact CD1-CD2 4.14Å; F303-L399 HydrophobicContact CE1-CD2 3.63Å; F303-L399 HydrophobicContact CE2-CD2 4.38Å; F303-L399 HydrophobicContact CZ-CD2 3.75Å; K304-L399 WeakPolarHBondContact O-CB 3.47Å; K304-L399 PolarHBondContact O-N 3.32Å; L309-L399 HydrophobicContact CD1-CD1 3.97Å; L309-L399 HydrophobicContact CD2-CD1 4.12Å; L309-L399 HydrophobicContact CG-CD1 4.36Å; K337-L399 HydrophobicContact CG-CD2 4.04Å; H348-L399 HydrophobicContact CB-CD1 4.3Å
400	V	96.3	Very high	91.9	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.012	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	135.8	169.6	179.5	0	0	0	0	107.3	Y349 M351 V370 L372 L382 L384	Y349-V400 WeakPolarHBondContact CA-O 3.48Å; Y349-V400 PolarHBondContact N-O 3.5Å; Y349-V400 PolarHBondContact O-N 3.14Å; M351-V400 HydrophobicContact CB-CG2 4.4Å; M351-V400 HydrophobicContact CG-CB 4.27Å; M351-V400 HydrophobicContact CG-CG2 3.84Å; M351-V400 HydrophobicContact SD-CB 3.99Å; M351-V400 HydrophobicContact SD-CG1 4.38Å; M351-V400 HydrophobicContact SD-CG2 3.43Å; M351-V400 WeakPolarHBondContact SD-CG2 3.43Å; V370-V400 HydrophobicContact CG1-CG1 3.97Å; V370-V400 HydrophobicContact CG1-CG2 4.2Å; L372-V400 HydrophobicContact CD1-CG1 4.13Å; L382-V400 HydrophobicContact CB-CG1 4.34Å; L382-V400 HydrophobicContact CD1-CG1 3.52Å; L384-V400 HydrophobicContact CD2-CG2 3.3Å
401	Y	96.1	Very high	92.6	Very high	84 Å²	84	49.2 Å²	49.2	33%	0.329	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	149.5	177.3	66.1	-83.7	0	0	0	110.8	K337 V346 Y347	K337-Y401 HydrophobicContact CB-CD1 4.12Å; K337-Y401 HydrophobicContact CB-CD2 3.89Å; K337-Y401 HydrophobicContact CB-CE1 4.38Å; K337-Y401 HydrophobicContact CB-CE2 4.17Å; K337-Y401 HydrophobicContact CB-CG 3.86Å; K337-Y401 HydrophobicContact CD-CD1 4.26Å; K337-Y401 HydrophobicContact CD-CE1 3.87Å; K337-Y401 HydrophobicContact CG-CD1 3.67Å; K337-Y401 HydrophobicContact CG-CD2 4.35Å; K337-Y401 HydrophobicContact CG-CE1 3.81Å; K337-Y401 HydrophobicContact CG-CE2 4.47Å; K337-Y401 HydrophobicContact CG-CG 3.95Å; V346-Y401 HydrophobicContact CB-CD2 4.39Å; V346-Y401 HydrophobicContact CG1-CD2 4.35Å; V346-Y401 HydrophobicContact CG2-CD2 4.28Å; Y347-Y401 WeakPolarHBondContact O-CA 3.44Å; Y347-Y401 WeakPolarHBondContact O-CB 3.5Å
402	T	96	Very high	93.3	Very high	7 Å²	7	43.1 Å²	43.1	4%	0.043	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	151.7	-179.6	-178.3	0	0	0	0	110.4	V346 Y347 Y349 E404 L406	V346-T402 CarbonylContact C-O 3.49Å; V346-T402 WeakPolarHBondContact CA-O 3.43Å; V346-T402 WeakPolarHBondContact CB-O 3.24Å; Y347-T402 PolarHBondContact N-O 3.34Å; Y347-T402 PolarHBondContact O-N 2.79Å; Y347-T402 VanDerWaalsContact O-N 3.11Å; Y349-T402 HydrophobicContact CE2-CG2 3.89Å; T402-E404 WeakPolarHBondContact CG2-O 3.46Å; T402-E404 PolarHBondContact OG1-N 3.19Å; T402-L406 HydrophobicContact CG2-CD1 3.97Å; T402-L406 HydrophobicContact CG2-CG 4.12Å
403	E	94.3	Very high	94	Very high	83 Å²	83	41.4 Å²	41.4	39%	0.388	22%	0.218	S	C	.	.	S	Bend	trans	-76.8	-29.8	177.1	-47.3	-160.2	154.9	0	0	111.6	R339	R339-E403 HydrophobicContact CG-CB 4.21Å; R339-E403 HydrophobicContact CG-CG 3.78Å; R339-E403 WeakPolarHBondContact CG-OE1 3.43Å; R339-E403 IonicContact CZ-OE2 3.36Å; R339-E403 VanDerWaalsContact CZ-OE2 3.23Å; R339-E403 IonicContact NE-OE1 3.09Å; R339-E403 IonicContact NE-OE2 3.95Å; R339-E403 PolarHBondContact NE-OE2 3.38Å; R339-E403 IonicContact NH2-OE2 2.74Å; R339-E403 PolarHBondContact NH2-OE2 3.26Å
404	E	93.3	Very high	94.5	Very high	103 Å²	103	36.8 Å²	36.8	48%	0.481	19%	0.193	S	C	.	.	S	Bend	trans	-81.4	140.7	-174	-61	-59	153.6	0	0	112.8	Y347 T402 L406	Y347-E404 WeakPolarHBondContact CD2-O 3.29Å; T402-E404 WeakPolarHBondContact CG2-O 3.46Å; T402-E404 PolarHBondContact OG1-N 3.19Å; E404-L406 HydrophobicContact CB-CD2 3.99Å; E404-L406 PolarHBondContact O-N 3.5Å
405	D	93.9	Very high	94.7	Very high	75 Å²	75	37.3 Å²	37.3	40%	0.401	19%	0.194	S	C	.	.			trans	-80.2	98.5	168.2	-174.1	1.5	0	0	0	110	Y347 N376 G407	Y347-D405 HydrophobicContact CE2-CB 3.76Å; N376-D405 WeakPolarHBondContact CB-O 3.35Å; D405-G407 PolarHBondContact O-N 3.05Å; D405-G407 PolarHBondContact OD1-N 3.1Å
406	L	95.3	Very high	94.7	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.174	C	C	.	.			trans	-73.7	-14.8	-178.3	-52.3	-178.8	0	0	0	112.8	L372 G374 T375 N376 A377 T402 E404 L409	L372-L406 HydrophobicContact CB-CD1 3.6Å; L372-L406 HydrophobicContact CD1-CD1 3.98Å; L372-L406 HydrophobicContact CG-CD1 4.46Å; G374-L406 CarbonylContact C-O 3.54Å; G374-L406 WeakPolarHBondContact CA-O 3.48Å; T375-L406 PolarHBondContact N-O 3.4Å; N376-L406 PolarHBondContact N-O 2.9Å; N376-L406 VanDerWaalsContact N-O 3.13Å; A377-L406 HydrophobicContact CB-CD2 4.36Å; A377-L406 WeakPolarHBondContact O-CD2 3.46Å; T402-L406 HydrophobicContact CG2-CD1 3.97Å; T402-L406 HydrophobicContact CG2-CG 4.12Å; E404-L406 HydrophobicContact CB-CD2 3.99Å; E404-L406 PolarHBondContact O-N 3.5Å; L406-L409 HydrophobicContact CB-CD2 4.17Å; L406-L409 HydrophobicContact CD1-CD2 3.63Å
407	G	93.7	Very high	94.4	Very high	24 Å²	24	36.9 Å²	36.9	25%	0.247	19%	0.186	C	C	.	.			trans	62.3	-134	-167.5	0	0	0	0	0	112.2	D405 L409	D405-G407 PolarHBondContact O-N 3.05Å; D405-G407 PolarHBondContact OD1-N 3.1Å; G407-L409 PolarHBondContact O-N 3.33Å
408	D	92.4	Very high	93.6	Very high	58 Å²	58	36.6 Å²	36.6	31%	0.31	19%	0.19	S	C	.	.	S	Bend	trans	-83.1	108.6	-178.5	-89.1	20	0	0	0	111.2	T375 L410 R458	T375-D408 HydrophobicContact CG2-CB 3.83Å; T375-D408 PolarHBondContact N-O 2.9Å; T375-D408 PolarHBondContact OG1-N 3.5Å; D408-L410 WeakPolarHBondContact O-CG 3.31Å; D408-L410 PolarHBondContact O-N 3.49Å; D408-R458 IonicContact OD1-CZ 3.73Å; D408-R458 IonicContact OD1-NH1 3.03Å; D408-R458 PolarHBondContact OD1-NH1 3.42Å; D408-R458 IonicContact OD2-CZ 3.59Å; D408-R458 IonicContact OD2-NH1 2.62Å; D408-R458 PolarHBondContact OD2-NH1 3.24Å; D408-R458 IonicContact OD2-NH2 3.21Å; D408-R458 PolarHBondContact OD2-NH2 2.93Å
409	L	95.3	Very high	91.9	Very high	5 Å²	5	40.1 Å²	40.1	3%	0.026	22%	0.221	C	C	.	.			trans	-53	124	176.8	-68.4	179.2	0	0	0	112.3	Y349 L372 Y373 L406 G407 V451 L460 F462 K482	Y349-L409 HydrophobicContact CD1-CD1 3.95Å; Y349-L409 HydrophobicContact CE1-CD1 3.81Å; Y349-L409 HydrophobicContact CE1-CG 4.3Å; L372-L409 HydrophobicContact CB-CD2 3.93Å; L372-L409 HydrophobicContact CD1-CD2 4.41Å; Y373-L409 CarbonylContact O-C 3.44Å; L406-L409 HydrophobicContact CB-CD2 4.17Å; L406-L409 HydrophobicContact CD1-CD2 3.63Å; G407-L409 PolarHBondContact O-N 3.33Å; L409-V451 HydrophobicContact CD1-CG1 3.86Å; L409-L460 HydrophobicContact CB-CD1 4.06Å; L409-F462 HydrophobicContact CB-CE1 4.5Å; L409-F462 HydrophobicContact CB-CE2 4.45Å; L409-F462 HydrophobicContact CB-CZ 3.68Å; L409-K482 WeakPolarHBondContact O-CE 3.25Å; L409-K482 PolarHBondContact O-NZ 3.08Å
410	L	93.8	Very high	89.7	Confident	78 Å²	78	42.9 Å²	42.9	41%	0.408	24%	0.24	S	C	.	.			trans	-105.2	-44.8	-176.3	-60.1	-177.8	0	0	0	113.2	Y373 T375 D408 F462	Y373-L410 PolarHBondContact O-N 3.19Å; T375-L410 HydrophobicContact CG2-CD1 4.11Å; T375-L410 HydrophobicContact CG2-CD2 3.93Å; T375-L410 HydrophobicContact CG2-CG 4.12Å; D408-L410 WeakPolarHBondContact O-CG 3.31Å; D408-L410 PolarHBondContact O-N 3.49Å; L410-F462 WeakPolarHBondContact O-CE1 3.5Å
411	K	95.9	Very high	87.2	Confident	65 Å²	65	52.5 Å²	52.5	28%	0.283	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	160.5	-179.4	-56.9	-172.4	-176.8	178.2	0	111.5	Y373 F480 R481	Y373-K411 HydrophobicContact CD2-CB 4.25Å; Y373-K411 HydrophobicContact CG-CB 4.44Å; Y373-K411 PolarHBondContact N-O 3.14Å; Y373-K411 PolarHBondContact O-N 3.46Å; K411-F480 CarbonylContact C-O 3.52Å; K411-F480 VanDerWaalsContact CA-O 3.27Å; K411-F480 WeakPolarHBondContact CA-O 3.42Å; K411-R481 HydrophobicContact CD-CG 4.33Å; K411-R481 HydrophobicContact CG-CG 4.21Å; K411-R481 VanDerWaalsContact NZ-NH2 3.15Å
412	I	97.4	Very high	84.7	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	129.4	175.3	-57.8	178.9	0	0	0	107.9	M351 V370 L372 I449 V451 F462 F480	M351-I412 HydrophobicContact CE-CD1 3.96Å; M351-I412 HydrophobicContact CE-CG2 4.07Å; V370-I412 HydrophobicContact CG2-CG2 3.47Å; V370-I412 VanDerWaalsContact CG2-CG2 3.47Å; L372-I412 HydrophobicContact CD2-CD1 4.2Å; L372-I412 HydrophobicContact CD2-CG1 3.9Å; L372-I412 HydrophobicContact CD2-CG2 4.12Å; I412-I449 HydrophobicContact CD1-CG2 4.13Å; I412-I449 HydrophobicContact CG2-CD1 4.18Å; I412-V451 HydrophobicContact CD1-CG2 3.62Å; I412-F462 HydrophobicContact CD1-CB 4.17Å; I412-F462 HydrophobicContact CD1-CD1 4.12Å; I412-F462 HydrophobicContact CD1-CD2 3.46Å; I412-F462 VanDerWaalsContact CD1-CD2 3.46Å; I412-F462 HydrophobicContact CD1-CE1 4.43Å; I412-F462 HydrophobicContact CD1-CE2 3.81Å; I412-F462 HydrophobicContact CD1-CG 3.65Å; I412-F462 HydrophobicContact CD1-CZ 4.3Å; I412-F462 HydrophobicContact CG1-CD1 4.07Å; I412-F462 HydrophobicContact CG1-CD2 4.29Å; I412-F462 HydrophobicContact CG1-CE1 4.27Å; I412-F462 HydrophobicContact CG1-CE2 4.46Å; I412-F462 HydrophobicContact CG1-CG 4.1Å; I412-F462 HydrophobicContact CG1-CZ 4.48Å; I412-F480 HydrophobicContact CB-CB 4.28Å; I412-F480 PolarHBondContact N-O 3.05Å; I412-F480 PolarHBondContact O-N 3.18Å
413	Q	96.8	Very high	82.5	Confident	24 Å²	24	61.6 Å²	61.6	11%	0.112	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	126.1	168.4	-178.2	-168	32.9	0	0	107.7	V370 T371 Y373 T415 E477 W479	V370-Q413 CarbonylContact C-O 3.49Å; V370-Q413 VanDerWaalsContact CA-O 3.29Å; V370-Q413 WeakPolarHBondContact CA-O 3.47Å; V370-Q413 WeakPolarHBondContact CG2-O 3.49Å; T371-Q413 PolarHBondContact N-O 3.06Å; T371-Q413 PolarHBondContact O-N 2.75Å; T371-Q413 PolarHBondContact OG1-OE1 3.25Å; Y373-Q413 HydrophobicContact CE2-CB 3.93Å; Y373-Q413 PolarHBondContact OH-OE1 3.45Å; Q413-T415 HydrophobicContact CG-CG2 4.22Å; Q413-E477 HydrophobicContact CG-CB 4.49Å; Q413-E477 PolarHBondContact NE2-OE2 2.93Å; Q413-W479 HydrophobicContact CB-CD2 4.29Å; Q413-W479 HydrophobicContact CB-CE3 4.04Å; Q413-W479 HydrophobicContact CB-CH2 4.02Å; Q413-W479 HydrophobicContact CB-CZ2 4.27Å; Q413-W479 HydrophobicContact CB-CZ3 3.91Å; Q413-W479 HydrophobicContact CG-CD2 4.29Å; Q413-W479 HydrophobicContact CG-CE3 4.49Å; Q413-W479 HydrophobicContact CG-CH2 4.08Å; Q413-W479 HydrophobicContact CG-CZ2 3.85Å; Q413-W479 HydrophobicContact CG-CZ3 4.4Å
414	L	96	Very high	80.5	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	123.7	174.5	-179.5	73.6	0	0	0	108.3	I353 F368 L384 I446 I472 E477 L478 F480	I353-L414 HydrophobicContact CD1-CD1 4.37Å; F368-L414 HydrophobicContact CB-CD1 4.12Å; F368-L414 HydrophobicContact CD1-CD1 4.35Å; F368-L414 HydrophobicContact CD1-CG 4.44Å; F368-L414 HydrophobicContact CG-CD1 4.35Å; L384-L414 HydrophobicContact CD1-CD1 3.98Å; L414-I446 HydrophobicContact CD2-CD1 3.35Å; L414-I472 HydrophobicContact CD2-CD1 4.27Å; L414-I472 HydrophobicContact CG-CD1 4.23Å; L414-E477 CarbonylContact O-C 3.54Å; L414-E477 VanDerWaalsContact O-CA 3.25Å; L414-E477 WeakPolarHBondContact O-CA 3.48Å; L414-L478 PolarHBondContact N-O 2.65Å; L414-L478 PolarHBondContact O-N 3.01Å; L414-F480 HydrophobicContact CB-CE2 3.91Å; L414-F480 HydrophobicContact CD2-CE2 4.37Å
415	T	93.6	Very high	78.5	Confident	29 Å²	29	64.3 Å²	64.3	18%	0.178	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	140.9	178.3	54	0	0	0	0	109.9	F368 Y369 Q413 E477	F368-T415 CarbonylContact C-O 3.58Å; F368-T415 WeakPolarHBondContact CA-O 3.41Å; Y369-T415 WeakPolarHBondContact CB-OG1 3.47Å; Y369-T415 PolarHBondContact N-O 3.24Å; Y369-T415 PolarHBondContact O-N 3.49Å; Y369-T415 PolarHBondContact O-OG1 3.15Å; Q413-T415 HydrophobicContact CG-CG2 4.22Å; T415-E477 HydrophobicContact CG2-CB 3.68Å
416	W	90.8	Very high	76.5	Confident	12 Å²	12	65.3 Å²	65.3	5%	0.045	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	122	169.7	-173.8	-5.9	0	0	0	108	I364 P366 F368 G418 R442 L444 I472 P474 G475 R476	I364-W416 HydrophobicContact CG2-CH2 4.18Å; I364-W416 HydrophobicContact CG2-CZ2 3.87Å; P366-W416 HydrophobicContact CB-CD2 4.23Å; P366-W416 VanDerWaalsContact CB-CE2 3.47Å; P366-W416 HydrophobicContact CB-CH2 4.48Å; P366-W416 HydrophobicContact CB-CZ2 3.63Å; F368-W416 HydrophobicContact CD1-CB 4.01Å; F368-W416 HydrophobicContact CD1-CG 4.24Å; F368-W416 HydrophobicContact CE1-CB 3.92Å; F368-W416 HydrophobicContact CE1-CD2 4.11Å; F368-W416 HydrophobicContact CE1-CE3 4.35Å; F368-W416 AromaticContact CE1-CG 3.93Å; F368-W416 HydrophobicContact CE1-CG 3.93Å; W416-G418 PolarHBondContact O-N 3.42Å; W416-R442 HydrophobicContact CH2-CB 3.85Å; W416-R442 HydrophobicContact CZ2-CB 4.46Å; W416-L444 HydrophobicContact CE3-CD1 4.45Å; W416-L444 HydrophobicContact CH2-CD1 3.81Å; W416-L444 HydrophobicContact CH2-CG 4.01Å; W416-L444 HydrophobicContact CZ3-CB 4.25Å; W416-L444 HydrophobicContact CZ3-CD1 3.78Å; W416-L444 HydrophobicContact CZ3-CG 3.8Å; W416-I472 HydrophobicContact CB-CD1 3.86Å; W416-I472 HydrophobicContact CB-CG1 3.91Å; W416-I472 HydrophobicContact CE3-CG1 4.38Å; W416-I472 HydrophobicContact CE3-CG2 4.13Å; W416-I472 WeakPolarHBondContact CZ3-O 3.47Å; W416-P474 HydrophobicContact CD2-CG 4.06Å; W416-P474 HydrophobicContact CE3-CG 4.31Å; W416-P474 HydrophobicContact CH2-CG 4.17Å; W416-P474 HydrophobicContact CZ2-CG 3.86Å; W416-P474 HydrophobicContact CZ3-CG 4.37Å; W416-G475 WeakPolarHBondContact O-CA 3.45Å; W416-G475 PolarHBondContact O-N 3.47Å; W416-R476 PolarHBondContact N-O 2.98Å
417	E	86.1	Confident	74.5	Confident	74 Å²	74	73.1 Å²	73.1	35%	0.346	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-48.2	126.2	172.4	-163.6	165.8	-131.4	0	0	111.9	T367 Y369	T367-E417 WeakPolarHBondContact CB-OE2 3.3Å; T367-E417 HydrophobicContact CG2-CB 4.4Å; T367-E417 WeakPolarHBondContact CG2-OE2 3.38Å; T367-E417 WeakPolarHBondContact O-CB 3.37Å; T367-E417 PolarHBondContact O-N 3.25Å; T367-E417 PolarHBondContact OG1-OE2 2.92Å; Y369-E417 HydrophobicContact CE2-CB 3.91Å; Y369-E417 HydrophobicContact CE2-CG 4.15Å; Y369-E417 PolarHBondContact OH-OE1 3.24Å
418	G	76.4	Confident	72.6	Confident	28 Å²	28	79 Å²	79	29%	0.289	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-81.5	171.1	171.2	0	0	0	0	0	111.7	W416 S420	W416-G418 PolarHBondContact O-N 3.42Å; G418-S420 PolarHBondContact O-N 3.21Å
419	A	59.4	Low	70.6	Confident	83 Å²	83	81.8 Å²	81.8	69%	0.686	40%	0.399	S	S	*	.			trans	-65	101.8	170	0	0	0	0	0	109.6
420	S	49.8	Very low	68.6	Low	66 Å²	66	86.5 Å²	86.5	46%	0.462	42%	0.424	S	S	.	.			trans	-75.9	142.2	170.3	61.3	0	0	0	0	110.1	G418 S422 N425	G418-S420 PolarHBondContact O-N 3.21Å; S420-S422 PolarHBondContact O-N 2.95Å; S420-N425 PolarHBondContact O-ND2 2.93Å
421	Q	44.8	Very low	66.7	Low	205 Å²	205	91.2 Å²	91.2	96%	0.958	44%	0.436	S	S	*	.			trans	-69.9	71	177.6	-71.5	177.1	-11	0	0	111.6
422	S	44.3	Very low	64.5	Low	57 Å²	57	91.1 Å²	91.1	40%	0.399	44%	0.444	S	S	.	.			trans	-101	140.6	168.9	174.2	0	0	0	0	109.6	S420 Y424 N425 L426	S420-S422 PolarHBondContact O-N 2.95Å; S422-Y424 PolarHBondContact O-N 3.32Å; S422-N425 WeakPolarHBondContact O-CA 3.39Å; S422-N425 WeakPolarHBondContact O-CB 3.35Å; S422-N425 PolarHBondContact O-N 3.22Å; S422-L426 PolarHBondContact O-N 3.34Å; S422-L426 VanDerWaalsContact O-N 3.17Å
423	W	49	Very low	62.3	Low	225 Å²	225	101 Å²	101	85%	0.852	48%	0.483	S	S	*	.	H	α-helix	trans	-51.4	-28	177.1	-119.3	-79.9	0	0	0	113.1	L426 W427	W423-L426 WeakPolarHBondContact O-CB 3.26Å; W423-L426 PolarHBondContact O-N 3.27Å; W423-W427 PolarHBondContact O-N 3.19Å
424	Y	52.9	Low	60	Low	187 Å²	187	106.7 Å²	106.7	73%	0.733	51%	0.513	S	S	*	.	H	α-helix	trans	-72.2	-36.7	177	-147.1	-91.8	0	0	0	112.7	S422 W427 K428	S422-Y424 PolarHBondContact O-N 3.32Å; Y424-W427 PolarHBondContact O-N 2.86Å; Y424-K428 PolarHBondContact O-N 3.29Å; Y424-K428 VanDerWaalsContact O-N 3.1Å
425	N	51.7	Low	57.7	Low	56 Å²	56	110.9 Å²	110.9	30%	0.299	54%	0.542	S	S	.	.	H	α-helix	trans	-70.3	-34.7	173.7	-73.4	-24.4	0	0	0	111.1	S420 S422 W427 K428 E429	S420-N425 PolarHBondContact O-ND2 2.93Å; S422-N425 WeakPolarHBondContact O-CA 3.39Å; S422-N425 WeakPolarHBondContact O-CB 3.35Å; S422-N425 PolarHBondContact O-N 3.22Å; N425-W427 VanDerWaalsContact C-N 3.33Å; N425-W427 PolarHBondContact O-N 3.16Å; N425-K428 PolarHBondContact O-N 3.42Å; N425-E429 WeakPolarHBondContact O-CB 3.25Å; N425-E429 WeakPolarHBondContact O-CG 3.34Å; N425-E429 PolarHBondContact O-N 2.86Å
426	L	50.8	Low	55	Low	96 Å²	96	118 Å²	118	50%	0.503	57%	0.574	S	S	.	*	H	α-helix	trans	-58.1	-42.4	171.1	-110.4	149.7	0	0	0	112.1	S422 W423 L430	S422-L426 PolarHBondContact O-N 3.34Å; S422-L426 VanDerWaalsContact O-N 3.17Å; W423-L426 WeakPolarHBondContact O-CB 3.26Å; W423-L426 PolarHBondContact O-N 3.27Å; L426-L430 WeakPolarHBondContact O-CB 3.49Å; L426-L430 PolarHBondContact O-N 3.06Å
427	W	54.3	Low	52.6	Low	164 Å²	164	123.1 Å²	123.1	62%	0.621	61%	0.608	S	S	*	*	H	α-helix	trans	-70.8	-35.7	177	-124	84.7	0	0	0	112.9	W423 Y424 N425 L430 R431	W423-W427 PolarHBondContact O-N 3.19Å; Y424-W427 PolarHBondContact O-N 2.86Å; N425-W427 VanDerWaalsContact C-N 3.33Å; N425-W427 PolarHBondContact O-N 3.16Å; W427-L430 PolarHBondContact O-N 3.41Å; W427-R431 PolarHBondContact O-N 2.9Å
428	K	52	Low	50.3	Low	148 Å²	148	128.6 Å²	128.6	64%	0.643	63%	0.633	S	S	*	*	H	α-helix	trans	-69.4	-39.5	175.5	-151.7	175.9	-175.5	178.2	0	111.1	Y424 N425 S432	Y424-K428 PolarHBondContact O-N 3.29Å; Y424-K428 VanDerWaalsContact O-N 3.1Å; N425-K428 PolarHBondContact O-N 3.42Å; K428-S432 PolarHBondContact O-N 3.39Å
429	E	52.3	Low	48.8	Very low	115 Å²	115	133 Å²	133	54%	0.537	65%	0.65	S	S	.	*	H	α-helix	trans	-65.5	-43.7	172.1	-80.6	-170.4	162.4	0	0	111.5	N425 R431 S432 Y433	N425-E429 WeakPolarHBondContact O-CB 3.25Å; N425-E429 WeakPolarHBondContact O-CG 3.34Å; N425-E429 PolarHBondContact O-N 2.86Å; E429-R431 VanDerWaalsContact C-N 3.33Å; E429-R431 PolarHBondContact O-N 3.12Å; E429-S432 WeakPolarHBondContact CA-OG 3.4Å; E429-S432 CarbonylContact O-C 3.2Å; E429-S432 WeakPolarHBondContact O-CA 3.44Å; E429-S432 PolarHBondContact O-N 2.91Å; E429-S432 PolarHBondContact O-OG 3.41Å; E429-Y433 WeakPolarHBondContact O-CB 3.43Å; E429-Y433 PolarHBondContact O-N 3.47Å
430	L	52.5	Low	48.2	Very low	104 Å²	104	133.6 Å²	133.6	55%	0.545	65%	0.647	S	S	.	*	H	α-helix	trans	-61.5	-40.2	177.4	-146.6	100.4	0	0	0	112.2	L426 W427 Y433 L434	L426-L430 WeakPolarHBondContact O-CB 3.49Å; L426-L430 PolarHBondContact O-N 3.06Å; W427-L430 PolarHBondContact O-N 3.41Å; L430-Y433 PolarHBondContact O-N 3.1Å; L430-L434 PolarHBondContact O-N 3.15Å
431	R	53.7	Low	48.6	Very low	177 Å²	177	133.1 Å²	133.1	67%	0.668	65%	0.652	S	S	*	*	H	α-helix	trans	-63.9	-40.6	171.9	-92.9	-173	177.9	176.3	1.8	112.2	W427 E429 Y433 L434	W427-R431 PolarHBondContact O-N 2.9Å; E429-R431 VanDerWaalsContact C-N 3.33Å; E429-R431 PolarHBondContact O-N 3.12Å; R431-Y433 VanDerWaalsContact C-N 3.34Å; R431-L434 PolarHBondContact O-N 2.85Å
432	S	50.9	Low	49.9	Very low	63 Å²	63	128.4 Å²	128.4	44%	0.441	63%	0.626	S	S	.	*	H	α-helix	trans	-70.6	-30.2	176.9	72.4	0	0	0	0	113	K428 E429 L434 S435	K428-S432 PolarHBondContact O-N 3.39Å; E429-S432 WeakPolarHBondContact CA-OG 3.4Å; E429-S432 CarbonylContact O-C 3.2Å; E429-S432 WeakPolarHBondContact O-CA 3.44Å; E429-S432 PolarHBondContact O-N 2.91Å; E429-S432 PolarHBondContact O-OG 3.41Å; S432-L434 VanDerWaalsContact C-N 3.25Å; S432-L434 PolarHBondContact O-N 3.47Å; S432-S435 CarbonylContact O-C 3.23Å; S432-S435 PolarHBondContact O-N 3.34Å
433	Y	49.7	Very low	51.7	Low	209 Å²	209	129.4 Å²	129.4	82%	0.82	62%	0.624	S	S	*	*	H	α-helix	trans	-66.5	-28.6	177.8	-162.9	-94.8	0	0	0	112.3	E429 L430 R431 S435	E429-Y433 WeakPolarHBondContact O-CB 3.43Å; E429-Y433 PolarHBondContact O-N 3.47Å; L430-Y433 PolarHBondContact O-N 3.1Å; R431-Y433 VanDerWaalsContact C-N 3.34Å; Y433-S435 VanDerWaalsContact C-N 3.28Å; Y433-S435 PolarHBondContact O-N 3.07Å
434	L	49.6	Very low	53.6	Low	142 Å²	142	119 Å²	119	74%	0.743	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	-0.3	174.9	-77.6	153.4	0	0	0	113.2	L430 R431 S432	L430-L434 PolarHBondContact O-N 3.15Å; R431-L434 PolarHBondContact O-N 2.85Å; S432-L434 VanDerWaalsContact C-N 3.25Å; S432-L434 PolarHBondContact O-N 3.47Å
435	S	47.1	Very low	55.4	Low	88 Å²	88	110.8 Å²	110.8	62%	0.615	55%	0.554	S	S	*	*	S	Bend	trans	-140.3	80.2	-173.8	-57.4	0	0	0	0	112	S432 Y433	S432-S435 CarbonylContact O-C 3.23Å; S432-S435 PolarHBondContact O-N 3.34Å; Y433-S435 VanDerWaalsContact C-N 3.28Å; Y433-S435 PolarHBondContact O-N 3.07Å
436	Q	37.3	Very low	57.3	Low	180 Å²	180	108.1 Å²	108.1	84%	0.841	54%	0.54	S	S	*	.	S	Bend	trans	68.9	158.8	167.7	-92.4	-175.2	-2	0	0	118
437	P	39.5	Very low	59.2	Low	118 Å²	118	109.6 Å²	109.6	77%	0.766	54%	0.539	S	S	*	.	S	Bend	trans	-80.2	149.1	-154.5	32.4	-34.2	0	0	0	113.6
438	H	38.5	Very low	61.1	Low	190 Å²	190	107.1 Å²	107.1	88%	0.88	53%	0.529	S	S	*	.			trans	13.1	109.3	165.1	-113.4	-8.2	0	0	0	117.5	P440	H438-P440 WeakPolarHBondContact O-CD 3.44Å
439	N	43.8	Very low	63.1	Low	121 Å²	121	100.1 Å²	100.1	65%	0.647	50%	0.499	S	S	*	.			trans	-55	119.1	171.6	-105.7	-37.6	0	0	0	110.9
440	P	47.3	Very low	65.3	Low	94 Å²	94	100.7 Å²	100.7	61%	0.61	50%	0.496	S	S	*	.			trans	-65.4	145	169.8	28	-31.2	0	0	0	109.3	H438 R442	H438-P440 WeakPolarHBondContact O-CD 3.44Å; P440-R442 PolarHBondContact O-N 2.93Å; P440-R442 VanDerWaalsContact O-N 3.12Å
441	G	57.7	Low	67.4	Low	56 Å²	56	96 Å²	96	58%	0.577	47%	0.472	S	S	*	.			trans	-43.6	116	-172.9	0	0	0	0	0	113.5	E443	G441-E443 PolarHBondContact O-N 2.01Å
442	R	73	Confident	69.4	Low	107 Å²	107	88.5 Å²	88.5	40%	0.404	44%	0.444	S	S	.	.			trans	-67.4	114.6	171.6	-68.3	179.4	175.2	-175.6	-5	107.6	M361 W416 P440 S473 P474	M361-R442 HydrophobicContact SD-CB 4.5Å; W416-R442 HydrophobicContact CH2-CB 3.85Å; W416-R442 HydrophobicContact CZ2-CB 4.46Å; P440-R442 PolarHBondContact O-N 2.93Å; P440-R442 VanDerWaalsContact O-N 3.12Å; R442-S473 WeakPolarHBondContact O-CA 3.43Å; R442-S473 VanDerWaalsContact O-CB 3.27Å; R442-S473 WeakPolarHBondContact O-CB 3.22Å; R442-P474 HydrophobicContact CB-CG 4.2Å; R442-P474 VanDerWaalsContact O-CD 3.24Å; R442-P474 WeakPolarHBondContact O-CD 3.12Å
443	E	82.9	Confident	71.6	Confident	78 Å²	78	86 Å²	86	36%	0.364	43%	0.427	S	S	.	.			trans	-139.9	120.5	-171.2	-171.6	177.1	-156.1	0	0	108.9	M361 G441 S471 I472	M361-E443 HydrophobicContact CE-CB 4.27Å; M361-E443 VanDerWaalsContact CE-O 3.3Å; M361-E443 WeakPolarHBondContact CE-O 3.49Å; G441-E443 PolarHBondContact O-N 2.01Å; E443-S471 WeakPolarHBondContact OE1-CB 3.47Å; E443-S471 PolarHBondContact OE1-OG 2.81Å; E443-I472 WeakPolarHBondContact CA-O 3.22Å
444	L	87.5	Confident	73.7	Confident	5 Å²	5	76.1 Å²	76.1	3%	0.026	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	149.3	176.5	-64.9	174.3	0	0	0	108.5	V355 I364 P366 F368 W416 S471 I472	V355-L444 HydrophobicContact CG1-CB 4.21Å; V355-L444 HydrophobicContact CG1-CD1 4.13Å; V355-L444 HydrophobicContact CG1-CD2 3.94Å; V355-L444 HydrophobicContact CG1-CG 4.32Å; I364-L444 HydrophobicContact CD1-CD2 4.38Å; P366-L444 HydrophobicContact CG-CD1 4.43Å; F368-L444 HydrophobicContact CZ-CD1 3.87Å; W416-L444 HydrophobicContact CE3-CD1 4.45Å; W416-L444 HydrophobicContact CH2-CD1 3.81Å; W416-L444 HydrophobicContact CH2-CG 4.01Å; W416-L444 HydrophobicContact CZ3-CB 4.25Å; W416-L444 HydrophobicContact CZ3-CD1 3.78Å; W416-L444 HydrophobicContact CZ3-CG 3.8Å; L444-S471 CarbonylContact O-C 3.23Å; L444-S471 VanDerWaalsContact O-CA 3.27Å; L444-S471 WeakPolarHBondContact O-CA 3.47Å; L444-I472 HydrophobicContact CB-CG2 4Å; L444-I472 PolarHBondContact N-O 2.99Å; L444-I472 PolarHBondContact O-N 3.45Å
445	N	90.4	Very high	75.8	Confident	16 Å²	16	71 Å²	71	9%	0.086	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	128.5	-179.5	-74.1	-99.3	0	0	0	110.5	F356 Y358 T470 S471	F356-N445 HydrophobicContact CB-CB 3.93Å; F356-N445 PolarHBondContact N-O 3.3Å; F356-N445 PolarHBondContact O-N 2.87Å; Y358-N445 WeakPolarHBondContact CD2-ND2 3.42Å; Y358-N445 HydrophobicContact CE2-CB 4.01Å; Y358-N445 VanDerWaalsContact CE2-CG 3.46Å; Y358-N445 WeakPolarHBondContact CE2-ND2 3.33Å; N445-T470 CarbonylContact C-O 3.57Å; N445-T470 VanDerWaalsContact CA-O 3.32Å; N445-T470 WeakPolarHBondContact CA-O 3.38Å; N445-S471 WeakPolarHBondContact OD1-CB 3.42Å
446	I	92.1	Very high	78.1	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	36%	0.356	C	S	.	.			trans	-133.6	109.4	-177.6	-58.9	172.3	0	0	0	108.6	I353 L414 I449 T470 I472 L478 F480	I353-I446 HydrophobicContact CG2-CB 4.48Å; I353-I446 HydrophobicContact CG2-CD1 3.89Å; I353-I446 HydrophobicContact CG2-CG1 4.1Å; I353-I446 HydrophobicContact CG2-CG2 3.55Å; L414-I446 HydrophobicContact CD2-CD1 3.35Å; I446-I449 HydrophobicContact CG2-CG1 4.32Å; I446-T470 PolarHBondContact N-O 3.24Å; I446-I472 HydrophobicContact CD1-CG2 4.08Å; I446-L478 HydrophobicContact CB-CD1 4.33Å; I446-F480 HydrophobicContact CB-CZ 4.15Å; I446-F480 HydrophobicContact CG2-CE1 3.89Å; I446-F480 HydrophobicContact CG2-CZ 3.61Å
447	R	91.4	Very high	80.8	Confident	126 Å²	126	64.9 Å²	64.9	48%	0.475	33%	0.328	S	S	.	.			trans	-91.8	-32.6	-176.8	-56.7	-173.8	-175.7	178.6	2.2	113.5	F356 Y358 A464 T470	F356-R447 HydrophobicContact CD2-CG 4.36Å; F356-R447 HydrophobicContact CE2-CG 4.07Å; Y358-R447 PolarHBondContact OH-NH2 3.29Å; R447-A464 PolarHBondContact O-N 2.83Å; R447-T470 HydrophobicContact CG-CG2 4.18Å
448	R	93.1	Very high	83.4	Confident	113 Å²	113	64.8 Å²	64.8	43%	0.426	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	145.7	-170.4	60.7	-177	166.5	-174.9	-6.4	112.3	F462	R448-F462 CarbonylContact C-O 3.57Å; R448-F462 VanDerWaalsContact CA-O 3.24Å; R448-F462 WeakPolarHBondContact CA-O 3.37Å
449	I	95.8	Very high	86.1	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	123.3	174.7	-59.2	-177.6	0	0	0	107.8	M351 I353 I412 I446 V451 F462 F480	M351-I449 HydrophobicContact CE-CD1 4.49Å; M351-I449 HydrophobicContact CE-CG2 3.47Å; M351-I449 VanDerWaalsContact CE-CG2 3.47Å; I353-I449 HydrophobicContact CD1-CD1 4.4Å; I353-I449 HydrophobicContact CG1-CG1 4.2Å; I353-I449 HydrophobicContact CG1-CG2 4.25Å; I412-I449 HydrophobicContact CD1-CG2 4.13Å; I412-I449 HydrophobicContact CG2-CD1 4.18Å; I446-I449 HydrophobicContact CG2-CG1 4.32Å; I449-V451 HydrophobicContact CG2-CG2 3.94Å; I449-F462 HydrophobicContact CB-CB 4.5Å; I449-F462 PolarHBondContact N-O 2.97Å; I449-F462 PolarHBondContact O-N 3.2Å; I449-F480 HydrophobicContact CD1-CD1 4.1Å; I449-F480 HydrophobicContact CD1-CD2 3.63Å; I449-F480 HydrophobicContact CD1-CE1 4.09Å; I449-F480 HydrophobicContact CD1-CE2 3.61Å; I449-F480 HydrophobicContact CD1-CG 3.91Å; I449-F480 HydrophobicContact CD1-CZ 3.86Å; I449-F480 HydrophobicContact CG1-CD1 4.01Å; I449-F480 HydrophobicContact CG1-CD2 4.44Å; I449-F480 HydrophobicContact CG1-CE1 3.96Å; I449-F480 HydrophobicContact CG1-CE2 4.38Å; I449-F480 HydrophobicContact CG1-CG 4.29Å; I449-F480 HydrophobicContact CG1-CZ 4.15Å
450	R	96.8	Very high	88.5	Confident	128 Å²	128	58.9 Å²	58.9	48%	0.483	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	127	172.9	-66.7	173.7	179.8	173.4	0	108.8	K352 T461	K352-R450 HydrophobicContact CB-CB 4.19Å; K352-R450 PolarHBondContact N-O 3.36Å; K352-R450 PolarHBondContact O-N 2.92Å; R450-T461 HydrophobicContact CG-CG2 3.95Å
451	V	96.8	Very high	90.8	Very high	5 Å²	5	57.3 Å²	57.3	3%	0.03	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	136.3	-179.6	-175.3	0	0	0	0	109.8	Y349 Q350 M351 L409 I412 I449 K459 L460 F462	Y349-V451 HydrophobicContact CD1-CG1 3.89Å; Y349-V451 HydrophobicContact CG-CG1 4.43Å; Q350-V451 CarbonylContact O-C 3.52Å; Q350-V451 VanDerWaalsContact O-CA 3.28Å; Q350-V451 WeakPolarHBondContact O-CA 2.96Å; M351-V451 HydrophobicContact CE-CG2 4.17Å; M351-V451 HydrophobicContact CG-CG2 4.21Å; L409-V451 HydrophobicContact CD1-CG1 3.86Å; I412-V451 HydrophobicContact CD1-CG2 3.62Å; I449-V451 HydrophobicContact CG2-CG2 3.94Å; V451-K459 CarbonylContact O-C 3.46Å; V451-K459 WeakPolarHBondContact O-CA 3.12Å; V451-L460 PolarHBondContact N-O 3.44Å; V451-L460 PolarHBondContact O-N 2.95Å; V451-F462 HydrophobicContact CB-CE2 4.22Å; V451-F462 HydrophobicContact CG2-CD2 3.98Å; V451-F462 HydrophobicContact CG2-CE2 4Å
452	K	96.4	Very high	92.6	Very high	20 Å²	20	54.7 Å²	54.7	9%	0.087	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	122.8	168.1	-178.2	-166.3	179.5	-161.3	0	109.5	L309 Y349 Q350 R458 K459	L309-K452 PolarHBondContact O-NZ 2.8Å; Y349-K452 CarbonylContact C-O 3.54Å; Y349-K452 WeakPolarHBondContact CA-O 3.16Å; Q350-K452 HydrophobicContact CB-CB 4.23Å; Q350-K452 PolarHBondContact N-O 3.43Å; Q350-K452 PolarHBondContact O-N 3.24Å; K452-R458 WeakPolarHBondContact CA-O 3.41Å; K452-K459 HydrophobicContact CB-CG 4.16Å; K452-K459 HydrophobicContact CD-CG 4.46Å; K452-K459 HydrophobicContact CG-CG 3.91Å
453	S	96.1	Very high	93.7	Very high	11 Å²	11	52 Å²	52	8%	0.077	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	133	170.5	164.5	0	0	0	0	110.1	T456 Q457 R458	S453-T456 WeakPolarHBondContact CB-OG1 3.04Å; S453-T456 PolarHBondContact OG-N 2.87Å; S453-T456 VanDerWaalsContact OG-N 3.15Å; S453-T456 PolarHBondContact OG-OG1 2.71Å; S453-Q457 WeakPolarHBondContact O-CA 3.34Å; S453-Q457 PolarHBondContact O-N 3.2Å; S453-Q457 VanDerWaalsContact O-N 3.09Å; S453-R458 PolarHBondContact N-O 2.89Å
454	G	95.1	Very high	94.2	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-43	175.8	0	0	0	0	0	111.7	H348 Q457	H348-G454 PolarHBondContact O-N 2.76Å; G454-Q457 PolarHBondContact O-NE2 2.81Å
455	E	94.1	Very high	94.3	Very high	35 Å²	35	52.8 Å²	52.8	16%	0.164	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-46.9	-175.3	-65.7	65.5	-141.3	0	0	111.1	Y347 H348	Y347-E455 HydrophobicContact CD1-CB 4.45Å; Y347-E455 HydrophobicContact CD1-CG 4.03Å; H348-E455 IonicContact CE1-OE1 3.23Å; H348-E455 IonicContact CG-OE1 3.52Å; H348-E455 VanDerWaalsContact N-CD 3.31Å; H348-E455 PolarHBondContact N-OE1 2.88Å; H348-E455 VanDerWaalsContact N-OE1 3.1Å; H348-E455 PolarHBondContact N-OE2 3.18Å; H348-E455 IonicContact ND1-OE1 2.87Å; H348-E455 PolarHBondContact ND1-OE1 2.83Å
456	T	93.7	Very high	94.2	Very high	86 Å²	86	55.7 Å²	55.7	53%	0.528	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-10.6	-178.2	68.8	0	0	0	0	113.5	S453 R458	S453-T456 WeakPolarHBondContact CB-OG1 3.04Å; S453-T456 PolarHBondContact OG-N 2.87Å; S453-T456 VanDerWaalsContact OG-N 3.15Å; S453-T456 PolarHBondContact OG-OG1 2.71Å; T456-R458 PolarHBondContact O-N 3.03Å; T456-R458 PolarHBondContact OG1-N 3.21Å
457	Q	95.1	Very high	93.7	Very high	54 Å²	54	60.9 Å²	60.9	25%	0.252	29%	0.293	S	S	.	.			trans	55.1	8.5	-170.8	-66	-67	-69.7	0	0	115.2	L309 C311 S453 G454	L309-Q457 PolarHBondContact O-NE2 2.92Å; C311-Q457 HydrophobicContact CB-CG 4.05Å; C311-Q457 VanDerWaalsContact N-OE1 3.12Å; S453-Q457 WeakPolarHBondContact O-CA 3.34Å; S453-Q457 PolarHBondContact O-N 3.2Å; S453-Q457 VanDerWaalsContact O-N 3.09Å; G454-Q457 PolarHBondContact O-NE2 2.81Å
458	R	93.9	Very high	93.2	Very high	115 Å²	115	63.9 Å²	63.9	43%	0.434	31%	0.313	S	S	.	.			trans	-72	147.5	178.4	-67.5	178.2	74.2	-169.5	-0.3	111.1	D408 K452 S453 T456	D408-R458 IonicContact OD1-CZ 3.73Å; D408-R458 IonicContact OD1-NH1 3.03Å; D408-R458 PolarHBondContact OD1-NH1 3.42Å; D408-R458 IonicContact OD2-CZ 3.59Å; D408-R458 IonicContact OD2-NH1 2.62Å; D408-R458 PolarHBondContact OD2-NH1 3.24Å; D408-R458 IonicContact OD2-NH2 3.21Å; D408-R458 PolarHBondContact OD2-NH2 2.93Å; K452-R458 WeakPolarHBondContact CA-O 3.41Å; S453-R458 PolarHBondContact N-O 2.89Å; T456-R458 PolarHBondContact O-N 3.03Å; T456-R458 PolarHBondContact OG1-N 3.21Å
459	K	94.9	Very high	92.8	Very high	149 Å²	149	62.5 Å²	62.5	65%	0.648	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.3	130.3	175.9	-65.9	179.1	-177.5	178.6	0	109.2	V451 K452	V451-K459 CarbonylContact O-C 3.46Å; V451-K459 WeakPolarHBondContact O-CA 3.12Å; K452-K459 HydrophobicContact CB-CG 4.16Å; K452-K459 HydrophobicContact CD-CG 4.46Å; K452-K459 HydrophobicContact CG-CG 3.91Å
460	L	94.2	Very high	92.5	Very high	39 Å²	39	63.2 Å²	63.2	20%	0.204	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	150.5	179.9	-63.2	171.8	0	0	0	109.1	L409 V451 F462	L409-L460 HydrophobicContact CB-CD1 4.06Å; V451-L460 PolarHBondContact N-O 3.44Å; V451-L460 PolarHBondContact O-N 2.95Å; L460-F462 HydrophobicContact CB-CD2 4.38Å; L460-F462 HydrophobicContact CB-CE2 3.6Å; L460-F462 HydrophobicContact CB-CZ 4.17Å; L460-F462 HydrophobicContact CD1-CE2 4.27Å; L460-F462 HydrophobicContact CD1-CZ 4.15Å
461	T	96.1	Very high	92.1	Very high	61 Å²	61	58.5 Å²	58.5	37%	0.374	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	130.2	173.3	-51.1	0	0	0	0	108.6	R450 C483	R450-T461 HydrophobicContact CG-CG2 3.95Å; T461-C483 VanDerWaalsContact CG2-SG 3.59Å; T461-C483 PolarHBondContact O-N 3.41Å; T461-C483 PolarHBondContact O-SG 2.91Å; T461-C483 VanDerWaalsContact O-SG 3.4Å
462	F	95.7	Very high	91.7	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	135	178	-62.3	-98.1	0	0	0	109	L409 L410 I412 R448 I449 V451 L460 F480 R481 K482	L409-F462 HydrophobicContact CB-CE1 4.5Å; L409-F462 HydrophobicContact CB-CE2 4.45Å; L409-F462 HydrophobicContact CB-CZ 3.68Å; L410-F462 WeakPolarHBondContact O-CE1 3.5Å; I412-F462 HydrophobicContact CD1-CB 4.17Å; I412-F462 HydrophobicContact CD1-CD1 4.12Å; I412-F462 HydrophobicContact CD1-CD2 3.46Å; I412-F462 VanDerWaalsContact CD1-CD2 3.46Å; I412-F462 HydrophobicContact CD1-CE1 4.43Å; I412-F462 HydrophobicContact CD1-CE2 3.81Å; I412-F462 HydrophobicContact CD1-CG 3.65Å; I412-F462 HydrophobicContact CD1-CZ 4.3Å; I412-F462 HydrophobicContact CG1-CD1 4.07Å; I412-F462 HydrophobicContact CG1-CD2 4.29Å; I412-F462 HydrophobicContact CG1-CE1 4.27Å; I412-F462 HydrophobicContact CG1-CE2 4.46Å; I412-F462 HydrophobicContact CG1-CG 4.1Å; I412-F462 HydrophobicContact CG1-CZ 4.48Å; R448-F462 CarbonylContact C-O 3.57Å; R448-F462 VanDerWaalsContact CA-O 3.24Å; R448-F462 WeakPolarHBondContact CA-O 3.37Å; I449-F462 HydrophobicContact CB-CB 4.5Å; I449-F462 PolarHBondContact N-O 2.97Å; I449-F462 PolarHBondContact O-N 3.2Å; V451-F462 HydrophobicContact CB-CE2 4.22Å; V451-F462 HydrophobicContact CG2-CD2 3.98Å; V451-F462 HydrophobicContact CG2-CE2 4Å; L460-F462 HydrophobicContact CB-CD2 4.38Å; L460-F462 HydrophobicContact CB-CE2 3.6Å; L460-F462 HydrophobicContact CB-CZ 4.17Å; L460-F462 HydrophobicContact CD1-CE2 4.27Å; L460-F462 HydrophobicContact CD1-CZ 4.15Å; F462-F480 HydrophobicContact CB-CB 3.81Å; F462-R481 CarbonylContact C-O 3.57Å; F462-R481 WeakPolarHBondContact CA-O 3.39Å; F462-K482 HydrophobicContact CD1-CG 4.28Å; F462-K482 HydrophobicContact CE1-CG 3.73Å; F462-K482 HydrophobicContact CZ-CG 4.21Å
463	C	94.9	Very high	91.3	Very high	50 Å²	50	59.3 Å²	59.3	34%	0.338	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	147.4	-178.5	-72	0	0	0	0	108.3	E465 F480 R481 C483	C463-E465 PolarHBondContact O-N 2.66Å; C463-F480 CarbonylContact O-C 3.59Å; C463-F480 WeakPolarHBondContact O-CA 3.48Å; C463-R481 PolarHBondContact N-O 2.84Å; C463-R481 PolarHBondContact O-N 2.87Å; C463-C483 HydrophobicContact CB-CB 4.12Å; C463-C483 WeakPolarHBondContact CB-SG 3.43Å; C463-C483 PolarHBondContact N-SG 3.41Å; C463-C483 WeakPolarHBondContact SG-CB 3.26Å; C463-C483 CovalentContact SG-SG 2.04Å; C463-C483 PolarHBondContact SG-SG 2.83Å
464	A	93.8	Very high	90.8	Very high	14 Å²	14	61.3 Å²	61.3	12%	0.116	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-52	136	175.2	0	0	0	0	0	110	R447 D466 T470 F480	R447-A464 PolarHBondContact O-N 2.83Å; A464-D466 VanDerWaalsContact C-N 3.29Å; A464-D466 PolarHBondContact O-N 3.45Å; A464-T470 HydrophobicContact CB-CG2 3.94Å; A464-F480 HydrophobicContact CB-CD1 4.32Å; A464-F480 HydrophobicContact CB-CE1 4.16Å
465	E	90.7	Very high	90.3	Very high	87 Å²	87	63.9 Å²	63.9	41%	0.407	35%	0.353	S	S	.	.	S	Bend	trans	-63.9	-39	-177.7	-178.5	162.1	171.7	0	0	111.7	C463 W479 R481	C463-E465 PolarHBondContact O-N 2.66Å; E465-W479 HydrophobicContact CB-CB 4.14Å; E465-W479 WeakPolarHBondContact CB-O 3.15Å; E465-W479 PolarHBondContact N-O 3.02Å; E465-R481 HydrophobicContact CB-CG 4.41Å; E465-R481 HydrophobicContact CG-CG 4.37Å; E465-R481 IonicContact OE1-CZ 3.1Å; E465-R481 IonicContact OE1-NE 3.06Å; E465-R481 PolarHBondContact OE1-NE 3.38Å; E465-R481 IonicContact OE1-NH2 2.8Å; E465-R481 PolarHBondContact OE1-NH2 2.99Å; E465-R481 IonicContact OE2-CZ 3.58Å; E465-R481 IonicContact OE2-NE 2.81Å; E465-R481 PolarHBondContact OE2-NE 2.92Å; E465-R481 IonicContact OE2-NH2 2.63Å; E465-R481 PolarHBondContact OE2-NH2 3.19Å
466	D	88.4	Confident	90.1	Very high	77 Å²	77	70.5 Å²	70.5	41%	0.412	38%	0.376	S	S	.	.	S	Bend	trans	-105.8	110.9	169.3	-175.5	-10.7	0	0	0	109.4	A464 E468 N469	A464-D466 VanDerWaalsContact C-N 3.29Å; A464-D466 PolarHBondContact O-N 3.45Å; D466-E468 PolarHBondContact O-N 3.09Å; D466-E468 PolarHBondContact OD1-N 3.45Å; D466-N469 HydrophobicContact CB-CB 4.04Å; D466-N469 CarbonylContact O-C 3.49Å; D466-N469 PolarHBondContact O-N 2.9Å; D466-N469 PolarHBondContact OD1-N 3.48Å; D466-N469 WeakPolarHBondContact OD2-CB 3.46Å
467	P	81.3	Confident	90.1	Very high	109 Å²	109	70.8 Å²	70.8	71%	0.708	37%	0.371	S	S	*	.	S	Bend	trans	-65.3	-22.9	177.9	-20.7	32.9	0	0	0	114.4	T470	P467-T470 WeakPolarHBondContact O-CG2 3.4Å
468	E	81.4	Confident	90.1	Very high	188 Å²	188	68.6 Å²	68.6	88%	0.879	36%	0.361	S	S	*	.	S	Bend	trans	-84.1	-31.7	178.6	-60.4	-165.6	168.9	0	0	111	D466	D466-E468 PolarHBondContact O-N 3.09Å; D466-E468 PolarHBondContact OD1-N 3.45Å
469	N	85	Confident	90.2	Very high	85 Å²	85	66.9 Å²	66.9	46%	0.455	36%	0.355	S	S	.	.			trans	-103.6	81.3	177.7	-169.4	17.5	0	0	0	112.4	D466	D466-N469 HydrophobicContact CB-CB 4.04Å; D466-N469 CarbonylContact O-C 3.49Å; D466-N469 PolarHBondContact O-N 2.9Å; D466-N469 PolarHBondContact OD1-N 3.48Å; D466-N469 WeakPolarHBondContact OD2-CB 3.46Å
470	T	88.4	Confident	90.3	Very high	15 Å²	15	59.8 Å²	59.8	9%	0.092	32%	0.324	C	S	.	.			trans	-104.7	7.2	178.1	67.5	0	0	0	0	113.7	N445 I446 R447 A464 P467	N445-T470 CarbonylContact C-O 3.57Å; N445-T470 VanDerWaalsContact CA-O 3.32Å; N445-T470 WeakPolarHBondContact CA-O 3.38Å; I446-T470 PolarHBondContact N-O 3.24Å; R447-T470 HydrophobicContact CG-CG2 4.18Å; A464-T470 HydrophobicContact CB-CG2 3.94Å; P467-T470 WeakPolarHBondContact O-CG2 3.4Å
471	S	89	Confident	90.3	Very high	29 Å²	29	63.2 Å²	63.2	20%	0.203	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	138.9	-175.5	73.2	0	0	0	0	112.6	E443 L444 N445 L478	E443-S471 WeakPolarHBondContact OE1-CB 3.47Å; E443-S471 PolarHBondContact OE1-OG 2.81Å; L444-S471 CarbonylContact O-C 3.23Å; L444-S471 VanDerWaalsContact O-CA 3.27Å; L444-S471 WeakPolarHBondContact O-CA 3.47Å; N445-S471 WeakPolarHBondContact OD1-CB 3.42Å; S471-L478 WeakPolarHBondContact O-CD2 3.13Å
472	I	88.6	Confident	90.1	Very high	1 Å²	1	64.2 Å²	64.2	1%	0.005	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	134.5	176.3	-166.5	166.4	0	0	0	109.1	F368 L414 W416 E443 L444 I446 L478	F368-I472 HydrophobicContact CE1-CD1 4.35Å; F368-I472 HydrophobicContact CE1-CG2 4.35Å; L414-I472 HydrophobicContact CD2-CD1 4.27Å; L414-I472 HydrophobicContact CG-CD1 4.23Å; W416-I472 HydrophobicContact CB-CD1 3.86Å; W416-I472 HydrophobicContact CB-CG1 3.91Å; W416-I472 HydrophobicContact CE3-CG1 4.38Å; W416-I472 HydrophobicContact CE3-CG2 4.13Å; W416-I472 WeakPolarHBondContact CZ3-O 3.47Å; E443-I472 WeakPolarHBondContact CA-O 3.22Å; L444-I472 HydrophobicContact CB-CG2 4Å; L444-I472 PolarHBondContact N-O 2.99Å; L444-I472 PolarHBondContact O-N 3.45Å; I446-I472 HydrophobicContact CD1-CG2 4.08Å; I472-L478 HydrophobicContact CB-CD1 3.66Å; I472-L478 HydrophobicContact CB-CG 3.94Å; I472-L478 HydrophobicContact CD1-CD1 4.49Å; I472-L478 HydrophobicContact CD1-CG 4.33Å; I472-L478 HydrophobicContact CG1-CG 4.35Å; I472-L478 HydrophobicContact CG2-CD1 4.26Å
473	S	87.4	Confident	89.8	Confident	41 Å²	41	65.5 Å²	65.5	29%	0.287	34%	0.342	S	S	.	.			trans	-124.9	161.5	174	53.8	0	0	0	0	110.1	R442 G475 R476	R442-S473 WeakPolarHBondContact O-CA 3.43Å; R442-S473 VanDerWaalsContact O-CB 3.27Å; R442-S473 WeakPolarHBondContact O-CB 3.22Å; S473-G475 PolarHBondContact O-N 3.18Å; S473-R476 WeakPolarHBondContact O-CB 3.16Å; S473-R476 PolarHBondContact O-N 3.24Å; S473-R476 VanDerWaalsContact OG-CG 3.24Å; S473-R476 WeakPolarHBondContact OG-CG 2.98Å
474	P	86.4	Confident	88.8	Confident	53 Å²	53	75 Å²	75	34%	0.344	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53	131.1	179.3	-26.7	33.9	0	0	0	112.2	W416 R442 R476	W416-P474 HydrophobicContact CD2-CG 4.06Å; W416-P474 HydrophobicContact CE3-CG 4.31Å; W416-P474 HydrophobicContact CH2-CG 4.17Å; W416-P474 HydrophobicContact CZ2-CG 3.86Å; W416-P474 HydrophobicContact CZ3-CG 4.37Å; R442-P474 HydrophobicContact CB-CG 4.2Å; R442-P474 VanDerWaalsContact O-CD 3.24Å; R442-P474 WeakPolarHBondContact O-CD 3.12Å; P474-R476 VanDerWaalsContact C-N 3.31Å
475	G	84.6	Confident	86.9	Confident	54 Å²	54	82 Å²	82	56%	0.557	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	81	3.4	-177.1	0	0	0	0	0	114.8	W416 S473	W416-G475 WeakPolarHBondContact O-CA 3.45Å; W416-G475 PolarHBondContact O-N 3.47Å; S473-G475 PolarHBondContact O-N 3.18Å
476	R	89.7	Confident	84.5	Confident	173 Å²	173	80.8 Å²	80.8	65%	0.653	42%	0.418	S	S	*	.			trans	-106	166.8	175.2	-61	-63.5	-171.2	161.8	0.3	111.8	W416 S473 P474	W416-R476 PolarHBondContact N-O 2.98Å; S473-R476 WeakPolarHBondContact O-CB 3.16Å; S473-R476 PolarHBondContact O-N 3.24Å; S473-R476 VanDerWaalsContact OG-CG 3.24Å; S473-R476 WeakPolarHBondContact OG-CG 2.98Å; P474-R476 VanDerWaalsContact C-N 3.31Å
477	E	92.9	Very high	82.2	Confident	92 Å²	92	89.4 Å²	89.4	43%	0.43	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	153.3	178.7	63.8	179.9	-151.6	0	0	111.5	Q413 L414 T415 W479	Q413-E477 HydrophobicContact CG-CB 4.49Å; Q413-E477 PolarHBondContact NE2-OE2 2.93Å; L414-E477 CarbonylContact O-C 3.54Å; L414-E477 VanDerWaalsContact O-CA 3.25Å; L414-E477 WeakPolarHBondContact O-CA 3.48Å; T415-E477 HydrophobicContact CG2-CB 3.68Å; E477-W479 PolarHBondContact OE1-NE1 3.25Å
478	L	94.6	Very high	79.7	Confident	8 Å²	8	95.6 Å²	95.6	4%	0.042	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	136	171.4	-76.8	-178.9	0	0	0	110	L414 I446 S471 I472 F480	L414-L478 PolarHBondContact N-O 2.65Å; L414-L478 PolarHBondContact O-N 3.01Å; I446-L478 HydrophobicContact CB-CD1 4.33Å; S471-L478 WeakPolarHBondContact O-CD2 3.13Å; I472-L478 HydrophobicContact CB-CD1 3.66Å; I472-L478 HydrophobicContact CB-CG 3.94Å; I472-L478 HydrophobicContact CD1-CD1 4.49Å; I472-L478 HydrophobicContact CD1-CG 4.33Å; I472-L478 HydrophobicContact CG1-CG 4.35Å; I472-L478 HydrophobicContact CG2-CD1 4.26Å; L478-F480 HydrophobicContact CB-CE2 3.63Å; L478-F480 HydrophobicContact CB-CZ 4.01Å; L478-F480 HydrophobicContact CD1-CZ 4.19Å
479	W	96.1	Very high	77.5	Confident	79 Å²	79	95.7 Å²	95.7	30%	0.299	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	136.8	178.4	-70.6	87.8	0	0	0	111	Y373 Q413 E465 E477	Y373-W479 HydrophobicContact CD2-CZ3 4.07Å; Y373-W479 AromaticContact CE2-CH2 3.8Å; Y373-W479 HydrophobicContact CE2-CH2 3.8Å; Y373-W479 AromaticContact CE2-CZ3 3.49Å; Y373-W479 HydrophobicContact CE2-CZ3 3.49Å; Y373-W479 VanDerWaalsContact CE2-CZ3 3.49Å; Y373-W479 AromaticContact CZ-CH2 3.81Å; Y373-W479 AromaticContact CZ-CZ3 3.91Å; Q413-W479 HydrophobicContact CB-CD2 4.29Å; Q413-W479 HydrophobicContact CB-CE3 4.04Å; Q413-W479 HydrophobicContact CB-CH2 4.02Å; Q413-W479 HydrophobicContact CB-CZ2 4.27Å; Q413-W479 HydrophobicContact CB-CZ3 3.91Å; Q413-W479 HydrophobicContact CG-CD2 4.29Å; Q413-W479 HydrophobicContact CG-CE3 4.49Å; Q413-W479 HydrophobicContact CG-CH2 4.08Å; Q413-W479 HydrophobicContact CG-CZ2 3.85Å; Q413-W479 HydrophobicContact CG-CZ3 4.4Å; E465-W479 HydrophobicContact CB-CB 4.14Å; E465-W479 WeakPolarHBondContact CB-O 3.15Å; E465-W479 PolarHBondContact N-O 3.02Å; E477-W479 PolarHBondContact OE1-NE1 3.25Å
480	F	96.4	Very high	75.2	Confident	0 Å²	0	100.9 Å²	100.9	0%	0	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	136.5	178	-56.2	-101.4	0	0	0	110.6	K411 I412 L414 I446 I449 F462 C463 A464 L478	K411-F480 CarbonylContact C-O 3.52Å; K411-F480 VanDerWaalsContact CA-O 3.27Å; K411-F480 WeakPolarHBondContact CA-O 3.42Å; I412-F480 HydrophobicContact CB-CB 4.28Å; I412-F480 PolarHBondContact N-O 3.05Å; I412-F480 PolarHBondContact O-N 3.18Å; L414-F480 HydrophobicContact CB-CE2 3.91Å; L414-F480 HydrophobicContact CD2-CE2 4.37Å; I446-F480 HydrophobicContact CB-CZ 4.15Å; I446-F480 HydrophobicContact CG2-CE1 3.89Å; I446-F480 HydrophobicContact CG2-CZ 3.61Å; I449-F480 HydrophobicContact CD1-CD1 4.1Å; I449-F480 HydrophobicContact CD1-CD2 3.63Å; I449-F480 HydrophobicContact CD1-CE1 4.09Å; I449-F480 HydrophobicContact CD1-CE2 3.61Å; I449-F480 HydrophobicContact CD1-CG 3.91Å; I449-F480 HydrophobicContact CD1-CZ 3.86Å; I449-F480 HydrophobicContact CG1-CD1 4.01Å; I449-F480 HydrophobicContact CG1-CD2 4.44Å; I449-F480 HydrophobicContact CG1-CE1 3.96Å; I449-F480 HydrophobicContact CG1-CE2 4.38Å; I449-F480 HydrophobicContact CG1-CG 4.29Å; I449-F480 HydrophobicContact CG1-CZ 4.15Å; F462-F480 HydrophobicContact CB-CB 3.81Å; C463-F480 CarbonylContact O-C 3.59Å; C463-F480 WeakPolarHBondContact O-CA 3.48Å; A464-F480 HydrophobicContact CB-CD1 4.32Å; A464-F480 HydrophobicContact CB-CE1 4.16Å; L478-F480 HydrophobicContact CB-CE2 3.63Å; L478-F480 HydrophobicContact CB-CZ 4.01Å; L478-F480 HydrophobicContact CD1-CZ 4.19Å
481	R	94.9	Very high	72.7	Confident	112 Å²	112	107.3 Å²	107.3	42%	0.423	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	159.5	174.6	-60.4	-170.6	176	-158	7.8	110	K411 F462 C463 E465 C483	K411-R481 HydrophobicContact CD-CG 4.33Å; K411-R481 HydrophobicContact CG-CG 4.21Å; K411-R481 VanDerWaalsContact NZ-NH2 3.15Å; F462-R481 CarbonylContact C-O 3.57Å; F462-R481 WeakPolarHBondContact CA-O 3.39Å; C463-R481 PolarHBondContact N-O 2.84Å; C463-R481 PolarHBondContact O-N 2.87Å; E465-R481 HydrophobicContact CB-CG 4.41Å; E465-R481 HydrophobicContact CG-CG 4.37Å; E465-R481 IonicContact OE1-CZ 3.1Å; E465-R481 IonicContact OE1-NE 3.06Å; E465-R481 PolarHBondContact OE1-NE 3.38Å; E465-R481 IonicContact OE1-NH2 2.8Å; E465-R481 PolarHBondContact OE1-NH2 2.99Å; E465-R481 IonicContact OE2-CZ 3.58Å; E465-R481 IonicContact OE2-NE 2.81Å; E465-R481 PolarHBondContact OE2-NE 2.92Å; E465-R481 IonicContact OE2-NH2 2.63Å; E465-R481 PolarHBondContact OE2-NH2 3.19Å; R481-C483 PolarHBondContact O-N 2.93Å
482	K	92.5	Very high	70.1	Confident	82 Å²	82	114.8 Å²	114.8	36%	0.357	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-49.3	126.9	172.1	-72.7	-175.6	-173.3	172.9	0	109.4	L409 F462	L409-K482 WeakPolarHBondContact O-CE 3.25Å; L409-K482 PolarHBondContact O-NZ 3.08Å; F462-K482 HydrophobicContact CD1-CG 4.28Å; F462-K482 HydrophobicContact CE1-CG 3.73Å; F462-K482 HydrophobicContact CZ-CG 4.21Å
483	C	88.9	Confident	67.6	Low	27 Å²	27	121.3 Å²	121.3	18%	0.182	58%	0.581	C	S	.	*			trans	-60.3	142.8	174.8	-57.3	0	0	0	0	109.2	T461 C463 R481 D485	T461-C483 VanDerWaalsContact CG2-SG 3.59Å; T461-C483 PolarHBondContact O-N 3.41Å; T461-C483 PolarHBondContact O-SG 2.91Å; T461-C483 VanDerWaalsContact O-SG 3.4Å; C463-C483 HydrophobicContact CB-CB 4.12Å; C463-C483 WeakPolarHBondContact CB-SG 3.43Å; C463-C483 PolarHBondContact N-SG 3.41Å; C463-C483 WeakPolarHBondContact SG-CB 3.26Å; C463-C483 CovalentContact SG-SG 2.04Å; C463-C483 PolarHBondContact SG-SG 2.83Å; R481-C483 PolarHBondContact O-N 2.93Å; C483-D485 PolarHBondContact O-N 2.91Å
484	R	73.9	Confident	64.8	Low	249 Å²	249	124.1 Å²	124.1	94%	0.94	60%	0.6	S	S	*	*	S	Bend	trans	-66.2	-15.8	179.8	-68.3	-177.1	178	-178.7	0.1	113.1	G486	R484-G486 PolarHBondContact O-N 2.89Å
485	D	54.6	Low	62.5	Low	160 Å²	160	127.1 Å²	127.1	86%	0.856	62%	0.62	S	S	*	*			trans	-91.2	87.9	-176.6	-61.9	-29.9	0	0	0	113	C483	C483-D485 PolarHBondContact O-N 2.91Å
486	G	40.5	Very low	60	Low	63 Å²	63	131.1 Å²	131.1	65%	0.649	63%	0.633	S	S	*	*			trans	-134.3	33.3	170.4	0	0	0	0	0	113.5	R484	R484-G486 PolarHBondContact O-N 2.89Å
487	W	38.5	Very low	57.4	Low	257 Å²	257	128.5 Å²	128.5	97%	0.973	64%	0.636	S	S	*	*			trans	-133.1	88.2	167.6	-99.4	67.3	0	0	0	110.8
488	R	30.3	Very low	54.4	Low	240 Å²	240	132.9 Å²	132.9	91%	0.906	66%	0.657	S	S	*	*			trans	-178.6	85.2	142.4	-98.5	172.8	-165.6	-161	4.6	106.7	K490	R488-K490 VanDerWaalsContact C-N 3.26Å; R488-K490 PolarHBondContact O-N 2.96Å
489	M	34.4	Very low	51.5	Low	189 Å²	189	139.8 Å²	139.8	93%	0.931	69%	0.693	S	S	*	*			trans	-59.2	100.4	151.1	-70.9	-111	-73.8	0	0	105.8	N491	M489-N491 VanDerWaalsContact C-N 3.26Å; M489-N491 PolarHBondContact O-N 2.82Å
490	K	37.1	Very low	48.7	Very low	194 Å²	194	145.1 Å²	145.1	84%	0.843	74%	0.738	S	S	*	*	S	Bend	trans	-63	99.8	159.6	-92.8	-173.5	179	-174.9	0	105.7	R488	R488-K490 VanDerWaalsContact C-N 3.26Å; R488-K490 PolarHBondContact O-N 2.96Å
491	N	36.5	Very low	46.3	Very low	151 Å²	151	152.4 Å²	152.4	81%	0.807	78%	0.775	S	S	*	*			trans	170.6	80.7	141.4	-82.9	-4.2	0	0	0	109.7	M489	M489-N491 VanDerWaalsContact C-N 3.26Å; M489-N491 PolarHBondContact O-N 2.82Å
492	E	32.6	Very low	43.8	Very low	185 Å²	185	154.5 Å²	154.5	86%	0.864	79%	0.793	S	S	*	*			trans	-133.8	98.3	142.4	-81.3	-174.8	172.7	0	0	105.8	S494	E492-S494 PolarHBondContact O-N 2.99Å
493	T	37.1	Very low	41.1	Very low	139 Å²	139	158.6 Å²	158.6	85%	0.853	82%	0.818	S	S	*	*			trans	-67.9	102.1	157.8	37.6	0	0	0	0	106.5
494	S	29	Very low	38.3	Very low	100 Å²	100	166.3 Å²	166.3	70%	0.699	86%	0.855	S	S	*	*			trans	-64.7	127.1	165	-57.8	0	0	0	0	108.6	E492 T496	E492-S494 PolarHBondContact O-N 2.99Å; S494-T496 PolarHBondContact O-N 2.96Å
495	P	38.2	Very low	36	Very low	115 Å²	115	161.1 Å²	161.1	75%	0.747	85%	0.85	S	S	*	*			trans	-80.2	109.4	165.6	29.8	-25.1	0	0	0	107.9	V497	P495-V497 PolarHBondContact O-N 3.49Å
496	T	32.2	Very low	34.8	Very low	138 Å²	138	161.2 Å²	161.2	85%	0.847	85%	0.849	S	S	*	*			trans	-69.5	104.9	157.5	39.3	0	0	0	0	107.5	S494	S494-T496 PolarHBondContact O-N 2.96Å
497	V	35.2	Very low	34.4	Very low	118 Å²	118	168.2 Å²	168.2	72%	0.715	86%	0.864	S	S	*	*			trans	-91.4	105.4	163.1	178.3	0	0	0	0	106.5	P495	P495-V497 PolarHBondContact O-N 3.49Å
498	E	29.6	Very low	34.1	Very low	184 Å²	184	161.4 Å²	161.4	86%	0.86	86%	0.855	S	S	*	*			trans	-86.8	121	157.1	-77.5	-178.8	162	0	0	107.4
499	L	33.5	Very low	34.4	Very low	154 Å²	154	154.8 Å²	154.8	81%	0.806	85%	0.851	S	S	*	*			trans	-78.6	147	166.3	-79	157.7	0	0	0	109.3
500	P	37.4	Very low	34.4	Very low	191 Å²	191	151.7 Å²	151.7	100%	1.24	84%	0.844	S	S	*	*				-105.2	0	114.9	28.3	-32.6	0	0	0	113.1

Retrieved 500 of 500 residues in 197.2 ms (Link to these results)

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