A0A087XU20_POEFO Loading...

Hexosyltransferase

AlphaFold DB , UniProt , Accession A0A087XU20, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 383 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.1	Very low	33.5	Very low	225 Å²	225	148.3 Å²	148.3	100%	1.108	78%	0.776	S	S	*	*				0	108.3	0	-168.8	166.2	179.4	0	0	106.7
2	F	31.1	Very low	33.5	Very low	183 Å²	183	150.3 Å²	150.3	80%	0.803	79%	0.787	S	S	*	*			trans	57.1	148	163.4	-71.6	-100	0	0	0	119.1
3	C	29.4	Very low	33.6	Very low	113 Å²	113	152 Å²	152	76%	0.764	79%	0.788	S	S	*	*			cis	177.1	168.5	-15.1	-102.2	0	0	0	0	103.8
4	G	28.4	Very low	33.9	Very low	61 Å²	61	156.2 Å²	156.2	63%	0.629	80%	0.797	S	S	*	*			cis	-176.2	157.5	12.8	0	0	0	0	0	107.2
5	D	33.8	Very low	34.2	Very low	155 Å²	155	158.4 Å²	158.4	83%	0.829	80%	0.799	S	S	*	*				56.4	132.1	115.5	-103.1	-23.8	0	0	0	115.9
6	E	34.5	Very low	34.5	Very low	140 Å²	140	156.3 Å²	156.3	65%	0.654	80%	0.799	S	S	*	*			cis	-177	162.2	47.4	-142.2	-178.2	-148.9	0	0	110.9
7	R	30.7	Very low	35	Very low	220 Å²	220	157.9 Å²	157.9	83%	0.83	81%	0.809	S	S	*	*			trans	99.1	106.2	152.6	-73.3	-179.6	-102.4	168.1	0.2	121.7
8	E	33.3	Very low	35.3	Very low	145 Å²	145	155.6 Å²	155.6	68%	0.678	81%	0.807	S	S	*	*			trans	-73.8	167.9	145.2	-67.6	-162.9	157	0	0	112.2	H10	E8-H10 IonicContact OE1-CD2 3.79Å; E8-H10 IonicContact OE1-NE2 3.94Å; E8-H10 IonicContact OE2-CD2 3.37Å; E8-H10 PolarHBondContact OE2-CD2 3.31Å
9	P	38.6	Very low	35.7	Very low	130 Å²	130	157.2 Å²	157.2	84%	0.844	81%	0.811	S	S	*	*				-142.5	138.3	97.5	33.7	-16.5	0	0	0	115.9
10	H	32.5	Very low	36	Very low	152 Å²	152	158.5 Å²	158.5	70%	0.704	81%	0.813	S	S	*	*			trans	-64.7	178.1	155.2	-88.3	-59.6	0	0	0	112	E8	E8-H10 IonicContact OE1-CD2 3.79Å; E8-H10 IonicContact OE1-NE2 3.94Å; E8-H10 IonicContact OE2-CD2 3.37Å; E8-H10 PolarHBondContact OE2-CD2 3.31Å
11	P	45.6	Very low	36.4	Very low	107 Å²	107	160.1 Å²	160.1	70%	0.695	81%	0.814	S	S	*	*			cis	-142.4	168.4	12.6	37.4	-16.7	0	0	0	116.6
12	L	33	Very low	37.1	Very low	173 Å²	173	158.1 Å²	158.1	91%	0.906	80%	0.799	S	S	*	*			trans	-165.1	123.5	137.7	-108.1	147.7	0	0	0	112.9
13	H	35.5	Very low	37.9	Very low	172 Å²	172	153.9 Å²	153.9	80%	0.796	79%	0.793	S	S	*	*			trans	-53.5	138.5	-177.2	-88.9	-81.9	0	0	0	116.8
14	K	36.9	Very low	39	Very low	211 Å²	211	151.9 Å²	151.9	92%	0.917	78%	0.779	S	S	*	*			trans	-135.2	132.9	137.8	-84.1	-173.9	179.3	174.3	0	111
15	K	39.1	Very low	40.8	Very low	189 Å²	189	156.7 Å²	156.7	82%	0.822	78%	0.784	S	S	*	*			trans	-66.5	157	-172.9	-70.5	171.9	173.1	177.4	0	114
16	P	38.1	Very low	42.3	Very low	124 Å²	124	158.3 Å²	158.3	81%	0.805	78%	0.778	S	S	*	*			trans	-83.9	122.1	169.4	32.3	-28.6	0	0	0	111.7	C18	P16-C18 VanDerWaalsContact C-N 3.3Å; P16-C18 PolarHBondContact O-N 3.41Å
17	L	43	Very low	44.3	Very low	184 Å²	184	158.7 Å²	158.7	96%	0.963	78%	0.778	S	S	*	*			trans	-75.5	77.4	166.5	-114.9	103	0	0	0	109.3
18	C	40.7	Very low	46.2	Very low	116 Å²	116	156 Å²	156	78%	0.784	77%	0.768	S	S	*	*			trans	-156.8	51.2	171	-153.8	0	0	0	0	113.7	P16	P16-C18 VanDerWaalsContact C-N 3.3Å; P16-C18 PolarHBondContact O-N 3.41Å
19	Q	42.3	Very low	48.4	Very low	186 Å²	186	155 Å²	155	87%	0.869	76%	0.761	S	S	*	*	S	Bend	trans	-134	-10.7	169.2	-82.8	-166.8	-31.4	0	0	116.2
20	E	42.9	Very low	50.4	Low	183 Å²	183	154.3 Å²	154.3	86%	0.855	75%	0.746	S	S	*	*	S	Bend	trans	-88.3	-18.7	-177.5	-77.4	-175.6	153.4	0	0	115.8
21	K	43.7	Very low	53	Low	193 Å²	193	152.9 Å²	152.9	84%	0.839	74%	0.738	S	S	*	*	H	α-helix	trans	-82.1	-14.3	-177.3	-90.1	-175.1	176.8	179.3	0	115.9
22	K	46.3	Very low	54.7	Low	183 Å²	183	152.9 Å²	152.9	80%	0.796	73%	0.732	S	S	*	*	H	α-helix	trans	-75.5	-24.7	180	-93.8	-179	176.2	177	0	113.7
23	S	48.7	Very low	57.2	Low	95 Å²	95	147.6 Å²	147.6	66%	0.664	71%	0.707	S	S	*	*	H	α-helix	trans	-73.7	-40.9	-179.2	-172.3	0	0	0	0	112.2	F25 R26 F27	S23-F25 PolarHBondContact O-N 3.14Å; S23-R26 PolarHBondContact O-N 3.42Å; S23-F27 PolarHBondContact O-N 2.78Å
24	S	52.3	Low	59.7	Low	70 Å²	70	144.9 Å²	144.9	49%	0.49	70%	0.698	S	S	.	*	H	α-helix	trans	-65.3	-39.4	-179.6	-174.4	0	0	0	0	112.8	F27 W28	S24-F27 PolarHBondContact O-N 3.43Å; S24-W28 VanDerWaalsContact O-CD1 3.32Å; S24-W28 PolarHBondContact O-N 3.16Å
25	F	65.3	Low	62.1	Low	163 Å²	163	140.4 Å²	140.4	72%	0.715	68%	0.679	S	S	*	*	H	α-helix	trans	-69	-37.5	-178.5	-159.1	-94.9	0	0	0	113.1	S23 F29	S23-F25 PolarHBondContact O-N 3.14Å; F25-F29 WeakPolarHBondContact O-CB 3.3Å; F25-F29 PolarHBondContact O-N 3.41Å
26	R	66.4	Low	64.2	Low	189 Å²	189	134.4 Å²	134.4	71%	0.713	66%	0.66	S	S	*	*	H	α-helix	trans	-64.8	-39.6	175.2	-98.2	-179	168.6	-174.2	-4.1	112.1	S23 F29 H30	S23-R26 PolarHBondContact O-N 3.42Å; R26-F29 PolarHBondContact O-N 3.32Å; R26-H30 PolarHBondContact O-CD2 3.11Å; R26-H30 PolarHBondContact O-N 3.41Å; R26-H30 VanDerWaalsContact O-N 3.07Å
27	F	75.1	Confident	66.6	Low	148 Å²	148	133.3 Å²	133.3	65%	0.649	65%	0.646	S	S	*	*	H	α-helix	trans	-64.1	-46.5	178	-171.3	-95.5	0	0	0	111.9	S23 S24 F29 H30 F31	S23-F27 PolarHBondContact O-N 2.78Å; S24-F27 PolarHBondContact O-N 3.43Å; F27-F29 PolarHBondContact O-N 3.25Å; F27-H30 PolarHBondContact O-N 2.92Å; F27-F31 PolarHBondContact O-N 3.2Å
28	W	71.4	Confident	68.7	Low	163 Å²	163	129.4 Å²	129.4	62%	0.617	63%	0.626	S	S	*	*	H	α-helix	trans	-65.4	-36.6	177.1	-84.3	89.3	0	0	0	112.9	S24 F31 L32	S24-W28 VanDerWaalsContact O-CD1 3.32Å; S24-W28 PolarHBondContact O-N 3.16Å; W28-F31 PolarHBondContact O-N 3.03Å; W28-L32 WeakPolarHBondContact O-CB 3.36Å; W28-L32 PolarHBondContact O-N 3.16Å
29	F	78.1	Confident	70.7	Confident	124 Å²	124	127 Å²	127	54%	0.544	60%	0.604	S	S	.	*	H	α-helix	trans	-64.5	-45.6	175.6	-176.1	-98.6	0	0	0	112.3	F25 R26 F27 F31 L32 V33	F25-F29 WeakPolarHBondContact O-CB 3.3Å; F25-F29 PolarHBondContact O-N 3.41Å; R26-F29 PolarHBondContact O-N 3.32Å; F27-F29 PolarHBondContact O-N 3.25Å; F29-F31 VanDerWaalsContact C-N 3.35Å; F29-F31 PolarHBondContact O-N 2.96Å; F29-L32 PolarHBondContact O-N 3.23Å; F29-V33 HydrophobicContact CD1-CG2 4.41Å; F29-V33 HydrophobicContact CE1-CG2 4.08Å; F29-V33 HydrophobicContact CZ-CG2 4.18Å; F29-V33 WeakPolarHBondContact O-CG2 3.22Å; F29-V33 PolarHBondContact O-N 3.14Å; F29-V33 VanDerWaalsContact O-N 3.1Å
30	H	81.8	Confident	72.7	Confident	115 Å²	115	123.6 Å²	123.6	53%	0.532	59%	0.592	S	S	.	*	H	α-helix	trans	-65	-37.7	176.7	-78	-65.1	0	0	0	112.6	R26 F27 V33 L34	R26-H30 PolarHBondContact O-CD2 3.11Å; R26-H30 PolarHBondContact O-N 3.41Å; R26-H30 VanDerWaalsContact O-N 3.07Å; F27-H30 PolarHBondContact O-N 2.92Å; H30-V33 PolarHBondContact O-N 3.45Å; H30-L34 WeakPolarHBondContact O-CG 3.44Å; H30-L34 PolarHBondContact O-N 2.66Å; H30-L34 VanDerWaalsContact O-N 3.09Å
31	F	86.3	Confident	74.6	Confident	122 Å²	122	122.1 Å²	122.1	54%	0.535	58%	0.579	S	S	.	*	H	α-helix	trans	-63.1	-42.3	175.4	-169	-95	0	0	0	111.9	F27 W28 F29 L34 F35	F27-F31 PolarHBondContact O-N 3.2Å; W28-F31 PolarHBondContact O-N 3.03Å; F29-F31 VanDerWaalsContact C-N 3.35Å; F29-F31 PolarHBondContact O-N 2.96Å; F31-L34 PolarHBondContact O-N 2.91Å; F31-F35 WeakPolarHBondContact O-CB 3.36Å; F31-F35 PolarHBondContact O-N 2.66Å
32	L	81.1	Confident	76.2	Confident	108 Å²	108	117.1 Å²	117.1	57%	0.565	56%	0.562	S	S	*	*	H	α-helix	trans	-67	-39.4	-179.8	-144.6	119.5	0	0	0	112.2	W28 F29 F35 C36	W28-L32 WeakPolarHBondContact O-CB 3.36Å; W28-L32 PolarHBondContact O-N 3.16Å; F29-L32 PolarHBondContact O-N 3.23Å; L32-F35 PolarHBondContact O-N 3.2Å; L32-C36 PolarHBondContact O-N 3.31Å; L32-C36 PolarHBondContact O-SG 3.05Å; L32-C36 VanDerWaalsContact O-SG 3.4Å
33	V	87.4	Confident	77.5	Confident	62 Å²	62	115.4 Å²	115.4	38%	0.376	55%	0.554	S	S	.	*	H	α-helix	trans	-65.5	-44.4	176.4	173	0	0	0	0	111.2	F29 H30 F35 C36 L37	F29-V33 HydrophobicContact CD1-CG2 4.41Å; F29-V33 HydrophobicContact CE1-CG2 4.08Å; F29-V33 HydrophobicContact CZ-CG2 4.18Å; F29-V33 WeakPolarHBondContact O-CG2 3.22Å; F29-V33 PolarHBondContact O-N 3.14Å; F29-V33 VanDerWaalsContact O-N 3.1Å; H30-V33 PolarHBondContact O-N 3.45Å; V33-F35 VanDerWaalsContact C-N 3.33Å; V33-F35 PolarHBondContact O-N 2.56Å; V33-C36 PolarHBondContact O-N 3.12Å; V33-L37 HydrophobicContact CG1-CD1 4.19Å; V33-L37 WeakPolarHBondContact O-CG 3.36Å; V33-L37 PolarHBondContact O-N 3.08Å
34	L	87.7	Confident	78.7	Confident	115 Å²	115	118 Å²	118	60%	0.602	55%	0.551	S	S	*	*	H	α-helix	trans	-64.8	-37.6	177.5	-72.7	168.9	0	0	0	112.1	H30 F31 L37 L38	H30-L34 WeakPolarHBondContact O-CG 3.44Å; H30-L34 PolarHBondContact O-N 2.66Å; H30-L34 VanDerWaalsContact O-N 3.09Å; F31-L34 PolarHBondContact O-N 2.91Å; L34-L37 PolarHBondContact O-N 3.47Å; L34-L38 PolarHBondContact O-N 2.85Å
35	F	86.7	Confident	79.5	Confident	117 Å²	117	117 Å²	117	51%	0.513	54%	0.541	S	S	.	.	H	α-helix	trans	-64.5	-43.2	175.5	-174.4	-106.4	0	0	0	112.3	F31 L32 V33 L37 L38 I39	F31-F35 WeakPolarHBondContact O-CB 3.36Å; F31-F35 PolarHBondContact O-N 2.66Å; L32-F35 PolarHBondContact O-N 3.2Å; V33-F35 VanDerWaalsContact C-N 3.33Å; V33-F35 PolarHBondContact O-N 2.56Å; F35-L37 PolarHBondContact O-N 2.92Å; F35-L38 PolarHBondContact O-N 3.05Å; F35-I39 HydrophobicContact CD1-CD1 3.84Å; F35-I39 HydrophobicContact CE1-CD1 3.4Å; F35-I39 HydrophobicContact CE1-CG1 4.44Å; F35-I39 HydrophobicContact CZ-CD1 3.8Å; F35-I39 WeakPolarHBondContact O-CG1 3.43Å; F35-I39 PolarHBondContact O-N 3.46Å; F35-I39 VanDerWaalsContact O-N 3.08Å
36	C	84.3	Confident	79.5	Confident	63 Å²	63	115.8 Å²	115.8	43%	0.426	54%	0.54	S	S	.	.	H	α-helix	trans	-63.3	-40.2	175.3	-73.9	0	0	0	0	112.7	L32 V33 L38 I39 L40	L32-C36 PolarHBondContact O-N 3.31Å; L32-C36 PolarHBondContact O-SG 3.05Å; L32-C36 VanDerWaalsContact O-SG 3.4Å; V33-C36 PolarHBondContact O-N 3.12Å; C36-L38 VanDerWaalsContact C-N 3.34Å; C36-I39 PolarHBondContact O-N 2.84Å; C36-L40 WeakPolarHBondContact O-CG 3.32Å; C36-L40 PolarHBondContact O-N 2.77Å
37	L	87.9	Confident	78.9	Confident	100 Å²	100	111.3 Å²	111.3	52%	0.524	54%	0.536	S	S	.	.	H	α-helix	trans	-65.9	-36.7	176.5	-71	172	0	0	0	112	V33 L34 F35 L40 Y41	V33-L37 HydrophobicContact CG1-CD1 4.19Å; V33-L37 WeakPolarHBondContact O-CG 3.36Å; V33-L37 PolarHBondContact O-N 3.08Å; L34-L37 PolarHBondContact O-N 3.47Å; F35-L37 PolarHBondContact O-N 2.92Å; L37-L40 PolarHBondContact O-N 3.3Å; L37-Y41 WeakPolarHBondContact O-CB 3.49Å; L37-Y41 PolarHBondContact O-N 2.7Å
38	L	86	Confident	77.8	Confident	103 Å²	103	109 Å²	109	54%	0.539	53%	0.531	S	S	.	.	H	α-helix	trans	-65.2	-41.6	175.5	-155.1	98.7	0	0	0	111.7	L34 F35 C36 Y41 L42	L34-L38 PolarHBondContact O-N 2.85Å; F35-L38 PolarHBondContact O-N 3.05Å; C36-L38 VanDerWaalsContact C-N 3.34Å; L38-Y41 PolarHBondContact O-N 3.01Å; L38-L42 HydrophobicContact CD2-CD1 4.27Å; L38-L42 WeakPolarHBondContact O-CB 3.24Å; L38-L42 VanDerWaalsContact O-CG 3.29Å; L38-L42 WeakPolarHBondContact O-CG 3.43Å; L38-L42 PolarHBondContact O-N 2.91Å
39	I	83.7	Confident	76.7	Confident	64 Å²	64	108.2 Å²	108.2	33%	0.328	54%	0.538	S	S	.	.	H	α-helix	trans	-63.3	-46.3	175.8	-70.3	173.7	0	0	0	110.7	F35 C36 Y41 L42 F43	F35-I39 HydrophobicContact CD1-CD1 3.84Å; F35-I39 HydrophobicContact CE1-CD1 3.4Å; F35-I39 HydrophobicContact CE1-CG1 4.44Å; F35-I39 HydrophobicContact CZ-CD1 3.8Å; F35-I39 WeakPolarHBondContact O-CG1 3.43Å; F35-I39 PolarHBondContact O-N 3.46Å; F35-I39 VanDerWaalsContact O-N 3.08Å; C36-I39 PolarHBondContact O-N 2.84Å; I39-Y41 VanDerWaalsContact C-N 3.31Å; I39-Y41 PolarHBondContact O-N 3.47Å; I39-L42 PolarHBondContact O-N 2.94Å; I39-F43 HydrophobicContact CG2-CD2 3.71Å; I39-F43 HydrophobicContact CG2-CE2 3.83Å; I39-F43 WeakPolarHBondContact O-CD2 3.39Å; I39-F43 PolarHBondContact O-N 3.37Å
40	L	83	Confident	75.2	Confident	115 Å²	115	108 Å²	108	60%	0.602	55%	0.547	S	S	*	.	H	α-helix	trans	-62	-38.8	177.6	-76.5	165.3	0	0	0	112.1	C36 L37 F43 Y44	C36-L40 WeakPolarHBondContact O-CG 3.32Å; C36-L40 PolarHBondContact O-N 2.77Å; L37-L40 PolarHBondContact O-N 3.3Å; L40-F43 PolarHBondContact O-N 2.92Å; L40-Y44 VanDerWaalsContact O-CB 3.3Å; L40-Y44 WeakPolarHBondContact O-CB 3.37Å; L40-Y44 PolarHBondContact O-N 2.9Å
41	Y	84.5	Confident	73.2	Confident	152 Å²	152	111.7 Å²	111.7	60%	0.596	57%	0.565	S	S	*	*	H	α-helix	trans	-65.8	-40.2	174.7	-177.2	-101	0	0	0	112.3	L37 L38 I39 Y44 T45	L37-Y41 WeakPolarHBondContact O-CB 3.49Å; L37-Y41 PolarHBondContact O-N 2.7Å; L38-Y41 PolarHBondContact O-N 3.01Å; I39-Y41 VanDerWaalsContact C-N 3.31Å; I39-Y41 PolarHBondContact O-N 3.47Å; Y41-Y44 PolarHBondContact O-N 3.36Å; Y41-T45 HydrophobicContact CD1-CG2 4.45Å; Y41-T45 HydrophobicContact CE1-CG2 4.06Å; Y41-T45 HydrophobicContact CE2-CG2 4.36Å; Y41-T45 WeakPolarHBondContact O-CG2 3.32Å; Y41-T45 PolarHBondContact O-N 3.03Å; Y41-T45 PolarHBondContact O-OG1 2.75Å
42	L	76.3	Confident	70.8	Confident	89 Å²	89	110.8 Å²	110.8	47%	0.466	57%	0.574	S	S	.	*	H	α-helix	trans	-65.3	-41.4	174.3	-72	167.5	0	0	0	111.7	L38 I39 T45 M46	L38-L42 HydrophobicContact CD2-CD1 4.27Å; L38-L42 WeakPolarHBondContact O-CB 3.24Å; L38-L42 VanDerWaalsContact O-CG 3.29Å; L38-L42 WeakPolarHBondContact O-CG 3.43Å; L38-L42 PolarHBondContact O-N 2.91Å; I39-L42 PolarHBondContact O-N 2.94Å; L42-T45 WeakPolarHBondContact CA-OG1 3.46Å; L42-T45 PolarHBondContact O-N 3.49Å; L42-T45 PolarHBondContact O-OG1 3.08Å; L42-M46 WeakPolarHBondContact O-CB 3.25Å; L42-M46 WeakPolarHBondContact O-CG 3.45Å; L42-M46 PolarHBondContact O-N 2.72Å
43	F	72.9	Confident	68.5	Low	146 Å²	146	113.9 Å²	113.9	64%	0.64	59%	0.59	S	S	*	*	H	α-helix	trans	-64.6	-40.5	173.4	-91.4	-80.3	0	0	0	112.6	I39 L40 M46 C47	I39-F43 HydrophobicContact CG2-CD2 3.71Å; I39-F43 HydrophobicContact CG2-CE2 3.83Å; I39-F43 WeakPolarHBondContact O-CD2 3.39Å; I39-F43 PolarHBondContact O-N 3.37Å; L40-F43 PolarHBondContact O-N 2.92Å; F43-M46 PolarHBondContact O-N 3.31Å; F43-C47 WeakPolarHBondContact O-CB 3.26Å; F43-C47 PolarHBondContact O-N 3.31Å
44	Y	75.9	Confident	65.9	Low	151 Å²	151	122.8 Å²	122.8	59%	0.592	62%	0.617	S	S	*	*	H	α-helix	trans	-64	-41.9	177.8	-178.7	-103.2	0	0	0	112.2	L40 Y41 C47 N48	L40-Y44 VanDerWaalsContact O-CB 3.3Å; L40-Y44 WeakPolarHBondContact O-CB 3.37Å; L40-Y44 PolarHBondContact O-N 2.9Å; Y41-Y44 PolarHBondContact O-N 3.36Å; Y44-C47 PolarHBondContact O-N 3.25Å; Y44-N48 VanDerWaalsContact CE1-ND2 3.33Å; Y44-N48 WeakPolarHBondContact CE1-ND2 3.49Å; Y44-N48 WeakPolarHBondContact O-CB 3.1Å; Y44-N48 PolarHBondContact O-N 3.23Å; Y44-N48 PolarHBondContact OH-ND2 2.84Å
45	T	68.8	Low	63.2	Low	48 Å²	48	127 Å²	127	29%	0.294	63%	0.633	S	S	.	*	H	α-helix	trans	-70	-33.1	176	50.6	0	0	0	0	112.8	Y41 L42 N49	Y41-T45 HydrophobicContact CD1-CG2 4.45Å; Y41-T45 HydrophobicContact CE1-CG2 4.06Å; Y41-T45 HydrophobicContact CE2-CG2 4.36Å; Y41-T45 WeakPolarHBondContact O-CG2 3.32Å; Y41-T45 PolarHBondContact O-N 3.03Å; Y41-T45 PolarHBondContact O-OG1 2.75Å; L42-T45 WeakPolarHBondContact CA-OG1 3.46Å; L42-T45 PolarHBondContact O-N 3.49Å; L42-T45 PolarHBondContact O-OG1 3.08Å; T45-N49 PolarHBondContact O-N 2.85Å
46	M	63.9	Low	60.3	Low	137 Å²	137	124.4 Å²	124.4	68%	0.675	64%	0.64	S	S	*	*	H	α-helix	trans	-72	-36.4	173.7	-69.7	-68.1	144.6	0	0	112.9	L42 F43	L42-M46 WeakPolarHBondContact O-CB 3.25Å; L42-M46 WeakPolarHBondContact O-CG 3.45Å; L42-M46 PolarHBondContact O-N 2.72Å; F43-M46 PolarHBondContact O-N 3.31Å
47	C	54.8	Low	57.7	Low	95 Å²	95	131.7 Å²	131.7	64%	0.642	67%	0.665	S	S	*	*	H	α-helix	trans	-69.4	-38.8	175	-101.1	0	0	0	0	112.6	F43 Y44 N49 T50	F43-C47 WeakPolarHBondContact O-CB 3.26Å; F43-C47 PolarHBondContact O-N 3.31Å; Y44-C47 PolarHBondContact O-N 3.25Å; C47-N49 VanDerWaalsContact C-N 3.3Å; C47-N49 PolarHBondContact O-N 2.91Å; C47-T50 PolarHBondContact O-OG1 3.28Å
48	N	52.7	Low	54.6	Low	100 Å²	100	131.6 Å²	131.6	54%	0.535	67%	0.673	S	S	.	*	H	α-helix	trans	-77.4	-11.9	-177.7	-82.4	-11.9	0	0	0	114.4	Y44	Y44-N48 VanDerWaalsContact CE1-ND2 3.33Å; Y44-N48 WeakPolarHBondContact CE1-ND2 3.49Å; Y44-N48 WeakPolarHBondContact O-CB 3.1Å; Y44-N48 PolarHBondContact O-N 3.23Å; Y44-N48 PolarHBondContact OH-ND2 2.84Å
49	N	47.8	Very low	52	Low	146 Å²	146	135 Å²	135	78%	0.781	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95	15.2	-178.3	-136.1	12.6	0	0	0	114.2	T45 C47	T45-N49 PolarHBondContact O-N 2.85Å; C47-N49 VanDerWaalsContact C-N 3.3Å; C47-N49 PolarHBondContact O-N 2.91Å
50	T	46.8	Very low	49.5	Very low	119 Å²	119	140.2 Å²	140.2	73%	0.73	71%	0.714	S	S	*	*			trans	-114.2	64.7	175.4	50.2	0	0	0	0	111.6	C47	C47-T50 PolarHBondContact O-OG1 3.28Å
51	Q	39.7	Very low	47	Very low	194 Å²	194	143.6 Å²	143.6	91%	0.907	72%	0.723	S	S	*	*			trans	-99.9	79.6	162.8	-121.6	176.3	3.2	0	0	108.5
52	S	34.4	Very low	44.6	Very low	103 Å²	103	141.9 Å²	141.9	72%	0.72	73%	0.729	S	S	*	*			trans	-164.4	127.4	165.4	176.7	0	0	0	0	109.4
53	L	32.9	Very low	42.5	Very low	173 Å²	173	147.3 Å²	147.3	91%	0.906	75%	0.749	S	S	*	*			trans	86.9	68.7	177.1	-59	161.4	0	0	0	116.4
54	R	32.7	Very low	40.2	Very low	249 Å²	249	144.9 Å²	144.9	94%	0.94	75%	0.75	S	S	*	*			trans	-124.8	85.8	155.8	-160.7	-171.3	-155.5	-161.3	7.4	109.2
55	E	31.6	Very low	37.8	Very low	202 Å²	202	149.5 Å²	149.5	94%	0.944	77%	0.767	S	S	*	*			trans	-152.9	130.7	159.5	-67.6	-167.6	165.8	0	0	106.9
56	G	26.8	Very low	35.8	Very low	64 Å²	64	154.8 Å²	154.8	66%	0.66	79%	0.792	S	S	*	*			cis	-174.7	163.3	0.2	0	0	0	0	0	111.3
57	F	28.1	Very low	34.1	Very low	216 Å²	216	157.1 Å²	157.1	95%	0.947	80%	0.799	S	S	*	*			trans	61.4	140.3	155	-75.4	-90.5	0	0	0	119.7
58	S	24.4	Very low	32.8	Very low	97 Å²	97	159.2 Å²	159.2	68%	0.678	81%	0.808	S	S	*	*			cis	-158.7	145.2	10.7	-178.4	0	0	0	0	110.3
59	L	30.9	Very low	31.6	Very low	174 Å²	174	163.2 Å²	163.2	91%	0.911	82%	0.824	S	S	*	*			trans	-73.9	115.8	169.1	-79.6	150.9	0	0	0	110.3
60	Q	30.8	Very low	30.7	Very low	175 Å²	175	162.1 Å²	162.1	82%	0.818	82%	0.823	S	S	*	*			trans	-147.9	132.2	154	-136	175.2	-7.5	0	0	110.5
61	K	30.6	Very low	30	Very low	186 Å²	186	162.4 Å²	162.4	81%	0.809	83%	0.827	S	S	*	*			trans	95.2	53.7	173.7	-52.1	-176.5	-178.8	-179	0	116	F63	K61-F63 PolarHBondContact O-N 2.68Å
62	T	33.3	Very low	29.5	Very low	116 Å²	116	162.4 Å²	162.4	71%	0.712	83%	0.827	S	S	*	*				-33.9	116.1	124.3	26	0	0	0	0	111.5
63	F	32.6	Very low	29.2	Very low	202 Å²	202	160.9 Å²	160.9	89%	0.886	83%	0.827	S	S	*	*			trans	150.4	81.3	148.9	-86.1	-70.3	0	0	0	110.3	K61	K61-F63 PolarHBondContact O-N 2.68Å
64	S	25.8	Very low	29	Very low	96 Å²	96	160.5 Å²	160.5	67%	0.671	83%	0.826	S	S	*	*			trans	-158.2	27.3	155.5	-169.6	0	0	0	0	112.5	L66	S64-L66 PolarHBondContact O-N 2.85Å
65	W	25.6	Very low	28.8	Very low	248 Å²	248	152.6 Å²	152.6	94%	0.939	81%	0.814	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	31.2	-177.4	-71.3	86.1	0	0	0	114.2
66	L	25.5	Very low	28.6	Very low	158 Å²	158	147.3 Å²	147.3	83%	0.827	80%	0.797	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111	9.1	179.7	-96	164	0	0	0	115.2	S64	S64-L66 PolarHBondContact O-N 2.85Å
67	F	28.9	Very low	28.7	Very low	186 Å²	186	150.1 Å²	150.1	82%	0.816	80%	0.804	S	S	*	*	S	Bend	trans	-117.8	102.7	168.6	-70.7	-74.1	0	0	0	111.1	Q69	F67-Q69 PolarHBondContact O-N 3.41Å
68	V	27.4	Very low	29.2	Very low	139 Å²	139	148 Å²	148	84%	0.842	79%	0.791	S	S	*	*			trans	-52.3	111.5	170.9	173.1	0	0	0	0	109.5
69	Q	27.5	Very low	29.5	Very low	185 Å²	185	155 Å²	155	86%	0.864	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-82.5	116.5	164	-76.4	176.6	-24.5	0	0	108.4	F67	F67-Q69 PolarHBondContact O-N 3.41Å
70	T	29.4	Very low	29.9	Very low	123 Å²	123	151.1 Å²	151.1	76%	0.755	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-65	143.3	162.7	41.4	0	0	0	0	110
71	P	31.3	Very low	30.3	Very low	124 Å²	124	149.1 Å²	149.1	81%	0.805	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-70.7	137.9	-174.1	-9.4	25.1	0	0	0	111.8	G73	P71-G73 PolarHBondContact O-N 2.96Å; P71-G73 VanDerWaalsContact O-N 3.08Å
72	Q	29.8	Very low	30.6	Very low	194 Å²	194	146.3 Å²	146.3	91%	0.907	77%	0.769	S	S	*	*			trans	-55.7	109	165.2	-86	172	-47.2	0	0	110.2
73	G	27.3	Very low	30.9	Very low	71 Å²	71	148 Å²	148	73%	0.732	77%	0.767	S	S	*	*			trans	-79.8	120.8	162.2	0	0	0	0	0	109.6	P71 A75	P71-G73 PolarHBondContact O-N 2.96Å; P71-G73 VanDerWaalsContact O-N 3.08Å; G73-A75 PolarHBondContact O-N 2.61Å
74	N	28.3	Very low	31.5	Very low	166 Å²	166	141.5 Å²	141.5	89%	0.888	74%	0.739	S	S	*	*			trans	-62.5	102.2	174.4	-69.8	-34.3	0	0	0	110.6
75	A	29.6	Very low	32.2	Very low	83 Å²	83	145.1 Å²	145.1	69%	0.686	74%	0.738	S	S	*	*			trans	-75.6	143	162.2	0	0	0	0	0	109.7	G73	G73-A75 PolarHBondContact O-N 2.61Å
76	P	27.8	Very low	32.9	Very low	90 Å²	90	139 Å²	139	58%	0.584	72%	0.723	S	S	*	*			trans	-63.8	150.2	-179.3	24.5	-31.7	0	0	0	112.2	Y78	P76-Y78 PolarHBondContact O-N 3Å; P76-Y78 VanDerWaalsContact O-N 3.09Å
77	P	27.9	Very low	33.7	Very low	124 Å²	124	137 Å²	137	81%	0.805	71%	0.711	S	S	*	*			trans	-76.1	101.4	-175.5	30.3	-32.4	0	0	0	110.4	R79	P77-R79 PolarHBondContact O-N 2.04Å
78	Y	37.8	Very low	34.7	Very low	172 Å²	172	131.4 Å²	131.4	68%	0.675	69%	0.689	S	S	*	*			trans	-68.2	111.7	166	-68.9	-85.6	0	0	0	109.1	P76 V80	P76-Y78 PolarHBondContact O-N 3Å; P76-Y78 VanDerWaalsContact O-N 3.09Å; Y78-V80 PolarHBondContact O-N 2.82Å
79	R	31.8	Very low	35.3	Very low	243 Å²	243	129.8 Å²	129.8	92%	0.917	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-66.7	125.5	172.4	-73.4	-172	-177.7	-158.7	1.5	109.8	P77 H81	P77-R79 PolarHBondContact O-N 2.04Å; R79-H81 PolarHBondContact O-N 3.34Å
80	V	38.4	Very low	36	Very low	93 Å²	93	126.3 Å²	126.3	56%	0.564	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-61.1	119.7	172.5	-179.7	0	0	0	0	109.3	Y78 L82 H84 D268	Y78-V80 PolarHBondContact O-N 2.82Å; V80-L82 PolarHBondContact O-N 3Å; V80-H84 HydrophobicContact CG1-CB 4.04Å; V80-D268 WeakPolarHBondContact CG2-O 3.26Å
81	H	40	Very low	36.8	Very low	133 Å²	133	126.5 Å²	126.5	62%	0.616	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-66.8	131.4	178.1	-157.5	-72.8	0	0	0	110.2	R79 K83 H84	R79-H81 PolarHBondContact O-N 3.34Å; H81-K83 PolarHBondContact O-N 2.96Å; H81-H84 WeakPolarHBondContact O-CB 3.35Å; H81-H84 PolarHBondContact O-N 2.72Å
82	L	36.1	Very low	37.3	Very low	127 Å²	127	128.1 Å²	128.1	67%	0.665	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.6	-21.2	-174.8	-166.3	69.6	0	0	0	114.9	V80 H84 R85	V80-L82 PolarHBondContact O-N 3Å; L82-H84 VanDerWaalsContact C-N 3.34Å; L82-H84 PolarHBondContact O-N 3.47Å; L82-R85 PolarHBondContact O-N 2.94Å
83	K	39.5	Very low	37.7	Very low	151 Å²	151	126.9 Å²	126.9	66%	0.657	65%	0.649	S	S	*	*	H	α-helix	trans	-69.2	-25	176	-79.1	-173.8	173	-176.4	0	113.7	H81 R85 L86 M87	H81-K83 PolarHBondContact O-N 2.96Å; K83-R85 VanDerWaalsContact C-N 3.28Å; K83-R85 PolarHBondContact O-N 3.45Å; K83-L86 PolarHBondContact O-N 3.16Å; K83-M87 PolarHBondContact O-N 3.33Å
84	H	45.5	Very low	38.3	Very low	66 Å²	66	132.1 Å²	132.1	31%	0.306	65%	0.652	S	S	.	*	H	α-helix	trans	-63.9	-34.3	173.6	-97	111.6	0	0	0	112.1	V80 H81 L82 L86 L88	V80-H84 HydrophobicContact CG1-CB 4.04Å; H81-H84 WeakPolarHBondContact O-CB 3.35Å; H81-H84 PolarHBondContact O-N 2.72Å; L82-H84 VanDerWaalsContact C-N 3.34Å; L82-H84 PolarHBondContact O-N 3.47Å; H84-L86 PolarHBondContact O-N 2.01Å; H84-L88 WeakPolarHBondContact O-CD1 3.37Å; H84-L88 WeakPolarHBondContact O-CG 3.19Å
85	R	40.8	Very low	38.8	Very low	171 Å²	171	129.9 Å²	129.9	65%	0.645	64%	0.644	S	S	*	*	H	α-helix	trans	-67.4	-35.4	-180	-173	-178.3	-74	-173.9	-4	112.4	L82 K83	L82-R85 PolarHBondContact O-N 2.94Å; K83-R85 VanDerWaalsContact C-N 3.28Å; K83-R85 PolarHBondContact O-N 3.45Å
86	L	40.3	Very low	39	Very low	120 Å²	120	134.9 Å²	134.9	63%	0.628	65%	0.653	S	S	*	*	H	α-helix	trans	-79	-37.3	-174.5	-65.8	171.8	0	0	0	112.5	K83 H84 L88 N89	K83-L86 PolarHBondContact O-N 3.16Å; H84-L86 PolarHBondContact O-N 2.01Å; L86-L88 VanDerWaalsContact C-N 3.33Å; L86-L88 PolarHBondContact O-N 2.94Å; L86-N89 PolarHBondContact O-N 3.41Å
87	M	42.7	Very low	39.8	Very low	115 Å²	115	136.5 Å²	136.5	57%	0.567	66%	0.664	S	S	*	*	H	α-helix	trans	-65.7	-33.6	176	-74.7	-95.1	-163.3	0	0	113	K83 N89 D90	K83-M87 PolarHBondContact O-N 3.33Å; M87-N89 VanDerWaalsContact C-N 3.31Å; M87-N89 PolarHBondContact O-N 3Å; M87-D90 PolarHBondContact O-N 3.39Å
88	L	49.5	Very low	40.1	Very low	70 Å²	70	139.7 Å²	139.7	37%	0.366	67%	0.667	S	S	.	*	H	α-helix	trans	-69.7	-27.1	179.9	-74.7	166.6	0	0	0	113.3	H84 L86	H84-L88 WeakPolarHBondContact O-CD1 3.37Å; H84-L88 WeakPolarHBondContact O-CG 3.19Å; L86-L88 VanDerWaalsContact C-N 3.33Å; L86-L88 PolarHBondContact O-N 2.94Å
89	N	39.7	Very low	40.4	Very low	105 Å²	105	137 Å²	137	56%	0.561	67%	0.671	S	S	*	*	H	α-helix	trans	-74.7	-34.1	178.5	-71.9	-7	0	0	0	111.8	L86 M87 I91 H92 E93	L86-N89 PolarHBondContact O-N 3.41Å; M87-N89 VanDerWaalsContact C-N 3.31Å; M87-N89 PolarHBondContact O-N 3Å; N89-I91 VanDerWaalsContact C-N 3.3Å; N89-I91 PolarHBondContact O-N 3.33Å; N89-H92 PolarHBondContact O-N 2.83Å; N89-H92 VanDerWaalsContact O-N 3.1Å; N89-E93 PolarHBondContact O-N 3.29Å
90	D	42.1	Very low	40.9	Very low	112 Å²	112	130 Å²	130	60%	0.599	67%	0.665	S	S	*	*	H	α-helix	trans	-68.9	-28.8	-178.1	-139.7	-1.4	0	0	0	112.4	M87 H92	M87-D90 PolarHBondContact O-N 3.39Å; D90-H92 VanDerWaalsContact C-N 3.3Å
91	I	46.7	Very low	40.7	Very low	126 Å²	126	133.7 Å²	133.7	65%	0.646	68%	0.676	S	S	*	*	H	α-helix	trans	-72.2	-26	174.4	-60.4	172.2	0	0	0	111.3	N89	N89-I91 VanDerWaalsContact C-N 3.3Å; N89-I91 PolarHBondContact O-N 3.33Å
92	H	42.6	Very low	40.7	Very low	159 Å²	159	137 Å²	137	74%	0.736	69%	0.692	S	S	*	*	H	α-helix	trans	-86.1	-19.5	-175	-141.9	46.1	0	0	0	113.4	N89 D90 K94	N89-H92 PolarHBondContact O-N 2.83Å; N89-H92 VanDerWaalsContact O-N 3.1Å; D90-H92 VanDerWaalsContact C-N 3.3Å; H92-K94 VanDerWaalsContact C-N 3.32Å; H92-K94 PolarHBondContact O-N 3.09Å
93	E	36.8	Very low	41	Very low	167 Å²	167	137.9 Å²	137.9	78%	0.78	69%	0.693	S	S	*	*	S	Bend	trans	-84.2	-4.6	-174.7	-150.9	167.4	-161.3	0	0	113.6	N89	N89-E93 PolarHBondContact O-N 3.29Å
94	K	40.4	Very low	41.2	Very low	182 Å²	182	141.6 Å²	141.6	79%	0.791	70%	0.703	S	S	*	*	S	Bend	trans	-127.3	70.6	178.6	-69.3	-178.8	-177.3	170.7	0	112.5	H92	H92-K94 VanDerWaalsContact C-N 3.32Å; H92-K94 PolarHBondContact O-N 3.09Å
95	T	38.9	Very low	41.3	Very low	119 Å²	119	143.9 Å²	143.9	73%	0.73	72%	0.716	S	S	*	*			trans	-154.9	95	156.2	-30.7	0	0	0	0	111.6
96	E	33.8	Very low	42	Very low	187 Å²	187	141.2 Å²	141.2	87%	0.874	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-91.7	140.7	152	-74.1	-148.6	159.7	0	0	109.3
97	P	44.6	Very low	43.4	Very low	125 Å²	125	138.6 Å²	138.6	81%	0.812	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-87.5	116.5	-175.7	31.7	-30	0	0	0	112.2
98	H	33.7	Very low	44.7	Very low	190 Å²	190	136.3 Å²	136.3	88%	0.88	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-95.6	138.3	161.5	-102.6	-63.1	0	0	0	110.7
99	P	43.7	Very low	46.2	Very low	115 Å²	115	139.4 Å²	139.4	75%	0.747	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-88	142.9	-175.1	32.9	-31.3	0	0	0	113.8
100	A	43.7	Very low	48.3	Very low	97 Å²	97	134.5 Å²	134.5	80%	0.802	67%	0.668	S	S	*	*			trans	65.1	93.3	157.2	0	0	0	0	0	119.2
101	Q	34.3	Very low	50.5	Low	171 Å²	171	130.4 Å²	130.4	80%	0.799	64%	0.644	S	S	*	*				-150.9	119	119.2	-106.9	176.1	7.9	0	0	108.6	Q103	Q101-Q103 PolarHBondContact O-N 3.07Å
102	Q	40.4	Very low	52.3	Low	201 Å²	201	124.5 Å²	124.5	94%	0.939	61%	0.614	S	S	*	*			trans	-72.9	65	170.9	-161.4	162.4	-3.8	0	0	108.4	R104	Q102-R104 PolarHBondContact O-N 3Å
103	Q	41.8	Very low	54.5	Low	146 Å²	146	122 Å²	122	68%	0.682	60%	0.603	S	S	*	*			trans	-54.7	136.3	158.8	-96.7	174.5	-20.9	0	0	106.3	Q101 L105	Q101-Q103 PolarHBondContact O-N 3.07Å; Q103-L105 VanDerWaalsContact C-N 3.32Å; Q103-L105 PolarHBondContact O-N 2.95Å
104	R	43.3	Very low	56.9	Low	229 Å²	229	118.4 Å²	118.4	86%	0.864	59%	0.589	S	S	*	*			trans	-47.6	106.6	164.9	-71.5	179.9	-167.4	-176.9	3.5	105.8	Q102 Q106	Q102-R104 PolarHBondContact O-N 3Å; R104-Q106 PolarHBondContact O-N 3.31Å
105	L	47.7	Very low	59.4	Low	114 Å²	114	112.1 Å²	112.1	60%	0.597	56%	0.56	S	S	*	*			trans	-68.1	87.7	-178.6	-81	145.5	0	0	0	105.9	Q103 Y107	Q103-L105 VanDerWaalsContact C-N 3.32Å; Q103-L105 PolarHBondContact O-N 2.95Å; L105-Y107 HydrophobicContact CB-CD2 4.41Å; L105-Y107 HydrophobicContact CB-CE1 3.93Å; L105-Y107 HydrophobicContact CB-CE2 3.76Å; L105-Y107 VanDerWaalsContact CB-CZ 3.5Å; L105-Y107 HydrophobicContact CD2-CE1 3.99Å; L105-Y107 HydrophobicContact CG-CE1 4.46Å; L105-Y107 VanDerWaalsContact O-CD2 3.27Å; L105-Y107 WeakPolarHBondContact O-CD2 3.16Å; L105-Y107 WeakPolarHBondContact O-CE2 3.35Å; L105-Y107 PolarHBondContact O-N 3.08Å
106	Q	55.6	Low	62.1	Low	115 Å²	115	115.7 Å²	115.7	54%	0.537	56%	0.56	S	S	.	*			trans	-77.8	109	169.3	-64.2	-175.2	-14.8	0	0	105.7	R104 H108 K307	R104-Q106 PolarHBondContact O-N 3.31Å; Q106-H108 WeakPolarHBondContact CB-NE2 3.35Å; Q106-H108 PolarHBondContact O-CD2 2.83Å; Q106-H108 VanDerWaalsContact O-CD2 3.22Å; Q106-H108 PolarHBondContact O-N 2.9Å; Q106-H108 PolarHBondContact OE1-CE1 3.36Å; Q106-H108 PolarHBondContact OE1-NE2 3.32Å; Q106-K307 CarbonylContact C-O 3.58Å; Q106-K307 VanDerWaalsContact CA-O 3.23Å; Q106-K307 WeakPolarHBondContact CA-O 3.07Å
107	Y	69	Low	65.1	Low	66 Å²	66	108.6 Å²	108.6	26%	0.259	53%	0.527	S	S	.	.			trans	-87.9	101	-178.2	-61.6	-74.1	0	0	0	108.2	L105 K307 K310	L105-Y107 HydrophobicContact CB-CD2 4.41Å; L105-Y107 HydrophobicContact CB-CE1 3.93Å; L105-Y107 HydrophobicContact CB-CE2 3.76Å; L105-Y107 VanDerWaalsContact CB-CZ 3.5Å; L105-Y107 HydrophobicContact CD2-CE1 3.99Å; L105-Y107 HydrophobicContact CG-CE1 4.46Å; L105-Y107 VanDerWaalsContact O-CD2 3.27Å; L105-Y107 WeakPolarHBondContact O-CD2 3.16Å; L105-Y107 WeakPolarHBondContact O-CE2 3.35Å; L105-Y107 PolarHBondContact O-N 3.08Å; Y107-K307 PolarHBondContact N-O 2.9Å; Y107-K310 HydrophobicContact CD1-CB 3.74Å; Y107-K310 HydrophobicContact CD1-CD 3.9Å; Y107-K310 HydrophobicContact CD1-CG 3.53Å; Y107-K310 HydrophobicContact CD2-CB 3.77Å; Y107-K310 HydrophobicContact CD2-CG 4.49Å; Y107-K310 HydrophobicContact CE1-CB 3.8Å; Y107-K310 HydrophobicContact CE1-CD 3.47Å; Y107-K310 VanDerWaalsContact CE1-CD 3.47Å; Y107-K310 HydrophobicContact CE1-CG 3.64Å; Y107-K310 HydrophobicContact CE2-CB 3.81Å; Y107-K310 VanDerWaalsContact CG-CA 3.42Å; Y107-K310 HydrophobicContact CG-CB 3.7Å; Y107-K310 HydrophobicContact CG-CG 3.98Å
108	H	71.5	Confident	67.5	Low	66 Å²	66	106.8 Å²	106.8	31%	0.306	51%	0.513	S	S	.	.			trans	-99.1	-7.9	-170.3	-70.8	-71.4	0	0	0	114.2	Q106 A110 Y111 N114	Q106-H108 WeakPolarHBondContact CB-NE2 3.35Å; Q106-H108 PolarHBondContact O-CD2 2.83Å; Q106-H108 VanDerWaalsContact O-CD2 3.22Å; Q106-H108 PolarHBondContact O-N 2.9Å; Q106-H108 PolarHBondContact OE1-CE1 3.36Å; Q106-H108 PolarHBondContact OE1-NE2 3.32Å; H108-A110 VanDerWaalsContact C-N 3.28Å; H108-A110 PolarHBondContact O-N 2.83Å; H108-Y111 AromaticContact ND1-CD1 3.93Å; H108-Y111 WeakPolarHBondContact O-CB 3.31Å; H108-Y111 PolarHBondContact O-N 2.9Å; H108-N114 PolarHBondContact O-ND2 3.42Å
109	E	81.1	Confident	70.5	Confident	135 Å²	135	98.7 Å²	98.7	63%	0.631	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-41.7	-173.3	-67.7	172.4	172.6	0	0	112.8	Y115 P311	E109-Y115 PolarHBondContact O-OH 3.3Å; E109-P311 HydrophobicContact CB-CG 3.92Å
110	A	82.6	Confident	72.9	Confident	2 Å²	2	94.8 Å²	94.8	2%	0.017	45%	0.449	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	4.7	175.1	0	0	0	0	0	114.3	H108 P112 T204 I205 M208 P311	H108-A110 VanDerWaalsContact C-N 3.28Å; H108-A110 PolarHBondContact O-N 2.83Å; A110-P112 WeakPolarHBondContact O-CD 3.47Å; A110-T204 HydrophobicContact CB-CG2 3.92Å; A110-I205 HydrophobicContact CB-CG1 4.11Å; A110-M208 HydrophobicContact CB-CG 4.31Å; A110-M208 WeakPolarHBondContact O-CB 3.29Å; A110-M208 WeakPolarHBondContact O-CG 3.2Å; A110-P311 HydrophobicContact CB-CB 3.49Å; A110-P311 VanDerWaalsContact CB-CB 3.49Å; A110-P311 HydrophobicContact CB-CG 3.88Å
111	Y	88	Confident	75.3	Confident	27 Å²	27	91.5 Å²	91.5	11%	0.106	42%	0.418	C	S	.	.			trans	-69.7	120.3	-179.7	-174.3	-124.8	0	0	0	109.7	H108 H113 N114 V303 K307	H108-Y111 AromaticContact ND1-CD1 3.93Å; H108-Y111 WeakPolarHBondContact O-CB 3.31Å; H108-Y111 PolarHBondContact O-N 2.9Å; Y111-H113 VanDerWaalsContact C-N 3.3Å; Y111-H113 HydrophobicContact CD1-CB 4.04Å; Y111-H113 HydrophobicContact CE1-CB 3.57Å; Y111-H113 AromaticContact CE1-CG 3.84Å; Y111-H113 AromaticContact CE1-ND1 3.8Å; Y111-H113 AromaticContact CZ-CG 3.78Å; Y111-H113 AromaticContact CZ-ND1 3.52Å; Y111-H113 PolarHBondContact O-N 3.31Å; Y111-H113 PolarHBondContact OH-CE1 3.15Å; Y111-H113 PolarHBondContact OH-ND1 2.84Å; Y111-N114 WeakPolarHBondContact O-CB 3.23Å; Y111-N114 PolarHBondContact O-N 2.91Å; Y111-N114 VanDerWaalsContact O-N 3.11Å; Y111-V303 HydrophobicContact CE2-CG1 3.79Å; Y111-K307 HydrophobicContact CD2-CG 3.77Å; Y111-K307 HydrophobicContact CE2-CD 4.16Å; Y111-K307 HydrophobicContact CE2-CG 3.74Å; Y111-K307 HydrophobicContact CG-CG 4.47Å; Y111-K307 WeakPolarHBondContact OH-CE 3.37Å
112	P	84.9	Confident	78.1	Confident	1 Å²	1	85 Å²	85	1%	0.006	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-68	-26.9	-165	22.5	-31.4	0	0	0	113.7	A110 N114 Y115 M208 V209 D212 V303	A110-P112 WeakPolarHBondContact O-CD 3.47Å; P112-N114 PolarHBondContact O-N 3.42Å; P112-N114 VanDerWaalsContact O-N 3.12Å; P112-Y115 WeakPolarHBondContact O-CB 3.47Å; P112-Y115 PolarHBondContact O-N 3.09Å; P112-M208 HydrophobicContact CB-CB 4.42Å; P112-M208 WeakPolarHBondContact CB-O 3.38Å; P112-M208 HydrophobicContact CG-CB 4.35Å; P112-V209 HydrophobicContact CB-CG2 4.35Å; P112-D212 HydrophobicContact CB-CB 3.53Å; P112-D212 HydrophobicContact CG-CB 3.62Å; P112-V303 HydrophobicContact CG-CB 4.45Å; P112-V303 HydrophobicContact CG-CG1 3.77Å; P112-V303 HydrophobicContact CG-CG2 3.94Å
113	H	88.5	Confident	80.6	Confident	107 Å²	107	80.2 Å²	80.2	50%	0.495	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-68.7	-7.9	177.4	-63.5	178.5	0	0	0	114.1	Y111 Y115 D212	Y111-H113 VanDerWaalsContact C-N 3.3Å; Y111-H113 HydrophobicContact CD1-CB 4.04Å; Y111-H113 HydrophobicContact CE1-CB 3.57Å; Y111-H113 AromaticContact CE1-CG 3.84Å; Y111-H113 AromaticContact CE1-ND1 3.8Å; Y111-H113 AromaticContact CZ-CG 3.78Å; Y111-H113 AromaticContact CZ-ND1 3.52Å; Y111-H113 PolarHBondContact O-N 3.31Å; Y111-H113 PolarHBondContact OH-CE1 3.15Å; Y111-H113 PolarHBondContact OH-ND1 2.84Å; H113-Y115 PolarHBondContact O-N 2.94Å; H113-D212 IonicContact CD2-OD1 2.77Å; H113-D212 PolarHBondContact CD2-OD1 2.8Å; H113-D212 IonicContact CD2-OD2 3.26Å; H113-D212 IonicContact NE2-OD1 2.67Å; H113-D212 PolarHBondContact NE2-OD1 2.83Å
114	N	87.8	Confident	83	Confident	91 Å²	91	74.2 Å²	74.2	49%	0.487	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-73	-13.4	167.6	-68.7	-20.4	0	0	0	112.5	H108 Y111 P112	H108-N114 PolarHBondContact O-ND2 3.42Å; Y111-N114 WeakPolarHBondContact O-CB 3.23Å; Y111-N114 PolarHBondContact O-N 2.91Å; Y111-N114 VanDerWaalsContact O-N 3.11Å; P112-N114 PolarHBondContact O-N 3.42Å; P112-N114 VanDerWaalsContact O-N 3.12Å
115	Y	93.6	Very high	85.4	Confident	50 Å²	50	63.4 Å²	63.4	20%	0.196	30%	0.301	C	S	.	.	S	Bend	trans	-115.2	155	-178.6	-51.3	-76.5	0	0	0	110.5	E109 P112 H113 S194 N195 F196 I205 V209	E109-Y115 PolarHBondContact O-OH 3.3Å; P112-Y115 WeakPolarHBondContact O-CB 3.47Å; P112-Y115 PolarHBondContact O-N 3.09Å; H113-Y115 PolarHBondContact O-N 2.94Å; Y115-S194 VanDerWaalsContact CB-OG 3.26Å; Y115-S194 WeakPolarHBondContact CB-OG 3.38Å; Y115-N195 WeakPolarHBondContact CA-OD1 3.21Å; Y115-N195 WeakPolarHBondContact CB-OD1 3.38Å; Y115-F196 HydrophobicContact CD1-CB 3.55Å; Y115-F196 HydrophobicContact CE1-CB 3.54Å; Y115-F196 HydrophobicContact CG-CB 4.14Å; Y115-I205 HydrophobicContact CD2-CG2 3.83Å; Y115-I205 HydrophobicContact CE1-CG2 4.27Å; Y115-I205 HydrophobicContact CE2-CB 4.38Å; Y115-I205 HydrophobicContact CE2-CG1 4.17Å; Y115-I205 HydrophobicContact CE2-CG2 3.35Å; Y115-I205 HydrophobicContact CG-CG2 4.45Å; Y115-I205 VanDerWaalsContact OH-CD1 3.26Å; Y115-I205 WeakPolarHBondContact OH-CD1 3.24Å; Y115-V209 HydrophobicContact CD2-CG2 4.44Å
116	R	95.5	Very high	87.5	Confident	194 Å²	194	63.7 Å²	63.7	73%	0.732	30%	0.297	S	S	*	.			trans	-121.9	135.8	-178.2	-61.7	179.2	-174.9	166.7	1.2	109.2	V118 S194 N195	R116-V118 PolarHBondContact O-N 2.84Å; R116-S194 WeakPolarHBondContact O-CA 3.4Å; R116-S194 PolarHBondContact O-OG 3.13Å; R116-N195 PolarHBondContact N-OD1 3.45Å; R116-N195 PolarHBondContact O-N 2.78Å
117	F	96.4	Very high	89.2	Confident	39 Å²	39	63.4 Å²	63.4	17%	0.171	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	115.1	169.3	-59.9	-72.4	0	0	0	109.3	D120 I192 Q193 V209 W213	F117-D120 HydrophobicContact CB-CB 3.84Å; F117-I192 HydrophobicContact CD1-CG2 3.69Å; F117-I192 HydrophobicContact CE1-CG2 3.79Å; F117-Q193 CarbonylContact C-O 3.5Å; F117-Q193 WeakPolarHBondContact CA-O 3.44Å; F117-V209 HydrophobicContact CE1-CG1 3.62Å; F117-V209 HydrophobicContact CZ-CG1 4.19Å; F117-W213 HydrophobicContact CE1-CB 3.99Å; F117-W213 AromaticContact CE1-CD1 3.7Å; F117-W213 HydrophobicContact CE1-CG 4.25Å; F117-W213 HydrophobicContact CZ-CB 3.79Å; F117-W213 AromaticContact CZ-CD1 3.87Å; F117-W213 HydrophobicContact CZ-CG 4.27Å
118	V	95.1	Very high	90.2	Very high	86 Å²	86	62.7 Å²	62.7	52%	0.521	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	-20.2	172.1	-62.8	0	0	0	0	111.1	R116 Q193 N195	R116-V118 PolarHBondContact O-N 2.84Å; V118-Q193 HydrophobicContact CG2-CB 3.75Å; V118-Q193 HydrophobicContact CG2-CG 3.6Å; V118-Q193 WeakPolarHBondContact CG2-O 3.49Å; V118-Q193 PolarHBondContact N-O 2.65Å; V118-N195 HydrophobicContact CG1-CB 4.05Å
119	M	95.5	Very high	91.2	Very high	20 Å²	20	65 Å²	65	10%	0.099	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	125.9	170.1	-172.3	-179.9	-73.3	0	0	107	L181 Q182 N185 L191 I192 Q193	M119-L181 HydrophobicContact CE-CG 4.41Å; M119-Q182 HydrophobicContact CE-CG 4.3Å; M119-N185 HydrophobicContact CE-CB 3.61Å; M119-N185 HydrophobicContact CG-CB 4.43Å; M119-N185 HydrophobicContact SD-CB 3.38Å; M119-N185 WeakPolarHBondContact SD-CB 3.03Å; M119-L191 HydrophobicContact SD-CB 3.46Å; M119-L191 WeakPolarHBondContact SD-CB 3.44Å; M119-L191 HydrophobicContact SD-CD1 4.04Å; M119-L191 HydrophobicContact SD-CG 4.32Å; M119-I192 CarbonylContact O-C 3.59Å; M119-I192 WeakPolarHBondContact O-CA 3.37Å; M119-Q193 HydrophobicContact CB-CB 3.76Å; M119-Q193 PolarHBondContact N-O 3.07Å; M119-Q193 VanDerWaalsContact N-O 3.16Å; M119-Q193 PolarHBondContact O-N 3.19Å; M119-Q193 VanDerWaalsContact O-O 3.14Å
120	D	94.3	Very high	91.9	Very high	34 Å²	34	58.7 Å²	58.7	18%	0.182	29%	0.288	C	S	.	.			trans	-132.3	-38.6	-155.7	-162.5	-15.1	0	0	0	113.4	F117 P122 W213 R217	F117-D120 HydrophobicContact CB-CB 3.84Å; D120-P122 VanDerWaalsContact C-CD 3.41Å; D120-P122 VanDerWaalsContact C-N 3.33Å; D120-W213 PolarHBondContact O-NE1 3.39Å; D120-W213 PolarHBondContact OD1-NE1 3.37Å; D120-W213 VanDerWaalsContact OD1-NE1 3.16Å; D120-R217 IonicContact OD1-CZ 3.24Å; D120-R217 IonicContact OD1-NH1 3.63Å; D120-R217 PolarHBondContact OD1-NH1 3.07Å; D120-R217 IonicContact OD1-NH2 3.36Å; D120-R217 IonicContact OD2-CZ 3.02Å; D120-R217 IonicContact OD2-NH1 2.73Å; D120-R217 PolarHBondContact OD2-NH1 2.74Å; D120-R217 IonicContact OD2-NH2 3.1Å; D120-R217 PolarHBondContact OD2-NH2 3.38Å
121	N	94.4	Very high	92.7	Very high	27 Å²	27	60 Å²	60	14%	0.144	29%	0.294	C	S	.	.			trans	45.2	46.5	177.5	-64.2	-19.5	0	0	0	114.7	E123 V124 N185 L191	N121-E123 PolarHBondContact O-N 3.46Å; N121-E123 VanDerWaalsContact O-N 3.13Å; N121-V124 HydrophobicContact CB-CG2 3.83Å; N121-V124 WeakPolarHBondContact O-CG2 3.45Å; N121-V124 PolarHBondContact O-N 3.12Å; N121-N185 PolarHBondContact ND2-OD1 2.79Å; N121-N185 PolarHBondContact OD1-ND2 3.03Å; N121-L191 PolarHBondContact ND2-N 3.36Å; N121-L191 PolarHBondContact ND2-O 2.86Å
122	P	92.4	Very high	93.2	Very high	34 Å²	34	58.7 Å²	58.7	22%	0.221	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-28.7	-173	22.2	-32.5	0	0	0	114.2	D120 V124	D120-P122 VanDerWaalsContact C-CD 3.41Å; D120-P122 VanDerWaalsContact C-N 3.33Å; P122-V124 PolarHBondContact O-N 3.31Å
123	E	92.8	Very high	93.9	Very high	102 Å²	102	58.6 Å²	58.6	48%	0.477	29%	0.288	S	S	.	.	H	α-helix	trans	-70.7	-21	-175.3	-58.4	-51.2	121.1	0	0	112.4	N121 C125 K126 V127	N121-E123 PolarHBondContact O-N 3.46Å; N121-E123 VanDerWaalsContact O-N 3.13Å; E123-C125 VanDerWaalsContact C-N 3.31Å; E123-C125 PolarHBondContact O-N 3.32Å; E123-K126 PolarHBondContact O-N 2.9Å; E123-K126 IonicContact OE1-NZ 3.35Å; E123-K126 PolarHBondContact OE1-NZ 3.36Å; E123-K126 IonicContact OE2-NZ 3.46Å; E123-V127 WeakPolarHBondContact O-CB 3.41Å; E123-V127 WeakPolarHBondContact O-CG2 3.01Å; E123-V127 PolarHBondContact O-N 3.22Å
124	V	93.7	Very high	94.4	Very high	19 Å²	19	53.5 Å²	53.5	12%	0.115	27%	0.265	C	S	.	.	H	α-helix	trans	-60.9	-41.3	-176.8	-175.4	0	0	0	0	111	N121 P122 N128 L165 L167 N189	N121-V124 HydrophobicContact CB-CG2 3.83Å; N121-V124 WeakPolarHBondContact O-CG2 3.45Å; N121-V124 PolarHBondContact O-N 3.12Å; P122-V124 PolarHBondContact O-N 3.31Å; V124-N128 WeakPolarHBondContact O-CB 3.25Å; V124-N128 PolarHBondContact O-N 3.2Å; V124-N128 PolarHBondContact O-ND2 2.72Å; V124-L165 HydrophobicContact CG1-CD1 3.53Å; V124-L165 HydrophobicContact CG1-CD2 3.71Å; V124-L165 HydrophobicContact CG1-CG 4.22Å; V124-L167 HydrophobicContact CG1-CD2 4.21Å; V124-N189 WeakPolarHBondContact CG2-O 3.09Å
125	C	93.8	Very high	94.9	Very high	3 Å²	3	49.2 Å²	49.2	2%	0.02	24%	0.241	C	C	.	.	H	α-helix	trans	-77.2	-38.2	176.8	-176.9	0	0	0	0	113	E123 V127 N128 L129 W213 C218	E123-C125 VanDerWaalsContact C-N 3.31Å; E123-C125 PolarHBondContact O-N 3.32Å; C125-V127 VanDerWaalsContact C-N 3.31Å; C125-V127 PolarHBondContact O-N 3.22Å; C125-N128 PolarHBondContact O-N 2.93Å; C125-L129 PolarHBondContact O-N 3.13Å; C125-W213 HydrophobicContact CB-CH2 4.01Å; C125-W213 HydrophobicContact CB-CZ3 4.49Å; C125-C218 HydrophobicContact CB-CB 3.52Å; C125-C218 WeakPolarHBondContact CB-SG 3.04Å; C125-C218 WeakPolarHBondContact SG-CA 3.23Å; C125-C218 WeakPolarHBondContact SG-CB 3.5Å; C125-C218 CovalentContact SG-SG 2.01Å; C125-C218 PolarHBondContact SG-SG 2.94Å
126	K	91	Very high	95.1	Very high	119 Å²	119	46.8 Å²	46.8	52%	0.517	23%	0.232	S	C	.	.	H	α-helix	trans	-62.2	-38.7	-179.8	-64.6	-179.8	-169	162.6	0	112.7	E123	E123-K126 PolarHBondContact O-N 2.9Å; E123-K126 IonicContact OE1-NZ 3.35Å; E123-K126 PolarHBondContact OE1-NZ 3.36Å; E123-K126 IonicContact OE2-NZ 3.46Å
127	V	90.5	Very high	95.3	Very high	109 Å²	109	38 Å²	38	66%	0.661	20%	0.2	S	C	*	.	H	α-helix	trans	-76.8	-42.1	-179.4	173.5	0	0	0	0	111.5	E123 C125	E123-V127 WeakPolarHBondContact O-CB 3.41Å; E123-V127 WeakPolarHBondContact O-CG2 3.01Å; E123-V127 PolarHBondContact O-N 3.22Å; C125-V127 VanDerWaalsContact C-N 3.31Å; C125-V127 PolarHBondContact O-N 3.22Å
128	N	90.6	Very high	95.3	Very high	51 Å²	51	36.3 Å²	36.3	27%	0.273	19%	0.193	S	C	.	.	H	α-helix	trans	-85.9	-23.7	-172.5	-69.3	-79.9	0	0	0	113.9	V124 C125 T163	V124-N128 WeakPolarHBondContact O-CB 3.25Å; V124-N128 PolarHBondContact O-N 3.2Å; V124-N128 PolarHBondContact O-ND2 2.72Å; C125-N128 PolarHBondContact O-N 2.93Å; N128-T163 HydrophobicContact CB-CG2 4.38Å
129	L	92.3	Very high	95.3	Very high	115 Å²	115	33.8 Å²	33.8	60%	0.602	18%	0.181	S	C	*	.			trans	43.8	58.9	-176.1	-60.9	175.9	0	0	0	112.6	C125 A220	C125-L129 PolarHBondContact O-N 3.13Å; L129-A220 HydrophobicContact CD2-CB 4.42Å
130	P	97.1	Very high	95.3	Very high	2 Å²	2	33 Å²	33	1%	0.013	18%	0.177	C	C	.	.			trans	-68.6	144	-169.3	28.6	-34.5	0	0	0	112.4	V133 T163 L165 A221	P130-V133 HydrophobicContact CB-CG2 4.15Å; P130-V133 HydrophobicContact CG-CG2 3.54Å; P130-T163 HydrophobicContact CB-CG2 4.23Å; P130-L165 HydrophobicContact CB-CB 3.91Å; P130-L165 HydrophobicContact CG-CB 4.18Å; P130-L165 HydrophobicContact CG-CD2 4.29Å; P130-A221 HydrophobicContact CG-CB 4.3Å; P130-A221 WeakPolarHBondContact O-CA 3.27Å; P130-A221 WeakPolarHBondContact O-CB 3.31Å
131	F	98.5	Very high	95.3	Very high	29 Å²	29	38.7 Å²	38.7	13%	0.127	20%	0.201	C	C	.	.	S	Bend	trans	-68.3	-42.6	165.5	168.3	-102.1	0	0	0	110.8	E162 T163 A222 Y223 V239 L242 K243	F131-E162 HydrophobicContact CB-CB 3.81Å; F131-E162 HydrophobicContact CB-CG 4.32Å; F131-E162 HydrophobicContact CD1-CB 3.74Å; F131-E162 HydrophobicContact CD1-CG 3.82Å; F131-E162 HydrophobicContact CD2-CG 4.44Å; F131-E162 HydrophobicContact CE1-CG 4.23Å; F131-E162 HydrophobicContact CG-CB 3.88Å; F131-E162 HydrophobicContact CG-CG 3.94Å; F131-T163 PolarHBondContact N-O 3.36Å; F131-A222 HydrophobicContact CD2-CB 3.83Å; F131-A222 HydrophobicContact CE2-CB 3.98Å; F131-A222 WeakPolarHBondContact O-CB 3.37Å; F131-A222 PolarHBondContact O-N 2.86Å; F131-A222 VanDerWaalsContact O-N 3.12Å; F131-Y223 HydrophobicContact CE1-CD2 4.1Å; F131-Y223 AromaticContact CE2-CD2 3.83Å; F131-Y223 HydrophobicContact CE2-CD2 3.83Å; F131-Y223 AromaticContact CE2-CE2 3.8Å; F131-Y223 HydrophobicContact CE2-CE2 3.8Å; F131-Y223 AromaticContact CZ-CD2 3.55Å; F131-Y223 HydrophobicContact CZ-CD2 3.55Å; F131-Y223 AromaticContact CZ-CE2 3.62Å; F131-Y223 HydrophobicContact CZ-CE2 3.62Å; F131-Y223 PolarHBondContact O-N 3.29Å; F131-V239 HydrophobicContact CE1-CG1 4.16Å; F131-L242 HydrophobicContact CE1-CB 4.11Å; F131-L242 HydrophobicContact CE1-CD1 4.19Å; F131-L242 HydrophobicContact CZ-CB 3.92Å; F131-K243 HydrophobicContact CZ-CG 4.26Å
132	L	98.8	Very high	95.4	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	132.5	-177.5	174.4	64.7	0	0	0	110.9	L134 T163 V164 L165 Y223 M225 L238 V239 L242	L132-L134 HydrophobicContact CD1-CD2 4.34Å; L132-L134 HydrophobicContact CD2-CD2 3.87Å; L132-L134 HydrophobicContact CG-CD2 4.02Å; L132-T163 PolarHBondContact N-O 3.48Å; L132-V164 HydrophobicContact CB-CG1 4.43Å; L132-V164 HydrophobicContact CB-CG2 4.32Å; L132-V164 HydrophobicContact CD2-CG1 4.21Å; L132-V164 HydrophobicContact CD2-CG2 4.46Å; L132-V164 HydrophobicContact CG-CG1 4.33Å; L132-V164 WeakPolarHBondContact O-CA 3.11Å; L132-L165 PolarHBondContact O-N 3.48Å; L132-Y223 WeakPolarHBondContact CA-O 3.36Å; L132-M225 HydrophobicContact CD1-CB 4.43Å; L132-L238 HydrophobicContact CD2-CD2 3.67Å; L132-L238 HydrophobicContact CD2-CG 4.06Å; L132-V239 HydrophobicContact CD2-CG2 4.17Å; L132-L242 HydrophobicContact CD1-CD1 4.2Å; L132-L242 HydrophobicContact CD2-CD1 4.43Å
133	V	98.6	Very high	95.5	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	121.4	170.9	-170.5	0	0	0	0	110.4	P130 M135 L165 L167 L214 C218 A221 Y223 A224 M225	P130-V133 HydrophobicContact CB-CG2 4.15Å; P130-V133 HydrophobicContact CG-CG2 3.54Å; V133-M135 HydrophobicContact CG1-CG 4.13Å; V133-M135 HydrophobicContact CG1-SD 3.67Å; V133-L165 CarbonylContact C-O 3.58Å; V133-L165 WeakPolarHBondContact CA-O 3.4Å; V133-L167 HydrophobicContact CG1-CD1 3.94Å; V133-L214 HydrophobicContact CB-CD2 4.11Å; V133-L214 HydrophobicContact CG1-CD2 4.06Å; V133-L214 HydrophobicContact CG2-CD2 4.45Å; V133-C218 VanDerWaalsContact CG2-SG 3.57Å; V133-A221 HydrophobicContact CG2-CB 3.8Å; V133-Y223 PolarHBondContact N-O 3.46Å; V133-Y223 VanDerWaalsContact N-O 3.09Å; V133-A224 HydrophobicContact CB-CB 4.34Å; V133-A224 CarbonylContact O-C 3.38Å; V133-A224 WeakPolarHBondContact O-CA 3.5Å; V133-M225 PolarHBondContact O-N 3.06Å
134	L	98.9	Very high	95.8	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	111.7	173.1	-54.6	177.8	0	0	0	108.7	L132 W153 V164 L165 T166 L167 M225 L233 V235 L238	L132-L134 HydrophobicContact CD1-CD2 4.34Å; L132-L134 HydrophobicContact CD2-CD2 3.87Å; L132-L134 HydrophobicContact CG-CD2 4.02Å; L134-W153 HydrophobicContact CD1-CE3 4.12Å; L134-W153 HydrophobicContact CD1-CZ3 3.95Å; L134-V164 HydrophobicContact CD1-CG1 3.91Å; L134-V164 HydrophobicContact CG-CG1 4.01Å; L134-L165 PolarHBondContact N-O 3.47Å; L134-T166 HydrophobicContact CB-CG2 4.38Å; L134-L167 PolarHBondContact O-N 2.68Å; L134-M225 HydrophobicContact CD2-CB 3.83Å; L134-M225 HydrophobicContact CD2-CG 4.44Å; L134-M225 HydrophobicContact CD2-SD 4.14Å; L134-L233 HydrophobicContact CD1-CD2 3.78Å; L134-L233 HydrophobicContact CD2-CD2 3.89Å; L134-L233 HydrophobicContact CG-CD2 4.45Å; L134-V235 HydrophobicContact CD1-CG2 4.13Å; L134-L238 HydrophobicContact CD2-CD2 4.22Å
135	M	98.8	Very high	96	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	111.1	179.6	-60.8	-67.2	-81	0	0	108.9	V133 P137 L167 V169 I192 I210 W213 L214 M225 K226 V227	V133-M135 HydrophobicContact CG1-CG 4.13Å; V133-M135 HydrophobicContact CG1-SD 3.67Å; M135-P137 WeakPolarHBondContact O-CD 3.47Å; M135-L167 HydrophobicContact SD-CB 4.04Å; M135-L167 HydrophobicContact SD-CD1 4.05Å; M135-V169 HydrophobicContact CE-CG2 3.72Å; M135-I192 HydrophobicContact CE-CD1 4.03Å; M135-I210 HydrophobicContact CB-CD1 4.34Å; M135-I210 HydrophobicContact CB-CG1 4.45Å; M135-I210 HydrophobicContact CB-CG2 3.67Å; M135-I210 HydrophobicContact CE-CB 4.27Å; M135-I210 HydrophobicContact CE-CG1 4.3Å; M135-I210 HydrophobicContact CE-CG2 3.81Å; M135-I210 HydrophobicContact CG-CG2 3.77Å; M135-W213 HydrophobicContact CE-CB 4.46Å; M135-W213 HydrophobicContact CE-CD2 4.46Å; M135-W213 HydrophobicContact CE-CE3 3.94Å; M135-W213 HydrophobicContact SD-CE3 4.46Å; M135-L214 HydrophobicContact CE-CD2 4.4Å; M135-L214 HydrophobicContact CE-CG 4.18Å; M135-L214 HydrophobicContact CG-CD1 4.07Å; M135-L214 HydrophobicContact CG-CD2 4.1Å; M135-L214 HydrophobicContact CG-CG 4.25Å; M135-L214 HydrophobicContact SD-CD2 4.06Å; M135-L214 HydrophobicContact SD-CG 4.4Å; M135-M225 PolarHBondContact N-O 3.36Å; M135-K226 WeakPolarHBondContact O-CA 3.44Å; M135-V227 PolarHBondContact O-N 2.85Å; M135-V227 VanDerWaalsContact O-N 3.09Å
136	V	98.8	Very high	96.2	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	95.9	-173.1	-171.3	0	0	0	0	109.9	V138 I149 W153 T166 L167 F168 V169 V227	V136-V138 PolarHBondContact O-N 3.09Å; V136-I149 HydrophobicContact CG1-CD1 3.78Å; V136-W153 HydrophobicContact CG2-CH2 3.71Å; V136-W153 HydrophobicContact CG2-CZ3 4.24Å; V136-T166 HydrophobicContact CG2-CG2 3.96Å; V136-L167 PolarHBondContact N-O 2.95Å; V136-F168 HydrophobicContact CB-CD1 3.71Å; V136-F168 HydrophobicContact CB-CE1 4.07Å; V136-F168 HydrophobicContact CG1-CD1 3.9Å; V136-F168 HydrophobicContact CG1-CE1 4.05Å; V136-F168 HydrophobicContact CG2-CD1 4.33Å; V136-F168 HydrophobicContact CG2-CE1 4.28Å; V136-F168 WeakPolarHBondContact O-CA 3.49Å; V136-V169 PolarHBondContact O-N 3.44Å; V136-V227 WeakPolarHBondContact CA-O 3.42Å; V136-V227 HydrophobicContact CG2-CG1 3.96Å
137	P	98.4	Very high	96.6	Very high	10 Å²	10	39.5 Å²	39.5	7%	0.065	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	121.3	170.9	24.6	-31	0	0	0	110.2	M135 V169 K206 I210 K226 V227	M135-P137 WeakPolarHBondContact O-CD 3.47Å; P137-V169 WeakPolarHBondContact CA-O 3.5Å; P137-K206 HydrophobicContact CB-CD 3.31Å; P137-K206 HydrophobicContact CB-CG 4.07Å; P137-I210 HydrophobicContact CB-CD1 4.21Å; P137-I210 HydrophobicContact CG-CD1 4.27Å; P137-K226 HydrophobicContact CG-CD 4.3Å; P137-K226 HydrophobicContact CG-CG 4.14Å; P137-V227 WeakPolarHBondContact CD-O 3.41Å
138	V	97.4	Very high	97	Very high	3 Å²	3	34.6 Å²	34.6	2%	0.018	18%	0.184	C	C	.	.			trans	-143.2	149.5	-177.1	63.9	0	0	0	0	109.6	V136 D142 A145 R146 F168 V169 L170 K206	V136-V138 PolarHBondContact O-N 3.09Å; V138-D142 HydrophobicContact CG2-CB 3.9Å; V138-A145 HydrophobicContact CG2-CB 4.31Å; V138-R146 HydrophobicContact CB-CG 4.46Å; V138-R146 HydrophobicContact CG1-CG 3.76Å; V138-R146 HydrophobicContact CG2-CG 4.01Å; V138-F168 HydrophobicContact CG1-CB 3.9Å; V138-F168 HydrophobicContact CG1-CD1 3.97Å; V138-F168 HydrophobicContact CG1-CG 4.33Å; V138-V169 PolarHBondContact N-O 3.48Å; V138-V169 VanDerWaalsContact N-O 3.09Å; V138-L170 HydrophobicContact CG1-CD2 4.15Å; V138-L170 HydrophobicContact CG1-CG 4.19Å; V138-K206 PolarHBondContact O-NZ 3.33Å
139	A	95.6	Very high	97.4	Very high	32 Å²	32	32.2 Å²	32.2	26%	0.264	17%	0.171	S	C	.	.			trans	-74.5	143.6	177.7	0	0	0	0	0	110.4	K141 D142 R146	A139-K141 VanDerWaalsContact C-N 3.27Å; A139-K141 HydrophobicContact CB-CG 4.26Å; A139-K141 PolarHBondContact O-N 3.37Å; A139-K141 VanDerWaalsContact O-N 3.15Å; A139-D142 HydrophobicContact CB-CB 4.35Å; A139-D142 PolarHBondContact O-N 3.02Å; A139-R146 PolarHBondContact O-NH1 3.15Å
140	P	95.3	Very high	97.7	Very high	3 Å²	3	28.4 Å²	28.4	2%	0.019	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.8	-44.1	176.8	-34.1	36.9	0	0	0	115	D142 R146 L170 G171 I176 D198	P140-D142 PolarHBondContact O-N 3.46Å; P140-R146 PolarHBondContact O-NH1 3.35Å; P140-R146 PolarHBondContact O-NH2 3.06Å; P140-L170 HydrophobicContact CB-CD2 4.33Å; P140-L170 HydrophobicContact CG-CB 4.23Å; P140-L170 HydrophobicContact CG-CD2 4.24Å; P140-G171 WeakPolarHBondContact CG-O 3.41Å; P140-I176 HydrophobicContact CB-CD1 3.93Å; P140-I176 HydrophobicContact CB-CG1 3.73Å; P140-I176 HydrophobicContact CB-CG2 4.48Å; P140-D198 VanDerWaalsContact CD-OD2 3.29Å; P140-D198 WeakPolarHBondContact CD-OD2 3.47Å
141	K	94.3	Very high	97.7	Very high	155 Å²	155	31.1 Å²	31.1	67%	0.674	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-17.5	179.5	59.2	-177.4	-175.5	176.3	0	114.6	A139 V143 I176	A139-K141 VanDerWaalsContact C-N 3.27Å; A139-K141 HydrophobicContact CB-CG 4.26Å; A139-K141 PolarHBondContact O-N 3.37Å; A139-K141 VanDerWaalsContact O-N 3.15Å; K141-V143 PolarHBondContact O-N 2.85Å; K141-I176 HydrophobicContact CB-CD1 3.64Å
142	D	95.5	Very high	97.7	Very high	56 Å²	56	29.9 Å²	29.9	30%	0.299	17%	0.166	S	C	.	.			trans	-88.7	62.8	-172.5	-158.8	-11.7	0	0	0	111.1	V138 A139 P140 L144 A145 R146	V138-D142 HydrophobicContact CG2-CB 3.9Å; A139-D142 HydrophobicContact CB-CB 4.35Å; A139-D142 PolarHBondContact O-N 3.02Å; P140-D142 PolarHBondContact O-N 3.46Å; D142-L144 VanDerWaalsContact C-N 3.27Å; D142-A145 HydrophobicContact CB-CB 4.38Å; D142-A145 VanDerWaalsContact CG-CB 3.41Å; D142-A145 WeakPolarHBondContact OD1-CB 3.35Å; D142-A145 PolarHBondContact OD1-N 3.01Å; D142-R146 VanDerWaalsContact C-NH1 3.31Å; D142-R146 PolarHBondContact O-N 3.21Å; D142-R146 PolarHBondContact O-NH1 3.33Å
143	V	95.9	Very high	97.7	Very high	62 Å²	62	30.3 Å²	30.3	38%	0.376	17%	0.167	S	C	.	.	H	α-helix	trans	-63	-39.2	177.1	-176	0	0	0	0	109.7	K141 A145 R146 D147	K141-V143 PolarHBondContact O-N 2.85Å; V143-A145 PolarHBondContact O-N 3.24Å; V143-R146 PolarHBondContact O-N 2.89Å; V143-R146 VanDerWaalsContact O-N 3.13Å; V143-D147 PolarHBondContact O-N 3.39Å
144	L	97.3	Very high	97.7	Very high	133 Å²	133	31 Å²	31	70%	0.696	18%	0.175	S	C	*	.	H	α-helix	trans	-60.3	-41.8	-179.9	-66.4	177.5	0	0	0	112.6	D142 A148	D142-L144 VanDerWaalsContact C-N 3.27Å; L144-A148 VanDerWaalsContact O-CB 3.27Å; L144-A148 WeakPolarHBondContact O-CB 3.46Å; L144-A148 PolarHBondContact O-N 2.8Å
145	A	98.4	Very high	97.6	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.008	20%	0.204	C	C	.	.	H	α-helix	trans	-65	-42.1	174.7	0	0	0	0	0	112.3	V138 D142 V143 A148 I149 S362	V138-A145 HydrophobicContact CG2-CB 4.31Å; D142-A145 HydrophobicContact CB-CB 4.38Å; D142-A145 VanDerWaalsContact CG-CB 3.41Å; D142-A145 WeakPolarHBondContact OD1-CB 3.35Å; D142-A145 PolarHBondContact OD1-N 3.01Å; V143-A145 PolarHBondContact O-N 3.24Å; A145-A148 PolarHBondContact O-N 3.25Å; A145-I149 VanDerWaalsContact O-CG1 3.27Å; A145-I149 WeakPolarHBondContact O-CG1 3.2Å; A145-I149 PolarHBondContact O-N 3.42Å; A145-S362 WeakPolarHBondContact CA-OG 3.47Å
146	R	98.4	Very high	97.3	Very high	1 Å²	1	41 Å²	41	0%	0.004	22%	0.222	C	C	.	.	H	α-helix	trans	-61.6	-47.3	176.8	-64.7	-167.6	-66.8	-82.7	13.1	111.6	V138 A139 P140 D142 V143 A148 I149 R150 F168 E184	V138-R146 HydrophobicContact CB-CG 4.46Å; V138-R146 HydrophobicContact CG1-CG 3.76Å; V138-R146 HydrophobicContact CG2-CG 4.01Å; A139-R146 PolarHBondContact O-NH1 3.15Å; P140-R146 PolarHBondContact O-NH1 3.35Å; P140-R146 PolarHBondContact O-NH2 3.06Å; D142-R146 VanDerWaalsContact C-NH1 3.31Å; D142-R146 PolarHBondContact O-N 3.21Å; D142-R146 PolarHBondContact O-NH1 3.33Å; V143-R146 PolarHBondContact O-N 2.89Å; V143-R146 VanDerWaalsContact O-N 3.13Å; R146-A148 PolarHBondContact O-N 3.38Å; R146-I149 PolarHBondContact O-N 2.78Å; R146-R150 WeakPolarHBondContact O-CG 3.36Å; R146-R150 PolarHBondContact O-N 2.92Å; R146-F168 HydrophobicContact CB-CD1 4.27Å; R146-F168 HydrophobicContact CB-CE1 4.04Å; R146-F168 HydrophobicContact CB-CE2 4.29Å; R146-F168 HydrophobicContact CB-CG 4.49Å; R146-F168 HydrophobicContact CB-CZ 4.05Å; R146-F168 HydrophobicContact CG-CB 4.49Å; R146-F168 HydrophobicContact CG-CD1 3.68Å; R146-F168 HydrophobicContact CG-CD2 4.37Å; R146-F168 HydrophobicContact CG-CE1 3.92Å; R146-F168 HydrophobicContact CG-CG 3.92Å; R146-F168 HydrophobicContact CG-CZ 4.36Å; R146-E184 IonicContact CZ-OE1 3.38Å; R146-E184 IonicContact CZ-OE2 3.57Å; R146-E184 IonicContact NE-OE1 3.76Å; R146-E184 PolarHBondContact NE-OE1 3.4Å; R146-E184 IonicContact NE-OE2 2.72Å; R146-E184 PolarHBondContact NE-OE2 2.99Å; R146-E184 IonicContact NH2-OE1 2.63Å; R146-E184 IonicContact NH2-OE2 3.59Å; R146-E184 PolarHBondContact NH2-OE2 3.35Å
147	D	98.6	Very high	97.2	Very high	67 Å²	67	47.6 Å²	47.6	36%	0.358	25%	0.247	S	C	.	.	H	α-helix	trans	-65.8	-39.2	179.6	-69.9	-14.2	0	0	0	112.3	V143 I149 R150 A151	V143-D147 PolarHBondContact O-N 3.39Å; D147-I149 VanDerWaalsContact C-N 3.33Å; D147-I149 PolarHBondContact O-N 3.38Å; D147-R150 PolarHBondContact O-N 3.5Å; D147-R150 IonicContact OD1-NH1 3.3Å; D147-R150 PolarHBondContact OD1-NH1 3.32Å; D147-A151 VanDerWaalsContact O-CB 3.31Å; D147-A151 WeakPolarHBondContact O-CB 3.48Å; D147-A151 PolarHBondContact O-N 3.47Å
148	A	98.8	Very high	97.2	Very high	7 Å²	7	51.9 Å²	51.9	6%	0.058	27%	0.272	C	S	.	.	H	α-helix	trans	-61.6	-42.5	174.8	0	0	0	0	0	111.6	L144 A145 R146 A151 T152 L365 I366	L144-A148 VanDerWaalsContact O-CB 3.27Å; L144-A148 WeakPolarHBondContact O-CB 3.46Å; L144-A148 PolarHBondContact O-N 2.8Å; A145-A148 PolarHBondContact O-N 3.25Å; R146-A148 PolarHBondContact O-N 3.38Å; A148-A151 PolarHBondContact O-N 3.22Å; A148-T152 WeakPolarHBondContact O-CB 3.37Å; A148-T152 VanDerWaalsContact O-CG2 3.27Å; A148-T152 WeakPolarHBondContact O-CG2 3.48Å; A148-T152 PolarHBondContact O-N 2.74Å; A148-T152 PolarHBondContact O-OG1 3.33Å; A148-L365 HydrophobicContact CB-CD2 4.19Å; A148-I366 HydrophobicContact CB-CD1 3.8Å; A148-I366 HydrophobicContact CB-CG1 4.07Å
149	I	98.9	Very high	97.2	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-65.2	-45.4	176.5	-69.5	169.2	0	0	0	110.9	V136 A145 R146 D147 A151 T152 W153 G154 T166 F168 L365	V136-I149 HydrophobicContact CG1-CD1 3.78Å; A145-I149 VanDerWaalsContact O-CG1 3.27Å; A145-I149 WeakPolarHBondContact O-CG1 3.2Å; A145-I149 PolarHBondContact O-N 3.42Å; R146-I149 PolarHBondContact O-N 2.78Å; D147-I149 VanDerWaalsContact C-N 3.33Å; D147-I149 PolarHBondContact O-N 3.38Å; I149-A151 PolarHBondContact O-N 3.31Å; I149-T152 CarbonylContact O-C 3.51Å; I149-T152 PolarHBondContact O-N 3.45Å; I149-T152 VanDerWaalsContact O-N 3.07Å; I149-W153 HydrophobicContact CB-CH2 4.39Å; I149-W153 HydrophobicContact CB-CZ2 4.16Å; I149-W153 HydrophobicContact CD1-CH2 3.92Å; I149-W153 HydrophobicContact CD1-CZ2 3.54Å; I149-W153 HydrophobicContact CG1-CH2 4.08Å; I149-W153 HydrophobicContact CG1-CZ2 3.47Å; I149-W153 VanDerWaalsContact CG1-CZ2 3.47Å; I149-W153 HydrophobicContact CG2-CD2 4.1Å; I149-W153 HydrophobicContact CG2-CE3 3.93Å; I149-W153 HydrophobicContact CG2-CH2 3.44Å; I149-W153 VanDerWaalsContact CG2-CH2 3.44Å; I149-W153 HydrophobicContact CG2-CZ2 3.65Å; I149-W153 HydrophobicContact CG2-CZ3 3.59Å; I149-G154 VanDerWaalsContact O-CA 3.3Å; I149-G154 WeakPolarHBondContact O-CA 3.37Å; I149-G154 PolarHBondContact O-N 3.19Å; I149-T166 HydrophobicContact CG2-CG2 4.15Å; I149-F168 HydrophobicContact CB-CE1 4.03Å; I149-F168 HydrophobicContact CB-CZ 3.98Å; I149-F168 HydrophobicContact CD1-CE1 4Å; I149-F168 HydrophobicContact CG2-CE1 3.9Å; I149-F168 HydrophobicContact CG2-CZ 3.77Å; I149-L365 HydrophobicContact CG1-CD2 3.98Å
150	R	98.7	Very high	97.3	Very high	35 Å²	35	54.7 Å²	54.7	13%	0.132	28%	0.28	C	S	.	.	H	α-helix	trans	-59.2	-33.7	175	-71.3	175.3	-174.2	125.5	-0.2	112.6	R146 D147 K155 F168 E184 D190	R146-R150 WeakPolarHBondContact O-CG 3.36Å; R146-R150 PolarHBondContact O-N 2.92Å; D147-R150 PolarHBondContact O-N 3.5Å; D147-R150 IonicContact OD1-NH1 3.3Å; D147-R150 PolarHBondContact OD1-NH1 3.32Å; R150-K155 VanDerWaalsContact O-CB 3.25Å; R150-K155 WeakPolarHBondContact O-CB 3.33Å; R150-F168 HydrophobicContact CG-CE2 3.92Å; R150-F168 HydrophobicContact CG-CZ 4.08Å; R150-E184 IonicContact CZ-OE1 3.87Å; R150-E184 VanDerWaalsContact CZ-OE1 3.26Å; R150-E184 IonicContact NH1-OE1 3.49Å; R150-E184 PolarHBondContact NH1-OE1 2.95Å; R150-E184 IonicContact NH2-OE1 3.49Å; R150-E184 PolarHBondContact NH2-OE1 3.11Å; R150-D190 IonicContact CZ-OD1 3.42Å; R150-D190 IonicContact CZ-OD2 2.81Å; R150-D190 IonicContact NE-OD1 3.34Å; R150-D190 IonicContact NE-OD2 2.75Å; R150-D190 PolarHBondContact NE-OD2 3.28Å; R150-D190 IonicContact NH2-OD1 2.69Å; R150-D190 PolarHBondContact NH2-OD1 2.96Å; R150-D190 IonicContact NH2-OD2 2.86Å; R150-D190 PolarHBondContact NH2-OD2 2.89Å
151	A	98.4	Very high	97.4	Very high	60 Å²	60	57.7 Å²	57.7	50%	0.496	31%	0.312	S	S	.	.	H	α-helix	trans	-81.1	-15.7	178.1	0	0	0	0	0	113.5	D147 A148 I149 I366	D147-A151 VanDerWaalsContact O-CB 3.31Å; D147-A151 WeakPolarHBondContact O-CB 3.48Å; D147-A151 PolarHBondContact O-N 3.47Å; A148-A151 PolarHBondContact O-N 3.22Å; I149-A151 PolarHBondContact O-N 3.31Å; A151-I366 HydrophobicContact CB-CD1 4.13Å
152	T	98.7	Very high	97.6	Very high	3 Å²	3	52.8 Å²	52.8	2%	0.018	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.5	-118.8	-171.9	60.7	0	0	0	0	112.3	A148 I149 G154 K155 L365 I366 W369	A148-T152 WeakPolarHBondContact O-CB 3.37Å; A148-T152 VanDerWaalsContact O-CG2 3.27Å; A148-T152 WeakPolarHBondContact O-CG2 3.48Å; A148-T152 PolarHBondContact O-N 2.74Å; A148-T152 PolarHBondContact O-OG1 3.33Å; I149-T152 CarbonylContact O-C 3.51Å; I149-T152 PolarHBondContact O-N 3.45Å; I149-T152 VanDerWaalsContact O-N 3.07Å; T152-G154 PolarHBondContact O-N 3.14Å; T152-K155 WeakPolarHBondContact O-CB 3.38Å; T152-K155 PolarHBondContact O-N 3Å; T152-L365 HydrophobicContact CG2-CG 4.27Å; T152-I366 HydrophobicContact CG2-CD1 3.5Å; T152-I366 VanDerWaalsContact CG2-CD1 3.5Å; T152-W369 VanDerWaalsContact CB-CG 3.45Å; T152-W369 HydrophobicContact CG2-CB 3.54Å; T152-W369 HydrophobicContact CG2-CD2 4.4Å; T152-W369 HydrophobicContact CG2-CG 3.54Å
153	W	98.4	Very high	97.7	Very high	8 Å²	8	52.4 Å²	52.4	3%	0.03	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-20.6	-172.5	55.3	-108.4	0	0	0	113.5	L134 V136 I149 K155 T166 V227 V231 L233 V235 W369	L134-W153 HydrophobicContact CD1-CE3 4.12Å; L134-W153 HydrophobicContact CD1-CZ3 3.95Å; V136-W153 HydrophobicContact CG2-CH2 3.71Å; V136-W153 HydrophobicContact CG2-CZ3 4.24Å; I149-W153 HydrophobicContact CB-CH2 4.39Å; I149-W153 HydrophobicContact CB-CZ2 4.16Å; I149-W153 HydrophobicContact CD1-CH2 3.92Å; I149-W153 HydrophobicContact CD1-CZ2 3.54Å; I149-W153 HydrophobicContact CG1-CH2 4.08Å; I149-W153 HydrophobicContact CG1-CZ2 3.47Å; I149-W153 VanDerWaalsContact CG1-CZ2 3.47Å; I149-W153 HydrophobicContact CG2-CD2 4.1Å; I149-W153 HydrophobicContact CG2-CE3 3.93Å; I149-W153 HydrophobicContact CG2-CH2 3.44Å; I149-W153 VanDerWaalsContact CG2-CH2 3.44Å; I149-W153 HydrophobicContact CG2-CZ2 3.65Å; I149-W153 HydrophobicContact CG2-CZ3 3.59Å; W153-K155 VanDerWaalsContact C-N 3.3Å; W153-T166 HydrophobicContact CZ3-CG2 4.12Å; W153-V227 HydrophobicContact CH2-CG1 3.76Å; W153-V227 HydrophobicContact CZ3-CG1 4.27Å; W153-V231 PolarHBondContact NE1-O 3.35Å; W153-L233 HydrophobicContact CB-CB 4.34Å; W153-L233 WeakPolarHBondContact CB-O 3.23Å; W153-L233 HydrophobicContact CD2-CB 3.78Å; W153-L233 HydrophobicContact CD2-CD2 4.38Å; W153-L233 HydrophobicContact CE3-CB 4.15Å; W153-L233 HydrophobicContact CE3-CD2 3.88Å; W153-L233 HydrophobicContact CG-CB 3.87Å; W153-L233 HydrophobicContact CZ3-CD2 4.03Å; W153-V235 HydrophobicContact CB-CG2 4.19Å; W153-V235 WeakPolarHBondContact O-CG2 3.39Å; W153-W369 HydrophobicContact CB-CE3 4.21Å; W153-W369 HydrophobicContact CB-CH2 3.67Å; W153-W369 HydrophobicContact CB-CZ2 4.22Å; W153-W369 HydrophobicContact CB-CZ3 3.67Å
154	G	98.2	Very high	97.9	Very high	15 Å²	15	49.6 Å²	49.6	16%	0.155	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-2.4	178.1	0	0	0	0	0	114.2	I149 T152 T166	I149-G154 VanDerWaalsContact O-CA 3.3Å; I149-G154 WeakPolarHBondContact O-CA 3.37Å; I149-G154 PolarHBondContact O-N 3.19Å; T152-G154 PolarHBondContact O-N 3.14Å; G154-T166 PolarHBondContact O-OG1 3.49Å
155	K	96.4	Very high	97.9	Very high	140 Å²	140	43.4 Å²	43.4	61%	0.609	24%	0.242	S	C	*	.	S	Bend	trans	-73.3	-46.1	-172.2	-173.9	-179.4	175.5	-179.4	0	114	R150 T152 W153	R150-K155 VanDerWaalsContact O-CB 3.25Å; R150-K155 WeakPolarHBondContact O-CB 3.33Å; T152-K155 WeakPolarHBondContact O-CB 3.38Å; T152-K155 PolarHBondContact O-N 3Å; W153-K155 VanDerWaalsContact C-N 3.3Å
156	D	94.1	Very high	97.9	Very high	71 Å²	71	44.2 Å²	44.2	38%	0.38	25%	0.247	S	C	.	.			trans	-83.8	124.8	-166.8	-66.5	-29.3	0	0	0	110.8	V159	D156-V159 HydrophobicContact CB-CG2 3.96Å
157	R	95.5	Very high	97.9	Very high	137 Å²	137	44.2 Å²	44.2	52%	0.517	25%	0.246	S	C	.	.	S	Bend	trans	-86.7	-17.7	179.4	-71.7	-169.4	135.4	119	4.2	114.3	T163 V164	R157-T163 CarbonylContact O-C 3.53Å; R157-T163 WeakPolarHBondContact O-CA 3.49Å; R157-V164 WeakPolarHBondContact CA-O 3.35Å; R157-V164 PolarHBondContact O-N 3.05Å
158	V	97.8	Very high	97.9	Very high	100 Å²	100	41 Å²	41	61%	0.606	23%	0.23	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-126.7	114.3	177.4	-179.5	0	0	0	0	107.7	E162	V158-E162 CarbonylContact C-O 3.58Å; V158-E162 VanDerWaalsContact CA-O 3.31Å; V158-E162 WeakPolarHBondContact CA-O 3.32Å
159	V	98.1	Very high	97.9	Very high	7 Å²	7	40.7 Å²	40.7	4%	0.042	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	125.4	-176.2	-179	0	0	0	0	108	D156 G161 E162 V164 V235 D236 V239	D156-V159 HydrophobicContact CB-CG2 3.96Å; V159-G161 PolarHBondContact O-N 3.47Å; V159-G161 VanDerWaalsContact O-N 3.11Å; V159-E162 PolarHBondContact N-O 2.97Å; V159-E162 PolarHBondContact O-N 2.93Å; V159-V164 HydrophobicContact CB-CG2 3.94Å; V159-V164 HydrophobicContact CG2-CG2 4.12Å; V159-V235 HydrophobicContact CB-CG1 4.18Å; V159-V235 HydrophobicContact CG1-CB 4.29Å; V159-V235 HydrophobicContact CG1-CG1 3.96Å; V159-V235 HydrophobicContact CG2-CG1 4.01Å; V159-D236 HydrophobicContact CG1-CB 4.41Å; V159-D236 WeakPolarHBondContact CG1-OD1 3.5Å; V159-V239 HydrophobicContact CB-CG2 4.42Å; V159-V239 HydrophobicContact CG1-CG2 4.25Å
160	Q	97.8	Very high	97.9	Very high	88 Å²	88	40.7 Å²	40.7	41%	0.411	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	35.1	-179	-58.4	-66.3	-37.7	0	0	113.6	E162 D236 V239 I240 K243	Q160-E162 VanDerWaalsContact C-N 3.3Å; Q160-E162 PolarHBondContact O-N 2.92Å; Q160-D236 HydrophobicContact CG-CB 4.31Å; Q160-D236 PolarHBondContact NE2-OD1 3.12Å; Q160-V239 HydrophobicContact CB-CB 4.13Å; Q160-V239 HydrophobicContact CB-CG1 3.71Å; Q160-V239 HydrophobicContact CG-CB 4.35Å; Q160-V239 HydrophobicContact CG-CG1 4.45Å; Q160-I240 HydrophobicContact CG-CD1 4.37Å; Q160-I240 HydrophobicContact CG-CG1 4Å; Q160-K243 PolarHBondContact O-NZ 2.78Å
161	G	97.6	Very high	97.7	Very high	66 Å²	66	39 Å²	39	68%	0.68	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.4	2.2	-179.4	0	0	0	0	0	115.4	V159	V159-G161 PolarHBondContact O-N 3.47Å; V159-G161 VanDerWaalsContact O-N 3.11Å
162	E	98.2	Very high	97.6	Very high	51 Å²	51	39.6 Å²	39.6	24%	0.238	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	146.6	-178.7	-58.6	-58.2	156.6	0	0	111.8	F131 V158 V159 Q160 V164 V239 K243	F131-E162 HydrophobicContact CB-CB 3.81Å; F131-E162 HydrophobicContact CB-CG 4.32Å; F131-E162 HydrophobicContact CD1-CB 3.74Å; F131-E162 HydrophobicContact CD1-CG 3.82Å; F131-E162 HydrophobicContact CD2-CG 4.44Å; F131-E162 HydrophobicContact CE1-CG 4.23Å; F131-E162 HydrophobicContact CG-CB 3.88Å; F131-E162 HydrophobicContact CG-CG 3.94Å; V158-E162 CarbonylContact C-O 3.58Å; V158-E162 VanDerWaalsContact CA-O 3.31Å; V158-E162 WeakPolarHBondContact CA-O 3.32Å; V159-E162 PolarHBondContact N-O 2.97Å; V159-E162 PolarHBondContact O-N 2.93Å; Q160-E162 VanDerWaalsContact C-N 3.3Å; Q160-E162 PolarHBondContact O-N 2.92Å; E162-V164 PolarHBondContact O-N 3.21Å; E162-V239 HydrophobicContact CB-CG1 4.09Å; E162-V239 HydrophobicContact CG-CG1 3.73Å; E162-K243 HydrophobicContact CG-CD 3.86Å; E162-K243 WeakPolarHBondContact OE1-CE 3.45Å; E162-K243 IonicContact OE1-NZ 2.84Å; E162-K243 PolarHBondContact OE1-NZ 3.49Å
163	T	98.3	Very high	97.1	Very high	48 Å²	48	41.5 Å²	41.5	29%	0.294	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	122.9	173	-56.9	0	0	0	0	110.4	N128 P130 F131 L132 R157	N128-T163 HydrophobicContact CB-CG2 4.38Å; P130-T163 HydrophobicContact CB-CG2 4.23Å; F131-T163 PolarHBondContact N-O 3.36Å; L132-T163 PolarHBondContact N-O 3.48Å; R157-T163 CarbonylContact O-C 3.53Å; R157-T163 WeakPolarHBondContact O-CA 3.49Å
164	V	98.6	Very high	96.1	Very high	4 Å²	4	44.5 Å²	44.5	2%	0.024	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	133.5	176	-175.6	0	0	0	0	109.5	L132 L134 R157 V159 E162 V235 V239	L132-V164 HydrophobicContact CB-CG1 4.43Å; L132-V164 HydrophobicContact CB-CG2 4.32Å; L132-V164 HydrophobicContact CD2-CG1 4.21Å; L132-V164 HydrophobicContact CD2-CG2 4.46Å; L132-V164 HydrophobicContact CG-CG1 4.33Å; L132-V164 WeakPolarHBondContact O-CA 3.11Å; L134-V164 HydrophobicContact CD1-CG1 3.91Å; L134-V164 HydrophobicContact CG-CG1 4.01Å; R157-V164 WeakPolarHBondContact CA-O 3.35Å; R157-V164 PolarHBondContact O-N 3.05Å; V159-V164 HydrophobicContact CB-CG2 3.94Å; V159-V164 HydrophobicContact CG2-CG2 4.12Å; E162-V164 PolarHBondContact O-N 3.21Å; V164-V235 HydrophobicContact CG1-CG1 4.11Å; V164-V235 HydrophobicContact CG2-CG1 4.2Å; V164-V239 HydrophobicContact CG2-CG2 4.06Å
165	L	98	Very high	94.9	Very high	3 Å²	3	48 Å²	48	2%	0.016	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	125.2	179.3	-179.2	66.5	0	0	0	110.8	V124 P130 L132 V133 L134 L167	V124-L165 HydrophobicContact CG1-CD1 3.53Å; V124-L165 HydrophobicContact CG1-CD2 3.71Å; V124-L165 HydrophobicContact CG1-CG 4.22Å; P130-L165 HydrophobicContact CB-CB 3.91Å; P130-L165 HydrophobicContact CG-CB 4.18Å; P130-L165 HydrophobicContact CG-CD2 4.29Å; L132-L165 PolarHBondContact O-N 3.48Å; V133-L165 CarbonylContact C-O 3.58Å; V133-L165 WeakPolarHBondContact CA-O 3.4Å; L134-L165 PolarHBondContact N-O 3.47Å; L165-L167 HydrophobicContact CD1-CD2 4.43Å; L165-L167 HydrophobicContact CD2-CD1 3.77Å; L165-L167 HydrophobicContact CD2-CD2 4.29Å; L165-L167 HydrophobicContact CD2-CG 4.05Å; L165-L167 HydrophobicContact CG-CD1 4.23Å; L165-L167 HydrophobicContact CG-CD2 4.27Å; L165-L167 HydrophobicContact CG-CG 3.99Å
166	T	98.6	Very high	94	Very high	18 Å²	18	43.6 Å²	43.6	11%	0.11	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	129.4	173.8	-50.8	0	0	0	0	110	L134 V136 I149 W153 G154 F168	L134-T166 HydrophobicContact CB-CG2 4.38Å; V136-T166 HydrophobicContact CG2-CG2 3.96Å; I149-T166 HydrophobicContact CG2-CG2 4.15Å; W153-T166 HydrophobicContact CZ3-CG2 4.12Å; G154-T166 PolarHBondContact O-OG1 3.49Å; T166-F168 HydrophobicContact CG2-CZ 4.43Å
167	L	98.7	Very high	93.3	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	138	180	-64.1	170	0	0	0	110.5	V124 V133 L134 M135 V136 L165 D190 I192 W213	V124-L167 HydrophobicContact CG1-CD2 4.21Å; V133-L167 HydrophobicContact CG1-CD1 3.94Å; L134-L167 PolarHBondContact O-N 2.68Å; M135-L167 HydrophobicContact SD-CB 4.04Å; M135-L167 HydrophobicContact SD-CD1 4.05Å; V136-L167 PolarHBondContact N-O 2.95Å; L165-L167 HydrophobicContact CD1-CD2 4.43Å; L165-L167 HydrophobicContact CD2-CD1 3.77Å; L165-L167 HydrophobicContact CD2-CD2 4.29Å; L165-L167 HydrophobicContact CD2-CG 4.05Å; L165-L167 HydrophobicContact CG-CD1 4.23Å; L165-L167 HydrophobicContact CG-CD2 4.27Å; L165-L167 HydrophobicContact CG-CG 3.99Å; L167-D190 WeakPolarHBondContact CA-O 3.4Å; L167-D190 HydrophobicContact CD2-CB 4.41Å; L167-I192 HydrophobicContact CB-CD1 4.13Å; L167-I192 HydrophobicContact CD1-CD1 3.94Å; L167-I192 HydrophobicContact CG-CD1 4.5Å; L167-W213 HydrophobicContact CD1-CE3 4.38Å; L167-W213 HydrophobicContact CD1-CH2 3.44Å; L167-W213 VanDerWaalsContact CD1-CH2 3.44Å; L167-W213 HydrophobicContact CD1-CZ2 4.23Å; L167-W213 HydrophobicContact CD1-CZ3 3.52Å
168	F	98.8	Very high	92.9	Very high	1 Å²	1	41.8 Å²	41.8	0%	0.004	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	130.7	179.2	-61	-74.9	0	0	0	110.7	V136 V138 R146 I149 R150 T166 L170 D190 L191 I192	V136-F168 HydrophobicContact CB-CD1 3.71Å; V136-F168 HydrophobicContact CB-CE1 4.07Å; V136-F168 HydrophobicContact CG1-CD1 3.9Å; V136-F168 HydrophobicContact CG1-CE1 4.05Å; V136-F168 HydrophobicContact CG2-CD1 4.33Å; V136-F168 HydrophobicContact CG2-CE1 4.28Å; V136-F168 WeakPolarHBondContact O-CA 3.49Å; V138-F168 HydrophobicContact CG1-CB 3.9Å; V138-F168 HydrophobicContact CG1-CD1 3.97Å; V138-F168 HydrophobicContact CG1-CG 4.33Å; R146-F168 HydrophobicContact CB-CD1 4.27Å; R146-F168 HydrophobicContact CB-CE1 4.04Å; R146-F168 HydrophobicContact CB-CE2 4.29Å; R146-F168 HydrophobicContact CB-CG 4.49Å; R146-F168 HydrophobicContact CB-CZ 4.05Å; R146-F168 HydrophobicContact CG-CB 4.49Å; R146-F168 HydrophobicContact CG-CD1 3.68Å; R146-F168 HydrophobicContact CG-CD2 4.37Å; R146-F168 HydrophobicContact CG-CE1 3.92Å; R146-F168 HydrophobicContact CG-CG 3.92Å; R146-F168 HydrophobicContact CG-CZ 4.36Å; I149-F168 HydrophobicContact CB-CE1 4.03Å; I149-F168 HydrophobicContact CB-CZ 3.98Å; I149-F168 HydrophobicContact CD1-CE1 4Å; I149-F168 HydrophobicContact CG2-CE1 3.9Å; I149-F168 HydrophobicContact CG2-CZ 3.77Å; R150-F168 HydrophobicContact CG-CE2 3.92Å; R150-F168 HydrophobicContact CG-CZ 4.08Å; T166-F168 HydrophobicContact CG2-CZ 4.43Å; F168-L170 HydrophobicContact CB-CD1 4.32Å; F168-L170 WeakPolarHBondContact O-CD1 3.34Å; F168-D190 HydrophobicContact CD2-CB 4.32Å; F168-D190 WeakPolarHBondContact CE2-OD2 3.25Å; F168-D190 PolarHBondContact N-O 3.48Å; F168-L191 HydrophobicContact CB-CD2 3.76Å; F168-L191 HydrophobicContact CD2-CD2 4.03Å; F168-L191 HydrophobicContact CG-CD2 4.28Å; F168-I192 PolarHBondContact O-N 3.11Å
169	V	98.6	Very high	92.4	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	121.6	-174.5	-173	0	0	0	0	111.2	M135 V136 P137 V138 I192 K206 V209 I210	M135-V169 HydrophobicContact CE-CG2 3.72Å; V136-V169 PolarHBondContact O-N 3.44Å; P137-V169 WeakPolarHBondContact CA-O 3.5Å; V138-V169 PolarHBondContact N-O 3.48Å; V138-V169 VanDerWaalsContact N-O 3.09Å; V169-I192 CarbonylContact C-O 3.57Å; V169-I192 WeakPolarHBondContact CA-O 3.49Å; V169-I192 HydrophobicContact CG2-CB 4.28Å; V169-I192 HydrophobicContact CG2-CD1 4.31Å; V169-K206 HydrophobicContact CG1-CG 4.43Å; V169-V209 HydrophobicContact CG1-CG1 4.42Å; V169-I210 HydrophobicContact CB-CD1 4.34Å; V169-I210 HydrophobicContact CB-CG1 3.97Å; V169-I210 HydrophobicContact CG1-CG1 3.82Å; V169-I210 HydrophobicContact CG2-CD1 4.48Å; V169-I210 HydrophobicContact CG2-CG1 3.91Å
170	L	97.8	Very high	92.1	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	150.7	-168.2	-48.8	101.8	0	0	0	111.6	V138 P140 F168 L181 L191 I192 Q193 S194	V138-L170 HydrophobicContact CG1-CD2 4.15Å; V138-L170 HydrophobicContact CG1-CG 4.19Å; P140-L170 HydrophobicContact CB-CD2 4.33Å; P140-L170 HydrophobicContact CG-CB 4.23Å; P140-L170 HydrophobicContact CG-CD2 4.24Å; F168-L170 HydrophobicContact CB-CD1 4.32Å; F168-L170 WeakPolarHBondContact O-CD1 3.34Å; L170-L181 HydrophobicContact CD2-CD1 4.29Å; L170-L191 HydrophobicContact CD1-CB 4.02Å; L170-L191 HydrophobicContact CD1-CD2 4.04Å; L170-L191 HydrophobicContact CD1-CG 4.43Å; L170-I192 PolarHBondContact N-O 3.29Å; L170-Q193 HydrophobicContact CB-CB 4.48Å; L170-Q193 HydrophobicContact CB-CG 4.24Å; L170-Q193 WeakPolarHBondContact O-CA 3.44Å; L170-S194 PolarHBondContact O-N 3.21Å
171	G	96.3	Very high	91.9	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	-162.5	163.1	0	0	0	0	0	112.1	P140 Q193 S194 F196 D198	P140-G171 WeakPolarHBondContact CG-O 3.41Å; G171-Q193 PolarHBondContact O-NE2 3.31Å; G171-S194 WeakPolarHBondContact CA-O 3.24Å; G171-F196 CarbonylContact C-O 3.58Å; G171-F196 WeakPolarHBondContact CA-O 3.39Å; G171-D198 PolarHBondContact N-OD2 3.24Å
172	L	94.4	Very high	91.8	Very high	72 Å²	72	46.9 Å²	46.9	38%	0.377	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	137.5	168.6	-55.6	-179.1	0	0	0	110	N195 F196 D198	L172-N195 HydrophobicContact CD1-CB 4.01Å; L172-N195 HydrophobicContact CG-CB 4.48Å; L172-F196 PolarHBondContact N-O 2.67Å; L172-D198 WeakPolarHBondContact O-CB 3.33Å; L172-D198 PolarHBondContact O-N 2.92Å
173	S	88.5	Confident	91.6	Very high	42 Å²	42	49.8 Å²	49.8	29%	0.294	30%	0.295	S	S	.	.			trans	-131.6	137.7	171.4	177.6	0	0	0	0	109.5
174	G	78.8	Confident	91.5	Very high	72 Å²	72	48.3 Å²	48.3	74%	0.742	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	141.6	171.3	0	0	0	0	0	111
175	G	72.4	Confident	91.4	Very high	88 Å²	88	48.9 Å²	48.9	91%	0.907	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.7	11.6	175.8	0	0	0	0	0	116
176	I	76.9	Confident	91.4	Very high	47 Å²	47	55.6 Å²	55.6	24%	0.241	32%	0.319	C	S	.	.			trans	-94.9	134.1	171.5	-57.4	-66.8	0	0	0	109.5	P140 K141 V178	P140-I176 HydrophobicContact CB-CD1 3.93Å; P140-I176 HydrophobicContact CB-CG1 3.73Å; P140-I176 HydrophobicContact CB-CG2 4.48Å; K141-I176 HydrophobicContact CB-CD1 3.64Å; I176-V178 PolarHBondContact O-N 3.38Å
177	D	80.5	Confident	91.3	Very high	78 Å²	78	61.5 Å²	61.5	42%	0.417	35%	0.345	S	S	.	.			trans	-73.9	112.4	165.5	-168.5	-17.8	0	0	0	109.1	K179 E180 L181	D177-K179 PolarHBondContact O-N 2.86Å; D177-K179 VanDerWaalsContact O-N 3.13Å; D177-K179 VanDerWaalsContact OD1-CB 3.26Å; D177-K179 WeakPolarHBondContact OD1-CB 3.39Å; D177-K179 PolarHBondContact OD1-N 2.75Å; D177-E180 HydrophobicContact CB-CB 4.32Å; D177-E180 HydrophobicContact CB-CG 3.94Å; D177-E180 PolarHBondContact O-N 2.92Å; D177-E180 VanDerWaalsContact O-N 3.09Å; D177-L181 PolarHBondContact O-N 3.18Å
178	V	85.4	Confident	91.1	Very high	92 Å²	92	64.9 Å²	64.9	56%	0.558	36%	0.361	S	S	*	.	H	α-helix	trans	-54.5	-30.9	176.4	176.6	0	0	0	0	111.2	I176 Q182	I176-V178 PolarHBondContact O-N 3.38Å; V178-Q182 HydrophobicContact CG1-CG 4.37Å; V178-Q182 WeakPolarHBondContact O-CB 3.48Å; V178-Q182 VanDerWaalsContact O-CG 3.24Å; V178-Q182 WeakPolarHBondContact O-CG 3.48Å; V178-Q182 PolarHBondContact O-N 2.78Å
179	K	88.5	Confident	91	Very high	139 Å²	139	68.8 Å²	68.8	60%	0.604	38%	0.382	S	S	*	.	H	α-helix	trans	-68.3	-40	178.5	-64.2	179.9	178.1	178.1	0	112.5	D177 Q182 Q183	D177-K179 PolarHBondContact O-N 2.86Å; D177-K179 VanDerWaalsContact O-N 3.13Å; D177-K179 VanDerWaalsContact OD1-CB 3.26Å; D177-K179 WeakPolarHBondContact OD1-CB 3.39Å; D177-K179 PolarHBondContact OD1-N 2.75Å; K179-Q182 PolarHBondContact O-N 3.04Å; K179-Q183 WeakPolarHBondContact O-CB 3.42Å; K179-Q183 VanDerWaalsContact O-CG 3.28Å; K179-Q183 WeakPolarHBondContact O-CG 3.33Å; K179-Q183 PolarHBondContact O-N 3.39Å
180	E	91.8	Very high	90.9	Very high	127 Å²	127	69.5 Å²	69.5	59%	0.593	39%	0.386	S	S	*	.	H	α-helix	trans	-63.6	-44.4	178	-70	178.3	172	0	0	110.6	D177 Q182 Q183 E184	D177-E180 HydrophobicContact CB-CB 4.32Å; D177-E180 HydrophobicContact CB-CG 3.94Å; D177-E180 PolarHBondContact O-N 2.92Å; D177-E180 VanDerWaalsContact O-N 3.09Å; E180-Q182 VanDerWaalsContact C-N 3.33Å; E180-Q182 PolarHBondContact O-N 2.96Å; E180-Q183 PolarHBondContact O-N 3.07Å; E180-E184 PolarHBondContact O-N 3.41Å
181	L	93.9	Very high	90.9	Very high	7 Å²	7	69.5 Å²	69.5	4%	0.037	39%	0.386	C	S	.	.	H	α-helix	trans	-65.8	-36.5	177.4	-165.1	69	0	0	0	112.2	M119 L170 D177 N185 L191	M119-L181 HydrophobicContact CE-CG 4.41Å; L170-L181 HydrophobicContact CD2-CD1 4.29Å; D177-L181 PolarHBondContact O-N 3.18Å; L181-N185 WeakPolarHBondContact O-CB 3.26Å; L181-N185 PolarHBondContact O-N 3.26Å; L181-L191 HydrophobicContact CD1-CD1 3.6Å; L181-L191 HydrophobicContact CG-CD1 4.02Å
182	Q	94.1	Very high	91	Very high	96 Å²	96	69.5 Å²	69.5	45%	0.449	39%	0.386	S	S	.	.	H	α-helix	trans	-65.5	-41.2	173.4	-76.9	175	-14.7	0	0	112.2	M119 V178 K179 E180 N185 Q186	M119-Q182 HydrophobicContact CE-CG 4.3Å; V178-Q182 HydrophobicContact CG1-CG 4.37Å; V178-Q182 WeakPolarHBondContact O-CB 3.48Å; V178-Q182 VanDerWaalsContact O-CG 3.24Å; V178-Q182 WeakPolarHBondContact O-CG 3.48Å; V178-Q182 PolarHBondContact O-N 2.78Å; K179-Q182 PolarHBondContact O-N 3.04Å; E180-Q182 VanDerWaalsContact C-N 3.33Å; E180-Q182 PolarHBondContact O-N 2.96Å; Q182-N185 PolarHBondContact O-N 2.94Å; Q182-Q186 VanDerWaalsContact O-CG 3.29Å; Q182-Q186 WeakPolarHBondContact O-CG 3.43Å; Q182-Q186 PolarHBondContact O-N 3.17Å
183	Q	95.4	Very high	91.2	Very high	112 Å²	112	67.1 Å²	67.1	52%	0.523	37%	0.373	S	S	.	.	H	α-helix	trans	-64.3	-44.9	175.8	-74.3	171.7	1.5	0	0	111.3	K179 E180 N185 Q186 Q187	K179-Q183 WeakPolarHBondContact O-CB 3.42Å; K179-Q183 VanDerWaalsContact O-CG 3.28Å; K179-Q183 WeakPolarHBondContact O-CG 3.33Å; K179-Q183 PolarHBondContact O-N 3.39Å; E180-Q183 PolarHBondContact O-N 3.07Å; Q183-N185 VanDerWaalsContact C-N 3.31Å; Q183-N185 PolarHBondContact O-N 3.3Å; Q183-Q186 PolarHBondContact O-N 3.36Å; Q183-Q187 WeakPolarHBondContact O-CG 3.48Å; Q183-Q187 PolarHBondContact O-N 2.84Å; Q183-Q187 VanDerWaalsContact O-N 3.09Å
184	E	96.6	Very high	91.6	Very high	16 Å²	16	65.2 Å²	65.2	8%	0.075	36%	0.359	C	S	.	.	H	α-helix	trans	-56.2	-47.4	173.3	-175.6	-172.9	173.4	0	0	110.7	R146 R150 E180 Q186 Q187 H188 L191	R146-E184 IonicContact CZ-OE1 3.38Å; R146-E184 IonicContact CZ-OE2 3.57Å; R146-E184 IonicContact NE-OE1 3.76Å; R146-E184 PolarHBondContact NE-OE1 3.4Å; R146-E184 IonicContact NE-OE2 2.72Å; R146-E184 PolarHBondContact NE-OE2 2.99Å; R146-E184 IonicContact NH2-OE1 2.63Å; R146-E184 IonicContact NH2-OE2 3.59Å; R146-E184 PolarHBondContact NH2-OE2 3.35Å; R150-E184 IonicContact CZ-OE1 3.87Å; R150-E184 VanDerWaalsContact CZ-OE1 3.26Å; R150-E184 IonicContact NH1-OE1 3.49Å; R150-E184 PolarHBondContact NH1-OE1 2.95Å; R150-E184 IonicContact NH2-OE1 3.49Å; R150-E184 PolarHBondContact NH2-OE1 3.11Å; E180-E184 PolarHBondContact O-N 3.41Å; E184-Q186 VanDerWaalsContact C-N 3.34Å; E184-Q186 PolarHBondContact O-N 3.2Å; E184-Q187 PolarHBondContact O-N 3.35Å; E184-Q187 VanDerWaalsContact O-N 3.15Å; E184-H188 PolarHBondContact O-CD2 3.06Å; E184-H188 VanDerWaalsContact O-CD2 3.3Å; E184-H188 PolarHBondContact O-N 3Å; E184-L191 HydrophobicContact CB-CD1 4.33Å; E184-L191 HydrophobicContact CG-CD1 4.14Å
185	N	96.4	Very high	92.4	Very high	17 Å²	17	64.7 Å²	64.7	9%	0.091	34%	0.339	C	S	.	.	H	α-helix	trans	-63.9	-38.2	178.8	-168.9	53.1	0	0	0	113	M119 N121 L181 Q182 Q183 Q187 H188 N189 L191	M119-N185 HydrophobicContact CE-CB 3.61Å; M119-N185 HydrophobicContact CG-CB 4.43Å; M119-N185 HydrophobicContact SD-CB 3.38Å; M119-N185 WeakPolarHBondContact SD-CB 3.03Å; N121-N185 PolarHBondContact ND2-OD1 2.79Å; N121-N185 PolarHBondContact OD1-ND2 3.03Å; L181-N185 WeakPolarHBondContact O-CB 3.26Å; L181-N185 PolarHBondContact O-N 3.26Å; Q182-N185 PolarHBondContact O-N 2.94Å; Q183-N185 VanDerWaalsContact C-N 3.31Å; Q183-N185 PolarHBondContact O-N 3.3Å; N185-Q187 PolarHBondContact O-N 3.25Å; N185-H188 PolarHBondContact O-N 3.13Å; N185-N189 VanDerWaalsContact O-CA 3.25Å; N185-N189 WeakPolarHBondContact O-CA 3.24Å; N185-N189 PolarHBondContact O-N 3.23Å; N185-N189 PolarHBondContact O-OD1 3.11Å; N185-L191 HydrophobicContact CB-CB 4.37Å; N185-L191 HydrophobicContact CB-CD1 4.04Å; N185-L191 HydrophobicContact CB-CG 4.29Å; N185-L191 WeakPolarHBondContact OD1-CB 3.42Å; N185-L191 PolarHBondContact OD1-N 3.44Å
186	Q	96.3	Very high	93.4	Very high	144 Å²	144	60.7 Å²	60.7	67%	0.673	30%	0.297	S	S	*	.	H	α-helix	trans	-62.3	-34.5	176.1	-75.3	170.7	1.2	0	0	111.8	Q182 Q183 E184 N189	Q182-Q186 VanDerWaalsContact O-CG 3.29Å; Q182-Q186 WeakPolarHBondContact O-CG 3.43Å; Q182-Q186 PolarHBondContact O-N 3.17Å; Q183-Q186 PolarHBondContact O-N 3.36Å; E184-Q186 VanDerWaalsContact C-N 3.34Å; E184-Q186 PolarHBondContact O-N 3.2Å; Q186-N189 PolarHBondContact O-ND2 3.38Å
187	Q	96.4	Very high	94.3	Very high	142 Å²	142	62.8 Å²	62.8	66%	0.664	31%	0.308	S	S	*	.	H	α-helix	trans	-75	-44.1	179	-69.3	172.5	-5	0	0	112.2	Q183 E184 N185	Q183-Q187 WeakPolarHBondContact O-CG 3.48Å; Q183-Q187 PolarHBondContact O-N 2.84Å; Q183-Q187 VanDerWaalsContact O-N 3.09Å; E184-Q187 PolarHBondContact O-N 3.35Å; E184-Q187 VanDerWaalsContact O-N 3.15Å; N185-Q187 PolarHBondContact O-N 3.25Å
188	H	96.3	Very high	94.9	Very high	71 Å²	71	60.3 Å²	60.3	33%	0.329	30%	0.295	S	S	.	.	H	α-helix	trans	-105.5	-26.8	-168.5	-61.4	-67.7	0	0	0	114.6	E184 N185 D190	E184-H188 PolarHBondContact O-CD2 3.06Å; E184-H188 VanDerWaalsContact O-CD2 3.3Å; E184-H188 PolarHBondContact O-N 3Å; N185-H188 PolarHBondContact O-N 3.13Å; H188-D190 VanDerWaalsContact CB-CG 3.49Å; H188-D190 VanDerWaalsContact CB-OD1 3.25Å; H188-D190 WeakPolarHBondContact CB-OD1 3.03Å; H188-D190 WeakPolarHBondContact CB-OD2 3.39Å; H188-D190 PolarHBondContact O-N 3.28Å
189	N	95.8	Very high	95.3	Very high	82 Å²	82	58.1 Å²	58.1	44%	0.439	28%	0.282	S	S	.	.			trans	50.6	38.1	-176.1	-60.5	-77.5	0	0	0	113.1	V124 N185 Q186	V124-N189 WeakPolarHBondContact CG2-O 3.09Å; N185-N189 VanDerWaalsContact O-CA 3.25Å; N185-N189 WeakPolarHBondContact O-CA 3.24Å; N185-N189 PolarHBondContact O-N 3.23Å; N185-N189 PolarHBondContact O-OD1 3.11Å; Q186-N189 PolarHBondContact O-ND2 3.38Å
190	D	97.4	Very high	95.3	Very high	16 Å²	16	55.5 Å²	55.5	9%	0.086	27%	0.269	C	S	.	.			trans	-126	6.2	-174.4	63.2	4	0	0	0	113.5	R150 L167 F168 H188	R150-D190 IonicContact CZ-OD1 3.42Å; R150-D190 IonicContact CZ-OD2 2.81Å; R150-D190 IonicContact NE-OD1 3.34Å; R150-D190 IonicContact NE-OD2 2.75Å; R150-D190 PolarHBondContact NE-OD2 3.28Å; R150-D190 IonicContact NH2-OD1 2.69Å; R150-D190 PolarHBondContact NH2-OD1 2.96Å; R150-D190 IonicContact NH2-OD2 2.86Å; R150-D190 PolarHBondContact NH2-OD2 2.89Å; L167-D190 WeakPolarHBondContact CA-O 3.4Å; L167-D190 HydrophobicContact CD2-CB 4.41Å; F168-D190 HydrophobicContact CD2-CB 4.32Å; F168-D190 WeakPolarHBondContact CE2-OD2 3.25Å; F168-D190 PolarHBondContact N-O 3.48Å; H188-D190 VanDerWaalsContact CB-CG 3.49Å; H188-D190 VanDerWaalsContact CB-OD1 3.25Å; H188-D190 WeakPolarHBondContact CB-OD1 3.03Å; H188-D190 WeakPolarHBondContact CB-OD2 3.39Å; H188-D190 PolarHBondContact O-N 3.28Å
191	L	97.9	Very high	95.2	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	136.4	-179.7	-54.3	-169.6	0	0	0	112.1	M119 N121 F168 L170 L181 E184 N185	M119-L191 HydrophobicContact SD-CB 3.46Å; M119-L191 WeakPolarHBondContact SD-CB 3.44Å; M119-L191 HydrophobicContact SD-CD1 4.04Å; M119-L191 HydrophobicContact SD-CG 4.32Å; N121-L191 PolarHBondContact ND2-N 3.36Å; N121-L191 PolarHBondContact ND2-O 2.86Å; F168-L191 HydrophobicContact CB-CD2 3.76Å; F168-L191 HydrophobicContact CD2-CD2 4.03Å; F168-L191 HydrophobicContact CG-CD2 4.28Å; L170-L191 HydrophobicContact CD1-CB 4.02Å; L170-L191 HydrophobicContact CD1-CD2 4.04Å; L170-L191 HydrophobicContact CD1-CG 4.43Å; L181-L191 HydrophobicContact CD1-CD1 3.6Å; L181-L191 HydrophobicContact CG-CD1 4.02Å; E184-L191 HydrophobicContact CB-CD1 4.33Å; E184-L191 HydrophobicContact CG-CD1 4.14Å; N185-L191 HydrophobicContact CB-CB 4.37Å; N185-L191 HydrophobicContact CB-CD1 4.04Å; N185-L191 HydrophobicContact CB-CG 4.29Å; N185-L191 WeakPolarHBondContact OD1-CB 3.42Å; N185-L191 PolarHBondContact OD1-N 3.44Å
192	I	98.2	Very high	95.3	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	120	167.8	-61.9	161	0	0	0	106.9	F117 M119 M135 L167 F168 V169 L170 W213	F117-I192 HydrophobicContact CD1-CG2 3.69Å; F117-I192 HydrophobicContact CE1-CG2 3.79Å; M119-I192 CarbonylContact O-C 3.59Å; M119-I192 WeakPolarHBondContact O-CA 3.37Å; M135-I192 HydrophobicContact CE-CD1 4.03Å; L167-I192 HydrophobicContact CB-CD1 4.13Å; L167-I192 HydrophobicContact CD1-CD1 3.94Å; L167-I192 HydrophobicContact CG-CD1 4.5Å; F168-I192 PolarHBondContact O-N 3.11Å; V169-I192 CarbonylContact C-O 3.57Å; V169-I192 WeakPolarHBondContact CA-O 3.49Å; V169-I192 HydrophobicContact CG2-CB 4.28Å; V169-I192 HydrophobicContact CG2-CD1 4.31Å; L170-I192 PolarHBondContact N-O 3.29Å; I192-W213 HydrophobicContact CD1-CD2 3.44Å; I192-W213 VanDerWaalsContact CD1-CD2 3.44Å; I192-W213 HydrophobicContact CD1-CE3 3.9Å; I192-W213 HydrophobicContact CD1-CG 3.81Å; I192-W213 HydrophobicContact CD1-CH2 4.21Å; I192-W213 HydrophobicContact CD1-CZ2 3.78Å; I192-W213 HydrophobicContact CD1-CZ3 4.25Å; I192-W213 HydrophobicContact CG1-CD2 4.42Å; I192-W213 HydrophobicContact CG1-CZ2 4.37Å; I192-W213 HydrophobicContact CG2-CG 4.25Å
193	Q	97.4	Very high	95.3	Very high	22 Å²	22	51.4 Å²	51.4	10%	0.103	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	129.6	178.6	-168.6	-179.6	32.2	0	0	110.4	F117 V118 M119 L170 G171	F117-Q193 CarbonylContact C-O 3.5Å; F117-Q193 WeakPolarHBondContact CA-O 3.44Å; V118-Q193 HydrophobicContact CG2-CB 3.75Å; V118-Q193 HydrophobicContact CG2-CG 3.6Å; V118-Q193 WeakPolarHBondContact CG2-O 3.49Å; V118-Q193 PolarHBondContact N-O 2.65Å; M119-Q193 HydrophobicContact CB-CB 3.76Å; M119-Q193 PolarHBondContact N-O 3.07Å; M119-Q193 VanDerWaalsContact N-O 3.16Å; M119-Q193 PolarHBondContact O-N 3.19Å; M119-Q193 VanDerWaalsContact O-O 3.14Å; L170-Q193 HydrophobicContact CB-CB 4.48Å; L170-Q193 HydrophobicContact CB-CG 4.24Å; L170-Q193 WeakPolarHBondContact O-CA 3.44Å; G171-Q193 PolarHBondContact O-NE2 3.31Å
194	S	97.1	Very high	95.4	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.007	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	152.6	172.8	-174	0	0	0	0	110.8	Y115 R116 L170 G171 F196	Y115-S194 VanDerWaalsContact CB-OG 3.26Å; Y115-S194 WeakPolarHBondContact CB-OG 3.38Å; R116-S194 WeakPolarHBondContact O-CA 3.4Å; R116-S194 PolarHBondContact O-OG 3.13Å; L170-S194 PolarHBondContact O-N 3.21Å; G171-S194 WeakPolarHBondContact CA-O 3.24Å; S194-F196 PolarHBondContact O-N 2.7Å
195	N	95.3	Very high	95.4	Very high	62 Å²	62	46.3 Å²	46.3	33%	0.332	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	26.6	-168.4	72.9	-22.9	0	0	0	115.7	Y115 R116 V118 L172	Y115-N195 WeakPolarHBondContact CA-OD1 3.21Å; Y115-N195 WeakPolarHBondContact CB-OD1 3.38Å; R116-N195 PolarHBondContact N-OD1 3.45Å; R116-N195 PolarHBondContact O-N 2.78Å; V118-N195 HydrophobicContact CG1-CB 4.05Å; L172-N195 HydrophobicContact CD1-CB 4.01Å; L172-N195 HydrophobicContact CG-CB 4.48Å
196	F	94.8	Very high	95.5	Very high	3 Å²	3	45.8 Å²	45.8	1%	0.013	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	154.6	172.5	67.9	-86.4	0	0	0	111.2	Y115 G171 L172 S194 D198 I205 K206 V209	Y115-F196 HydrophobicContact CD1-CB 3.55Å; Y115-F196 HydrophobicContact CE1-CB 3.54Å; Y115-F196 HydrophobicContact CG-CB 4.14Å; G171-F196 CarbonylContact C-O 3.58Å; G171-F196 WeakPolarHBondContact CA-O 3.39Å; L172-F196 PolarHBondContact N-O 2.67Å; S194-F196 PolarHBondContact O-N 2.7Å; F196-D198 HydrophobicContact CE2-CB 4.44Å; F196-D198 PolarHBondContact O-N 3.02Å; F196-I205 HydrophobicContact CB-CG2 3.58Å; F196-I205 HydrophobicContact CD1-CG2 4.1Å; F196-I205 HydrophobicContact CD2-CG2 3.99Å; F196-I205 HydrophobicContact CG-CG2 3.62Å; F196-K206 HydrophobicContact CE1-CB 4.44Å; F196-K206 HydrophobicContact CE1-CG 4.5Å; F196-K206 HydrophobicContact CE2-CB 3.72Å; F196-K206 HydrophobicContact CE2-CG 4.21Å; F196-K206 HydrophobicContact CZ-CB 3.56Å; F196-K206 HydrophobicContact CZ-CD 4.18Å; F196-K206 HydrophobicContact CZ-CG 3.63Å; F196-V209 HydrophobicContact CD1-CG2 4.12Å; F196-V209 HydrophobicContact CE1-CB 4.49Å; F196-V209 HydrophobicContact CE1-CG1 4.48Å; F196-V209 HydrophobicContact CE1-CG2 4.26Å
197	L	94.5	Very high	95.6	Very high	92 Å²	92	39 Å²	39	48%	0.482	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	119.9	175.2	-178.2	67.8	0	0	0	110.6	T199 N202	L197-T199 HydrophobicContact CD2-CG2 4.04Å; L197-T199 HydrophobicContact CG-CG2 3.96Å; L197-T199 PolarHBondContact O-N 3.33Å; L197-T199 VanDerWaalsContact O-N 3.11Å; L197-N202 WeakPolarHBondContact O-CB 3.4Å; L197-N202 PolarHBondContact O-ND2 2.66Å
198	D	94.2	Very high	95.7	Very high	25 Å²	25	32.3 Å²	32.3	13%	0.134	16%	0.164	C	C	.	.			trans	-78.8	95.2	-176.2	-154.9	-30.6	0	0	0	111.5	P140 G171 L172 F196 K206	P140-D198 VanDerWaalsContact CD-OD2 3.29Å; P140-D198 WeakPolarHBondContact CD-OD2 3.47Å; G171-D198 PolarHBondContact N-OD2 3.24Å; L172-D198 WeakPolarHBondContact O-CB 3.33Å; L172-D198 PolarHBondContact O-N 2.92Å; F196-D198 HydrophobicContact CE2-CB 4.44Å; F196-D198 PolarHBondContact O-N 3.02Å; D198-K206 WeakPolarHBondContact OD1-CE 3.47Å; D198-K206 IonicContact OD1-NZ 3Å; D198-K206 PolarHBondContact OD1-NZ 2.94Å; D198-K206 VanDerWaalsContact OD2-CE 3.28Å; D198-K206 WeakPolarHBondContact OD2-CE 3.26Å; D198-K206 IonicContact OD2-NZ 2.8Å; D198-K206 PolarHBondContact OD2-NZ 3.47Å
199	T	92.6	Very high	95.8	Very high	47 Å²	47	29 Å²	29	29%	0.288	15%	0.149	S	C	.	.			trans	-138.5	160.4	176.6	63.9	0	0	0	0	110.2	L197 L201 N202 L203	L197-T199 HydrophobicContact CD2-CG2 4.04Å; L197-T199 HydrophobicContact CG-CG2 3.96Å; L197-T199 PolarHBondContact O-N 3.33Å; L197-T199 VanDerWaalsContact O-N 3.11Å; T199-L201 PolarHBondContact O-N 2.73Å; T199-N202 CarbonylContact O-C 3.56Å; T199-N202 PolarHBondContact O-N 2.64Å; T199-N202 PolarHBondContact OG1-N 2.71Å; T199-N202 PolarHBondContact OG1-ND2 3.49Å; T199-L203 PolarHBondContact O-N 2.77Å
200	Y	88.6	Confident	96	Very high	83 Å²	83	25 Å²	25	33%	0.325	13%	0.128	S	C	.	.	G	3₁₀ helix	trans	-55.1	-38.4	174.3	-177.4	-98.3	0	0	0	112.8	N202 L203 K270	Y200-N202 PolarHBondContact O-N 3.13Å; Y200-L203 HydrophobicContact CD2-CD1 3.51Å; Y200-L203 HydrophobicContact CD2-CG 4.41Å; Y200-L203 HydrophobicContact CE2-CD1 3.54Å; Y200-L203 HydrophobicContact CG-CD1 4.29Å; Y200-L203 VanDerWaalsContact O-CG 3.28Å; Y200-L203 WeakPolarHBondContact O-CG 3.45Å; Y200-L203 PolarHBondContact O-N 3.39Å; Y200-K270 VanDerWaalsContact CE1-O 3.31Å; Y200-K270 WeakPolarHBondContact CE1-O 3.46Å
201	L	90.6	Very high	96	Very high	72 Å²	72	24.3 Å²	24.3	38%	0.377	12%	0.124	S	C	.	.	G	3₁₀ helix	trans	-67	-22.5	178.6	-63.5	178.1	0	0	0	113	T199 N313	T199-L201 PolarHBondContact O-N 2.73Å; L201-N313 HydrophobicContact CD2-CB 3.97Å
202	N	94.9	Very high	96.1	Very high	41 Å²	41	24.8 Å²	24.8	22%	0.219	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-100.5	16.1	-179.1	-67.8	-15.5	0	0	0	113	L197 T199 Y200 T204 I205 K206	L197-N202 WeakPolarHBondContact O-CB 3.4Å; L197-N202 PolarHBondContact O-ND2 2.66Å; T199-N202 CarbonylContact O-C 3.56Å; T199-N202 PolarHBondContact O-N 2.64Å; T199-N202 PolarHBondContact OG1-N 2.71Å; T199-N202 PolarHBondContact OG1-ND2 3.49Å; Y200-N202 PolarHBondContact O-N 3.13Å; N202-T204 PolarHBondContact O-N 2.97Å; N202-I205 HydrophobicContact CB-CB 4.46Å; N202-I205 HydrophobicContact CB-CD1 3.88Å; N202-I205 WeakPolarHBondContact O-CB 3.47Å; N202-I205 PolarHBondContact O-N 3.16Å; N202-I205 VanDerWaalsContact O-N 3.08Å; N202-K206 PolarHBondContact O-N 3Å
203	L	95.1	Very high	96.1	Very high	32 Å²	32	24.9 Å²	24.9	17%	0.168	13%	0.127	C	C	.	.	H	α-helix	trans	-57.2	-37.8	176.2	-77	175.2	0	0	0	112.2	T199 Y200 I205 K206 T207 E315	T199-L203 PolarHBondContact O-N 2.77Å; Y200-L203 HydrophobicContact CD2-CD1 3.51Å; Y200-L203 HydrophobicContact CD2-CG 4.41Å; Y200-L203 HydrophobicContact CE2-CD1 3.54Å; Y200-L203 HydrophobicContact CG-CD1 4.29Å; Y200-L203 VanDerWaalsContact O-CG 3.28Å; Y200-L203 WeakPolarHBondContact O-CG 3.45Å; Y200-L203 PolarHBondContact O-N 3.39Å; L203-I205 VanDerWaalsContact C-N 3.34Å; L203-I205 PolarHBondContact O-N 2.9Å; L203-K206 WeakPolarHBondContact O-CB 3.44Å; L203-K206 PolarHBondContact O-N 3Å; L203-K206 VanDerWaalsContact O-N 3.14Å; L203-T207 PolarHBondContact O-N 3.37Å; L203-T207 PolarHBondContact O-OG1 3.28Å; L203-E315 HydrophobicContact CB-CB 4.08Å; L203-E315 HydrophobicContact CB-CG 4.29Å
204	T	97.3	Very high	96.1	Very high	4 Å²	4	23.8 Å²	23.8	3%	0.025	12%	0.122	C	C	.	.	H	α-helix	trans	-62.1	-40	175.8	-59.7	0	0	0	0	112.3	A110 N202 T207 M208 P311 F312 E315 Y318	A110-T204 HydrophobicContact CB-CG2 3.92Å; N202-T204 PolarHBondContact O-N 2.97Å; T204-T207 PolarHBondContact O-N 3.48Å; T204-M208 VanDerWaalsContact O-CG 3.3Å; T204-M208 WeakPolarHBondContact O-CG 3.38Å; T204-M208 PolarHBondContact O-N 3.01Å; T204-P311 HydrophobicContact CG2-CB 4.1Å; T204-F312 WeakPolarHBondContact CB-O 3.34Å; T204-F312 PolarHBondContact OG1-O 2.69Å; T204-E315 WeakPolarHBondContact OG1-CA 3.35Å; T204-Y318 HydrophobicContact CG2-CD1 3.49Å; T204-Y318 VanDerWaalsContact CG2-CD1 3.49Å; T204-Y318 HydrophobicContact CG2-CD2 3.95Å; T204-Y318 HydrophobicContact CG2-CE1 3.81Å; T204-Y318 HydrophobicContact CG2-CE2 4.25Å; T204-Y318 HydrophobicContact CG2-CG 3.56Å
205	I	97.4	Very high	96.2	Very high	16 Å²	16	25 Å²	25	8%	0.082	13%	0.132	C	C	.	.	H	α-helix	trans	-60.7	-48.8	172.3	-69.3	154	0	0	0	110	A110 Y115 F196 N202 L203 T207 M208 V209	A110-I205 HydrophobicContact CB-CG1 4.11Å; Y115-I205 HydrophobicContact CD2-CG2 3.83Å; Y115-I205 HydrophobicContact CE1-CG2 4.27Å; Y115-I205 HydrophobicContact CE2-CB 4.38Å; Y115-I205 HydrophobicContact CE2-CG1 4.17Å; Y115-I205 HydrophobicContact CE2-CG2 3.35Å; Y115-I205 HydrophobicContact CG-CG2 4.45Å; Y115-I205 VanDerWaalsContact OH-CD1 3.26Å; Y115-I205 WeakPolarHBondContact OH-CD1 3.24Å; F196-I205 HydrophobicContact CB-CG2 3.58Å; F196-I205 HydrophobicContact CD1-CG2 4.1Å; F196-I205 HydrophobicContact CD2-CG2 3.99Å; F196-I205 HydrophobicContact CG-CG2 3.62Å; N202-I205 HydrophobicContact CB-CB 4.46Å; N202-I205 HydrophobicContact CB-CD1 3.88Å; N202-I205 WeakPolarHBondContact O-CB 3.47Å; N202-I205 PolarHBondContact O-N 3.16Å; N202-I205 VanDerWaalsContact O-N 3.08Å; L203-I205 VanDerWaalsContact C-N 3.34Å; L203-I205 PolarHBondContact O-N 2.9Å; I205-T207 VanDerWaalsContact C-N 3.31Å; I205-T207 PolarHBondContact O-N 3.36Å; I205-M208 PolarHBondContact O-N 3Å; I205-M208 VanDerWaalsContact O-N 3.15Å; I205-V209 HydrophobicContact CG2-CG2 4.43Å; I205-V209 WeakPolarHBondContact O-CG2 3.25Å; I205-V209 PolarHBondContact O-N 3.49Å
206	K	98	Very high	96.3	Very high	6 Å²	6	25.3 Å²	25.3	3%	0.026	14%	0.136	C	C	.	.	H	α-helix	trans	-57.4	-44.7	178.7	-175.3	176.7	-64.2	-168.6	0	111.6	P137 V138 V169 F196 D198 N202 L203 V209 I210	P137-K206 HydrophobicContact CB-CD 3.31Å; P137-K206 HydrophobicContact CB-CG 4.07Å; V138-K206 PolarHBondContact O-NZ 3.33Å; V169-K206 HydrophobicContact CG1-CG 4.43Å; F196-K206 HydrophobicContact CE1-CB 4.44Å; F196-K206 HydrophobicContact CE1-CG 4.5Å; F196-K206 HydrophobicContact CE2-CB 3.72Å; F196-K206 HydrophobicContact CE2-CG 4.21Å; F196-K206 HydrophobicContact CZ-CB 3.56Å; F196-K206 HydrophobicContact CZ-CD 4.18Å; F196-K206 HydrophobicContact CZ-CG 3.63Å; D198-K206 WeakPolarHBondContact OD1-CE 3.47Å; D198-K206 IonicContact OD1-NZ 3Å; D198-K206 PolarHBondContact OD1-NZ 2.94Å; D198-K206 VanDerWaalsContact OD2-CE 3.28Å; D198-K206 WeakPolarHBondContact OD2-CE 3.26Å; D198-K206 IonicContact OD2-NZ 2.8Å; D198-K206 PolarHBondContact OD2-NZ 3.47Å; N202-K206 PolarHBondContact O-N 3Å; L203-K206 WeakPolarHBondContact O-CB 3.44Å; L203-K206 PolarHBondContact O-N 3Å; L203-K206 VanDerWaalsContact O-N 3.14Å; K206-V209 WeakPolarHBondContact O-CB 3.47Å; K206-V209 PolarHBondContact O-N 2.89Å; K206-I210 WeakPolarHBondContact O-CG1 3.21Å; K206-I210 PolarHBondContact O-N 3.45Å
207	T	98.6	Very high	96.4	Very high	3 Å²	3	28.2 Å²	28.2	2%	0.018	15%	0.147	C	C	.	.	H	α-helix	trans	-64.4	-41	176.6	-66.9	0	0	0	0	111.7	L203 T204 I205 V209 I210 M211 Y292 E315 I319	L203-T207 PolarHBondContact O-N 3.37Å; L203-T207 PolarHBondContact O-OG1 3.28Å; T204-T207 PolarHBondContact O-N 3.48Å; I205-T207 VanDerWaalsContact C-N 3.31Å; I205-T207 PolarHBondContact O-N 3.36Å; T207-V209 VanDerWaalsContact C-N 3.31Å; T207-V209 PolarHBondContact O-N 3.29Å; T207-I210 VanDerWaalsContact O-CB 3.3Å; T207-I210 WeakPolarHBondContact O-CB 3.48Å; T207-I210 PolarHBondContact O-N 2.98Å; T207-M211 HydrophobicContact CG2-CE 4.07Å; T207-M211 WeakPolarHBondContact O-CG 3.3Å; T207-M211 PolarHBondContact O-N 3.17Å; T207-Y292 WeakPolarHBondContact CG2-OH 3.42Å; T207-E315 WeakPolarHBondContact OG1-CG 3.36Å; T207-I319 HydrophobicContact CG2-CD1 3.85Å; T207-I319 HydrophobicContact CG2-CG1 3.93Å
208	M	98.5	Very high	96.6	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-68	-32.1	176.3	-67.7	-45.7	-55.8	0	0	112.7	A110 P112 T204 I205 M211 D212 F302 V303 Y318 I319	A110-M208 HydrophobicContact CB-CG 4.31Å; A110-M208 WeakPolarHBondContact O-CB 3.29Å; A110-M208 WeakPolarHBondContact O-CG 3.2Å; P112-M208 HydrophobicContact CB-CB 4.42Å; P112-M208 WeakPolarHBondContact CB-O 3.38Å; P112-M208 HydrophobicContact CG-CB 4.35Å; T204-M208 VanDerWaalsContact O-CG 3.3Å; T204-M208 WeakPolarHBondContact O-CG 3.38Å; T204-M208 PolarHBondContact O-N 3.01Å; I205-M208 PolarHBondContact O-N 3Å; I205-M208 VanDerWaalsContact O-N 3.15Å; M208-M211 HydrophobicContact CE-CB 4.35Å; M208-M211 PolarHBondContact O-N 2.84Å; M208-D212 PolarHBondContact O-N 2.91Å; M208-F302 HydrophobicContact CE-CB 4.38Å; M208-F302 WeakPolarHBondContact CE-O 3.42Å; M208-V303 HydrophobicContact CE-CB 4.44Å; M208-V303 HydrophobicContact CE-CG2 4.04Å; M208-Y318 HydrophobicContact CG-CE1 4.17Å; M208-Y318 HydrophobicContact SD-CD1 4.33Å; M208-Y318 HydrophobicContact SD-CE1 3.77Å; M208-I319 HydrophobicContact SD-CD1 4.46Å
209	V	98.4	Very high	96.7	Very high	1 Å²	1	27 Å²	27	1%	0.006	15%	0.146	C	C	.	.	H	α-helix	trans	-64.4	-39.8	169.9	167.6	0	0	0	0	111.4	P112 Y115 F117 V169 F196 I205 K206 T207 M211 D212 W213	P112-V209 HydrophobicContact CB-CG2 4.35Å; Y115-V209 HydrophobicContact CD2-CG2 4.44Å; F117-V209 HydrophobicContact CE1-CG1 3.62Å; F117-V209 HydrophobicContact CZ-CG1 4.19Å; V169-V209 HydrophobicContact CG1-CG1 4.42Å; F196-V209 HydrophobicContact CD1-CG2 4.12Å; F196-V209 HydrophobicContact CE1-CB 4.49Å; F196-V209 HydrophobicContact CE1-CG1 4.48Å; F196-V209 HydrophobicContact CE1-CG2 4.26Å; I205-V209 HydrophobicContact CG2-CG2 4.43Å; I205-V209 WeakPolarHBondContact O-CG2 3.25Å; I205-V209 PolarHBondContact O-N 3.49Å; K206-V209 WeakPolarHBondContact O-CB 3.47Å; K206-V209 PolarHBondContact O-N 2.89Å; T207-V209 VanDerWaalsContact C-N 3.31Å; T207-V209 PolarHBondContact O-N 3.29Å; V209-M211 VanDerWaalsContact C-N 3.32Å; V209-M211 PolarHBondContact O-N 3.26Å; V209-D212 PolarHBondContact O-N 3.28Å; V209-W213 PolarHBondContact O-N 3.27Å
210	I	98.8	Very high	96.8	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-57	-48.4	171.4	-70.5	170	0	0	0	110.1	M135 P137 V169 K206 T207 D212 W213 L214 K226	M135-I210 HydrophobicContact CB-CD1 4.34Å; M135-I210 HydrophobicContact CB-CG1 4.45Å; M135-I210 HydrophobicContact CB-CG2 3.67Å; M135-I210 HydrophobicContact CE-CB 4.27Å; M135-I210 HydrophobicContact CE-CG1 4.3Å; M135-I210 HydrophobicContact CE-CG2 3.81Å; M135-I210 HydrophobicContact CG-CG2 3.77Å; P137-I210 HydrophobicContact CB-CD1 4.21Å; P137-I210 HydrophobicContact CG-CD1 4.27Å; V169-I210 HydrophobicContact CB-CD1 4.34Å; V169-I210 HydrophobicContact CB-CG1 3.97Å; V169-I210 HydrophobicContact CG1-CG1 3.82Å; V169-I210 HydrophobicContact CG2-CD1 4.48Å; V169-I210 HydrophobicContact CG2-CG1 3.91Å; K206-I210 WeakPolarHBondContact O-CG1 3.21Å; K206-I210 PolarHBondContact O-N 3.45Å; T207-I210 VanDerWaalsContact O-CB 3.3Å; T207-I210 WeakPolarHBondContact O-CB 3.48Å; T207-I210 PolarHBondContact O-N 2.98Å; I210-D212 PolarHBondContact O-N 2.83Å; I210-W213 PolarHBondContact O-N 2.95Å; I210-L214 HydrophobicContact CG2-CD1 4Å; I210-L214 WeakPolarHBondContact O-CG 3.42Å; I210-L214 PolarHBondContact O-N 3Å; I210-K226 HydrophobicContact CD1-CG 4.26Å
211	M	98.8	Very high	97.3	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63.1	-41.4	-179.5	-61.1	-52.9	171.2	0	0	112	T207 M208 V209 L214 A215 Y292 F294 P299 F302 V303 I319	T207-M211 HydrophobicContact CG2-CE 4.07Å; T207-M211 WeakPolarHBondContact O-CG 3.3Å; T207-M211 PolarHBondContact O-N 3.17Å; M208-M211 HydrophobicContact CE-CB 4.35Å; M208-M211 PolarHBondContact O-N 2.84Å; V209-M211 VanDerWaalsContact C-N 3.32Å; V209-M211 PolarHBondContact O-N 3.26Å; M211-L214 PolarHBondContact O-N 3.26Å; M211-A215 VanDerWaalsContact O-CB 3.26Å; M211-A215 WeakPolarHBondContact O-CB 3.42Å; M211-A215 PolarHBondContact O-N 3.38Å; M211-Y292 HydrophobicContact CE-CE2 4.17Å; M211-F294 HydrophobicContact CE-CE1 3.99Å; M211-F294 HydrophobicContact CE-CE2 4.45Å; M211-F294 HydrophobicContact CE-CZ 3.88Å; M211-F294 HydrophobicContact SD-CE2 4.01Å; M211-F294 HydrophobicContact SD-CZ 3.86Å; M211-P299 HydrophobicContact CB-CB 4.16Å; M211-P299 WeakPolarHBondContact O-CB 3.46Å; M211-P299 HydrophobicContact SD-CB 4.18Å; M211-P299 HydrophobicContact SD-CG 4.18Å; M211-F302 HydrophobicContact CE-CD2 3.94Å; M211-F302 HydrophobicContact CE-CE2 4.25Å; M211-F302 HydrophobicContact CG-CB 4.29Å; M211-F302 HydrophobicContact CG-CD2 4.25Å; M211-F302 HydrophobicContact SD-CD2 3.83Å; M211-V303 HydrophobicContact CB-CG2 3.85Å; M211-I319 HydrophobicContact CE-CD1 3.9Å; M211-I319 HydrophobicContact CE-CG1 4.49Å
212	D	98.5	Very high	97.6	Very high	11 Å²	11	22.3 Å²	22.3	6%	0.059	14%	0.14	C	C	.	.	H	α-helix	trans	-64.6	-43.7	177.4	-174.1	50.4	0	0	0	112.8	P112 H113 M208 V209 I210 L214 A215 T216 V303	P112-D212 HydrophobicContact CB-CB 3.53Å; P112-D212 HydrophobicContact CG-CB 3.62Å; H113-D212 IonicContact CD2-OD1 2.77Å; H113-D212 PolarHBondContact CD2-OD1 2.8Å; H113-D212 IonicContact CD2-OD2 3.26Å; H113-D212 IonicContact NE2-OD1 2.67Å; H113-D212 PolarHBondContact NE2-OD1 2.83Å; M208-D212 PolarHBondContact O-N 2.91Å; V209-D212 PolarHBondContact O-N 3.28Å; I210-D212 PolarHBondContact O-N 2.83Å; D212-L214 PolarHBondContact O-N 3.3Å; D212-A215 PolarHBondContact O-N 2.63Å; D212-T216 WeakPolarHBondContact O-CB 3.14Å; D212-T216 WeakPolarHBondContact O-CG2 3.17Å; D212-T216 PolarHBondContact O-N 3.3Å; D212-T216 PolarHBondContact O-OG1 3.33Å; D212-V303 HydrophobicContact CB-CG2 4.19Å
213	W	98.6	Very high	97.8	Very high	1 Å²	1	20.5 Å²	20.5	0%	0.004	13%	0.13	C	C	.	.	H	α-helix	trans	-63.1	-44.6	178.1	-167.3	94.9	0	0	0	111.3	F117 D120 C125 M135 L167 I192 V209 I210 A215 T216 R217 C218	F117-W213 HydrophobicContact CE1-CB 3.99Å; F117-W213 AromaticContact CE1-CD1 3.7Å; F117-W213 HydrophobicContact CE1-CG 4.25Å; F117-W213 HydrophobicContact CZ-CB 3.79Å; F117-W213 AromaticContact CZ-CD1 3.87Å; F117-W213 HydrophobicContact CZ-CG 4.27Å; D120-W213 PolarHBondContact O-NE1 3.39Å; D120-W213 PolarHBondContact OD1-NE1 3.37Å; D120-W213 VanDerWaalsContact OD1-NE1 3.16Å; C125-W213 HydrophobicContact CB-CH2 4.01Å; C125-W213 HydrophobicContact CB-CZ3 4.49Å; M135-W213 HydrophobicContact CE-CB 4.46Å; M135-W213 HydrophobicContact CE-CD2 4.46Å; M135-W213 HydrophobicContact CE-CE3 3.94Å; M135-W213 HydrophobicContact SD-CE3 4.46Å; L167-W213 HydrophobicContact CD1-CE3 4.38Å; L167-W213 HydrophobicContact CD1-CH2 3.44Å; L167-W213 VanDerWaalsContact CD1-CH2 3.44Å; L167-W213 HydrophobicContact CD1-CZ2 4.23Å; L167-W213 HydrophobicContact CD1-CZ3 3.52Å; I192-W213 HydrophobicContact CD1-CD2 3.44Å; I192-W213 VanDerWaalsContact CD1-CD2 3.44Å; I192-W213 HydrophobicContact CD1-CE3 3.9Å; I192-W213 HydrophobicContact CD1-CG 3.81Å; I192-W213 HydrophobicContact CD1-CH2 4.21Å; I192-W213 HydrophobicContact CD1-CZ2 3.78Å; I192-W213 HydrophobicContact CD1-CZ3 4.25Å; I192-W213 HydrophobicContact CG1-CD2 4.42Å; I192-W213 HydrophobicContact CG1-CZ2 4.37Å; I192-W213 HydrophobicContact CG2-CG 4.25Å; V209-W213 PolarHBondContact O-N 3.27Å; I210-W213 PolarHBondContact O-N 2.95Å; W213-A215 PolarHBondContact O-N 3.09Å; W213-T216 PolarHBondContact O-N 2.89Å; W213-R217 HydrophobicContact CD2-CB 3.88Å; W213-R217 HydrophobicContact CD2-CG 4.15Å; W213-R217 HydrophobicContact CE3-CB 4.3Å; W213-R217 HydrophobicContact CG-CB 4.34Å; W213-R217 HydrophobicContact CG-CG 4.09Å; W213-R217 HydrophobicContact CH2-CB 4.32Å; W213-R217 HydrophobicContact CZ2-CB 3.91Å; W213-R217 WeakPolarHBondContact O-CA 3.35Å; W213-R217 VanDerWaalsContact O-CB 3.24Å; W213-R217 WeakPolarHBondContact O-CB 3.33Å; W213-R217 PolarHBondContact O-N 2.92Å; W213-C218 HydrophobicContact CE3-CB 4.17Å; W213-C218 HydrophobicContact CH2-CB 4.21Å; W213-C218 HydrophobicContact CZ3-CB 3.55Å; W213-C218 PolarHBondContact O-N 2.95Å
214	L	98.6	Very high	98	Very high	0 Å²	0	19 Å²	19	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-60.8	-46.8	175.6	-72.1	171.2	0	0	0	111.7	V133 M135 I210 M211 D212 T216 C218 A224 F294 P299	V133-L214 HydrophobicContact CB-CD2 4.11Å; V133-L214 HydrophobicContact CG1-CD2 4.06Å; V133-L214 HydrophobicContact CG2-CD2 4.45Å; M135-L214 HydrophobicContact CE-CD2 4.4Å; M135-L214 HydrophobicContact CE-CG 4.18Å; M135-L214 HydrophobicContact CG-CD1 4.07Å; M135-L214 HydrophobicContact CG-CD2 4.1Å; M135-L214 HydrophobicContact CG-CG 4.25Å; M135-L214 HydrophobicContact SD-CD2 4.06Å; M135-L214 HydrophobicContact SD-CG 4.4Å; I210-L214 HydrophobicContact CG2-CD1 4Å; I210-L214 WeakPolarHBondContact O-CG 3.42Å; I210-L214 PolarHBondContact O-N 3Å; M211-L214 PolarHBondContact O-N 3.26Å; D212-L214 PolarHBondContact O-N 3.3Å; L214-T216 VanDerWaalsContact C-N 3.34Å; L214-T216 PolarHBondContact O-N 3.29Å; L214-C218 HydrophobicContact CD2-CB 4.33Å; L214-C218 CarbonylContact O-C 3.6Å; L214-C218 WeakPolarHBondContact O-CA 3.4Å; L214-C218 PolarHBondContact O-N 2.7Å; L214-C218 VanDerWaalsContact O-N 3.11Å; L214-A224 HydrophobicContact CD1-CB 3.61Å; L214-A224 HydrophobicContact CD2-CB 3.99Å; L214-A224 HydrophobicContact CG-CB 4.47Å; L214-F294 HydrophobicContact CD1-CE2 3.65Å; L214-F294 HydrophobicContact CD1-CZ 3.66Å; L214-P299 HydrophobicContact CB-CB 3.95Å; L214-P299 HydrophobicContact CB-CG 3.9Å; L214-P299 HydrophobicContact CD1-CG 4.06Å
215	A	98.2	Very high	98.1	Very high	25 Å²	25	18.8 Å²	18.8	21%	0.207	12%	0.121	C	C	.	.	H	α-helix	trans	-62.4	-39.6	-179	0	0	0	0	0	112.8	M211 D212 W213 P299 A300	M211-A215 VanDerWaalsContact O-CB 3.26Å; M211-A215 WeakPolarHBondContact O-CB 3.42Å; M211-A215 PolarHBondContact O-N 3.38Å; D212-A215 PolarHBondContact O-N 2.63Å; W213-A215 PolarHBondContact O-N 3.09Å; A215-P299 HydrophobicContact CB-CB 4.1Å; A215-A300 HydrophobicContact CB-CB 3.92Å
216	T	97.3	Very high	98.1	Very high	70 Å²	70	18 Å²	18	43%	0.429	12%	0.117	S	C	.	.	H	α-helix	trans	-97.7	-31.6	-171.4	61.5	0	0	0	0	113.4	D212 W213 L214	D212-T216 WeakPolarHBondContact O-CB 3.14Å; D212-T216 WeakPolarHBondContact O-CG2 3.17Å; D212-T216 PolarHBondContact O-N 3.3Å; D212-T216 PolarHBondContact O-OG1 3.33Å; W213-T216 PolarHBondContact O-N 2.89Å; L214-T216 VanDerWaalsContact C-N 3.34Å; L214-T216 PolarHBondContact O-N 3.29Å
217	R	97.5	Very high	98.2	Very high	64 Å²	64	17.8 Å²	17.8	24%	0.242	12%	0.116	C	C	.	.	H	α-helix	trans	-112.1	-22.3	-172.1	-48.2	-47.7	-179.6	80.7	5.2	114	D120 W213 P219	D120-R217 IonicContact OD1-CZ 3.24Å; D120-R217 IonicContact OD1-NH1 3.63Å; D120-R217 PolarHBondContact OD1-NH1 3.07Å; D120-R217 IonicContact OD1-NH2 3.36Å; D120-R217 IonicContact OD2-CZ 3.02Å; D120-R217 IonicContact OD2-NH1 2.73Å; D120-R217 PolarHBondContact OD2-NH1 2.74Å; D120-R217 IonicContact OD2-NH2 3.1Å; D120-R217 PolarHBondContact OD2-NH2 3.38Å; W213-R217 HydrophobicContact CD2-CB 3.88Å; W213-R217 HydrophobicContact CD2-CG 4.15Å; W213-R217 HydrophobicContact CE3-CB 4.3Å; W213-R217 HydrophobicContact CG-CB 4.34Å; W213-R217 HydrophobicContact CG-CG 4.09Å; W213-R217 HydrophobicContact CH2-CB 4.32Å; W213-R217 HydrophobicContact CZ2-CB 3.91Å; W213-R217 WeakPolarHBondContact O-CA 3.35Å; W213-R217 VanDerWaalsContact O-CB 3.24Å; W213-R217 WeakPolarHBondContact O-CB 3.33Å; W213-R217 PolarHBondContact O-N 2.92Å; R217-P219 VanDerWaalsContact C-CD 3.42Å
218	C	97.8	Very high	98.1	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	12%	0.124	C	C	.	.			trans	-132.3	44.5	-178	-158.7	0	0	0	0	114.7	C125 V133 W213 L214 A220 A221 N296	C125-C218 HydrophobicContact CB-CB 3.52Å; C125-C218 WeakPolarHBondContact CB-SG 3.04Å; C125-C218 WeakPolarHBondContact SG-CA 3.23Å; C125-C218 WeakPolarHBondContact SG-CB 3.5Å; C125-C218 CovalentContact SG-SG 2.01Å; C125-C218 PolarHBondContact SG-SG 2.94Å; V133-C218 VanDerWaalsContact CG2-SG 3.57Å; W213-C218 HydrophobicContact CE3-CB 4.17Å; W213-C218 HydrophobicContact CH2-CB 4.21Å; W213-C218 HydrophobicContact CZ3-CB 3.55Å; W213-C218 PolarHBondContact O-N 2.95Å; L214-C218 HydrophobicContact CD2-CB 4.33Å; L214-C218 CarbonylContact O-C 3.6Å; L214-C218 WeakPolarHBondContact O-CA 3.4Å; L214-C218 PolarHBondContact O-N 2.7Å; L214-C218 VanDerWaalsContact O-N 3.11Å; C218-A220 PolarHBondContact O-N 2.77Å; C218-A220 VanDerWaalsContact O-N 3.16Å; C218-A221 PolarHBondContact O-N 3.02Å; C218-N296 PolarHBondContact O-ND2 2.77Å
219	P	96.5	Very high	98.1	Very high	90 Å²	90	20.5 Å²	20.5	58%	0.584	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-17.9	-173	29.8	-37.5	0	0	0	114.1	R217	R217-P219 VanDerWaalsContact C-CD 3.42Å
220	A	95.2	Very high	98.1	Very high	73 Å²	73	23.6 Å²	23.6	60%	0.603	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-14.4	-175	0	0	0	0	0	114.2	L129 C218	L129-A220 HydrophobicContact CD2-CB 4.42Å; C218-A220 PolarHBondContact O-N 2.77Å; C218-A220 VanDerWaalsContact O-N 3.16Å
221	A	97.9	Very high	98	Very high	7 Å²	7	23.6 Å²	23.6	6%	0.058	15%	0.148	C	C	.	.			trans	-63.9	148.3	178.1	0	0	0	0	0	111.2	P130 V133 C218 N296	P130-A221 HydrophobicContact CG-CB 4.3Å; P130-A221 WeakPolarHBondContact O-CA 3.27Å; P130-A221 WeakPolarHBondContact O-CB 3.31Å; V133-A221 HydrophobicContact CG2-CB 3.8Å; C218-A221 PolarHBondContact O-N 3.02Å; A221-N296 HydrophobicContact CB-CB 4.47Å; A221-N296 WeakPolarHBondContact O-CB 3.28Å; A221-N296 PolarHBondContact O-ND2 2.9Å
222	A	98.1	Very high	98	Very high	25 Å²	25	23.6 Å²	23.6	21%	0.207	15%	0.148	C	C	.	.	S	Bend	trans	-77.6	-44.5	177.7	0	0	0	0	0	110.8	F131 N296	F131-A222 HydrophobicContact CD2-CB 3.83Å; F131-A222 HydrophobicContact CE2-CB 3.98Å; F131-A222 WeakPolarHBondContact O-CB 3.37Å; F131-A222 PolarHBondContact O-N 2.86Å; F131-A222 VanDerWaalsContact O-N 3.12Å; A222-N296 PolarHBondContact O-N 2.94Å
223	Y	98.9	Very high	98	Very high	2 Å²	2	23 Å²	23	1%	0.008	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	157.2	-178.7	-59.2	-79.5	0	0	0	111.2	F131 L132 V133 L242 I247 P248 Q249 Y252 F294	F131-Y223 HydrophobicContact CE1-CD2 4.1Å; F131-Y223 AromaticContact CE2-CD2 3.83Å; F131-Y223 HydrophobicContact CE2-CD2 3.83Å; F131-Y223 AromaticContact CE2-CE2 3.8Å; F131-Y223 HydrophobicContact CE2-CE2 3.8Å; F131-Y223 AromaticContact CZ-CD2 3.55Å; F131-Y223 HydrophobicContact CZ-CD2 3.55Å; F131-Y223 AromaticContact CZ-CE2 3.62Å; F131-Y223 HydrophobicContact CZ-CE2 3.62Å; F131-Y223 PolarHBondContact O-N 3.29Å; L132-Y223 WeakPolarHBondContact CA-O 3.36Å; V133-Y223 PolarHBondContact N-O 3.46Å; V133-Y223 VanDerWaalsContact N-O 3.09Å; Y223-L242 HydrophobicContact CD1-CD2 3.86Å; Y223-L242 HydrophobicContact CD2-CB 4.21Å; Y223-L242 HydrophobicContact CD2-CD1 3.96Å; Y223-L242 HydrophobicContact CD2-CD2 4.18Å; Y223-L242 HydrophobicContact CD2-CG 4.35Å; Y223-L242 HydrophobicContact CE1-CD2 3.92Å; Y223-L242 HydrophobicContact CE2-CB 4.05Å; Y223-L242 HydrophobicContact CE2-CD2 4.22Å; Y223-L242 HydrophobicContact CG-CD1 3.98Å; Y223-L242 HydrophobicContact CG-CD2 3.99Å; Y223-L242 HydrophobicContact CG-CG 4.47Å; Y223-I247 HydrophobicContact CE1-CG2 4.4Å; Y223-P248 WeakPolarHBondContact CE1-O 3.43Å; Y223-P248 PolarHBondContact OH-O 2.85Å; Y223-Q249 HydrophobicContact CE2-CG 4.37Å; Y223-Q249 WeakPolarHBondContact OH-CG 3.4Å; Y223-Y252 HydrophobicContact CD1-CD1 4.36Å; Y223-Y252 AromaticContact CE1-CD1 3.95Å; Y223-Y252 HydrophobicContact CE1-CD1 3.95Å; Y223-Y252 HydrophobicContact CE1-CE1 4.45Å; Y223-F294 WeakPolarHBondContact CA-O 3.4Å
224	A	98.9	Very high	97.9	Very high	0 Å²	0	23 Å²	23	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	156.7	165	0	0	0	0	0	109.8	V133 L214 V293 F294	V133-A224 HydrophobicContact CB-CB 4.34Å; V133-A224 CarbonylContact O-C 3.38Å; V133-A224 WeakPolarHBondContact O-CA 3.5Å; L214-A224 HydrophobicContact CD1-CB 3.61Å; L214-A224 HydrophobicContact CD2-CB 3.99Å; L214-A224 HydrophobicContact CG-CB 4.47Å; A224-V293 WeakPolarHBondContact O-CA 3.18Å; A224-F294 HydrophobicContact CB-CD2 4.2Å; A224-F294 HydrophobicContact CB-CE2 3.52Å; A224-F294 HydrophobicContact CB-CZ 3.72Å; A224-F294 PolarHBondContact N-O 2.73Å; A224-F294 PolarHBondContact O-N 2.67Å
225	M	98.8	Very high	97.9	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	128.1	175.1	-178.5	178.5	-175.8	0	0	108.6	L132 V133 L134 M135 V227 L233 L238 Y292 V293 T356	L132-M225 HydrophobicContact CD1-CB 4.43Å; V133-M225 PolarHBondContact O-N 3.06Å; L134-M225 HydrophobicContact CD2-CB 3.83Å; L134-M225 HydrophobicContact CD2-CG 4.44Å; L134-M225 HydrophobicContact CD2-SD 4.14Å; M135-M225 PolarHBondContact N-O 3.36Å; M225-V227 HydrophobicContact CE-CB 3.95Å; M225-V227 HydrophobicContact CE-CG2 3.99Å; M225-V227 HydrophobicContact CG-CB 4.28Å; M225-V227 HydrophobicContact SD-CB 4.32Å; M225-L233 HydrophobicContact CE-CD1 3.76Å; M225-L233 HydrophobicContact SD-CD1 3.82Å; M225-L233 HydrophobicContact SD-CD2 4.1Å; M225-L238 HydrophobicContact SD-CD2 3.5Å; M225-L238 WeakPolarHBondContact SD-CD2 3.1Å; M225-Y292 VanDerWaalsContact CA-O 3.29Å; M225-Y292 WeakPolarHBondContact CA-O 3.46Å; M225-Y292 WeakPolarHBondContact CG-O 3.26Å; M225-V293 HydrophobicContact CB-CG2 4.09Å; M225-V293 HydrophobicContact CE-CG2 4.36Å; M225-V293 HydrophobicContact CG-CG2 3.79Å; M225-V293 HydrophobicContact SD-CG2 3.85Å; M225-T356 HydrophobicContact CE-CG2 3.77Å
226	K	98.8	Very high	98	Very high	1 Å²	1	23.9 Å²	23.9	0%	0.004	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	131	159.1	179.4	-95.8	177.6	170.9	0	106.9	M135 P137 I210 D228 G289 G291 Y292 E315	M135-K226 WeakPolarHBondContact O-CA 3.44Å; P137-K226 HydrophobicContact CG-CD 4.3Å; P137-K226 HydrophobicContact CG-CG 4.14Å; I210-K226 HydrophobicContact CD1-CG 4.26Å; K226-D228 WeakPolarHBondContact CE-OD1 3.31Å; K226-D228 VanDerWaalsContact NZ-CG 3.32Å; K226-D228 IonicContact NZ-OD1 2.71Å; K226-D228 PolarHBondContact NZ-OD1 2.89Å; K226-D228 IonicContact NZ-OD2 2.64Å; K226-D228 PolarHBondContact NZ-OD2 3.35Å; K226-G289 PolarHBondContact NZ-O 2.73Å; K226-G291 CarbonylContact O-C 3.56Å; K226-G291 WeakPolarHBondContact O-CA 3.21Å; K226-Y292 HydrophobicContact CB-CD2 4.41Å; K226-Y292 HydrophobicContact CB-CE1 4.17Å; K226-Y292 HydrophobicContact CB-CE2 3.82Å; K226-Y292 HydrophobicContact CD-CD1 4.37Å; K226-Y292 HydrophobicContact CD-CE1 3.69Å; K226-Y292 HydrophobicContact CG-CE1 4.35Å; K226-Y292 PolarHBondContact N-O 2.88Å; K226-Y292 PolarHBondContact O-N 3.03Å; K226-E315 IonicContact NZ-OE1 2.73Å; K226-E315 PolarHBondContact NZ-OE1 3.3Å
227	V	98.7	Very high	98	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	131.5	178.8	62.6	0	0	0	0	110.1	M135 V136 P137 W153 M225 V231 L233 M290	M135-V227 PolarHBondContact O-N 2.85Å; M135-V227 VanDerWaalsContact O-N 3.09Å; V136-V227 WeakPolarHBondContact CA-O 3.42Å; V136-V227 HydrophobicContact CG2-CG1 3.96Å; P137-V227 WeakPolarHBondContact CD-O 3.41Å; W153-V227 HydrophobicContact CH2-CG1 3.76Å; W153-V227 HydrophobicContact CZ3-CG1 4.27Å; M225-V227 HydrophobicContact CE-CB 3.95Å; M225-V227 HydrophobicContact CE-CG2 3.99Å; M225-V227 HydrophobicContact CG-CB 4.28Å; M225-V227 HydrophobicContact SD-CB 4.32Å; V227-V231 HydrophobicContact CG2-CB 3.89Å; V227-V231 HydrophobicContact CG2-CG1 3.83Å; V227-V231 HydrophobicContact CG2-CG2 4.37Å; V227-L233 HydrophobicContact CG1-CD2 4.43Å; V227-M290 WeakPolarHBondContact CA-O 3.14Å
228	D	98.4	Very high	98.1	Very high	38 Å²	38	18.7 Å²	18.7	20%	0.203	12%	0.121	C	C	.	.			trans	-69.7	155.1	179.2	-72.9	-27.2	0	0	0	111.5	K226 D230 V231 M290	K226-D228 WeakPolarHBondContact CE-OD1 3.31Å; K226-D228 VanDerWaalsContact NZ-CG 3.32Å; K226-D228 IonicContact NZ-OD1 2.71Å; K226-D228 PolarHBondContact NZ-OD1 2.89Å; K226-D228 IonicContact NZ-OD2 2.64Å; K226-D228 PolarHBondContact NZ-OD2 3.35Å; D228-D230 VanDerWaalsContact CB-OD1 3.23Å; D228-D230 WeakPolarHBondContact CB-OD1 3.38Å; D228-D230 PolarHBondContact O-N 2.82Å; D228-V231 HydrophobicContact CB-CG2 4.15Å; D228-V231 PolarHBondContact O-N 3.16Å; D228-M290 PolarHBondContact N-O 3.13Å; D228-M290 WeakPolarHBondContact OD2-CA 3.07Å
229	S	98	Very high	98.1	Very high	22 Å²	22	18.7 Å²	18.7	15%	0.154	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-10.8	-175	62	0	0	0	0	114.1
230	D	96.9	Very high	98.2	Very high	66 Å²	66	17.8 Å²	17.8	35%	0.353	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.6	30.9	177	62.9	-9.6	0	0	0	111.8	D228 L359	D228-D230 VanDerWaalsContact CB-OD1 3.23Å; D228-D230 WeakPolarHBondContact CB-OD1 3.38Å; D228-D230 PolarHBondContact O-N 2.82Å; D230-L359 WeakPolarHBondContact O-CA 3.45Å; D230-L359 WeakPolarHBondContact O-CB 3.49Å; D230-L359 PolarHBondContact O-N 3.45Å
231	V	97.9	Very high	98.4	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	135.5	-177.8	174.1	0	0	0	0	111.5	W153 V227 D228 M290 T356 Y357 I358	W153-V231 PolarHBondContact NE1-O 3.35Å; V227-V231 HydrophobicContact CG2-CB 3.89Å; V227-V231 HydrophobicContact CG2-CG1 3.83Å; V227-V231 HydrophobicContact CG2-CG2 4.37Å; D228-V231 HydrophobicContact CB-CG2 4.15Å; D228-V231 PolarHBondContact O-N 3.16Å; V231-M290 HydrophobicContact CG2-CB 4Å; V231-M290 WeakPolarHBondContact CG2-O 3.23Å; V231-T356 HydrophobicContact CG1-CG2 4.36Å; V231-Y357 CarbonylContact C-O 3.6Å; V231-Y357 WeakPolarHBondContact CA-O 3.47Å; V231-I358 HydrophobicContact CG2-CG1 4.46Å
232	F	97.8	Very high	98.4	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	118.5	157.9	-176.1	-81.2	0	0	0	108.3	N234 F351 T356 Y357 L359 L365 W369 Y372	F232-N234 HydrophobicContact CE1-CB 4.18Å; F232-F351 HydrophobicContact CB-CE1 4.1Å; F232-F351 AromaticContact CD1-CD1 3.74Å; F232-F351 HydrophobicContact CD1-CD1 3.74Å; F232-F351 HydrophobicContact CD1-CE1 4.14Å; F232-F351 AromaticContact CD2-CD1 3.93Å; F232-F351 HydrophobicContact CD2-CD1 3.93Å; F232-F351 HydrophobicContact CD2-CE1 4.07Å; F232-F351 AromaticContact CE1-CD1 3.82Å; F232-F351 HydrophobicContact CE1-CD1 3.82Å; F232-F351 AromaticContact CE2-CD1 3.97Å; F232-F351 HydrophobicContact CE2-CD1 3.97Å; F232-F351 AromaticContact CG-CD1 3.81Å; F232-F351 HydrophobicContact CG-CD1 3.81Å; F232-F351 AromaticContact CG-CE1 3.85Å; F232-F351 HydrophobicContact CG-CE1 3.85Å; F232-F351 AromaticContact CZ-CD1 3.94Å; F232-F351 HydrophobicContact CZ-CD1 3.94Å; F232-T356 WeakPolarHBondContact O-CA 3.28Å; F232-Y357 PolarHBondContact N-O 2.95Å; F232-Y357 PolarHBondContact O-N 3.07Å; F232-Y357 VanDerWaalsContact O-N 3.11Å; F232-L359 HydrophobicContact CB-CD1 3.97Å; F232-L359 HydrophobicContact CB-CD2 4.19Å; F232-L359 HydrophobicContact CB-CG 4.18Å; F232-L365 HydrophobicContact CD2-CD1 4.29Å; F232-W369 HydrophobicContact CD2-CE3 4.22Å; F232-W369 HydrophobicContact CE1-CZ3 4.36Å; F232-W369 AromaticContact CE2-CE3 3.49Å; F232-W369 HydrophobicContact CE2-CE3 3.49Å; F232-W369 VanDerWaalsContact CE2-CE3 3.49Å; F232-W369 HydrophobicContact CE2-CZ3 4.08Å; F232-W369 AromaticContact CZ-CE3 3.67Å; F232-W369 HydrophobicContact CZ-CE3 3.67Å; F232-W369 AromaticContact CZ-CZ3 3.79Å; F232-W369 HydrophobicContact CZ-CZ3 3.79Å; F232-Y372 HydrophobicContact CE2-CG 4.5Å; F232-Y372 AromaticContact CZ-CD1 3.91Å; F232-Y372 HydrophobicContact CZ-CD1 3.91Å; F232-Y372 HydrophobicContact CZ-CD2 4.39Å; F232-Y372 HydrophobicContact CZ-CE1 4.35Å; F232-Y372 AromaticContact CZ-CG 3.95Å; F232-Y372 HydrophobicContact CZ-CG 3.95Å
233	L	98.5	Very high	98.4	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	119.3	176.8	-178.3	62.9	0	0	0	110.8	L134 W153 M225 V227 V235 L238 I355 T356	L134-L233 HydrophobicContact CD1-CD2 3.78Å; L134-L233 HydrophobicContact CD2-CD2 3.89Å; L134-L233 HydrophobicContact CG-CD2 4.45Å; W153-L233 HydrophobicContact CB-CB 4.34Å; W153-L233 WeakPolarHBondContact CB-O 3.23Å; W153-L233 HydrophobicContact CD2-CB 3.78Å; W153-L233 HydrophobicContact CD2-CD2 4.38Å; W153-L233 HydrophobicContact CE3-CB 4.15Å; W153-L233 HydrophobicContact CE3-CD2 3.88Å; W153-L233 HydrophobicContact CG-CB 3.87Å; W153-L233 HydrophobicContact CZ3-CD2 4.03Å; M225-L233 HydrophobicContact CE-CD1 3.76Å; M225-L233 HydrophobicContact SD-CD1 3.82Å; M225-L233 HydrophobicContact SD-CD2 4.1Å; V227-L233 HydrophobicContact CG1-CD2 4.43Å; L233-V235 HydrophobicContact CD2-CG2 3.91Å; L233-V235 HydrophobicContact CG-CG2 3.93Å; L233-V235 PolarHBondContact O-N 3.5Å; L233-L238 HydrophobicContact CD1-CD2 4.28Å; L233-I355 CarbonylContact C-O 3.54Å; L233-I355 WeakPolarHBondContact CA-O 3.43Å; L233-I355 HydrophobicContact CD1-CG2 4Å; L233-T356 HydrophobicContact CD1-CG2 4.15Å
234	N	98.2	Very high	98.3	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.108	C	C	.	.			trans	-87.4	90.6	168.6	-164.9	-44.6	0	0	0	109.7	F232 D236 N237 L238 F351 I354 I355 Y372	F232-N234 HydrophobicContact CE1-CB 4.18Å; N234-D236 VanDerWaalsContact C-N 3.29Å; N234-D236 PolarHBondContact O-N 2.7Å; N234-D236 PolarHBondContact OD1-N 3.12Å; N234-N237 HydrophobicContact CB-CB 4.14Å; N234-N237 PolarHBondContact ND2-ND2 3.47Å; N234-N237 PolarHBondContact O-N 3.47Å; N234-N237 PolarHBondContact OD1-N 2.97Å; N234-L238 PolarHBondContact O-N 3.08Å; N234-L238 VanDerWaalsContact O-N 3.08Å; N234-F351 PolarHBondContact ND2-O 3.49Å; N234-I354 WeakPolarHBondContact CB-O 3.48Å; N234-I355 PolarHBondContact N-O 3.31Å; N234-Y372 PolarHBondContact ND2-OH 2.93Å
235	V	98.7	Very high	98.1	Very high	4 Å²	4	28 Å²	28	2%	0.024	15%	0.15	C	C	.	.	H	α-helix	trans	-65.2	-33.4	-176.8	-171	0	0	0	0	111.5	L134 W153 V159 V164 L233 L238 V239	L134-V235 HydrophobicContact CD1-CG2 4.13Å; W153-V235 HydrophobicContact CB-CG2 4.19Å; W153-V235 WeakPolarHBondContact O-CG2 3.39Å; V159-V235 HydrophobicContact CB-CG1 4.18Å; V159-V235 HydrophobicContact CG1-CB 4.29Å; V159-V235 HydrophobicContact CG1-CG1 3.96Å; V159-V235 HydrophobicContact CG2-CG1 4.01Å; V164-V235 HydrophobicContact CG1-CG1 4.11Å; V164-V235 HydrophobicContact CG2-CG1 4.2Å; L233-V235 HydrophobicContact CD2-CG2 3.91Å; L233-V235 HydrophobicContact CG-CG2 3.93Å; L233-V235 PolarHBondContact O-N 3.5Å; V235-L238 PolarHBondContact O-N 2.83Å; V235-V239 HydrophobicContact CG1-CG2 4.23Å; V235-V239 WeakPolarHBondContact O-CG2 3.47Å; V235-V239 PolarHBondContact O-N 2.77Å
236	D	98.3	Very high	97.9	Very high	39 Å²	39	31.7 Å²	31.7	21%	0.209	19%	0.188	C	C	.	.	H	α-helix	trans	-58.6	-52.7	174.9	-72.1	-75.9	0	0	0	111.2	V159 Q160 N234 L238 V239 I240	V159-D236 HydrophobicContact CG1-CB 4.41Å; V159-D236 WeakPolarHBondContact CG1-OD1 3.5Å; Q160-D236 HydrophobicContact CG-CB 4.31Å; Q160-D236 PolarHBondContact NE2-OD1 3.12Å; N234-D236 VanDerWaalsContact C-N 3.29Å; N234-D236 PolarHBondContact O-N 2.7Å; N234-D236 PolarHBondContact OD1-N 3.12Å; D236-L238 VanDerWaalsContact C-N 3.28Å; D236-L238 PolarHBondContact O-N 3.39Å; D236-V239 PolarHBondContact O-N 2.79Å; D236-I240 WeakPolarHBondContact O-CB 3.39Å; D236-I240 WeakPolarHBondContact O-CD1 3.26Å; D236-I240 VanDerWaalsContact O-CG1 3.24Å; D236-I240 WeakPolarHBondContact O-CG1 3.35Å; D236-I240 PolarHBondContact O-N 2.72Å
237	N	98.4	Very high	97.9	Very high	25 Å²	25	33 Å²	33	13%	0.134	19%	0.194	C	C	.	.	H	α-helix	trans	-62.8	-36.6	178.7	-74.4	-16.9	0	0	0	112.2	N234 M241 S352 I354 I355	N234-N237 HydrophobicContact CB-CB 4.14Å; N234-N237 PolarHBondContact ND2-ND2 3.47Å; N234-N237 PolarHBondContact O-N 3.47Å; N234-N237 PolarHBondContact OD1-N 2.97Å; N237-M241 WeakPolarHBondContact O-CB 3.4Å; N237-M241 PolarHBondContact O-N 3.22Å; N237-S352 PolarHBondContact ND2-O 2.96Å; N237-I354 PolarHBondContact ND2-O 2.94Å; N237-I355 HydrophobicContact CB-CG1 3.79Å
238	L	98.8	Very high	97.8	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-62.9	-50.8	175.6	175.1	55.6	0	0	0	111.6	L132 L134 M225 L233 N234 V235 D236 I240 M241 L242 V293 I355	L132-L238 HydrophobicContact CD2-CD2 3.67Å; L132-L238 HydrophobicContact CD2-CG 4.06Å; L134-L238 HydrophobicContact CD2-CD2 4.22Å; M225-L238 HydrophobicContact SD-CD2 3.5Å; M225-L238 WeakPolarHBondContact SD-CD2 3.1Å; L233-L238 HydrophobicContact CD1-CD2 4.28Å; N234-L238 PolarHBondContact O-N 3.08Å; N234-L238 VanDerWaalsContact O-N 3.08Å; V235-L238 PolarHBondContact O-N 2.83Å; D236-L238 VanDerWaalsContact C-N 3.28Å; D236-L238 PolarHBondContact O-N 3.39Å; L238-I240 VanDerWaalsContact C-N 3.35Å; L238-I240 PolarHBondContact O-N 3.45Å; L238-M241 HydrophobicContact CD1-CE 3.97Å; L238-M241 WeakPolarHBondContact O-CB 3.43Å; L238-M241 PolarHBondContact O-N 3.33Å; L238-L242 HydrophobicContact CD1-CD1 3.92Å; L238-L242 HydrophobicContact CD1-CG 4.1Å; L238-L242 HydrophobicContact CG-CD1 4.14Å; L238-L242 WeakPolarHBondContact O-CG 3.3Å; L238-L242 PolarHBondContact O-N 3.11Å; L238-V293 HydrophobicContact CD1-CG1 4.36Å; L238-V293 HydrophobicContact CD1-CG2 3.6Å; L238-V293 HydrophobicContact CD2-CG2 4.47Å; L238-I355 HydrophobicContact CB-CG2 4.02Å; L238-I355 HydrophobicContact CD1-CG2 4.38Å
239	V	98.8	Very high	97.7	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-65.5	-40.5	-180	177.1	0	0	0	0	110.7	F131 L132 V159 Q160 E162 V164 V235 D236 M241 L242 K243	F131-V239 HydrophobicContact CE1-CG1 4.16Å; L132-V239 HydrophobicContact CD2-CG2 4.17Å; V159-V239 HydrophobicContact CB-CG2 4.42Å; V159-V239 HydrophobicContact CG1-CG2 4.25Å; Q160-V239 HydrophobicContact CB-CB 4.13Å; Q160-V239 HydrophobicContact CB-CG1 3.71Å; Q160-V239 HydrophobicContact CG-CB 4.35Å; Q160-V239 HydrophobicContact CG-CG1 4.45Å; E162-V239 HydrophobicContact CB-CG1 4.09Å; E162-V239 HydrophobicContact CG-CG1 3.73Å; V164-V239 HydrophobicContact CG2-CG2 4.06Å; V235-V239 HydrophobicContact CG1-CG2 4.23Å; V235-V239 WeakPolarHBondContact O-CG2 3.47Å; V235-V239 PolarHBondContact O-N 2.77Å; D236-V239 PolarHBondContact O-N 2.79Å; V239-M241 VanDerWaalsContact C-N 3.31Å; V239-M241 PolarHBondContact O-N 3.48Å; V239-L242 PolarHBondContact O-N 3.12Å; V239-K243 HydrophobicContact CG1-CD 3.69Å; V239-K243 HydrophobicContact CG1-CG 4.29Å; V239-K243 WeakPolarHBondContact O-CB 3.18Å; V239-K243 VanDerWaalsContact O-CG 3.32Å; V239-K243 WeakPolarHBondContact O-CG 3.43Å; V239-K243 PolarHBondContact O-N 3.22Å
240	I	98.5	Very high	97.7	Very high	72 Å²	72	46.2 Å²	46.2	37%	0.369	26%	0.255	S	S	.	.	H	α-helix	trans	-56.7	-46.9	172.8	-71.8	163.3	0	0	0	110.5	Q160 D236 L238 K243 K244	Q160-I240 HydrophobicContact CG-CD1 4.37Å; Q160-I240 HydrophobicContact CG-CG1 4Å; D236-I240 WeakPolarHBondContact O-CB 3.39Å; D236-I240 WeakPolarHBondContact O-CD1 3.26Å; D236-I240 VanDerWaalsContact O-CG1 3.24Å; D236-I240 WeakPolarHBondContact O-CG1 3.35Å; D236-I240 PolarHBondContact O-N 2.72Å; L238-I240 VanDerWaalsContact C-N 3.35Å; L238-I240 PolarHBondContact O-N 3.45Å; I240-K243 PolarHBondContact O-N 2.91Å; I240-K244 PolarHBondContact O-N 3.27Å
241	M	98.4	Very high	97.8	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-59.2	-48.9	177.6	-175.7	-167.2	72.3	0	0	111	N237 L238 V239 K243 K244 I247 T254 P334 F339 I355	N237-M241 WeakPolarHBondContact O-CB 3.4Å; N237-M241 PolarHBondContact O-N 3.22Å; L238-M241 HydrophobicContact CD1-CE 3.97Å; L238-M241 WeakPolarHBondContact O-CB 3.43Å; L238-M241 PolarHBondContact O-N 3.33Å; V239-M241 VanDerWaalsContact C-N 3.31Å; V239-M241 PolarHBondContact O-N 3.48Å; M241-K243 VanDerWaalsContact C-N 3.27Å; M241-K243 PolarHBondContact O-N 3.33Å; M241-K244 WeakPolarHBondContact O-CB 3.25Å; M241-K244 PolarHBondContact O-N 3.42Å; M241-K244 VanDerWaalsContact O-N 3.16Å; M241-I247 WeakPolarHBondContact O-CG1 3.3Å; M241-T254 HydrophobicContact CE-CG2 4.11Å; M241-P334 HydrophobicContact CG-CG 4.07Å; M241-F339 HydrophobicContact CE-CE2 4.23Å; M241-F339 HydrophobicContact CE-CZ 4.02Å; M241-F339 HydrophobicContact SD-CE2 3.8Å; M241-F339 HydrophobicContact SD-CZ 4.18Å; M241-I355 HydrophobicContact CB-CD1 4.16Å; M241-I355 HydrophobicContact CE-CD1 4.31Å; M241-I355 HydrophobicContact CG-CD1 4.49Å; M241-I355 HydrophobicContact SD-CD1 3.67Å
242	L	98.6	Very high	97.8	Very high	5 Å²	5	46.2 Å²	46.2	3%	0.026	26%	0.255	C	S	.	.	H	α-helix	trans	-67.1	-24.2	-176.5	-69.2	173.7	0	0	0	114.2	F131 L132 Y223 L238 V239 I247 Y252 V293	F131-L242 HydrophobicContact CE1-CB 4.11Å; F131-L242 HydrophobicContact CE1-CD1 4.19Å; F131-L242 HydrophobicContact CZ-CB 3.92Å; L132-L242 HydrophobicContact CD1-CD1 4.2Å; L132-L242 HydrophobicContact CD2-CD1 4.43Å; Y223-L242 HydrophobicContact CD1-CD2 3.86Å; Y223-L242 HydrophobicContact CD2-CB 4.21Å; Y223-L242 HydrophobicContact CD2-CD1 3.96Å; Y223-L242 HydrophobicContact CD2-CD2 4.18Å; Y223-L242 HydrophobicContact CD2-CG 4.35Å; Y223-L242 HydrophobicContact CE1-CD2 3.92Å; Y223-L242 HydrophobicContact CE2-CB 4.05Å; Y223-L242 HydrophobicContact CE2-CD2 4.22Å; Y223-L242 HydrophobicContact CG-CD1 3.98Å; Y223-L242 HydrophobicContact CG-CD2 3.99Å; Y223-L242 HydrophobicContact CG-CG 4.47Å; L238-L242 HydrophobicContact CD1-CD1 3.92Å; L238-L242 HydrophobicContact CD1-CG 4.1Å; L238-L242 HydrophobicContact CG-CD1 4.14Å; L238-L242 WeakPolarHBondContact O-CG 3.3Å; L238-L242 PolarHBondContact O-N 3.11Å; V239-L242 PolarHBondContact O-N 3.12Å; L242-I247 HydrophobicContact CD2-CG2 4.3Å; L242-Y252 HydrophobicContact CD2-CE1 4.11Å; L242-V293 HydrophobicContact CD1-CG1 4.14Å; L242-V293 HydrophobicContact CD2-CG1 3.9Å
243	K	97.8	Very high	97.8	Very high	98 Å²	98	46.2 Å²	46.2	43%	0.426	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-8.2	176.4	-70.2	173.8	69.6	145.6	0	113.6	F131 Q160 E162 V239 I240 M241	F131-K243 HydrophobicContact CZ-CG 4.26Å; Q160-K243 PolarHBondContact O-NZ 2.78Å; E162-K243 HydrophobicContact CG-CD 3.86Å; E162-K243 WeakPolarHBondContact OE1-CE 3.45Å; E162-K243 IonicContact OE1-NZ 2.84Å; E162-K243 PolarHBondContact OE1-NZ 3.49Å; V239-K243 HydrophobicContact CG1-CD 3.69Å; V239-K243 HydrophobicContact CG1-CG 4.29Å; V239-K243 WeakPolarHBondContact O-CB 3.18Å; V239-K243 VanDerWaalsContact O-CG 3.32Å; V239-K243 WeakPolarHBondContact O-CG 3.43Å; V239-K243 PolarHBondContact O-N 3.22Å; I240-K243 PolarHBondContact O-N 2.91Å; M241-K243 VanDerWaalsContact C-N 3.27Å; M241-K243 PolarHBondContact O-N 3.33Å
244	K	97.1	Very high	97.9	Very high	84 Å²	84	46.2 Å²	46.2	37%	0.365	26%	0.255	S	S	.	.	S	Bend	trans	-61	139.5	178.6	-73.8	176.2	-178.8	175	0	110.4	I240 M241 G246 I247	I240-K244 PolarHBondContact O-N 3.27Å; M241-K244 WeakPolarHBondContact O-CB 3.25Å; M241-K244 PolarHBondContact O-N 3.42Å; M241-K244 VanDerWaalsContact O-N 3.16Å; K244-G246 PolarHBondContact O-N 3.32Å; K244-I247 HydrophobicContact CB-CG1 4Å; K244-I247 WeakPolarHBondContact O-CG1 3.38Å; K244-I247 PolarHBondContact O-N 3.18Å
245	P	95.6	Very high	97.8	Very high	135 Å²	135	46.2 Å²	46.2	88%	0.877	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	136.3	171.4	-25.3	34.4	0	0	0	111.4
246	G	94.8	Very high	97.8	Very high	77 Å²	77	47.7 Å²	47.7	79%	0.794	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.6	-5.4	178.6	0	0	0	0	0	115.4	K244 P248	K244-G246 PolarHBondContact O-N 3.32Å; G246-P248 VanDerWaalsContact O-CD 3.3Å; G246-P248 WeakPolarHBondContact O-CD 3.33Å
247	I	97.4	Very high	97.7	Very high	27 Å²	27	47.8 Å²	47.8	14%	0.138	26%	0.263	C	S	.	.			trans	-72.7	119.4	169.9	-56.5	-61.8	0	0	0	109.4	Y223 M241 L242 K244 Y252 P334	Y223-I247 HydrophobicContact CE1-CG2 4.4Å; M241-I247 WeakPolarHBondContact O-CG1 3.3Å; L242-I247 HydrophobicContact CD2-CG2 4.3Å; K244-I247 HydrophobicContact CB-CG1 4Å; K244-I247 WeakPolarHBondContact O-CG1 3.38Å; K244-I247 PolarHBondContact O-N 3.18Å; I247-Y252 HydrophobicContact CG2-CD1 4.27Å; I247-Y252 HydrophobicContact CG2-CE1 3.73Å; I247-Y252 HydrophobicContact CG2-CE2 4.39Å; I247-P334 HydrophobicContact CD1-CG 3.47Å; I247-P334 VanDerWaalsContact CD1-CG 3.47Å
248	P	97	Very high	97.7	Very high	56 Å²	56	49 Å²	49	36%	0.364	27%	0.267	S	S	.	.			trans	-72.4	136.7	-176.9	-13.8	28.1	0	0	0	112.3	Y223 G246 K250 Y252	Y223-P248 WeakPolarHBondContact CE1-O 3.43Å; Y223-P248 PolarHBondContact OH-O 2.85Å; G246-P248 VanDerWaalsContact O-CD 3.3Å; G246-P248 WeakPolarHBondContact O-CD 3.33Å; P248-K250 VanDerWaalsContact C-N 3.31Å; P248-Y252 HydrophobicContact CG-CD2 4.09Å; P248-Y252 VanDerWaalsContact O-CB 3.22Å; P248-Y252 WeakPolarHBondContact O-CB 3.35Å
249	Q	96.1	Very high	97.5	Very high	128 Å²	128	50.8 Å²	50.8	60%	0.598	29%	0.285	S	S	*	.	S	Bend	trans	-89.5	5.4	172.3	-68.2	-177.2	-7.5	0	0	113.4	Y223 S295	Y223-Q249 HydrophobicContact CE2-CG 4.37Å; Y223-Q249 WeakPolarHBondContact OH-CG 3.4Å; Q249-S295 VanDerWaalsContact C-CB 3.41Å; Q249-S295 VanDerWaalsContact O-CB 3.26Å; Q249-S295 WeakPolarHBondContact O-CB 3.49Å
250	K	98	Very high	97.4	Very high	155 Å²	155	57.2 Å²	57.2	67%	0.674	32%	0.32	S	S	*	.	S	Bend	trans	-141.1	145.9	178	-67.7	-172.1	179.7	-179.5	0	110.4	P248 Y252 S295 D297	P248-K250 VanDerWaalsContact C-N 3.31Å; K250-Y252 PolarHBondContact O-N 3.37Å; K250-Y252 VanDerWaalsContact O-N 3.14Å; K250-S295 VanDerWaalsContact C-OG 3.3Å; K250-S295 WeakPolarHBondContact CA-OG 3.39Å; K250-D297 WeakPolarHBondContact CA-OD1 3.42Å
251	N	98.4	Very high	97.3	Very high	64 Å²	64	55.6 Å²	55.6	34%	0.342	31%	0.313	S	S	.	.	S	Bend	trans	51.2	31.5	179.9	-61.6	-40.9	0	0	0	113.8	S295 D297 K301 L328	N251-S295 PolarHBondContact N-OG 3.15Å; N251-S295 VanDerWaalsContact N-OG 3.08Å; N251-D297 PolarHBondContact N-OD1 3.4Å; N251-D297 PolarHBondContact N-OD2 3.26Å; N251-K301 PolarHBondContact OD1-NZ 2.81Å; N251-L328 HydrophobicContact CB-CD1 3.89Å; N251-L328 HydrophobicContact CB-CD2 4.05Å; N251-L328 WeakPolarHBondContact OD1-CD1 3.28Å
252	Y	98.7	Very high	97.3	Very high	2 Å²	2	59.4 Å²	59.4	1%	0.008	34%	0.338	C	S	.	.			trans	-105.4	126.6	-176.5	-179	-117.6	0	0	0	109.9	Y223 L242 I247 P248 K250 T254 F294 S295 L298 T331	Y223-Y252 HydrophobicContact CD1-CD1 4.36Å; Y223-Y252 AromaticContact CE1-CD1 3.95Å; Y223-Y252 HydrophobicContact CE1-CD1 3.95Å; Y223-Y252 HydrophobicContact CE1-CE1 4.45Å; L242-Y252 HydrophobicContact CD2-CE1 4.11Å; I247-Y252 HydrophobicContact CG2-CD1 4.27Å; I247-Y252 HydrophobicContact CG2-CE1 3.73Å; I247-Y252 HydrophobicContact CG2-CE2 4.39Å; P248-Y252 HydrophobicContact CG-CD2 4.09Å; P248-Y252 VanDerWaalsContact O-CB 3.22Å; P248-Y252 WeakPolarHBondContact O-CB 3.35Å; K250-Y252 PolarHBondContact O-N 3.37Å; K250-Y252 VanDerWaalsContact O-N 3.14Å; Y252-T254 HydrophobicContact CE1-CG2 3.71Å; Y252-T254 HydrophobicContact CE2-CG2 4.38Å; Y252-T254 VanDerWaalsContact OH-CG2 3.23Å; Y252-T254 WeakPolarHBondContact OH-CG2 3.39Å; Y252-F294 CarbonylContact O-C 3.44Å; Y252-F294 WeakPolarHBondContact O-CA 3.5Å; Y252-F294 WeakPolarHBondContact O-CB 3.12Å; Y252-S295 PolarHBondContact N-OG 2.77Å; Y252-S295 PolarHBondContact O-N 2.92Å; Y252-S295 PolarHBondContact O-OG 3.42Å; Y252-L298 WeakPolarHBondContact O-CD1 3.2Å; Y252-T331 HydrophobicContact CD2-CG2 3.96Å; Y252-T331 HydrophobicContact CE2-CG2 3.58Å
253	L	98.8	Very high	97.3	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	122.2	172	170.7	61.3	0	0	0	107.9	T287 Y292 V293 F294 L298 F302 I319 I323 V330 T331	L253-T287 HydrophobicContact CD1-CG2 4.15Å; L253-T287 HydrophobicContact CG-CG2 4.02Å; L253-Y292 HydrophobicContact CD1-CD2 3.76Å; L253-Y292 HydrophobicContact CD1-CG 4.32Å; L253-V293 CarbonylContact C-O 3.57Å; L253-V293 WeakPolarHBondContact CA-O 3.33Å; L253-F294 HydrophobicContact CB-CB 4.49Å; L253-F294 HydrophobicContact CD1-CB 4Å; L253-F294 HydrophobicContact CD1-CD1 4.42Å; L253-L298 HydrophobicContact CB-CD1 4.06Å; L253-F302 HydrophobicContact CD2-CZ 4.3Å; L253-I319 HydrophobicContact CD2-CG2 3.74Å; L253-I323 HydrophobicContact CB-CD1 3.6Å; L253-I323 HydrophobicContact CD2-CB 4.4Å; L253-I323 HydrophobicContact CD2-CD1 3.66Å; L253-I323 HydrophobicContact CD2-CG2 4.37Å; L253-I323 HydrophobicContact CG-CD1 4.22Å; L253-V330 HydrophobicContact CD2-CG1 3.94Å; L253-V330 HydrophobicContact CG-CG1 4.25Å; L253-T331 PolarHBondContact O-N 2.84Å
254	T	98.6	Very high	97.3	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	168.8	-178.5	-160.1	0	0	0	0	112.1	M241 Y252 Y292 V293 T331 P333	M241-T254 HydrophobicContact CE-CG2 4.11Å; Y252-T254 HydrophobicContact CE1-CG2 3.71Å; Y252-T254 HydrophobicContact CE2-CG2 4.38Å; Y252-T254 VanDerWaalsContact OH-CG2 3.23Å; Y252-T254 WeakPolarHBondContact OH-CG2 3.39Å; T254-Y292 WeakPolarHBondContact O-CA 3.38Å; T254-Y292 WeakPolarHBondContact O-CB 3.19Å; T254-V293 HydrophobicContact CG2-CB 4.2Å; T254-V293 PolarHBondContact N-O 3.26Å; T254-V293 PolarHBondContact O-N 3.49Å; T254-T331 WeakPolarHBondContact CA-O 3.35Å; T254-T331 VanDerWaalsContact CB-O 3.24Å; T254-T331 WeakPolarHBondContact CB-O 3.41Å; T254-T331 PolarHBondContact OG1-O 3.09Å; T254-P333 WeakPolarHBondContact OG1-CA 3.4Å
255	G	97.8	Very high	97.3	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	156.1	-153.7	179.4	0	0	0	0	0	110.1	L257	G255-L257 PolarHBondContact O-N 2.79Å
256	L	97.5	Very high	97.3	Very high	35 Å²	35	54 Å²	54	18%	0.183	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	104.5	170.5	-178	56.4	0	0	0	110.1	Q288 M290 F339 D341	L256-Q288 HydrophobicContact CB-CB 4.17Å; L256-Q288 HydrophobicContact CD2-CB 4.48Å; L256-Q288 HydrophobicContact CG-CB 4.46Å; L256-Q288 PolarHBondContact O-N 3.22Å; L256-M290 HydrophobicContact CB-CE 3.66Å; L256-M290 HydrophobicContact CD2-CE 3.77Å; L256-M290 HydrophobicContact CG-CE 4.38Å; L256-F339 HydrophobicContact CB-CB 4.01Å; L256-D341 HydrophobicContact CD2-CB 4.03Å
257	L	97.6	Very high	97.3	Very high	41 Å²	41	56.8 Å²	56.8	22%	0.215	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	135.5	-177.3	-55.8	-166.9	0	0	0	111.9	G255 T285 Y286 T287 V330	G255-L257 PolarHBondContact O-N 2.79Å; L257-T285 HydrophobicContact CB-CG2 4.45Å; L257-Y286 CarbonylContact C-O 3.56Å; L257-Y286 WeakPolarHBondContact CA-O 3.38Å; L257-T287 HydrophobicContact CD2-CG2 3.76Å; L257-V330 HydrophobicContact CD1-CG2 4.03Å; L257-V330 HydrophobicContact CD2-CB 3.97Å; L257-V330 HydrophobicContact CD2-CG2 3.88Å
258	K	97.1	Very high	97.1	Very high	50 Å²	50	61.9 Å²	61.9	22%	0.217	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	112.1	175.3	-62.7	-60.6	-176.9	175.4	0	108.9	V261 T285 Y286 Q288 D341	K258-V261 HydrophobicContact CB-CG2 3.86Å; K258-T285 VanDerWaalsContact O-CA 3.32Å; K258-T285 WeakPolarHBondContact O-CA 3.48Å; K258-Y286 HydrophobicContact CB-CD1 4.04Å; K258-Y286 HydrophobicContact CB-CD2 4.37Å; K258-Y286 HydrophobicContact CB-CE1 3.63Å; K258-Y286 HydrophobicContact CB-CE2 3.97Å; K258-Y286 HydrophobicContact CB-CG 4.4Å; K258-Y286 HydrophobicContact CG-CE2 4.15Å; K258-Y286 PolarHBondContact N-O 3.11Å; K258-Y286 PolarHBondContact O-N 3.44Å; K258-Q288 VanDerWaalsContact CE-CD 3.43Å; K258-Q288 HydrophobicContact CG-CB 4.05Å; K258-D341 IonicContact NZ-OD2 3.88Å; K258-D341 PolarHBondContact NZ-OD2 2.76Å
259	G	95.8	Very high	97	Very high	38 Å²	38	60.8 Å²	60.8	39%	0.392	32%	0.321	S	S	.	.			trans	-114.7	157.8	176.2	0	0	0	0	0	111.4	V261	G259-V261 PolarHBondContact O-N 3.4Å; G259-V261 VanDerWaalsContact O-N 3.13Å
260	N	95.5	Very high	96.8	Very high	135 Å²	135	59.3 Å²	59.3	72%	0.722	31%	0.312	S	S	*	.	S	Bend	trans	54.4	29.9	177.4	-54.2	-38.9	0	0	0	114.1	P262	N260-P262 WeakPolarHBondContact O-CD 3.47Å
261	V	97.6	Very high	96.6	Very high	37 Å²	37	58 Å²	58	22%	0.224	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-79.4	121.2	-179.7	-179.4	0	0	0	0	109.2	K258 G259 Q282 Y283 Y286	K258-V261 HydrophobicContact CB-CG2 3.86Å; G259-V261 PolarHBondContact O-N 3.4Å; G259-V261 VanDerWaalsContact O-N 3.13Å; V261-Q282 WeakPolarHBondContact O-CA 3.38Å; V261-Y283 HydrophobicContact CB-CD2 4.25Å; V261-Y283 HydrophobicContact CG1-CD2 4.03Å; V261-Y283 PolarHBondContact O-N 2.86Å; V261-Y286 HydrophobicContact CB-CE1 4.06Å; V261-Y286 HydrophobicContact CG2-CE1 3.88Å
262	P	97.8	Very high	96.5	Very high	81 Å²	81	57 Å²	57	53%	0.526	30%	0.295	S	S	.	.	B	Isolated β-bridge	trans	-71.7	143.1	176.3	30	-34.1	0	0	0	111	N260 I264	N260-P262 WeakPolarHBondContact O-CD 3.47Å; P262-I264 PolarHBondContact O-N 3.43Å
263	V	98.1	Very high	96.3	Very high	10 Å²	10	56.9 Å²	56.9	6%	0.061	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-73.5	120.7	172.2	-177.3	0	0	0	0	109.2	R265 V273 Y278 P281 Y283	V263-R265 PolarHBondContact O-N 2.75Å; V263-V273 HydrophobicContact CG1-CB 3.72Å; V263-V273 HydrophobicContact CG1-CG1 4.25Å; V263-Y278 HydrophobicContact CG1-CD1 4.46Å; V263-Y278 HydrophobicContact CG2-CD1 3.55Å; V263-Y278 HydrophobicContact CG2-CE1 3.53Å; V263-P281 PolarHBondContact N-O 2.77Å; V263-Y283 HydrophobicContact CB-CE1 4.42Å; V263-Y283 HydrophobicContact CB-CE2 4.5Å; V263-Y283 HydrophobicContact CG1-CE1 4.3Å; V263-Y283 HydrophobicContact CG2-CD1 3.74Å; V263-Y283 HydrophobicContact CG2-CD2 4.19Å; V263-Y283 HydrophobicContact CG2-CE1 3.47Å; V263-Y283 VanDerWaalsContact CG2-CE1 3.47Å; V263-Y283 HydrophobicContact CG2-CE2 3.97Å; V263-Y283 HydrophobicContact CG2-CG 4.09Å
264	I	97.8	Very high	96.1	Very high	60 Å²	60	58 Å²	58	31%	0.308	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-73.7	119.6	-178.3	-65.8	169	0	0	0	109.5	P262 W271 Y272 V273	P262-I264 PolarHBondContact O-N 3.43Å; I264-W271 HydrophobicContact CD1-CB 3.72Å; I264-W271 HydrophobicContact CD1-CD2 4.33Å; I264-W271 HydrophobicContact CD1-CE3 3.78Å; I264-W271 HydrophobicContact CD1-CG 4.38Å; I264-Y272 WeakPolarHBondContact O-CA 3.32Å; I264-V273 PolarHBondContact O-N 3.09Å
265	R	97	Very high	96	Very high	75 Å²	75	64.7 Å²	64.7	28%	0.283	33%	0.331	S	S	.	.			trans	-103.2	1.5	-178.5	-52.9	-53	-176	164.3	5.7	114.1	V263 K267 Y272 V273 P274 Y278 D280	V263-R265 PolarHBondContact O-N 2.75Å; R265-K267 PolarHBondContact O-N 2.77Å; R265-Y272 VanDerWaalsContact C-CD2 3.5Å; R265-Y272 VanDerWaalsContact O-CE2 3.27Å; R265-Y272 WeakPolarHBondContact O-CE2 3.12Å; R265-V273 VanDerWaalsContact CD-O 3.26Å; R265-V273 WeakPolarHBondContact CD-O 3.45Å; R265-V273 PolarHBondContact NH1-O 3.47Å; R265-P274 PolarHBondContact NH1-O 3.43Å; R265-P274 VanDerWaalsContact NH1-O 3.15Å; R265-Y278 VanDerWaalsContact CZ-O 3.29Å; R265-Y278 PolarHBondContact NH1-O 3.09Å; R265-Y278 PolarHBondContact NH2-O 2.87Å; R265-D280 PolarHBondContact NH2-O 3.25Å
266	S	96.5	Very high	95.8	Very high	64 Å²	64	71.3 Å²	71.3	45%	0.448	36%	0.362	S	S	.	.			trans	-78.6	118.4	174.8	178.3	0	0	0	0	110.2	D268 S269 Y272	S266-D268 PolarHBondContact O-N 2.98Å; S266-S269 WeakPolarHBondContact O-CB 3.24Å; S266-S269 PolarHBondContact O-N 3.37Å; S266-S269 VanDerWaalsContact O-N 3.08Å; S266-Y272 VanDerWaalsContact O-CB 3.32Å; S266-Y272 WeakPolarHBondContact O-CB 3.37Å; S266-Y272 WeakPolarHBondContact O-CD2 3.43Å
267	K	93.9	Very high	95.5	Very high	135 Å²	135	71.9 Å²	71.9	59%	0.587	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-19.2	179.6	-67.8	-175.9	179.3	-176.2	0	113.8	R265 S269 Y272	R265-K267 PolarHBondContact O-N 2.77Å; K267-S269 VanDerWaalsContact C-N 3.31Å; K267-Y272 HydrophobicContact CG-CD1 4.46Å; K267-Y272 HydrophobicContact CG-CD2 4.3Å; K267-Y272 HydrophobicContact CG-CE1 4.02Å; K267-Y272 HydrophobicContact CG-CE2 3.83Å
268	D	94.1	Very high	95.4	Very high	134 Å²	134	70.3 Å²	70.3	72%	0.717	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-7.4	178.3	-61.7	-45.2	0	0	0	113	V80 S266	V80-D268 WeakPolarHBondContact CG2-O 3.26Å; S266-D268 PolarHBondContact O-N 2.98Å
269	S	94.9	Very high	95.3	Very high	33 Å²	33	72.6 Å²	72.6	23%	0.231	38%	0.376	C	S	.	.	S	Bend	trans	-85	138.7	176.3	-173.7	0	0	0	0	111.4	S266 K267 W271 Y272	S266-S269 WeakPolarHBondContact O-CB 3.24Å; S266-S269 PolarHBondContact O-N 3.37Å; S266-S269 VanDerWaalsContact O-N 3.08Å; K267-S269 VanDerWaalsContact C-N 3.31Å; S269-W271 PolarHBondContact O-N 3.4Å; S269-W271 VanDerWaalsContact O-N 3.14Å; S269-W271 PolarHBondContact OG-N 3.3Å; S269-Y272 VanDerWaalsContact O-CB 3.29Å; S269-Y272 WeakPolarHBondContact O-CB 3.29Å; S269-Y272 PolarHBondContact O-N 3.15Å; S269-Y272 VanDerWaalsContact O-N 3.1Å
270	K	91.3	Very high	95.4	Very high	97 Å²	97	74.3 Å²	74.3	42%	0.422	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-22.2	168.6	71.6	177.8	-174.6	176.5	0	112.9	Y200	Y200-K270 VanDerWaalsContact CE1-O 3.31Å; Y200-K270 WeakPolarHBondContact CE1-O 3.46Å
271	W	94.7	Very high	95.4	Very high	126 Å²	126	72.5 Å²	72.5	48%	0.477	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	14.6	-179.9	-56	-59	0	0	0	113.5	I264 S269 V273 I314	I264-W271 HydrophobicContact CD1-CB 3.72Å; I264-W271 HydrophobicContact CD1-CD2 4.33Å; I264-W271 HydrophobicContact CD1-CE3 3.78Å; I264-W271 HydrophobicContact CD1-CG 4.38Å; S269-W271 PolarHBondContact O-N 3.4Å; S269-W271 VanDerWaalsContact O-N 3.14Å; S269-W271 PolarHBondContact OG-N 3.3Å; W271-V273 PolarHBondContact O-N 3.08Å; W271-I314 HydrophobicContact CB-CD1 4.14Å
272	Y	95.6	Very high	95.5	Very high	43 Å²	43	75.2 Å²	75.2	17%	0.169	38%	0.382	C	S	.	.			trans	-56.7	131	177.1	173.8	-117	0	0	0	111.6	I264 R265 S266 K267 S269 P274 N313	I264-Y272 WeakPolarHBondContact O-CA 3.32Å; R265-Y272 VanDerWaalsContact C-CD2 3.5Å; R265-Y272 VanDerWaalsContact O-CE2 3.27Å; R265-Y272 WeakPolarHBondContact O-CE2 3.12Å; S266-Y272 VanDerWaalsContact O-CB 3.32Å; S266-Y272 WeakPolarHBondContact O-CB 3.37Å; S266-Y272 WeakPolarHBondContact O-CD2 3.43Å; K267-Y272 HydrophobicContact CG-CD1 4.46Å; K267-Y272 HydrophobicContact CG-CD2 4.3Å; K267-Y272 HydrophobicContact CG-CE1 4.02Å; K267-Y272 HydrophobicContact CG-CE2 3.83Å; S269-Y272 VanDerWaalsContact O-CB 3.29Å; S269-Y272 WeakPolarHBondContact O-CB 3.29Å; S269-Y272 PolarHBondContact O-N 3.15Å; S269-Y272 VanDerWaalsContact O-N 3.1Å; Y272-P274 HydrophobicContact CE1-CB 4.15Å; Y272-P274 HydrophobicContact CE1-CG 4.4Å; Y272-P274 WeakPolarHBondContact OH-CB 3.39Å; Y272-N313 PolarHBondContact O-OD1 2.92Å
273	V	95.6	Very high	95.5	Very high	0 Å²	0	72.2 Å²	72.2	0%	0	36%	0.36	C	S	.	.			trans	-129	123.6	166.9	179.1	0	0	0	0	109.7	V263 I264 R265 W271 L277 Y283 F312 I314	V263-V273 HydrophobicContact CG1-CB 3.72Å; V263-V273 HydrophobicContact CG1-CG1 4.25Å; I264-V273 PolarHBondContact O-N 3.09Å; R265-V273 VanDerWaalsContact CD-O 3.26Å; R265-V273 WeakPolarHBondContact CD-O 3.45Å; R265-V273 PolarHBondContact NH1-O 3.47Å; W271-V273 PolarHBondContact O-N 3.08Å; V273-L277 HydrophobicContact CG1-CB 4.26Å; V273-Y283 WeakPolarHBondContact CG2-OH 3.47Å; V273-F312 HydrophobicContact CG1-CB 3.98Å; V273-F312 HydrophobicContact CG1-CD2 4.35Å; V273-F312 HydrophobicContact CG1-CG 4.3Å; V273-F312 HydrophobicContact CG2-CD2 4.11Å; V273-I314 HydrophobicContact CG2-CD1 4.42Å; V273-I314 HydrophobicContact CG2-CG1 3.51Å
274	P	94.4	Very high	95.4	Very high	23 Å²	23	72.6 Å²	72.6	15%	0.149	36%	0.363	C	S	.	.			trans	-69.4	153.5	177.2	29.3	-36.9	0	0	0	112.4	R265 Y272 E276 L277 Y278	R265-P274 PolarHBondContact NH1-O 3.43Å; R265-P274 VanDerWaalsContact NH1-O 3.15Å; Y272-P274 HydrophobicContact CE1-CB 4.15Å; Y272-P274 HydrophobicContact CE1-CG 4.4Å; Y272-P274 WeakPolarHBondContact OH-CB 3.39Å; P274-E276 VanDerWaalsContact CB-OE2 3.27Å; P274-E276 WeakPolarHBondContact CB-OE2 3.23Å; P274-E276 PolarHBondContact O-N 2.82Å; P274-L277 HydrophobicContact CG-CB 3.94Å; P274-L277 HydrophobicContact CG-CD1 3.66Å; P274-L277 HydrophobicContact CG-CG 3.56Å; P274-L277 PolarHBondContact O-N 3.14Å; P274-Y278 PolarHBondContact O-N 3.05Å; P274-Y278 VanDerWaalsContact O-N 3.11Å
275	K	95.8	Very high	95.4	Very high	141 Å²	141	73 Å²	73	61%	0.613	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-28.4	-179.7	-76.8	-174.7	178	-178.9	0	112.1	L277 Y278 P279	K275-L277 VanDerWaalsContact C-N 3.27Å; K275-L277 PolarHBondContact O-N 3.39Å; K275-Y278 WeakPolarHBondContact CA-O 3.27Å; K275-Y278 CarbonylContact O-C 3.23Å; K275-Y278 VanDerWaalsContact O-C 3.23Å; K275-Y278 PolarHBondContact O-N 3.28Å; K275-P279 WeakPolarHBondContact O-CA 3.27Å
276	E	92.9	Very high	95.5	Very high	139 Å²	139	70.4 Å²	70.4	65%	0.65	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-27	178.9	-59.8	70.3	-151.1	0	0	112	P274 K310	P274-E276 VanDerWaalsContact CB-OE2 3.27Å; P274-E276 WeakPolarHBondContact CB-OE2 3.23Å; P274-E276 PolarHBondContact O-N 2.82Å; E276-K310 WeakPolarHBondContact O-CD 3.31Å; E276-K310 PolarHBondContact O-NZ 2.89Å
277	L	91.4	Very high	95.6	Very high	48 Å²	48	67.3 Å²	67.3	25%	0.251	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-40.4	173.5	-66.2	-173.6	0	0	0	111.6	V273 P274 K275 K310 F312	V273-L277 HydrophobicContact CG1-CB 4.26Å; P274-L277 HydrophobicContact CG-CB 3.94Å; P274-L277 HydrophobicContact CG-CD1 3.66Å; P274-L277 HydrophobicContact CG-CG 3.56Å; P274-L277 PolarHBondContact O-N 3.14Å; K275-L277 VanDerWaalsContact C-N 3.27Å; K275-L277 PolarHBondContact O-N 3.39Å; L277-K310 HydrophobicContact CD2-CD 3.93Å; L277-K310 HydrophobicContact CD2-CG 4.1Å; L277-F312 HydrophobicContact CB-CB 4.17Å; L277-F312 HydrophobicContact CD1-CB 4.17Å
278	Y	95.3	Very high	95.7	Very high	8 Å²	8	62.3 Å²	62.3	3%	0.031	32%	0.316	C	S	.	.			trans	-142.3	106	-179.6	-169.6	-88.6	0	0	0	110	V263 R265 P274 K275 D280 Q282 Y283 P284 F312 M321	V263-Y278 HydrophobicContact CG1-CD1 4.46Å; V263-Y278 HydrophobicContact CG2-CD1 3.55Å; V263-Y278 HydrophobicContact CG2-CE1 3.53Å; R265-Y278 VanDerWaalsContact CZ-O 3.29Å; R265-Y278 PolarHBondContact NH1-O 3.09Å; R265-Y278 PolarHBondContact NH2-O 2.87Å; P274-Y278 PolarHBondContact O-N 3.05Å; P274-Y278 VanDerWaalsContact O-N 3.11Å; K275-Y278 WeakPolarHBondContact CA-O 3.27Å; K275-Y278 CarbonylContact O-C 3.23Å; K275-Y278 VanDerWaalsContact O-C 3.23Å; K275-Y278 PolarHBondContact O-N 3.28Å; Y278-D280 HydrophobicContact CD1-CB 4.21Å; Y278-D280 VanDerWaalsContact CD1-O 3.24Å; Y278-D280 WeakPolarHBondContact CD1-O 3.35Å; Y278-D280 HydrophobicContact CE1-CB 3.48Å; Y278-D280 VanDerWaalsContact CE1-CB 3.48Å; Y278-D280 VanDerWaalsContact CE1-O 3.26Å; Y278-D280 WeakPolarHBondContact CE1-O 3.34Å; Y278-Q282 WeakPolarHBondContact CE1-O 3.25Å; Y278-Q282 PolarHBondContact OH-O 2.81Å; Y278-Y283 HydrophobicContact CD1-CD1 4.4Å; Y278-Y283 HydrophobicContact CD1-CE1 4.22Å; Y278-Y283 HydrophobicContact CD2-CE1 4.48Å; Y278-Y283 AromaticContact CE1-CD1 3.93Å; Y278-Y283 HydrophobicContact CE1-CD1 3.93Å; Y278-Y283 HydrophobicContact CE1-CE1 4.21Å; Y278-Y283 HydrophobicContact CE2-CD1 4.15Å; Y278-Y283 HydrophobicContact CG-CE1 4.34Å; Y278-Y283 AromaticContact CZ-CD1 3.83Å; Y278-Y283 WeakPolarHBondContact OH-CA 3.39Å; Y278-P284 WeakPolarHBondContact OH-CD 3.39Å; Y278-F312 HydrophobicContact CD2-CD1 4.32Å; Y278-F312 AromaticContact CD2-CE1 3.81Å; Y278-F312 HydrophobicContact CD2-CE1 3.81Å; Y278-F312 HydrophobicContact CD2-CZ 4.13Å; Y278-F312 HydrophobicContact CE2-CE1 4.4Å; Y278-F312 HydrophobicContact CE2-CZ 4.46Å; Y278-M321 HydrophobicContact CE2-CE 4.04Å; Y278-M321 HydrophobicContact CE2-CG 3.9Å; Y278-M321 HydrophobicContact CE2-SD 3.65Å
279	P	95.6	Very high	95.7	Very high	97 Å²	97	56.2 Å²	56.2	63%	0.63	28%	0.284	S	S	*	.			trans	-77.3	-30.9	-172.3	27.9	-34	0	0	0	113.4	K275	K275-P279 WeakPolarHBondContact O-CA 3.27Å
280	D	96.8	Very high	95.7	Very high	74 Å²	74	54.9 Å²	54.9	40%	0.396	28%	0.275	S	S	.	.	S	Bend	trans	-67.1	147.3	-175.2	-67	-20	0	0	0	111.5	R265 Y278 Q282	R265-D280 PolarHBondContact NH2-O 3.25Å; Y278-D280 HydrophobicContact CD1-CB 4.21Å; Y278-D280 VanDerWaalsContact CD1-O 3.24Å; Y278-D280 WeakPolarHBondContact CD1-O 3.35Å; Y278-D280 HydrophobicContact CE1-CB 3.48Å; Y278-D280 VanDerWaalsContact CE1-CB 3.48Å; Y278-D280 VanDerWaalsContact CE1-O 3.26Å; Y278-D280 WeakPolarHBondContact CE1-O 3.34Å; D280-Q282 VanDerWaalsContact C-N 3.26Å; D280-Q282 PolarHBondContact O-N 2.84Å
281	P	97.4	Very high	96	Very high	97 Å²	97	50.3 Å²	50.3	63%	0.63	26%	0.255	S	S	*	.	S	Bend	trans	-74.2	-17.1	-178.5	29.8	-35.6	0	0	0	113.4	V263	V263-P281 PolarHBondContact N-O 2.77Å
282	Q	97.8	Very high	96.2	Very high	95 Å²	95	44.3 Å²	44.3	44%	0.444	23%	0.232	S	C	.	.	B	Isolated β-bridge	trans	-138	149.6	-176.1	-63.2	179.9	13.7	0	0	111	V261 Y278 D280	V261-Q282 WeakPolarHBondContact O-CA 3.38Å; Y278-Q282 WeakPolarHBondContact CE1-O 3.25Å; Y278-Q282 PolarHBondContact OH-O 2.81Å; D280-Q282 VanDerWaalsContact C-N 3.26Å; D280-Q282 PolarHBondContact O-N 2.84Å
283	Y	98	Very high	96.4	Very high	17 Å²	17	42.2 Å²	42.2	7%	0.067	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-75.6	152.9	172.4	-62.2	-55.8	0	0	0	111.4	V261 V263 V273 Y278 Y286 F312 A317	V261-Y283 HydrophobicContact CB-CD2 4.25Å; V261-Y283 HydrophobicContact CG1-CD2 4.03Å; V261-Y283 PolarHBondContact O-N 2.86Å; V263-Y283 HydrophobicContact CB-CE1 4.42Å; V263-Y283 HydrophobicContact CB-CE2 4.5Å; V263-Y283 HydrophobicContact CG1-CE1 4.3Å; V263-Y283 HydrophobicContact CG2-CD1 3.74Å; V263-Y283 HydrophobicContact CG2-CD2 4.19Å; V263-Y283 HydrophobicContact CG2-CE1 3.47Å; V263-Y283 VanDerWaalsContact CG2-CE1 3.47Å; V263-Y283 HydrophobicContact CG2-CE2 3.97Å; V263-Y283 HydrophobicContact CG2-CG 4.09Å; V273-Y283 WeakPolarHBondContact CG2-OH 3.47Å; Y278-Y283 HydrophobicContact CD1-CD1 4.4Å; Y278-Y283 HydrophobicContact CD1-CE1 4.22Å; Y278-Y283 HydrophobicContact CD2-CE1 4.48Å; Y278-Y283 AromaticContact CE1-CD1 3.93Å; Y278-Y283 HydrophobicContact CE1-CD1 3.93Å; Y278-Y283 HydrophobicContact CE1-CE1 4.21Å; Y278-Y283 HydrophobicContact CE2-CD1 4.15Å; Y278-Y283 HydrophobicContact CG-CE1 4.34Å; Y278-Y283 AromaticContact CZ-CD1 3.83Å; Y278-Y283 WeakPolarHBondContact OH-CA 3.39Å; Y283-Y286 HydrophobicContact CD2-CE1 4.25Å; Y283-F312 HydrophobicContact CD1-CE2 4.33Å; Y283-F312 HydrophobicContact CD1-CZ 4.37Å; Y283-F312 HydrophobicContact CE1-CD2 4.4Å; Y283-F312 AromaticContact CE1-CE2 3.63Å; Y283-F312 HydrophobicContact CE1-CE2 3.63Å; Y283-F312 HydrophobicContact CE1-CZ 4.03Å; Y283-A317 HydrophobicContact CD1-CB 3.76Å; Y283-A317 HydrophobicContact CD2-CB 4.01Å; Y283-A317 HydrophobicContact CE1-CB 4.02Å; Y283-A317 HydrophobicContact CE2-CB 4.25Å; Y283-A317 HydrophobicContact CG-CB 3.75Å
284	P	97.2	Very high	96.5	Very high	18 Å²	18	42.2 Å²	42.2	12%	0.117	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-61.5	164.8	163	32.8	-38.7	0	0	0	110.1	Y278 Y286 M321 K324	Y278-P284 WeakPolarHBondContact OH-CD 3.39Å; P284-Y286 WeakPolarHBondContact O-CD1 3.24Å; P284-Y286 PolarHBondContact O-N 3.45Å; P284-M321 HydrophobicContact CG-CG 4.01Å; P284-M321 HydrophobicContact CG-SD 3.66Å; P284-K324 HydrophobicContact CB-CB 4.42Å; P284-K324 HydrophobicContact CB-CD 3.69Å; P284-K324 HydrophobicContact CG-CD 4.34Å
285	T	98	Very high	96.7	Very high	69 Å²	69	41.1 Å²	41.1	42%	0.423	22%	0.217	S	C	.	.	S	Bend	trans	-59.5	128.5	171.4	-51.7	0	0	0	0	110	L257 K258 V330	L257-T285 HydrophobicContact CB-CG2 4.45Å; K258-T285 VanDerWaalsContact O-CA 3.32Å; K258-T285 WeakPolarHBondContact O-CA 3.48Å; T285-V330 HydrophobicContact CG2-CG2 3.63Å
286	Y	98.3	Very high	96.9	Very high	20 Å²	20	35 Å²	35	8%	0.078	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	173	-178.1	69.1	-82.7	0	0	0	111	L257 K258 V261 Y283 P284 D316 A317	L257-Y286 CarbonylContact C-O 3.56Å; L257-Y286 WeakPolarHBondContact CA-O 3.38Å; K258-Y286 HydrophobicContact CB-CD1 4.04Å; K258-Y286 HydrophobicContact CB-CD2 4.37Å; K258-Y286 HydrophobicContact CB-CE1 3.63Å; K258-Y286 HydrophobicContact CB-CE2 3.97Å; K258-Y286 HydrophobicContact CB-CG 4.4Å; K258-Y286 HydrophobicContact CG-CE2 4.15Å; K258-Y286 PolarHBondContact N-O 3.11Å; K258-Y286 PolarHBondContact O-N 3.44Å; V261-Y286 HydrophobicContact CB-CE1 4.06Å; V261-Y286 HydrophobicContact CG2-CE1 3.88Å; Y283-Y286 HydrophobicContact CD2-CE1 4.25Å; P284-Y286 WeakPolarHBondContact O-CD1 3.24Å; P284-Y286 PolarHBondContact O-N 3.45Å; Y286-D316 HydrophobicContact CD2-CB 3.98Å; Y286-D316 HydrophobicContact CE2-CB 4.14Å; Y286-D316 VanDerWaalsContact CE2-CG 3.46Å; Y286-D316 VanDerWaalsContact CE2-OD2 3.29Å; Y286-D316 WeakPolarHBondContact CE2-OD2 3.27Å; Y286-A317 HydrophobicContact CD1-CB 4.26Å; Y286-A317 HydrophobicContact CD2-CB 4.37Å; Y286-A317 HydrophobicContact CE1-CB 4.3Å; Y286-A317 HydrophobicContact CE2-CB 4.43Å; Y286-A317 HydrophobicContact CG-CB 4.29Å
287	T	97.8	Very high	97.1	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	131.3	175	49.1	0	0	0	0	109.9	L253 L257 Y292 D316 V330	L253-T287 HydrophobicContact CD1-CG2 4.15Å; L253-T287 HydrophobicContact CG-CG2 4.02Å; L257-T287 HydrophobicContact CD2-CG2 3.76Å; T287-Y292 VanDerWaalsContact OG1-CB 3.26Å; T287-Y292 WeakPolarHBondContact OG1-CB 3.5Å; T287-D316 WeakPolarHBondContact O-CB 3.34Å; T287-V330 HydrophobicContact CG2-CG1 4.27Å
288	Q	96.7	Very high	97.5	Very high	30 Å²	30	28 Å²	28	14%	0.14	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	142.2	-177.6	-170.7	176.5	-97.9	0	0	113.3	L256 K258 M290 G291	L256-Q288 HydrophobicContact CB-CB 4.17Å; L256-Q288 HydrophobicContact CD2-CB 4.48Å; L256-Q288 HydrophobicContact CG-CB 4.46Å; L256-Q288 PolarHBondContact O-N 3.22Å; K258-Q288 VanDerWaalsContact CE-CD 3.43Å; K258-Q288 HydrophobicContact CG-CB 4.05Å; Q288-M290 VanDerWaalsContact C-N 3.3Å; Q288-M290 PolarHBondContact NE2-SD 3.42Å; Q288-M290 PolarHBondContact O-N 2.58Å; Q288-M290 VanDerWaalsContact O-N 3.17Å; Q288-G291 PolarHBondContact O-N 3.41Å
289	G	94.3	Very high	97.6	Very high	5 Å²	5	27.6 Å²	27.6	5%	0.052	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.4	-28.6	-173.8	0	0	0	0	0	116.7	K226 G291 D316	K226-G289 PolarHBondContact NZ-O 2.73Å; G289-G291 PolarHBondContact O-N 3.45Å; G289-D316 WeakPolarHBondContact CA-OD2 3.45Å; G289-D316 PolarHBondContact N-OD2 3.15Å
290	M	95.7	Very high	97.8	Very high	6 Å²	6	25.7 Å²	25.7	3%	0.03	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-51.9	-34.4	179.8	71.9	-179.7	179.1	0	0	113.3	V227 D228 V231 L256 Q288 R340 D341 T356 I358	V227-M290 WeakPolarHBondContact CA-O 3.14Å; D228-M290 PolarHBondContact N-O 3.13Å; D228-M290 WeakPolarHBondContact OD2-CA 3.07Å; V231-M290 HydrophobicContact CG2-CB 4Å; V231-M290 WeakPolarHBondContact CG2-O 3.23Å; L256-M290 HydrophobicContact CB-CE 3.66Å; L256-M290 HydrophobicContact CD2-CE 3.77Å; L256-M290 HydrophobicContact CG-CE 4.38Å; Q288-M290 VanDerWaalsContact C-N 3.3Å; Q288-M290 PolarHBondContact NE2-SD 3.42Å; Q288-M290 PolarHBondContact O-N 2.58Å; Q288-M290 VanDerWaalsContact O-N 3.17Å; M290-R340 VanDerWaalsContact CE-O 3.28Å; M290-R340 WeakPolarHBondContact CE-O 3.49Å; M290-D341 HydrophobicContact SD-CB 4.02Å; M290-T356 WeakPolarHBondContact CE-OG1 3.5Å; M290-I358 HydrophobicContact CB-CD1 3.7Å; M290-I358 HydrophobicContact CB-CG1 3.64Å; M290-I358 HydrophobicContact CG-CD1 4.23Å; M290-I358 HydrophobicContact CG-CG1 4.19Å; M290-I358 HydrophobicContact SD-CD1 3.66Å; M290-I358 HydrophobicContact SD-CG1 3.55Å; M290-I358 VanDerWaalsContact SD-CG1 3.55Å
291	G	97.4	Very high	97.9	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	178	129.3	-178.4	0	0	0	0	0	112.8	K226 Q288 G289	K226-G291 CarbonylContact O-C 3.56Å; K226-G291 WeakPolarHBondContact O-CA 3.21Å; Q288-G291 PolarHBondContact O-N 3.41Å; G289-G291 PolarHBondContact O-N 3.45Å
292	Y	98.6	Very high	97.9	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	144.7	175.7	56.5	-99.9	0	0	0	111.2	T207 M211 M225 K226 L253 T254 T287 F294	T207-Y292 WeakPolarHBondContact CG2-OH 3.42Å; M211-Y292 HydrophobicContact CE-CE2 4.17Å; M225-Y292 VanDerWaalsContact CA-O 3.29Å; M225-Y292 WeakPolarHBondContact CA-O 3.46Å; M225-Y292 WeakPolarHBondContact CG-O 3.26Å; K226-Y292 HydrophobicContact CB-CD2 4.41Å; K226-Y292 HydrophobicContact CB-CE1 4.17Å; K226-Y292 HydrophobicContact CB-CE2 3.82Å; K226-Y292 HydrophobicContact CD-CD1 4.37Å; K226-Y292 HydrophobicContact CD-CE1 3.69Å; K226-Y292 HydrophobicContact CG-CE1 4.35Å; K226-Y292 PolarHBondContact N-O 2.88Å; K226-Y292 PolarHBondContact O-N 3.03Å; L253-Y292 HydrophobicContact CD1-CD2 3.76Å; L253-Y292 HydrophobicContact CD1-CG 4.32Å; T254-Y292 WeakPolarHBondContact O-CA 3.38Å; T254-Y292 WeakPolarHBondContact O-CB 3.19Å; T287-Y292 VanDerWaalsContact OG1-CB 3.26Å; T287-Y292 WeakPolarHBondContact OG1-CB 3.5Å; Y292-F294 AromaticContact CD2-CD1 3.77Å; Y292-F294 HydrophobicContact CD2-CD1 3.77Å; Y292-F294 HydrophobicContact CD2-CE1 4Å; Y292-F294 AromaticContact CE2-CD1 3.92Å; Y292-F294 HydrophobicContact CE2-CD1 3.92Å; Y292-F294 AromaticContact CE2-CE1 3.77Å; Y292-F294 HydrophobicContact CE2-CE1 3.77Å
293	V	98.6	Very high	97.9	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	137.5	-172.2	-173.1	0	0	0	0	108.6	A224 M225 L238 L242 L253 T254	A224-V293 WeakPolarHBondContact O-CA 3.18Å; M225-V293 HydrophobicContact CB-CG2 4.09Å; M225-V293 HydrophobicContact CE-CG2 4.36Å; M225-V293 HydrophobicContact CG-CG2 3.79Å; M225-V293 HydrophobicContact SD-CG2 3.85Å; L238-V293 HydrophobicContact CD1-CG1 4.36Å; L238-V293 HydrophobicContact CD1-CG2 3.6Å; L238-V293 HydrophobicContact CD2-CG2 4.47Å; L242-V293 HydrophobicContact CD1-CG1 4.14Å; L242-V293 HydrophobicContact CD2-CG1 3.9Å; L253-V293 CarbonylContact C-O 3.57Å; L253-V293 WeakPolarHBondContact CA-O 3.33Å; T254-V293 HydrophobicContact CG2-CB 4.2Å; T254-V293 PolarHBondContact N-O 3.26Å; T254-V293 PolarHBondContact O-N 3.49Å
294	F	98.9	Very high	97.9	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	151.7	-179.7	48.8	-85.7	0	0	0	112.1	M211 L214 Y223 A224 Y252 L253 Y292 L298 P299	M211-F294 HydrophobicContact CE-CE1 3.99Å; M211-F294 HydrophobicContact CE-CE2 4.45Å; M211-F294 HydrophobicContact CE-CZ 3.88Å; M211-F294 HydrophobicContact SD-CE2 4.01Å; M211-F294 HydrophobicContact SD-CZ 3.86Å; L214-F294 HydrophobicContact CD1-CE2 3.65Å; L214-F294 HydrophobicContact CD1-CZ 3.66Å; Y223-F294 WeakPolarHBondContact CA-O 3.4Å; A224-F294 HydrophobicContact CB-CD2 4.2Å; A224-F294 HydrophobicContact CB-CE2 3.52Å; A224-F294 HydrophobicContact CB-CZ 3.72Å; A224-F294 PolarHBondContact N-O 2.73Å; A224-F294 PolarHBondContact O-N 2.67Å; Y252-F294 CarbonylContact O-C 3.44Å; Y252-F294 WeakPolarHBondContact O-CA 3.5Å; Y252-F294 WeakPolarHBondContact O-CB 3.12Å; L253-F294 HydrophobicContact CB-CB 4.49Å; L253-F294 HydrophobicContact CD1-CB 4Å; L253-F294 HydrophobicContact CD1-CD1 4.42Å; Y292-F294 AromaticContact CD2-CD1 3.77Å; Y292-F294 HydrophobicContact CD2-CD1 3.77Å; Y292-F294 HydrophobicContact CD2-CE1 4Å; Y292-F294 AromaticContact CE2-CD1 3.92Å; Y292-F294 HydrophobicContact CE2-CD1 3.92Å; Y292-F294 AromaticContact CE2-CE1 3.77Å; Y292-F294 HydrophobicContact CE2-CE1 3.77Å; F294-L298 HydrophobicContact CB-CD1 4.03Å; F294-P299 HydrophobicContact CD2-CG 4.05Å; F294-P299 HydrophobicContact CE2-CG 3.6Å
295	S	98.8	Very high	97.8	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	139	166.9	54.8	0	0	0	0	109.7	Q249 K250 N251 Y252 D297 L298	Q249-S295 VanDerWaalsContact C-CB 3.41Å; Q249-S295 VanDerWaalsContact O-CB 3.26Å; Q249-S295 WeakPolarHBondContact O-CB 3.49Å; K250-S295 VanDerWaalsContact C-OG 3.3Å; K250-S295 WeakPolarHBondContact CA-OG 3.39Å; N251-S295 PolarHBondContact N-OG 3.15Å; N251-S295 VanDerWaalsContact N-OG 3.08Å; Y252-S295 PolarHBondContact N-OG 2.77Å; Y252-S295 PolarHBondContact O-N 2.92Å; Y252-S295 PolarHBondContact O-OG 3.42Å; S295-D297 VanDerWaalsContact CB-OD1 3.25Å; S295-D297 WeakPolarHBondContact CB-OD1 3.45Å; S295-D297 PolarHBondContact O-N 3.32Å; S295-D297 PolarHBondContact OG-OD1 3.42Å; S295-L298 WeakPolarHBondContact O-CB 3.27Å; S295-L298 PolarHBondContact O-N 3.02Å; S295-L298 VanDerWaalsContact O-N 3.09Å
296	N	98.4	Very high	97.7	Very high	12 Å²	12	18 Å²	18	6%	0.064	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	8.2	-169.9	-160.6	51.4	0	0	0	113.9	C218 A221 A222 P299	C218-N296 PolarHBondContact O-ND2 2.77Å; A221-N296 HydrophobicContact CB-CB 4.47Å; A221-N296 WeakPolarHBondContact O-CB 3.28Å; A221-N296 PolarHBondContact O-ND2 2.9Å; A222-N296 PolarHBondContact O-N 2.94Å; N296-P299 VanDerWaalsContact C-CD 3.46Å; N296-P299 WeakPolarHBondContact O-CD 3.43Å
297	D	98.5	Very high	97.4	Very high	40 Å²	40	19.1 Å²	19.1	21%	0.214	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-16.5	167.1	77	-52.5	0	0	0	113.1	K250 N251 S295 K301	K250-D297 WeakPolarHBondContact CA-OD1 3.42Å; N251-D297 PolarHBondContact N-OD1 3.4Å; N251-D297 PolarHBondContact N-OD2 3.26Å; S295-D297 VanDerWaalsContact CB-OD1 3.25Å; S295-D297 WeakPolarHBondContact CB-OD1 3.45Å; S295-D297 PolarHBondContact O-N 3.32Å; S295-D297 PolarHBondContact OG-OD1 3.42Å; D297-K301 IonicContact OD2-NZ 2.78Å; D297-K301 PolarHBondContact OD2-NZ 3.06Å
298	L	98.8	Very high	97.1	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-73.9	-35.2	178.8	-75.9	176.9	0	0	0	115.2	Y252 L253 F294 S295 A300 K301 F302 L328	Y252-L298 WeakPolarHBondContact O-CD1 3.2Å; L253-L298 HydrophobicContact CB-CD1 4.06Å; F294-L298 HydrophobicContact CB-CD1 4.03Å; S295-L298 WeakPolarHBondContact O-CB 3.27Å; S295-L298 PolarHBondContact O-N 3.02Å; S295-L298 VanDerWaalsContact O-N 3.09Å; L298-A300 PolarHBondContact O-N 3.35Å; L298-K301 HydrophobicContact CD2-CD 4.18Å; L298-K301 CarbonylContact O-C 3.09Å; L298-K301 WeakPolarHBondContact O-CA 3.46Å; L298-K301 WeakPolarHBondContact O-CB 3.47Å; L298-K301 PolarHBondContact O-N 3.07Å; L298-F302 HydrophobicContact CB-CD2 4.18Å; L298-F302 HydrophobicContact CB-CE1 4.44Å; L298-F302 HydrophobicContact CB-CE2 3.76Å; L298-F302 HydrophobicContact CB-CZ 3.92Å; L298-F302 HydrophobicContact CD1-CE2 4.3Å; L298-F302 HydrophobicContact CD1-CZ 3.88Å; L298-F302 HydrophobicContact CD2-CE1 4.18Å; L298-F302 HydrophobicContact CD2-CZ 4.19Å; L298-F302 HydrophobicContact CG-CZ 4.23Å; L298-F302 WeakPolarHBondContact O-CG 3.39Å; L298-F302 PolarHBondContact O-N 3.13Å; L298-L328 HydrophobicContact CD2-CD1 3.92Å
299	P	98.8	Very high	96.9	Very high	0 Å²	0	22 Å²	22	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-51.2	-49.8	-178.2	-32.4	38.9	0	0	0	114.2	M211 L214 A215 F294 N296 K301 F302 V303	M211-P299 HydrophobicContact CB-CB 4.16Å; M211-P299 WeakPolarHBondContact O-CB 3.46Å; M211-P299 HydrophobicContact SD-CB 4.18Å; M211-P299 HydrophobicContact SD-CG 4.18Å; L214-P299 HydrophobicContact CB-CB 3.95Å; L214-P299 HydrophobicContact CB-CG 3.9Å; L214-P299 HydrophobicContact CD1-CG 4.06Å; A215-P299 HydrophobicContact CB-CB 4.1Å; F294-P299 HydrophobicContact CD2-CG 4.05Å; F294-P299 HydrophobicContact CE2-CG 3.6Å; N296-P299 VanDerWaalsContact C-CD 3.46Å; N296-P299 WeakPolarHBondContact O-CD 3.43Å; P299-K301 VanDerWaalsContact C-N 3.3Å; P299-K301 PolarHBondContact O-N 2.68Å; P299-F302 PolarHBondContact O-N 3.21Å; P299-V303 WeakPolarHBondContact O-CG2 3.34Å; P299-V303 PolarHBondContact O-N 2.81Å
300	A	98.6	Very high	96.8	Very high	56 Å²	56	24.7 Å²	24.7	46%	0.463	14%	0.136	S	C	.	.	H	α-helix	trans	-61.4	-37.9	177.9	0	0	0	0	0	112.4	A215 L298 E304	A215-A300 HydrophobicContact CB-CB 3.92Å; L298-A300 PolarHBondContact O-N 3.35Å; A300-E304 PolarHBondContact O-N 2.99Å
301	K	98.6	Very high	96.7	Very high	69 Å²	69	25 Å²	25	30%	0.3	14%	0.138	S	C	.	.	H	α-helix	trans	-68.8	-40	177.3	-63.5	169.5	179.2	167.3	0	111.6	N251 D297 L298 P299 E304 V305 L326	N251-K301 PolarHBondContact OD1-NZ 2.81Å; D297-K301 IonicContact OD2-NZ 2.78Å; D297-K301 PolarHBondContact OD2-NZ 3.06Å; L298-K301 HydrophobicContact CD2-CD 4.18Å; L298-K301 CarbonylContact O-C 3.09Å; L298-K301 WeakPolarHBondContact O-CA 3.46Å; L298-K301 WeakPolarHBondContact O-CB 3.47Å; L298-K301 PolarHBondContact O-N 3.07Å; P299-K301 VanDerWaalsContact C-N 3.3Å; P299-K301 PolarHBondContact O-N 2.68Å; K301-E304 PolarHBondContact O-N 3.06Å; K301-V305 WeakPolarHBondContact O-CB 3.4Å; K301-V305 WeakPolarHBondContact O-CG1 3.25Å; K301-V305 PolarHBondContact O-N 3.42Å; K301-L326 HydrophobicContact CB-CD1 3.74Å; K301-L326 HydrophobicContact CB-CD2 4.06Å
302	F	98.6	Very high	96.6	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-63.8	-45.6	174.9	-67.6	-24.9	0	0	0	111.4	M208 M211 L253 L298 P299 E304 V305 S306 I319 C322 I323 L326	M208-F302 HydrophobicContact CE-CB 4.38Å; M208-F302 WeakPolarHBondContact CE-O 3.42Å; M211-F302 HydrophobicContact CE-CD2 3.94Å; M211-F302 HydrophobicContact CE-CE2 4.25Å; M211-F302 HydrophobicContact CG-CB 4.29Å; M211-F302 HydrophobicContact CG-CD2 4.25Å; M211-F302 HydrophobicContact SD-CD2 3.83Å; L253-F302 HydrophobicContact CD2-CZ 4.3Å; L298-F302 HydrophobicContact CB-CD2 4.18Å; L298-F302 HydrophobicContact CB-CE1 4.44Å; L298-F302 HydrophobicContact CB-CE2 3.76Å; L298-F302 HydrophobicContact CB-CZ 3.92Å; L298-F302 HydrophobicContact CD1-CE2 4.3Å; L298-F302 HydrophobicContact CD1-CZ 3.88Å; L298-F302 HydrophobicContact CD2-CE1 4.18Å; L298-F302 HydrophobicContact CD2-CZ 4.19Å; L298-F302 HydrophobicContact CG-CZ 4.23Å; L298-F302 WeakPolarHBondContact O-CG 3.39Å; L298-F302 PolarHBondContact O-N 3.13Å; P299-F302 PolarHBondContact O-N 3.21Å; F302-E304 VanDerWaalsContact C-N 3.29Å; F302-E304 PolarHBondContact O-N 2.94Å; F302-V305 PolarHBondContact O-N 3.34Å; F302-S306 VanDerWaalsContact O-CB 3.24Å; F302-S306 WeakPolarHBondContact O-CB 3.44Å; F302-S306 PolarHBondContact O-N 3.16Å; F302-I319 HydrophobicContact CD2-CD1 4.3Å; F302-I319 HydrophobicContact CE2-CG2 4.13Å; F302-I319 HydrophobicContact CZ-CG2 4.1Å; F302-C322 HydrophobicContact CD1-CB 3.64Å; F302-C322 HydrophobicContact CE1-CB 4.06Å; F302-C322 HydrophobicContact CG-CB 4.34Å; F302-I323 HydrophobicContact CE1-CB 4.12Å; F302-L326 HydrophobicContact CD1-CD1 3.76Å; F302-L326 HydrophobicContact CE1-CD1 3.89Å
303	V	97.9	Very high	96.2	Very high	9 Å²	9	26 Å²	26	6%	0.055	14%	0.143	C	C	.	.	H	α-helix	trans	-58.1	-43.7	175.1	173.4	0	0	0	0	110.8	Y111 P112 M208 M211 D212 P299 S306	Y111-V303 HydrophobicContact CE2-CG1 3.79Å; P112-V303 HydrophobicContact CG-CB 4.45Å; P112-V303 HydrophobicContact CG-CG1 3.77Å; P112-V303 HydrophobicContact CG-CG2 3.94Å; M208-V303 HydrophobicContact CE-CB 4.44Å; M208-V303 HydrophobicContact CE-CG2 4.04Å; M211-V303 HydrophobicContact CB-CG2 3.85Å; D212-V303 HydrophobicContact CB-CG2 4.19Å; P299-V303 WeakPolarHBondContact O-CG2 3.34Å; P299-V303 PolarHBondContact O-N 2.81Å; V303-S306 PolarHBondContact O-OG 2.88Å
304	E	96.5	Very high	96.1	Very high	110 Å²	110	26.5 Å²	26.5	51%	0.514	15%	0.146	S	C	.	.	H	α-helix	trans	-67.9	-49.4	179.9	-171.3	57	-145.5	0	0	112.8	A300 K301 F302 S306 K307	A300-E304 PolarHBondContact O-N 2.99Å; K301-E304 PolarHBondContact O-N 3.06Å; F302-E304 VanDerWaalsContact C-N 3.29Å; F302-E304 PolarHBondContact O-N 2.94Å; E304-S306 VanDerWaalsContact C-N 3.26Å; E304-S306 PolarHBondContact O-N 3.22Å; E304-K307 WeakPolarHBondContact O-CB 3.43Å; E304-K307 WeakPolarHBondContact O-CG 3.44Å; E304-K307 PolarHBondContact O-N 2.93Å; E304-K307 IonicContact OE1-NZ 2.7Å; E304-K307 PolarHBondContact OE1-NZ 2.77Å; E304-K307 WeakPolarHBondContact OE2-CE 3.44Å; E304-K307 IonicContact OE2-NZ 3.44Å; E304-K307 PolarHBondContact OE2-NZ 2.75Å
305	V	96.6	Very high	96	Very high	20 Å²	20	27.1 Å²	27.1	12%	0.121	15%	0.148	C	C	.	.	H	α-helix	trans	-68.1	-27.8	-177.2	78.3	0	0	0	0	112.3	K301 F302 K307 S308 I309 C322 N325 L326	K301-V305 WeakPolarHBondContact O-CB 3.4Å; K301-V305 WeakPolarHBondContact O-CG1 3.25Å; K301-V305 PolarHBondContact O-N 3.42Å; F302-V305 PolarHBondContact O-N 3.34Å; V305-K307 PolarHBondContact O-N 2.97Å; V305-K307 VanDerWaalsContact O-N 3.14Å; V305-S308 PolarHBondContact O-N 2.89Å; V305-I309 HydrophobicContact CG1-CD1 4.29Å; V305-I309 HydrophobicContact CG2-CD1 4.26Å; V305-C322 HydrophobicContact CG1-CB 3.75Å; V305-N325 HydrophobicContact CG2-CB 3.63Å; V305-L326 HydrophobicContact CB-CD2 3.95Å; V305-L326 HydrophobicContact CB-CG 4.19Å; V305-L326 HydrophobicContact CG1-CD1 4.37Å; V305-L326 HydrophobicContact CG1-CD2 4.34Å; V305-L326 HydrophobicContact CG1-CG 4.12Å; V305-L326 HydrophobicContact CG2-CD2 4.23Å; V305-L326 HydrophobicContact CG2-CG 4.31Å
306	S	95.2	Very high	96	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.007	15%	0.153	C	C	.	.	H	α-helix	trans	-56.1	-31.1	179.3	72.5	0	0	0	0	113.1	F302 V303 E304 S308 I309 Y318	F302-S306 VanDerWaalsContact O-CB 3.24Å; F302-S306 WeakPolarHBondContact O-CB 3.44Å; F302-S306 PolarHBondContact O-N 3.16Å; V303-S306 PolarHBondContact O-OG 2.88Å; E304-S306 VanDerWaalsContact C-N 3.26Å; E304-S306 PolarHBondContact O-N 3.22Å; S306-S308 PolarHBondContact O-N 2.73Å; S306-I309 PolarHBondContact O-N 3.26Å; S306-Y318 WeakPolarHBondContact CA-OH 3.36Å; S306-Y318 VanDerWaalsContact CB-OH 3.26Å; S306-Y318 WeakPolarHBondContact CB-OH 3.28Å; S306-Y318 PolarHBondContact O-OH 3.23Å
307	K	92.9	Very high	96	Very high	43 Å²	43	27.3 Å²	27.3	19%	0.187	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-23.5	176.6	-63.6	173	-178.6	168.5	0	113.2	Q106 Y107 Y111 E304 V305	Q106-K307 CarbonylContact C-O 3.58Å; Q106-K307 VanDerWaalsContact CA-O 3.23Å; Q106-K307 WeakPolarHBondContact CA-O 3.07Å; Y107-K307 PolarHBondContact N-O 2.9Å; Y111-K307 HydrophobicContact CD2-CG 3.77Å; Y111-K307 HydrophobicContact CE2-CD 4.16Å; Y111-K307 HydrophobicContact CE2-CG 3.74Å; Y111-K307 HydrophobicContact CG-CG 4.47Å; Y111-K307 WeakPolarHBondContact OH-CE 3.37Å; E304-K307 WeakPolarHBondContact O-CB 3.43Å; E304-K307 WeakPolarHBondContact O-CG 3.44Å; E304-K307 PolarHBondContact O-N 2.93Å; E304-K307 IonicContact OE1-NZ 2.7Å; E304-K307 PolarHBondContact OE1-NZ 2.77Å; E304-K307 WeakPolarHBondContact OE2-CE 3.44Å; E304-K307 IonicContact OE2-NZ 3.44Å; E304-K307 PolarHBondContact OE2-NZ 2.75Å; V305-K307 PolarHBondContact O-N 2.97Å; V305-K307 VanDerWaalsContact O-N 3.14Å
308	S	91.8	Very high	96	Very high	84 Å²	84	25.5 Å²	25.5	59%	0.587	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	-106.8	4.4	-177.4	-53.9	0	0	0	0	113.3	V305 S306	V305-S308 PolarHBondContact O-N 2.89Å; S306-S308 PolarHBondContact O-N 2.73Å
309	I	91.9	Very high	95.9	Very high	8 Å²	8	25.5 Å²	25.5	4%	0.041	14%	0.14	C	C	.	.	S	Bend	trans	-121.6	120.5	-175.1	-54.1	176.8	0	0	0	109.1	V305 S306 P311 Y318 M321 C322 N325	V305-I309 HydrophobicContact CG1-CD1 4.29Å; V305-I309 HydrophobicContact CG2-CD1 4.26Å; S306-I309 PolarHBondContact O-N 3.26Å; I309-P311 WeakPolarHBondContact O-CD 3.46Å; I309-Y318 HydrophobicContact CB-CE2 3.95Å; I309-Y318 HydrophobicContact CG2-CD2 4.09Å; I309-Y318 HydrophobicContact CG2-CE2 3.49Å; I309-Y318 VanDerWaalsContact CG2-CE2 3.49Å; I309-Y318 PolarHBondContact O-OH 3.25Å; I309-M321 HydrophobicContact CD1-CB 4.39Å; I309-M321 HydrophobicContact CG2-CB 4.21Å; I309-C322 HydrophobicContact CD1-CB 4.39Å; I309-N325 HydrophobicContact CD1-CB 4.02Å; I309-N325 WeakPolarHBondContact CD1-ND2 3.38Å; I309-N325 VanDerWaalsContact CG1-ND2 3.33Å; I309-N325 WeakPolarHBondContact CG1-ND2 3.21Å
310	K	92.6	Very high	95.9	Very high	61 Å²	61	25.6 Å²	25.6	27%	0.265	14%	0.14	S	C	.	.			trans	-61.8	122.2	175.8	-163.9	167.9	-171.7	-167.8	0	110.1	Y107 E276 L277	Y107-K310 HydrophobicContact CD1-CB 3.74Å; Y107-K310 HydrophobicContact CD1-CD 3.9Å; Y107-K310 HydrophobicContact CD1-CG 3.53Å; Y107-K310 HydrophobicContact CD2-CB 3.77Å; Y107-K310 HydrophobicContact CD2-CG 4.49Å; Y107-K310 HydrophobicContact CE1-CB 3.8Å; Y107-K310 HydrophobicContact CE1-CD 3.47Å; Y107-K310 VanDerWaalsContact CE1-CD 3.47Å; Y107-K310 HydrophobicContact CE1-CG 3.64Å; Y107-K310 HydrophobicContact CE2-CB 3.81Å; Y107-K310 VanDerWaalsContact CG-CA 3.42Å; Y107-K310 HydrophobicContact CG-CB 3.7Å; Y107-K310 HydrophobicContact CG-CG 3.98Å; E276-K310 WeakPolarHBondContact O-CD 3.31Å; E276-K310 PolarHBondContact O-NZ 2.89Å; L277-K310 HydrophobicContact CD2-CD 3.93Å; L277-K310 HydrophobicContact CD2-CG 4.1Å
311	P	93.1	Very high	95.9	Very high	12 Å²	12	24 Å²	24	8%	0.078	12%	0.124	C	C	.	.			trans	-71.8	149.8	-179.8	28.9	-33.1	0	0	0	111.8	E109 A110 T204 I309 Y318	E109-P311 HydrophobicContact CB-CG 3.92Å; A110-P311 HydrophobicContact CB-CB 3.49Å; A110-P311 VanDerWaalsContact CB-CB 3.49Å; A110-P311 HydrophobicContact CB-CG 3.88Å; T204-P311 HydrophobicContact CG2-CB 4.1Å; I309-P311 WeakPolarHBondContact O-CD 3.46Å; P311-Y318 HydrophobicContact CB-CE2 4.11Å
312	F	94.4	Very high	95.9	Very high	8 Å²	8	20.8 Å²	20.8	4%	0.035	11%	0.11	C	C	.	.			trans	-143.4	163.1	171.3	55.9	-84.1	0	0	0	108.4	T204 V273 L277 Y278 Y283 I314 A317 Y318 M321	T204-F312 WeakPolarHBondContact CB-O 3.34Å; T204-F312 PolarHBondContact OG1-O 2.69Å; V273-F312 HydrophobicContact CG1-CB 3.98Å; V273-F312 HydrophobicContact CG1-CD2 4.35Å; V273-F312 HydrophobicContact CG1-CG 4.3Å; V273-F312 HydrophobicContact CG2-CD2 4.11Å; L277-F312 HydrophobicContact CB-CB 4.17Å; L277-F312 HydrophobicContact CD1-CB 4.17Å; Y278-F312 HydrophobicContact CD2-CD1 4.32Å; Y278-F312 AromaticContact CD2-CE1 3.81Å; Y278-F312 HydrophobicContact CD2-CE1 3.81Å; Y278-F312 HydrophobicContact CD2-CZ 4.13Å; Y278-F312 HydrophobicContact CE2-CE1 4.4Å; Y278-F312 HydrophobicContact CE2-CZ 4.46Å; Y283-F312 HydrophobicContact CD1-CE2 4.33Å; Y283-F312 HydrophobicContact CD1-CZ 4.37Å; Y283-F312 HydrophobicContact CE1-CD2 4.4Å; Y283-F312 AromaticContact CE1-CE2 3.63Å; Y283-F312 HydrophobicContact CE1-CE2 3.63Å; Y283-F312 HydrophobicContact CE1-CZ 4.03Å; F312-I314 VanDerWaalsContact C-N 3.27Å; F312-I314 HydrophobicContact CD2-CB 3.83Å; F312-I314 HydrophobicContact CD2-CG1 4.24Å; F312-I314 HydrophobicContact CE2-CB 3.83Å; F312-I314 VanDerWaalsContact CE2-O 3.28Å; F312-I314 WeakPolarHBondContact CE2-O 3.19Å; F312-I314 PolarHBondContact O-N 3.34Å; F312-A317 HydrophobicContact CE2-CB 3.87Å; F312-A317 HydrophobicContact CZ-CB 4.13Å; F312-Y318 HydrophobicContact CD1-CD2 4.08Å; F312-Y318 AromaticContact CE1-CD2 3.85Å; F312-Y318 HydrophobicContact CE1-CD2 3.85Å; F312-M321 HydrophobicContact CE1-CG 4.37Å; F312-M321 HydrophobicContact CZ-CG 4.38Å
313	N	90.5	Very high	95.8	Very high	13 Å²	13	20.9 Å²	20.9	7%	0.07	11%	0.11	C	C	.	.	S	Bend	trans	-75.4	-4.3	-166.8	59.5	-67.8	0	0	0	116	L201 Y272 E315	L201-N313 HydrophobicContact CD2-CB 3.97Å; Y272-N313 PolarHBondContact O-OD1 2.92Å; N313-E315 PolarHBondContact O-N 3.04Å
314	I	97.1	Very high	95.8	Very high	11 Å²	11	25.6 Å²	25.6	6%	0.056	13%	0.13	C	C	.	.			trans	-95.9	86.3	178.5	-48.3	-59.8	0	0	0	106.7	W271 V273 F312 D316 A317 Y318	W271-I314 HydrophobicContact CB-CD1 4.14Å; V273-I314 HydrophobicContact CG2-CD1 4.42Å; V273-I314 HydrophobicContact CG2-CG1 3.51Å; F312-I314 VanDerWaalsContact C-N 3.27Å; F312-I314 HydrophobicContact CD2-CB 3.83Å; F312-I314 HydrophobicContact CD2-CG1 4.24Å; F312-I314 HydrophobicContact CE2-CB 3.83Å; F312-I314 VanDerWaalsContact CE2-O 3.28Å; F312-I314 WeakPolarHBondContact CE2-O 3.19Å; F312-I314 PolarHBondContact O-N 3.34Å; I314-D316 VanDerWaalsContact C-N 3.31Å; I314-D316 WeakPolarHBondContact CG2-OD1 3.2Å; I314-D316 PolarHBondContact O-N 3.3Å; I314-A317 HydrophobicContact CB-CB 4.33Å; I314-A317 HydrophobicContact CG2-CB 3.77Å; I314-A317 PolarHBondContact O-N 2.72Å; I314-Y318 PolarHBondContact O-N 3.35Å
315	E	97.3	Very high	95.9	Very high	12 Å²	12	24.1 Å²	24.1	6%	0.056	13%	0.125	C	C	.	.	H	α-helix	trans	-67.5	-32.9	-164.3	86.7	-63.6	174.4	0	0	112.7	L203 T204 T207 K226 N313 Y318 I319	L203-E315 HydrophobicContact CB-CB 4.08Å; L203-E315 HydrophobicContact CB-CG 4.29Å; T204-E315 WeakPolarHBondContact OG1-CA 3.35Å; T207-E315 WeakPolarHBondContact OG1-CG 3.36Å; K226-E315 IonicContact NZ-OE1 2.73Å; K226-E315 PolarHBondContact NZ-OE1 3.3Å; N313-E315 PolarHBondContact O-N 3.04Å; E315-Y318 WeakPolarHBondContact O-CB 3.46Å; E315-Y318 PolarHBondContact O-N 3.47Å; E315-I319 WeakPolarHBondContact O-CG1 3.39Å; E315-I319 PolarHBondContact O-N 2.97Å
316	D	97.9	Very high	96	Very high	17 Å²	17	25.9 Å²	25.9	9%	0.091	13%	0.134	C	C	.	.	H	α-helix	trans	-69.3	-43	178.8	61.4	-10.3	0	0	0	111.7	Y286 T287 G289 I314 Y318 I319 G320	Y286-D316 HydrophobicContact CD2-CB 3.98Å; Y286-D316 HydrophobicContact CE2-CB 4.14Å; Y286-D316 VanDerWaalsContact CE2-CG 3.46Å; Y286-D316 VanDerWaalsContact CE2-OD2 3.29Å; Y286-D316 WeakPolarHBondContact CE2-OD2 3.27Å; T287-D316 WeakPolarHBondContact O-CB 3.34Å; G289-D316 WeakPolarHBondContact CA-OD2 3.45Å; G289-D316 PolarHBondContact N-OD2 3.15Å; I314-D316 VanDerWaalsContact C-N 3.31Å; I314-D316 WeakPolarHBondContact CG2-OD1 3.2Å; I314-D316 PolarHBondContact O-N 3.3Å; D316-Y318 VanDerWaalsContact C-N 3.32Å; D316-I319 PolarHBondContact O-N 3.18Å; D316-G320 PolarHBondContact O-N 3.26Å; D316-G320 VanDerWaalsContact O-N 3.07Å
317	A	98.2	Very high	96.1	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-67.4	-31.2	169.4	0	0	0	0	0	112.4	Y283 Y286 F312 I314 G320 M321	Y283-A317 HydrophobicContact CD1-CB 3.76Å; Y283-A317 HydrophobicContact CD2-CB 4.01Å; Y283-A317 HydrophobicContact CE1-CB 4.02Å; Y283-A317 HydrophobicContact CE2-CB 4.25Å; Y283-A317 HydrophobicContact CG-CB 3.75Å; Y286-A317 HydrophobicContact CD1-CB 4.26Å; Y286-A317 HydrophobicContact CD2-CB 4.37Å; Y286-A317 HydrophobicContact CE1-CB 4.3Å; Y286-A317 HydrophobicContact CE2-CB 4.43Å; Y286-A317 HydrophobicContact CG-CB 4.29Å; F312-A317 HydrophobicContact CE2-CB 3.87Å; F312-A317 HydrophobicContact CZ-CB 4.13Å; I314-A317 HydrophobicContact CB-CB 4.33Å; I314-A317 HydrophobicContact CG2-CB 3.77Å; I314-A317 PolarHBondContact O-N 2.72Å; A317-G320 CarbonylContact O-C 3.5Å; A317-G320 WeakPolarHBondContact O-CA 3.2Å; A317-G320 PolarHBondContact O-N 3.29Å; A317-M321 PolarHBondContact O-N 3.15Å
318	Y	98.1	Very high	96.3	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.008	17%	0.17	C	C	.	.	H	α-helix	trans	-64.1	-42.5	172.4	-176	-93.5	0	0	0	111.7	T204 M208 S306 I309 P311 F312 I314 E315 D316 G320 M321 C322	T204-Y318 HydrophobicContact CG2-CD1 3.49Å; T204-Y318 VanDerWaalsContact CG2-CD1 3.49Å; T204-Y318 HydrophobicContact CG2-CD2 3.95Å; T204-Y318 HydrophobicContact CG2-CE1 3.81Å; T204-Y318 HydrophobicContact CG2-CE2 4.25Å; T204-Y318 HydrophobicContact CG2-CG 3.56Å; M208-Y318 HydrophobicContact CG-CE1 4.17Å; M208-Y318 HydrophobicContact SD-CD1 4.33Å; M208-Y318 HydrophobicContact SD-CE1 3.77Å; S306-Y318 WeakPolarHBondContact CA-OH 3.36Å; S306-Y318 VanDerWaalsContact CB-OH 3.26Å; S306-Y318 WeakPolarHBondContact CB-OH 3.28Å; S306-Y318 PolarHBondContact O-OH 3.23Å; I309-Y318 HydrophobicContact CB-CE2 3.95Å; I309-Y318 HydrophobicContact CG2-CD2 4.09Å; I309-Y318 HydrophobicContact CG2-CE2 3.49Å; I309-Y318 VanDerWaalsContact CG2-CE2 3.49Å; I309-Y318 PolarHBondContact O-OH 3.25Å; P311-Y318 HydrophobicContact CB-CE2 4.11Å; F312-Y318 HydrophobicContact CD1-CD2 4.08Å; F312-Y318 AromaticContact CE1-CD2 3.85Å; F312-Y318 HydrophobicContact CE1-CD2 3.85Å; I314-Y318 PolarHBondContact O-N 3.35Å; E315-Y318 WeakPolarHBondContact O-CB 3.46Å; E315-Y318 PolarHBondContact O-N 3.47Å; D316-Y318 VanDerWaalsContact C-N 3.32Å; Y318-G320 VanDerWaalsContact C-N 3.28Å; Y318-G320 PolarHBondContact O-N 3.45Å; Y318-M321 WeakPolarHBondContact O-CA 3.38Å; Y318-M321 WeakPolarHBondContact O-CB 3.4Å; Y318-M321 PolarHBondContact O-N 3Å; Y318-C322 VanDerWaalsContact CE1-SG 3.53Å; Y318-C322 PolarHBondContact O-N 3.01Å; Y318-C322 PolarHBondContact O-SG 2.95Å
319	I	98.5	Very high	96.5	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-61.9	-37.1	171.4	-66.8	-56.2	0	0	0	111.5	T207 M208 M211 L253 F302 E315 D316 M321 C322 I323	T207-I319 HydrophobicContact CG2-CD1 3.85Å; T207-I319 HydrophobicContact CG2-CG1 3.93Å; M208-I319 HydrophobicContact SD-CD1 4.46Å; M211-I319 HydrophobicContact CE-CD1 3.9Å; M211-I319 HydrophobicContact CE-CG1 4.49Å; L253-I319 HydrophobicContact CD2-CG2 3.74Å; F302-I319 HydrophobicContact CD2-CD1 4.3Å; F302-I319 HydrophobicContact CE2-CG2 4.13Å; F302-I319 HydrophobicContact CZ-CG2 4.1Å; E315-I319 WeakPolarHBondContact O-CG1 3.39Å; E315-I319 PolarHBondContact O-N 2.97Å; D316-I319 PolarHBondContact O-N 3.18Å; I319-M321 VanDerWaalsContact C-N 3.29Å; I319-M321 PolarHBondContact O-N 2.9Å; I319-C322 WeakPolarHBondContact O-CB 3.29Å; I319-C322 PolarHBondContact O-N 3.39Å; I319-I323 PolarHBondContact O-N 3.04Å
320	G	98.1	Very high	96.8	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.01	18%	0.178	C	C	.	.	H	α-helix	trans	-57	-39	169.6	0	0	0	0	0	113.6	D316 A317 Y318 I323 K324	D316-G320 PolarHBondContact O-N 3.26Å; D316-G320 VanDerWaalsContact O-N 3.07Å; A317-G320 CarbonylContact O-C 3.5Å; A317-G320 WeakPolarHBondContact O-CA 3.2Å; A317-G320 PolarHBondContact O-N 3.29Å; Y318-G320 VanDerWaalsContact C-N 3.28Å; Y318-G320 PolarHBondContact O-N 3.45Å; G320-I323 WeakPolarHBondContact O-CG2 3.26Å; G320-K324 WeakPolarHBondContact O-CB 3.42Å; G320-K324 PolarHBondContact O-N 3.1Å; G320-K324 VanDerWaalsContact O-N 3.15Å
321	M	97.7	Very high	97.1	Very high	24 Å²	24	29.8 Å²	29.8	12%	0.118	18%	0.18	C	C	.	.	H	α-helix	trans	-68.8	-42.3	173.2	-74.7	-65.4	-67.7	0	0	112.3	Y278 P284 I309 F312 A317 Y318 I319 I323 K324 N325	Y278-M321 HydrophobicContact CE2-CE 4.04Å; Y278-M321 HydrophobicContact CE2-CG 3.9Å; Y278-M321 HydrophobicContact CE2-SD 3.65Å; P284-M321 HydrophobicContact CG-CG 4.01Å; P284-M321 HydrophobicContact CG-SD 3.66Å; I309-M321 HydrophobicContact CD1-CB 4.39Å; I309-M321 HydrophobicContact CG2-CB 4.21Å; F312-M321 HydrophobicContact CE1-CG 4.37Å; F312-M321 HydrophobicContact CZ-CG 4.38Å; A317-M321 PolarHBondContact O-N 3.15Å; Y318-M321 WeakPolarHBondContact O-CA 3.38Å; Y318-M321 WeakPolarHBondContact O-CB 3.4Å; Y318-M321 PolarHBondContact O-N 3Å; I319-M321 VanDerWaalsContact C-N 3.29Å; I319-M321 PolarHBondContact O-N 2.9Å; M321-I323 PolarHBondContact O-N 3.48Å; M321-K324 PolarHBondContact O-N 3.05Å; M321-N325 WeakPolarHBondContact O-CB 3.34Å; M321-N325 PolarHBondContact O-N 3.14Å; M321-N325 PolarHBondContact O-OD1 2.75Å
322	C	98.2	Very high	97.3	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-57.7	-49.5	176	-69.1	0	0	0	0	111.5	F302 V305 I309 Y318 I319 K324 N325 L326	F302-C322 HydrophobicContact CD1-CB 3.64Å; F302-C322 HydrophobicContact CE1-CB 4.06Å; F302-C322 HydrophobicContact CG-CB 4.34Å; V305-C322 HydrophobicContact CG1-CB 3.75Å; I309-C322 HydrophobicContact CD1-CB 4.39Å; Y318-C322 VanDerWaalsContact CE1-SG 3.53Å; Y318-C322 PolarHBondContact O-N 3.01Å; Y318-C322 PolarHBondContact O-SG 2.95Å; I319-C322 WeakPolarHBondContact O-CB 3.29Å; I319-C322 PolarHBondContact O-N 3.39Å; C322-K324 PolarHBondContact O-N 3.4Å; C322-N325 PolarHBondContact O-N 3.08Å; C322-L326 VanDerWaalsContact O-CG 3.31Å; C322-L326 WeakPolarHBondContact O-CG 3.48Å; C322-L326 PolarHBondContact O-N 3.35Å; C322-L326 VanDerWaalsContact O-N 3.08Å
323	I	98.3	Very high	97.3	Very high	3 Å²	3	31.4 Å²	31.4	2%	0.015	19%	0.192	C	C	.	.	H	α-helix	trans	-66.7	-38.4	-178.7	-160.8	163.5	0	0	0	112.1	L253 F302 I319 G320 M321 L326 L328 V330	L253-I323 HydrophobicContact CB-CD1 3.6Å; L253-I323 HydrophobicContact CD2-CB 4.4Å; L253-I323 HydrophobicContact CD2-CD1 3.66Å; L253-I323 HydrophobicContact CD2-CG2 4.37Å; L253-I323 HydrophobicContact CG-CD1 4.22Å; F302-I323 HydrophobicContact CE1-CB 4.12Å; I319-I323 PolarHBondContact O-N 3.04Å; G320-I323 WeakPolarHBondContact O-CG2 3.26Å; M321-I323 PolarHBondContact O-N 3.48Å; I323-L326 PolarHBondContact O-N 3.13Å; I323-L328 HydrophobicContact CD1-CB 4.3Å; I323-L328 HydrophobicContact CG1-CB 3.55Å; I323-L328 CarbonylContact O-C 3.59Å; I323-L328 PolarHBondContact O-N 3.38Å; I323-V330 HydrophobicContact CG2-CG1 4.13Å
324	K	97.8	Very high	97.6	Very high	107 Å²	107	34.1 Å²	34.1	47%	0.465	21%	0.21	S	C	.	.	H	α-helix	trans	-61.6	-45.1	173.5	175.2	176	169.4	-170	0	111.9	P284 G320 M321 C322 L326 G327	P284-K324 HydrophobicContact CB-CB 4.42Å; P284-K324 HydrophobicContact CB-CD 3.69Å; P284-K324 HydrophobicContact CG-CD 4.34Å; G320-K324 WeakPolarHBondContact O-CB 3.42Å; G320-K324 PolarHBondContact O-N 3.1Å; G320-K324 VanDerWaalsContact O-N 3.15Å; M321-K324 PolarHBondContact O-N 3.05Å; C322-K324 PolarHBondContact O-N 3.4Å; K324-L326 PolarHBondContact O-N 3.2Å; K324-G327 PolarHBondContact O-N 3.02Å
325	N	97.5	Very high	97.5	Very high	79 Å²	79	36.7 Å²	36.7	42%	0.422	22%	0.224	S	C	.	.	H	α-helix	trans	-69.8	-22.1	-179.4	-79.7	20.5	0	0	0	113.3	V305 I309 M321 C322 G327	V305-N325 HydrophobicContact CG2-CB 3.63Å; I309-N325 HydrophobicContact CD1-CB 4.02Å; I309-N325 WeakPolarHBondContact CD1-ND2 3.38Å; I309-N325 VanDerWaalsContact CG1-ND2 3.33Å; I309-N325 WeakPolarHBondContact CG1-ND2 3.21Å; M321-N325 WeakPolarHBondContact O-CB 3.34Å; M321-N325 PolarHBondContact O-N 3.14Å; M321-N325 PolarHBondContact O-OD1 2.75Å; C322-N325 PolarHBondContact O-N 3.08Å; N325-G327 PolarHBondContact O-N 3.18Å
326	L	98.3	Very high	97.3	Very high	57 Å²	57	43 Å²	43	30%	0.298	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-3.2	168.9	-69.2	169.3	0	0	0	113.1	K301 F302 V305 C322 I323 K324 L328	K301-L326 HydrophobicContact CB-CD1 3.74Å; K301-L326 HydrophobicContact CB-CD2 4.06Å; F302-L326 HydrophobicContact CD1-CD1 3.76Å; F302-L326 HydrophobicContact CE1-CD1 3.89Å; V305-L326 HydrophobicContact CB-CD2 3.95Å; V305-L326 HydrophobicContact CB-CG 4.19Å; V305-L326 HydrophobicContact CG1-CD1 4.37Å; V305-L326 HydrophobicContact CG1-CD2 4.34Å; V305-L326 HydrophobicContact CG1-CG 4.12Å; V305-L326 HydrophobicContact CG2-CD2 4.23Å; V305-L326 HydrophobicContact CG2-CG 4.31Å; C322-L326 VanDerWaalsContact O-CG 3.31Å; C322-L326 WeakPolarHBondContact O-CG 3.48Å; C322-L326 PolarHBondContact O-N 3.35Å; C322-L326 VanDerWaalsContact O-N 3.08Å; I323-L326 PolarHBondContact O-N 3.13Å; K324-L326 PolarHBondContact O-N 3.2Å; L326-L328 HydrophobicContact CB-CB 4.48Å; L326-L328 HydrophobicContact CB-CD1 4.06Å; L326-L328 HydrophobicContact CB-CG 4.08Å; L326-L328 HydrophobicContact CD1-CD1 4.41Å; L326-L328 PolarHBondContact O-N 2.84Å
327	G	98.1	Very high	97.1	Very high	71 Å²	71	44.6 Å²	44.6	73%	0.732	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	71	19.6	-173.4	0	0	0	0	0	113.2	K324 N325	K324-G327 PolarHBondContact O-N 3.02Å; N325-G327 PolarHBondContact O-N 3.18Å
328	L	98.1	Very high	97	Very high	43 Å²	43	45.6 Å²	45.6	23%	0.225	27%	0.266	C	S	.	.			trans	-105.4	171.8	179.4	-61.6	175.9	0	0	0	110.2	N251 L298 I323 L326	N251-L328 HydrophobicContact CB-CD1 3.89Å; N251-L328 HydrophobicContact CB-CD2 4.05Å; N251-L328 WeakPolarHBondContact OD1-CD1 3.28Å; L298-L328 HydrophobicContact CD2-CD1 3.92Å; I323-L328 HydrophobicContact CD1-CB 4.3Å; I323-L328 HydrophobicContact CG1-CB 3.55Å; I323-L328 CarbonylContact O-C 3.59Å; I323-L328 PolarHBondContact O-N 3.38Å; L326-L328 HydrophobicContact CB-CB 4.48Å; L326-L328 HydrophobicContact CB-CD1 4.06Å; L326-L328 HydrophobicContact CB-CG 4.08Å; L326-L328 HydrophobicContact CD1-CD1 4.41Å; L326-L328 PolarHBondContact O-N 2.84Å
329	S	95.9	Very high	96.9	Very high	92 Å²	92	45.7 Å²	45.7	64%	0.643	27%	0.267	S	S	*	.			trans	-131	150.8	176.7	-67.3	0	0	0	0	110.4
330	V	97.7	Very high	96.6	Very high	24 Å²	24	48.4 Å²	48.4	15%	0.145	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-61.1	143.8	165.8	-63.7	0	0	0	0	109.6	L253 L257 T285 T287 I323	L253-V330 HydrophobicContact CD2-CG1 3.94Å; L253-V330 HydrophobicContact CG-CG1 4.25Å; L257-V330 HydrophobicContact CD1-CG2 4.03Å; L257-V330 HydrophobicContact CD2-CB 3.97Å; L257-V330 HydrophobicContact CD2-CG2 3.88Å; T285-V330 HydrophobicContact CG2-CG2 3.63Å; T287-V330 HydrophobicContact CG2-CG1 4.27Å; I323-V330 HydrophobicContact CG2-CG1 4.13Å
331	T	97.9	Very high	96.2	Very high	50 Å²	50	50.2 Å²	50.2	31%	0.307	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-101.7	128.7	178.5	-53.1	0	0	0	0	109.4	Y252 L253 T254	Y252-T331 HydrophobicContact CD2-CG2 3.96Å; Y252-T331 HydrophobicContact CE2-CG2 3.58Å; L253-T331 PolarHBondContact O-N 2.84Å; T254-T331 WeakPolarHBondContact CA-O 3.35Å; T254-T331 VanDerWaalsContact CB-O 3.24Å; T254-T331 WeakPolarHBondContact CB-O 3.41Å; T254-T331 PolarHBondContact OG1-O 3.09Å
332	S	96.9	Very high	95.4	Very high	50 Å²	50	55.8 Å²	55.8	35%	0.35	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-59.3	137	172.3	-68.6	0	0	0	0	111.4	Y336	S332-Y336 VanDerWaalsContact CB-CZ 3.45Å; S332-Y336 WeakPolarHBondContact CB-OH 3.28Å; S332-Y336 PolarHBondContact OG-OH 3.11Å
333	P	96.1	Very high	93.8	Very high	4 Å²	4	62.6 Å²	62.6	3%	0.026	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-63.9	150.5	173.7	29.1	-36	0	0	0	109.7	T254 D335 Y336 F339	T254-P333 WeakPolarHBondContact OG1-CA 3.4Å; P333-D335 PolarHBondContact O-N 3.44Å; P333-D335 VanDerWaalsContact O-N 3.16Å; P333-Y336 HydrophobicContact CG-CD1 3.88Å; P333-Y336 HydrophobicContact CG-CE1 4.4Å; P333-Y336 HydrophobicContact CG-CG 4.31Å; P333-F339 HydrophobicContact CB-CD2 3.79Å; P333-F339 HydrophobicContact CB-CE2 3.69Å; P333-F339 HydrophobicContact CG-CD2 4.03Å; P333-F339 HydrophobicContact CG-CE2 4.41Å
334	P	95.8	Very high	92.4	Very high	69 Å²	69	63.9 Å²	63.9	45%	0.448	35%	0.351	S	S	.	.	S	Bend	trans	-56.2	-31.9	177.5	-26.4	34.7	0	0	0	113.6	M241 I247	M241-P334 HydrophobicContact CG-CG 4.07Å; I247-P334 HydrophobicContact CD1-CG 3.47Å; I247-P334 VanDerWaalsContact CD1-CG 3.47Å
335	D	96.1	Very high	91.8	Very high	65 Å²	65	70 Å²	70	35%	0.348	37%	0.371	S	S	.	.			trans	-134	109	172.7	-179.9	-5.9	0	0	0	109.2	P333 S337 Q338	P333-D335 PolarHBondContact O-N 3.44Å; P333-D335 VanDerWaalsContact O-N 3.16Å; D335-S337 VanDerWaalsContact CG-OG 3.28Å; D335-S337 PolarHBondContact O-N 3.32Å; D335-S337 VanDerWaalsContact OD1-CB 3.25Å; D335-S337 WeakPolarHBondContact OD1-CB 3.2Å; D335-S337 PolarHBondContact OD1-N 2.81Å; D335-S337 PolarHBondContact OD1-OG 3.27Å; D335-S337 PolarHBondContact OD2-OG 3.38Å; D335-Q338 HydrophobicContact CB-CG 3.9Å; D335-Q338 PolarHBondContact O-N 2.83Å
336	Y	93.3	Very high	91.5	Very high	144 Å²	144	68.3 Å²	68.3	57%	0.565	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-62.4	-24.6	179.3	-63.5	-86.7	0	0	0	113.2	S332 P333 Q338	S332-Y336 VanDerWaalsContact CB-CZ 3.45Å; S332-Y336 WeakPolarHBondContact CB-OH 3.28Å; S332-Y336 PolarHBondContact OG-OH 3.11Å; P333-Y336 HydrophobicContact CG-CD1 3.88Å; P333-Y336 HydrophobicContact CG-CE1 4.4Å; P333-Y336 HydrophobicContact CG-CG 4.31Å; Y336-Q338 PolarHBondContact O-N 3.18Å
337	S	93.4	Very high	91.3	Very high	52 Å²	52	69.2 Å²	69.2	36%	0.364	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-73.3	-12.6	-176.8	78.6	0	0	0	0	113.1	D335 R340	D335-S337 VanDerWaalsContact CG-OG 3.28Å; D335-S337 PolarHBondContact O-N 3.32Å; D335-S337 VanDerWaalsContact OD1-CB 3.25Å; D335-S337 WeakPolarHBondContact OD1-CB 3.2Å; D335-S337 PolarHBondContact OD1-N 2.81Å; D335-S337 PolarHBondContact OD1-OG 3.27Å; D335-S337 PolarHBondContact OD2-OG 3.38Å; S337-R340 WeakPolarHBondContact O-CG 3.27Å; S337-R340 PolarHBondContact O-NE 3.4Å
338	Q	95.6	Very high	91.1	Very high	21 Å²	21	67.7 Å²	67.7	10%	0.098	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-82	-25.2	-179.1	-56.2	-163.9	-76.6	0	0	113.2	D335 Y336 K353 I354 I355 T356	D335-Q338 HydrophobicContact CB-CG 3.9Å; D335-Q338 PolarHBondContact O-N 2.83Å; Y336-Q338 PolarHBondContact O-N 3.18Å; Q338-K353 WeakPolarHBondContact CG-O 3.27Å; Q338-K353 PolarHBondContact NE2-O 3.28Å; Q338-I354 CarbonylContact O-C 3.48Å; Q338-I354 WeakPolarHBondContact O-CA 3.29Å; Q338-I354 WeakPolarHBondContact O-CB 3.36Å; Q338-I355 HydrophobicContact CB-CB 4.4Å; Q338-I355 HydrophobicContact CB-CD1 3.92Å; Q338-I355 HydrophobicContact CB-CG1 3.97Å; Q338-I355 PolarHBondContact O-N 3.4Å; Q338-T356 PolarHBondContact O-N 3.09Å
339	F	95.6	Very high	91	Very high	4 Å²	4	66.8 Å²	66.8	2%	0.018	33%	0.334	C	S	.	.	B	Isolated β-bridge	trans	-98.2	98.7	176.1	-70.3	-90.1	0	0	0	109.9	M241 L256 P333 I355 T356	M241-F339 HydrophobicContact CE-CE2 4.23Å; M241-F339 HydrophobicContact CE-CZ 4.02Å; M241-F339 HydrophobicContact SD-CE2 3.8Å; M241-F339 HydrophobicContact SD-CZ 4.18Å; L256-F339 HydrophobicContact CB-CB 4.01Å; P333-F339 HydrophobicContact CB-CD2 3.79Å; P333-F339 HydrophobicContact CB-CE2 3.69Å; P333-F339 HydrophobicContact CG-CD2 4.03Å; P333-F339 HydrophobicContact CG-CE2 4.41Å; F339-I355 HydrophobicContact CD1-CG2 4.5Å; F339-I355 HydrophobicContact CD2-CD1 4.48Å; F339-I355 HydrophobicContact CE1-CB 4.39Å; F339-I355 HydrophobicContact CE1-CG2 3.93Å; F339-I355 HydrophobicContact CE2-CD1 3.77Å; F339-I355 HydrophobicContact CZ-CB 4.43Å; F339-I355 HydrophobicContact CZ-CD1 3.86Å; F339-I355 HydrophobicContact CZ-CG2 4.13Å; F339-T356 HydrophobicContact CD1-CG2 3.96Å; F339-T356 HydrophobicContact CE1-CG2 4.21Å
340	R	92.1	Very high	90.8	Very high	57 Å²	57	64.9 Å²	64.9	22%	0.215	32%	0.315	C	S	.	.			trans	-114.6	150.9	-178.3	-59.1	-162.6	-175.4	179.8	4.5	111.6	M290 S337 E350 I354 T356 Y357	M290-R340 VanDerWaalsContact CE-O 3.28Å; M290-R340 WeakPolarHBondContact CE-O 3.49Å; S337-R340 WeakPolarHBondContact O-CG 3.27Å; S337-R340 PolarHBondContact O-NE 3.4Å; R340-E350 IonicContact CZ-OE2 2.66Å; R340-E350 IonicContact NH1-OE2 3.82Å; R340-E350 PolarHBondContact NH1-OE2 3.46Å; R340-E350 IonicContact NH2-OE2 2.82Å; R340-E350 PolarHBondContact NH2-OE2 3.41Å; R340-I354 HydrophobicContact CG-CG2 4.02Å; R340-T356 PolarHBondContact N-O 3.29Å; R340-T356 VanDerWaalsContact N-O 3.12Å; R340-T356 PolarHBondContact N-OG1 3.1Å; R340-T356 CarbonylContact O-C 3.57Å; R340-T356 PolarHBondContact O-OG1 3.43Å; R340-Y357 HydrophobicContact CB-CD2 4.13Å; R340-Y357 WeakPolarHBondContact O-CA 3.26Å
341	D	89.1	Confident	90.7	Very high	38 Å²	38	63.8 Å²	63.8	20%	0.203	31%	0.308	C	S	.	.	S	Bend	trans	-102.2	-70.7	-179.7	54.2	8.5	0	0	0	112.3	L256 K258 M290 I358	L256-D341 HydrophobicContact CD2-CB 4.03Å; K258-D341 IonicContact NZ-OD2 3.88Å; K258-D341 PolarHBondContact NZ-OD2 2.76Å; M290-D341 HydrophobicContact SD-CB 4.02Å; D341-I358 HydrophobicContact CB-CD1 3.83Å; D341-I358 WeakPolarHBondContact O-CA 3.26Å; D341-I358 VanDerWaalsContact O-CB 3.25Å; D341-I358 WeakPolarHBondContact O-CB 3.39Å; D341-I358 PolarHBondContact O-N 2.95Å
342	Y	81.1	Confident	90.6	Very high	141 Å²	141	62.5 Å²	62.5	55%	0.553	30%	0.301	S	S	*	.	S	Bend	trans	-135.9	4.8	-170.7	-60.7	-77.1	0	0	0	114.9	T344 Y357 I358	Y342-T344 PolarHBondContact O-N 3.46Å; Y342-Y357 PolarHBondContact O-OH 3.47Å; Y342-I358 HydrophobicContact CD1-CB 3.92Å; Y342-I358 HydrophobicContact CD1-CD1 4.49Å; Y342-I358 HydrophobicContact CD1-CG2 4.18Å; Y342-I358 HydrophobicContact CD2-CD1 4.16Å; Y342-I358 HydrophobicContact CE1-CB 3.51Å; Y342-I358 HydrophobicContact CE1-CD1 3.87Å; Y342-I358 HydrophobicContact CE1-CG1 4.29Å; Y342-I358 HydrophobicContact CE1-CG2 3.33Å; Y342-I358 HydrophobicContact CE2-CD1 3.48Å; Y342-I358 VanDerWaalsContact CE2-CD1 3.48Å; Y342-I358 WeakPolarHBondContact OH-CD1 3.37Å
343	N	64.8	Low	90.6	Very high	143 Å²	143	64.6 Å²	64.6	77%	0.765	30%	0.304	S	S	*	.			trans	-92.1	11.9	-153.8	-140.1	5.3	0	0	0	115.9
344	T	69.3	Low	90.6	Very high	31 Å²	31	64.5 Å²	64.5	19%	0.19	30%	0.303	C	S	.	.			trans	-147.4	123	-178.3	51	0	0	0	0	112.3	Y342 Y346 Y357	Y342-T344 PolarHBondContact O-N 3.46Å; T344-Y346 PolarHBondContact O-N 3.44Å; T344-Y357 PolarHBondContact N-OH 3.46Å; T344-Y357 PolarHBondContact O-OH 3.34Å; T344-Y357 WeakPolarHBondContact OG1-CE2 3.33Å
345	R	84.8	Confident	90.7	Very high	234 Å²	234	61.2 Å²	61.2	88%	0.883	28%	0.282	S	S	*	.			trans	-50	142.3	161.9	-173.4	178.7	-175	177.9	1.9	109	D347	R345-D347 PolarHBondContact O-N 3.49Å; R345-D347 VanDerWaalsContact O-N 3.13Å
346	Y	91.8	Very high	90.7	Very high	44 Å²	44	58.1 Å²	58.1	17%	0.173	27%	0.265	C	S	.	.			trans	-50.4	122.7	178.5	176.1	-102.6	0	0	0	111.6	T344 F351 Y368 D371 Y372	T344-Y346 PolarHBondContact O-N 3.44Å; Y346-F351 AromaticContact CD2-CD1 3.94Å; Y346-F351 HydrophobicContact CD2-CD1 3.94Å; Y346-F351 AromaticContact CD2-CD2 3.91Å; Y346-F351 HydrophobicContact CD2-CD2 3.91Å; Y346-F351 AromaticContact CD2-CE1 3.95Å; Y346-F351 HydrophobicContact CD2-CE1 3.95Å; Y346-F351 AromaticContact CD2-CE2 3.93Å; Y346-F351 HydrophobicContact CD2-CE2 3.93Å; Y346-F351 AromaticContact CD2-CG 3.91Å; Y346-F351 HydrophobicContact CD2-CG 3.91Å; Y346-F351 AromaticContact CD2-CZ 3.95Å; Y346-F351 HydrophobicContact CD2-CZ 3.95Å; Y346-F351 HydrophobicContact CE2-CB 4.33Å; Y346-F351 HydrophobicContact CE2-CD1 4.05Å; Y346-F351 HydrophobicContact CE2-CD2 4.36Å; Y346-F351 HydrophobicContact CE2-CE1 4.47Å; Y346-F351 AromaticContact CE2-CG 3.98Å; Y346-F351 HydrophobicContact CE2-CG 3.98Å; Y346-Y368 HydrophobicContact CD1-CD1 4.05Å; Y346-Y368 HydrophobicContact CD1-CE1 4.28Å; Y346-Y368 HydrophobicContact CD1-CG 4.46Å; Y346-Y368 AromaticContact CD2-CD1 3.86Å; Y346-Y368 HydrophobicContact CD2-CD1 3.86Å; Y346-Y368 AromaticContact CD2-CD2 3.58Å; Y346-Y368 HydrophobicContact CD2-CD2 3.58Å; Y346-Y368 HydrophobicContact CD2-CE1 4.38Å; Y346-Y368 HydrophobicContact CD2-CE2 4.13Å; Y346-Y368 AromaticContact CD2-CG 3.43Å; Y346-Y368 HydrophobicContact CD2-CG 3.43Å; Y346-Y368 VanDerWaalsContact CD2-CG 3.43Å; Y346-Y368 HydrophobicContact CE2-CD1 4.42Å; Y346-Y368 HydrophobicContact CE2-CD2 4.42Å; Y346-Y368 AromaticContact CE2-CG 3.94Å; Y346-Y368 HydrophobicContact CE2-CG 3.94Å; Y346-Y368 AromaticContact CG-CD1 3.67Å; Y346-Y368 HydrophobicContact CG-CD1 3.67Å; Y346-Y368 AromaticContact CG-CD2 3.96Å; Y346-Y368 HydrophobicContact CG-CD2 3.96Å; Y346-Y368 AromaticContact CG-CE1 3.83Å; Y346-Y368 HydrophobicContact CG-CE1 3.83Å; Y346-Y368 HydrophobicContact CG-CE2 4.11Å; Y346-Y368 AromaticContact CG-CG 3.74Å; Y346-Y368 HydrophobicContact CG-CG 3.74Å; Y346-Y368 PolarHBondContact OH-O 3.04Å; Y346-D371 HydrophobicContact CE1-CB 4.04Å; Y346-D371 VanDerWaalsContact CE1-OD2 3.23Å; Y346-D371 WeakPolarHBondContact CE1-OD2 3.5Å; Y346-D371 WeakPolarHBondContact OH-CB 3.31Å; Y346-D371 PolarHBondContact OH-OD2 3.48Å; Y346-Y372 PolarHBondContact OH-N 3.07Å; Y346-Y372 VanDerWaalsContact OH-N 3.11Å
347	D	93.4	Very high	90.8	Very high	77 Å²	77	52.2 Å²	52.2	41%	0.412	24%	0.242	S	C	.	.			trans	-140.2	123.8	172.8	174	-89.8	0	0	0	107	R345 C349 E350 F351	R345-D347 PolarHBondContact O-N 3.49Å; R345-D347 VanDerWaalsContact O-N 3.13Å; D347-C349 PolarHBondContact O-N 3.42Å; D347-C349 WeakPolarHBondContact OD1-CA 3.41Å; D347-C349 VanDerWaalsContact OD1-CB 3.23Å; D347-C349 WeakPolarHBondContact OD1-CB 3.29Å; D347-C349 PolarHBondContact OD1-N 3.49Å; D347-E350 HydrophobicContact CB-CB 4.21Å; D347-E350 HydrophobicContact CB-CG 4.28Å; D347-E350 PolarHBondContact O-N 3.31Å; D347-E350 PolarHBondContact OD1-N 3.41Å; D347-F351 WeakPolarHBondContact O-CB 3.4Å; D347-F351 VanDerWaalsContact O-CD2 3.31Å; D347-F351 WeakPolarHBondContact O-CD2 3.24Å; D347-F351 PolarHBondContact O-N 3.36Å
348	R	94.7	Very high	90.9	Very high	39 Å²	39	50.1 Å²	50.1	15%	0.147	23%	0.227	C	C	.	.	H	α-helix	trans	-61.9	-32.4	-172.7	-174.8	169.3	174.2	-118.6	-12	112.6	S352 D371 Y372 K374 G376 P377 H378	R348-S352 PolarHBondContact O-N 2.89Å; R348-D371 WeakPolarHBondContact CD-O 3.43Å; R348-D371 PolarHBondContact NE-O 2.93Å; R348-D371 VanDerWaalsContact NE-O 3.15Å; R348-Y372 HydrophobicContact CG-CD2 4.44Å; R348-Y372 PolarHBondContact NE-O 3.47Å; R348-Y372 PolarHBondContact NH2-O 3.44Å; R348-K374 PolarHBondContact NH2-O 3.37Å; R348-G376 PolarHBondContact NH2-O 3.03Å; R348-P377 PolarHBondContact NH1-O 3.09Å; R348-H378 HydrophobicContact CG-CB 4.25Å; R348-H378 PolarHBondContact NE-ND1 3.43Å; R348-H378 PolarHBondContact NH2-ND1 3.04Å
349	C	94.7	Very high	90.9	Very high	24 Å²	24	49.3 Å²	49.3	16%	0.162	22%	0.223	C	C	.	.	H	α-helix	trans	-72.7	-45.7	177.9	-178.9	0	0	0	0	111.2	D347 S352 H378 C379	D347-C349 PolarHBondContact O-N 3.42Å; D347-C349 WeakPolarHBondContact OD1-CA 3.41Å; D347-C349 VanDerWaalsContact OD1-CB 3.23Å; D347-C349 WeakPolarHBondContact OD1-CB 3.29Å; D347-C349 PolarHBondContact OD1-N 3.49Å; C349-S352 WeakPolarHBondContact O-CB 3.45Å; C349-S352 PolarHBondContact O-N 3.35Å; C349-S352 PolarHBondContact O-OG 3.42Å; C349-H378 PolarHBondContact N-O 3.12Å; C349-C379 VanDerWaalsContact CA-SG 3.58Å; C349-C379 HydrophobicContact CB-CB 3.79Å; C349-C379 WeakPolarHBondContact CB-SG 3.39Å; C349-C379 WeakPolarHBondContact SG-CB 3.32Å; C349-C379 CovalentContact SG-SG 2.04Å; C349-C379 PolarHBondContact SG-SG 3.32Å
350	E	93.6	Very high	90.7	Very high	52 Å²	52	55.3 Å²	55.3	24%	0.243	26%	0.256	C	S	.	.	H	α-helix	trans	-63.8	-42.4	176.5	-69.8	-60.7	110.7	0	0	111.5	R340 D347 S352 K353 I354	R340-E350 IonicContact CZ-OE2 2.66Å; R340-E350 IonicContact NH1-OE2 3.82Å; R340-E350 PolarHBondContact NH1-OE2 3.46Å; R340-E350 IonicContact NH2-OE2 2.82Å; R340-E350 PolarHBondContact NH2-OE2 3.41Å; D347-E350 HydrophobicContact CB-CB 4.21Å; D347-E350 HydrophobicContact CB-CG 4.28Å; D347-E350 PolarHBondContact O-N 3.31Å; D347-E350 PolarHBondContact OD1-N 3.41Å; E350-S352 PolarHBondContact O-N 3.48Å; E350-K353 PolarHBondContact O-N 3.44Å; E350-K353 IonicContact OE1-NZ 3.82Å; E350-K353 PolarHBondContact OE1-NZ 2.92Å; E350-I354 PolarHBondContact O-N 3.37Å
351	F	95	Very high	90.8	Very high	0 Å²	0	55 Å²	55	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-64.9	-23.1	177.3	-85.7	-118.2	0	0	0	113	F232 N234 Y346 D347 K353 I354 Y357 Y368 Y372	F232-F351 HydrophobicContact CB-CE1 4.1Å; F232-F351 AromaticContact CD1-CD1 3.74Å; F232-F351 HydrophobicContact CD1-CD1 3.74Å; F232-F351 HydrophobicContact CD1-CE1 4.14Å; F232-F351 AromaticContact CD2-CD1 3.93Å; F232-F351 HydrophobicContact CD2-CD1 3.93Å; F232-F351 HydrophobicContact CD2-CE1 4.07Å; F232-F351 AromaticContact CE1-CD1 3.82Å; F232-F351 HydrophobicContact CE1-CD1 3.82Å; F232-F351 AromaticContact CE2-CD1 3.97Å; F232-F351 HydrophobicContact CE2-CD1 3.97Å; F232-F351 AromaticContact CG-CD1 3.81Å; F232-F351 HydrophobicContact CG-CD1 3.81Å; F232-F351 AromaticContact CG-CE1 3.85Å; F232-F351 HydrophobicContact CG-CE1 3.85Å; F232-F351 AromaticContact CZ-CD1 3.94Å; F232-F351 HydrophobicContact CZ-CD1 3.94Å; N234-F351 PolarHBondContact ND2-O 3.49Å; Y346-F351 AromaticContact CD2-CD1 3.94Å; Y346-F351 HydrophobicContact CD2-CD1 3.94Å; Y346-F351 AromaticContact CD2-CD2 3.91Å; Y346-F351 HydrophobicContact CD2-CD2 3.91Å; Y346-F351 AromaticContact CD2-CE1 3.95Å; Y346-F351 HydrophobicContact CD2-CE1 3.95Å; Y346-F351 AromaticContact CD2-CE2 3.93Å; Y346-F351 HydrophobicContact CD2-CE2 3.93Å; Y346-F351 AromaticContact CD2-CG 3.91Å; Y346-F351 HydrophobicContact CD2-CG 3.91Å; Y346-F351 AromaticContact CD2-CZ 3.95Å; Y346-F351 HydrophobicContact CD2-CZ 3.95Å; Y346-F351 HydrophobicContact CE2-CB 4.33Å; Y346-F351 HydrophobicContact CE2-CD1 4.05Å; Y346-F351 HydrophobicContact CE2-CD2 4.36Å; Y346-F351 HydrophobicContact CE2-CE1 4.47Å; Y346-F351 AromaticContact CE2-CG 3.98Å; Y346-F351 HydrophobicContact CE2-CG 3.98Å; D347-F351 WeakPolarHBondContact O-CB 3.4Å; D347-F351 VanDerWaalsContact O-CD2 3.31Å; D347-F351 WeakPolarHBondContact O-CD2 3.24Å; D347-F351 PolarHBondContact O-N 3.36Å; F351-K353 PolarHBondContact O-N 3.01Å; F351-I354 HydrophobicContact CB-CD1 4.47Å; F351-I354 HydrophobicContact CD1-CD1 4.12Å; F351-I354 HydrophobicContact CD2-CD1 4.07Å; F351-I354 HydrophobicContact CE1-CD1 4.36Å; F351-I354 HydrophobicContact CE2-CD1 4.3Å; F351-I354 HydrophobicContact CG-CD1 3.97Å; F351-I354 HydrophobicContact CZ-CD1 4.45Å; F351-Y357 HydrophobicContact CE1-CD1 4.13Å; F351-Y357 HydrophobicContact CE1-CG 4.1Å; F351-Y357 HydrophobicContact CE2-CD2 4.44Å; F351-Y357 HydrophobicContact CE2-CG 4.39Å; F351-Y357 AromaticContact CZ-CD1 3.59Å; F351-Y357 HydrophobicContact CZ-CD1 3.59Å; F351-Y357 HydrophobicContact CZ-CD2 4.11Å; F351-Y357 HydrophobicContact CZ-CE1 4.05Å; F351-Y357 AromaticContact CZ-CG 3.63Å; F351-Y357 HydrophobicContact CZ-CG 3.63Å; F351-Y368 HydrophobicContact CE1-CD2 4.07Å; F351-Y368 HydrophobicContact CZ-CD2 4.21Å; F351-Y368 HydrophobicContact CZ-CE2 4.44Å; F351-Y372 HydrophobicContact CB-CD2 4.48Å
352	S	95.9	Very high	91.2	Very high	24 Å²	24	54.6 Å²	54.6	17%	0.168	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-16.1	172.2	79.7	0	0	0	0	114.2	N237 R348 C349 E350	N237-S352 PolarHBondContact ND2-O 2.96Å; R348-S352 PolarHBondContact O-N 2.89Å; C349-S352 WeakPolarHBondContact O-CB 3.45Å; C349-S352 PolarHBondContact O-N 3.35Å; C349-S352 PolarHBondContact O-OG 3.42Å; E350-S352 PolarHBondContact O-N 3.48Å
353	K	95.8	Very high	92	Very high	94 Å²	94	54.7 Å²	54.7	41%	0.409	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	-23.3	-177.3	-59	169.9	-164.9	162.2	0	113.1	Q338 E350 F351	Q338-K353 WeakPolarHBondContact CG-O 3.27Å; Q338-K353 PolarHBondContact NE2-O 3.28Å; E350-K353 PolarHBondContact O-N 3.44Å; E350-K353 IonicContact OE1-NZ 3.82Å; E350-K353 PolarHBondContact OE1-NZ 2.92Å; F351-K353 PolarHBondContact O-N 3.01Å
354	I	95.9	Very high	93.5	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.005	24%	0.238	C	C	.	.			trans	-88.4	161.9	-177.2	71.5	-171.2	0	0	0	112	N234 N237 Q338 R340 E350 F351 Y357	N234-I354 WeakPolarHBondContact CB-O 3.48Å; N237-I354 PolarHBondContact ND2-O 2.94Å; Q338-I354 CarbonylContact O-C 3.48Å; Q338-I354 WeakPolarHBondContact O-CA 3.29Å; Q338-I354 WeakPolarHBondContact O-CB 3.36Å; R340-I354 HydrophobicContact CG-CG2 4.02Å; E350-I354 PolarHBondContact O-N 3.37Å; F351-I354 HydrophobicContact CB-CD1 4.47Å; F351-I354 HydrophobicContact CD1-CD1 4.12Å; F351-I354 HydrophobicContact CD2-CD1 4.07Å; F351-I354 HydrophobicContact CE1-CD1 4.36Å; F351-I354 HydrophobicContact CE2-CD1 4.3Å; F351-I354 HydrophobicContact CG-CD1 3.97Å; F351-I354 HydrophobicContact CZ-CD1 4.45Å; I354-Y357 HydrophobicContact CD1-CD2 4.22Å; I354-Y357 HydrophobicContact CD1-CG 4.35Å
355	I	97.8	Very high	94.8	Very high	0 Å²	0	48 Å²	48	0%	0	23%	0.229	C	C	.	.	S	Bend	trans	-98.8	-48.6	170.8	-68.6	167.2	0	0	0	109.9	L233 N234 N237 L238 M241 Q338 F339	L233-I355 CarbonylContact C-O 3.54Å; L233-I355 WeakPolarHBondContact CA-O 3.43Å; L233-I355 HydrophobicContact CD1-CG2 4Å; N234-I355 PolarHBondContact N-O 3.31Å; N237-I355 HydrophobicContact CB-CG1 3.79Å; L238-I355 HydrophobicContact CB-CG2 4.02Å; L238-I355 HydrophobicContact CD1-CG2 4.38Å; M241-I355 HydrophobicContact CB-CD1 4.16Å; M241-I355 HydrophobicContact CE-CD1 4.31Å; M241-I355 HydrophobicContact CG-CD1 4.49Å; M241-I355 HydrophobicContact SD-CD1 3.67Å; Q338-I355 HydrophobicContact CB-CB 4.4Å; Q338-I355 HydrophobicContact CB-CD1 3.92Å; Q338-I355 HydrophobicContact CB-CG1 3.97Å; Q338-I355 PolarHBondContact O-N 3.4Å; F339-I355 HydrophobicContact CD1-CG2 4.5Å; F339-I355 HydrophobicContact CD2-CD1 4.48Å; F339-I355 HydrophobicContact CE1-CB 4.39Å; F339-I355 HydrophobicContact CE1-CG2 3.93Å; F339-I355 HydrophobicContact CE2-CD1 3.77Å; F339-I355 HydrophobicContact CZ-CB 4.43Å; F339-I355 HydrophobicContact CZ-CD1 3.86Å; F339-I355 HydrophobicContact CZ-CG2 4.13Å
356	T	96.6	Very high	95.5	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	149.6	-178	63.5	0	0	0	0	112.5	M225 V231 F232 L233 M290 Q338 F339 R340	M225-T356 HydrophobicContact CE-CG2 3.77Å; V231-T356 HydrophobicContact CG1-CG2 4.36Å; F232-T356 WeakPolarHBondContact O-CA 3.28Å; L233-T356 HydrophobicContact CD1-CG2 4.15Å; M290-T356 WeakPolarHBondContact CE-OG1 3.5Å; Q338-T356 PolarHBondContact O-N 3.09Å; F339-T356 HydrophobicContact CD1-CG2 3.96Å; F339-T356 HydrophobicContact CE1-CG2 4.21Å; R340-T356 PolarHBondContact N-O 3.29Å; R340-T356 VanDerWaalsContact N-O 3.12Å; R340-T356 PolarHBondContact N-OG1 3.1Å; R340-T356 CarbonylContact O-C 3.57Å; R340-T356 PolarHBondContact O-OG1 3.43Å
357	Y	95.8	Very high	95.7	Very high	20 Å²	20	41.9 Å²	41.9	8%	0.078	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	135.3	167.5	-167.7	-89.7	0	0	0	110.2	V231 F232 R340 Y342 T344 F351 I354 L359	V231-Y357 CarbonylContact C-O 3.6Å; V231-Y357 WeakPolarHBondContact CA-O 3.47Å; F232-Y357 PolarHBondContact N-O 2.95Å; F232-Y357 PolarHBondContact O-N 3.07Å; F232-Y357 VanDerWaalsContact O-N 3.11Å; R340-Y357 HydrophobicContact CB-CD2 4.13Å; R340-Y357 WeakPolarHBondContact O-CA 3.26Å; Y342-Y357 PolarHBondContact O-OH 3.47Å; T344-Y357 PolarHBondContact N-OH 3.46Å; T344-Y357 PolarHBondContact O-OH 3.34Å; T344-Y357 WeakPolarHBondContact OG1-CE2 3.33Å; F351-Y357 HydrophobicContact CE1-CD1 4.13Å; F351-Y357 HydrophobicContact CE1-CG 4.1Å; F351-Y357 HydrophobicContact CE2-CD2 4.44Å; F351-Y357 HydrophobicContact CE2-CG 4.39Å; F351-Y357 AromaticContact CZ-CD1 3.59Å; F351-Y357 HydrophobicContact CZ-CD1 3.59Å; F351-Y357 HydrophobicContact CZ-CD2 4.11Å; F351-Y357 HydrophobicContact CZ-CE1 4.05Å; F351-Y357 AromaticContact CZ-CG 3.63Å; F351-Y357 HydrophobicContact CZ-CG 3.63Å; I354-Y357 HydrophobicContact CD1-CD2 4.22Å; I354-Y357 HydrophobicContact CD1-CG 4.35Å; Y357-L359 HydrophobicContact CD1-CD2 3.98Å
358	I	95.4	Very high	95.9	Very high	9 Å²	9	40.5 Å²	40.5	5%	0.046	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	135.8	179.2	-55.4	167.6	0	0	0	109.6	V231 M290 D341 Y342	V231-I358 HydrophobicContact CG2-CG1 4.46Å; M290-I358 HydrophobicContact CB-CD1 3.7Å; M290-I358 HydrophobicContact CB-CG1 3.64Å; M290-I358 HydrophobicContact CG-CD1 4.23Å; M290-I358 HydrophobicContact CG-CG1 4.19Å; M290-I358 HydrophobicContact SD-CD1 3.66Å; M290-I358 HydrophobicContact SD-CG1 3.55Å; M290-I358 VanDerWaalsContact SD-CG1 3.55Å; D341-I358 HydrophobicContact CB-CD1 3.83Å; D341-I358 WeakPolarHBondContact O-CA 3.26Å; D341-I358 VanDerWaalsContact O-CB 3.25Å; D341-I358 WeakPolarHBondContact O-CB 3.39Å; D341-I358 PolarHBondContact O-N 2.95Å; Y342-I358 HydrophobicContact CD1-CB 3.92Å; Y342-I358 HydrophobicContact CD1-CD1 4.49Å; Y342-I358 HydrophobicContact CD1-CG2 4.18Å; Y342-I358 HydrophobicContact CD2-CD1 4.16Å; Y342-I358 HydrophobicContact CE1-CB 3.51Å; Y342-I358 HydrophobicContact CE1-CD1 3.87Å; Y342-I358 HydrophobicContact CE1-CG1 4.29Å; Y342-I358 HydrophobicContact CE1-CG2 3.33Å; Y342-I358 HydrophobicContact CE2-CD1 3.48Å; Y342-I358 VanDerWaalsContact CE2-CD1 3.48Å; Y342-I358 WeakPolarHBondContact OH-CD1 3.37Å
359	L	94.8	Very high	96	Very high	4 Å²	4	39.8 Å²	39.8	2%	0.021	20%	0.204	C	C	.	.			trans	-110.8	159.9	-177.8	-57.8	176.3	0	0	0	110.7	D230 F232 Y357 Q364 L365 Y368	D230-L359 WeakPolarHBondContact O-CA 3.45Å; D230-L359 WeakPolarHBondContact O-CB 3.49Å; D230-L359 PolarHBondContact O-N 3.45Å; F232-L359 HydrophobicContact CB-CD1 3.97Å; F232-L359 HydrophobicContact CB-CD2 4.19Å; F232-L359 HydrophobicContact CB-CG 4.18Å; Y357-L359 HydrophobicContact CD1-CD2 3.98Å; L359-Q364 VanDerWaalsContact CB-OE1 3.24Å; L359-Q364 HydrophobicContact CD2-CG 4.28Å; L359-L365 HydrophobicContact CD1-CB 3.49Å; L359-L365 VanDerWaalsContact CD1-CB 3.49Å; L359-L365 HydrophobicContact CD1-CD1 3.75Å; L359-L365 HydrophobicContact CD1-CG 4.16Å; L359-Y368 HydrophobicContact CD2-CD2 3.61Å; L359-Y368 HydrophobicContact CD2-CE2 3.79Å
360	D	92.3	Very high	96.2	Very high	130 Å²	130	42.7 Å²	42.7	70%	0.695	22%	0.221	S	C	*	.	S	Bend	trans	-84.3	-26	177.7	-61.1	-53	0	0	0	112.5	Q364	D360-Q364 PolarHBondContact OD2-NE2 3.48Å
361	S	95.3	Very high	96.3	Very high	49 Å²	49	42.3 Å²	42.3	34%	0.343	22%	0.22	S	C	.	.			trans	-161.3	163.2	-175.4	74.5	0	0	0	0	114	E363 Q364 L365	S361-E363 VanDerWaalsContact C-N 3.26Å; S361-E363 PolarHBondContact O-N 3Å; S361-E363 PolarHBondContact OG-N 2.89Å; S361-Q364 WeakPolarHBondContact O-CB 3.37Å; S361-Q364 PolarHBondContact O-N 2.88Å; S361-Q364 PolarHBondContact OG-N 2.94Å; S361-Q364 VanDerWaalsContact OG-N 3.13Å; S361-L365 PolarHBondContact O-N 3.08Å; S361-L365 VanDerWaalsContact O-N 3.16Å
362	S	97.3	Very high	96.4	Very high	30 Å²	30	42.9 Å²	42.9	21%	0.21	22%	0.223	C	C	.	.	H	α-helix	trans	-63.1	-30.2	171.9	-44.5	0	0	0	0	113	A145 L365 I366	A145-S362 WeakPolarHBondContact CA-OG 3.47Å; S362-L365 WeakPolarHBondContact O-CB 3.47Å; S362-L365 PolarHBondContact O-N 3.38Å; S362-I366 WeakPolarHBondContact O-CG1 3.35Å; S362-I366 PolarHBondContact O-N 3.41Å; S362-I366 VanDerWaalsContact O-N 3.12Å
363	E	97.1	Very high	96.4	Very high	143 Å²	143	46.8 Å²	46.8	67%	0.668	24%	0.236	S	C	*	.	H	α-helix	trans	-66.6	-44.1	174.8	-174.9	177.1	-167.6	0	0	110.8	S361 L365 I366 D367	S361-E363 VanDerWaalsContact C-N 3.26Å; S361-E363 PolarHBondContact O-N 3Å; S361-E363 PolarHBondContact OG-N 2.89Å; E363-L365 PolarHBondContact O-N 2.94Å; E363-I366 PolarHBondContact O-N 3.06Å; E363-I366 VanDerWaalsContact O-N 3.12Å; E363-D367 PolarHBondContact O-N 3.36Å
364	Q	95.8	Very high	96.4	Very high	31 Å²	31	47.5 Å²	47.5	15%	0.145	24%	0.24	C	C	.	.	H	α-helix	trans	-60.1	-37	174.7	-169.4	-176.7	73.4	0	0	111.5	L359 D360 S361 D367 Y368	L359-Q364 VanDerWaalsContact CB-OE1 3.24Å; L359-Q364 HydrophobicContact CD2-CG 4.28Å; D360-Q364 PolarHBondContact OD2-NE2 3.48Å; S361-Q364 WeakPolarHBondContact O-CB 3.37Å; S361-Q364 PolarHBondContact O-N 2.88Å; S361-Q364 PolarHBondContact OG-N 2.94Å; S361-Q364 VanDerWaalsContact OG-N 3.13Å; Q364-D367 PolarHBondContact O-N 3.48Å; Q364-Y368 HydrophobicContact CG-CD1 4.19Å; Q364-Y368 HydrophobicContact CG-CD2 3.94Å; Q364-Y368 HydrophobicContact CG-CE1 3.73Å; Q364-Y368 HydrophobicContact CG-CE2 3.46Å; Q364-Y368 VanDerWaalsContact CG-CE2 3.46Å; Q364-Y368 HydrophobicContact CG-CG 4.28Å; Q364-Y368 PolarHBondContact NE2-OH 3.2Å; Q364-Y368 WeakPolarHBondContact O-CB 3.47Å; Q364-Y368 VanDerWaalsContact O-CG 3.26Å; Q364-Y368 PolarHBondContact O-N 3.41Å
365	L	97.8	Very high	96.4	Very high	2 Å²	2	53.6 Å²	53.6	1%	0.01	28%	0.279	C	S	.	.	H	α-helix	trans	-59.9	-49.9	173	174.8	57.2	0	0	0	111.7	A148 I149 T152 F232 L359 S361 S362 E363 D367 W369	A148-L365 HydrophobicContact CB-CD2 4.19Å; I149-L365 HydrophobicContact CG1-CD2 3.98Å; T152-L365 HydrophobicContact CG2-CG 4.27Å; F232-L365 HydrophobicContact CD2-CD1 4.29Å; L359-L365 HydrophobicContact CD1-CB 3.49Å; L359-L365 VanDerWaalsContact CD1-CB 3.49Å; L359-L365 HydrophobicContact CD1-CD1 3.75Å; L359-L365 HydrophobicContact CD1-CG 4.16Å; S361-L365 PolarHBondContact O-N 3.08Å; S361-L365 VanDerWaalsContact O-N 3.16Å; S362-L365 WeakPolarHBondContact O-CB 3.47Å; S362-L365 PolarHBondContact O-N 3.38Å; E363-L365 PolarHBondContact O-N 2.94Å; L365-D367 VanDerWaalsContact C-N 3.35Å; L365-D367 PolarHBondContact O-N 3.49Å; L365-W369 WeakPolarHBondContact O-CB 3.18Å; L365-W369 PolarHBondContact O-N 3.3Å
366	I	98.4	Very high	96.2	Very high	56 Å²	56	56.1 Å²	56.1	29%	0.287	31%	0.306	S	S	.	.	H	α-helix	trans	-59.3	-47.1	178.5	-65.3	-54.2	0	0	0	110.9	A148 A151 T152 S362 E363 W369 T370	A148-I366 HydrophobicContact CB-CD1 3.8Å; A148-I366 HydrophobicContact CB-CG1 4.07Å; A151-I366 HydrophobicContact CB-CD1 4.13Å; T152-I366 HydrophobicContact CG2-CD1 3.5Å; T152-I366 VanDerWaalsContact CG2-CD1 3.5Å; S362-I366 WeakPolarHBondContact O-CG1 3.35Å; S362-I366 PolarHBondContact O-N 3.41Å; S362-I366 VanDerWaalsContact O-N 3.12Å; E363-I366 PolarHBondContact O-N 3.06Å; E363-I366 VanDerWaalsContact O-N 3.12Å; I366-W369 PolarHBondContact O-N 2.98Å; I366-T370 VanDerWaalsContact O-CB 3.24Å; I366-T370 WeakPolarHBondContact O-CB 3.3Å; I366-T370 PolarHBondContact O-N 3.33Å; I366-T370 PolarHBondContact O-OG1 3.4Å
367	D	97.1	Very high	96	Very high	95 Å²	95	60.4 Å²	60.4	51%	0.508	33%	0.333	S	S	.	.	H	α-helix	trans	-61.9	-50.6	-177.9	-75.5	-14.4	0	0	0	111.7	E363 Q364 L365 W369 T370 D371	E363-D367 PolarHBondContact O-N 3.36Å; Q364-D367 PolarHBondContact O-N 3.48Å; L365-D367 VanDerWaalsContact C-N 3.35Å; L365-D367 PolarHBondContact O-N 3.49Å; D367-W369 PolarHBondContact O-N 3.47Å; D367-T370 PolarHBondContact O-N 3.02Å; D367-D371 PolarHBondContact O-N 3.4Å
368	Y	96.8	Very high	95.9	Very high	48 Å²	48	62.4 Å²	62.4	19%	0.188	34%	0.343	C	S	.	.	H	α-helix	trans	-66.6	-40.6	-177.9	-69.5	4.4	0	0	0	110.8	Y346 F351 L359 Q364 Y372	Y346-Y368 HydrophobicContact CD1-CD1 4.05Å; Y346-Y368 HydrophobicContact CD1-CE1 4.28Å; Y346-Y368 HydrophobicContact CD1-CG 4.46Å; Y346-Y368 AromaticContact CD2-CD1 3.86Å; Y346-Y368 HydrophobicContact CD2-CD1 3.86Å; Y346-Y368 AromaticContact CD2-CD2 3.58Å; Y346-Y368 HydrophobicContact CD2-CD2 3.58Å; Y346-Y368 HydrophobicContact CD2-CE1 4.38Å; Y346-Y368 HydrophobicContact CD2-CE2 4.13Å; Y346-Y368 AromaticContact CD2-CG 3.43Å; Y346-Y368 HydrophobicContact CD2-CG 3.43Å; Y346-Y368 VanDerWaalsContact CD2-CG 3.43Å; Y346-Y368 HydrophobicContact CE2-CD1 4.42Å; Y346-Y368 HydrophobicContact CE2-CD2 4.42Å; Y346-Y368 AromaticContact CE2-CG 3.94Å; Y346-Y368 HydrophobicContact CE2-CG 3.94Å; Y346-Y368 AromaticContact CG-CD1 3.67Å; Y346-Y368 HydrophobicContact CG-CD1 3.67Å; Y346-Y368 AromaticContact CG-CD2 3.96Å; Y346-Y368 HydrophobicContact CG-CD2 3.96Å; Y346-Y368 AromaticContact CG-CE1 3.83Å; Y346-Y368 HydrophobicContact CG-CE1 3.83Å; Y346-Y368 HydrophobicContact CG-CE2 4.11Å; Y346-Y368 AromaticContact CG-CG 3.74Å; Y346-Y368 HydrophobicContact CG-CG 3.74Å; Y346-Y368 PolarHBondContact OH-O 3.04Å; F351-Y368 HydrophobicContact CE1-CD2 4.07Å; F351-Y368 HydrophobicContact CZ-CD2 4.21Å; F351-Y368 HydrophobicContact CZ-CE2 4.44Å; L359-Y368 HydrophobicContact CD2-CD2 3.61Å; L359-Y368 HydrophobicContact CD2-CE2 3.79Å; Q364-Y368 HydrophobicContact CG-CD1 4.19Å; Q364-Y368 HydrophobicContact CG-CD2 3.94Å; Q364-Y368 HydrophobicContact CG-CE1 3.73Å; Q364-Y368 HydrophobicContact CG-CE2 3.46Å; Q364-Y368 VanDerWaalsContact CG-CE2 3.46Å; Q364-Y368 HydrophobicContact CG-CG 4.28Å; Q364-Y368 PolarHBondContact NE2-OH 3.2Å; Q364-Y368 WeakPolarHBondContact O-CB 3.47Å; Q364-Y368 VanDerWaalsContact O-CG 3.26Å; Q364-Y368 PolarHBondContact O-N 3.41Å; Y368-Y372 WeakPolarHBondContact O-CB 3.39Å; Y368-Y372 PolarHBondContact O-N 3.48Å
369	W	97.7	Very high	95.8	Very high	24 Å²	24	64.1 Å²	64.1	9%	0.091	36%	0.356	C	S	.	.	H	α-helix	trans	-65.9	-41.7	176.9	-169.4	-100.2	0	0	0	112.4	T152 W153 F232 L365 I366 D367 D371 Y372 K373	T152-W369 VanDerWaalsContact CB-CG 3.45Å; T152-W369 HydrophobicContact CG2-CB 3.54Å; T152-W369 HydrophobicContact CG2-CD2 4.4Å; T152-W369 HydrophobicContact CG2-CG 3.54Å; W153-W369 HydrophobicContact CB-CE3 4.21Å; W153-W369 HydrophobicContact CB-CH2 3.67Å; W153-W369 HydrophobicContact CB-CZ2 4.22Å; W153-W369 HydrophobicContact CB-CZ3 3.67Å; F232-W369 HydrophobicContact CD2-CE3 4.22Å; F232-W369 HydrophobicContact CE1-CZ3 4.36Å; F232-W369 AromaticContact CE2-CE3 3.49Å; F232-W369 HydrophobicContact CE2-CE3 3.49Å; F232-W369 VanDerWaalsContact CE2-CE3 3.49Å; F232-W369 HydrophobicContact CE2-CZ3 4.08Å; F232-W369 AromaticContact CZ-CE3 3.67Å; F232-W369 HydrophobicContact CZ-CE3 3.67Å; F232-W369 AromaticContact CZ-CZ3 3.79Å; F232-W369 HydrophobicContact CZ-CZ3 3.79Å; L365-W369 WeakPolarHBondContact O-CB 3.18Å; L365-W369 PolarHBondContact O-N 3.3Å; I366-W369 PolarHBondContact O-N 2.98Å; D367-W369 PolarHBondContact O-N 3.47Å; W369-D371 PolarHBondContact O-N 3.44Å; W369-Y372 HydrophobicContact CE3-CD1 4.2Å; W369-Y372 HydrophobicContact CZ3-CD1 4.16Å; W369-Y372 HydrophobicContact CZ3-CE1 4.34Å; W369-Y372 PolarHBondContact O-N 3.49Å; W369-K373 HydrophobicContact CD2-CG 4.26Å; W369-K373 HydrophobicContact CG-CG 4.37Å; W369-K373 HydrophobicContact CZ2-CD 3.96Å; W369-K373 HydrophobicContact CZ2-CG 4.25Å; W369-K373 WeakPolarHBondContact O-CB 3.44Å; W369-K373 WeakPolarHBondContact O-CG 3.29Å; W369-K373 PolarHBondContact O-N 3.1Å
370	T	97.6	Very high	95.4	Very high	85 Å²	85	71.2 Å²	71.2	52%	0.521	39%	0.393	S	S	.	.	H	α-helix	trans	-61.6	-44.7	179	-61.6	0	0	0	0	111.1	I366 D367	I366-T370 VanDerWaalsContact O-CB 3.24Å; I366-T370 WeakPolarHBondContact O-CB 3.3Å; I366-T370 PolarHBondContact O-N 3.33Å; I366-T370 PolarHBondContact O-OG1 3.4Å; D367-T370 PolarHBondContact O-N 3.02Å
371	D	96.8	Very high	94.7	Very high	43 Å²	43	72.1 Å²	72.1	23%	0.23	40%	0.398	C	S	.	.	H	α-helix	trans	-68.2	-43.6	174.7	-175.3	77.2	0	0	0	112.1	Y346 R348 D367 W369 K373 K374	Y346-D371 HydrophobicContact CE1-CB 4.04Å; Y346-D371 VanDerWaalsContact CE1-OD2 3.23Å; Y346-D371 WeakPolarHBondContact CE1-OD2 3.5Å; Y346-D371 WeakPolarHBondContact OH-CB 3.31Å; Y346-D371 PolarHBondContact OH-OD2 3.48Å; R348-D371 WeakPolarHBondContact CD-O 3.43Å; R348-D371 PolarHBondContact NE-O 2.93Å; R348-D371 VanDerWaalsContact NE-O 3.15Å; D367-D371 PolarHBondContact O-N 3.4Å; W369-D371 PolarHBondContact O-N 3.44Å; D371-K373 VanDerWaalsContact C-N 3.29Å; D371-K373 PolarHBondContact O-N 3.01Å; D371-K374 WeakPolarHBondContact O-CB 3.47Å; D371-K374 WeakPolarHBondContact O-CG 3.39Å; D371-K374 PolarHBondContact O-N 3.44Å; D371-K374 VanDerWaalsContact O-N 3.09Å; D371-K374 WeakPolarHBondContact OD1-CD 3.45Å; D371-K374 WeakPolarHBondContact OD1-CE 3.38Å; D371-K374 IonicContact OD1-NZ 2.78Å; D371-K374 PolarHBondContact OD1-NZ 2.94Å
372	Y	96.8	Very high	93.1	Very high	13 Å²	13	79.8 Å²	79.8	5%	0.051	43%	0.425	C	S	.	.	H	α-helix	trans	-54.1	-46	179	175.6	-110.9	0	0	0	111.7	F232 N234 Y346 R348 F351 Y368 W369 K374 H378	F232-Y372 HydrophobicContact CE2-CG 4.5Å; F232-Y372 AromaticContact CZ-CD1 3.91Å; F232-Y372 HydrophobicContact CZ-CD1 3.91Å; F232-Y372 HydrophobicContact CZ-CD2 4.39Å; F232-Y372 HydrophobicContact CZ-CE1 4.35Å; F232-Y372 AromaticContact CZ-CG 3.95Å; F232-Y372 HydrophobicContact CZ-CG 3.95Å; N234-Y372 PolarHBondContact ND2-OH 2.93Å; Y346-Y372 PolarHBondContact OH-N 3.07Å; Y346-Y372 VanDerWaalsContact OH-N 3.11Å; R348-Y372 HydrophobicContact CG-CD2 4.44Å; R348-Y372 PolarHBondContact NE-O 3.47Å; R348-Y372 PolarHBondContact NH2-O 3.44Å; F351-Y372 HydrophobicContact CB-CD2 4.48Å; Y368-Y372 WeakPolarHBondContact O-CB 3.39Å; Y368-Y372 PolarHBondContact O-N 3.48Å; W369-Y372 HydrophobicContact CE3-CD1 4.2Å; W369-Y372 HydrophobicContact CZ3-CD1 4.16Å; W369-Y372 HydrophobicContact CZ3-CE1 4.34Å; W369-Y372 PolarHBondContact O-N 3.49Å; Y372-K374 VanDerWaalsContact C-N 3.3Å; Y372-K374 PolarHBondContact O-N 3.5Å; Y372-H378 AromaticContact CD2-CE1 3.65Å; Y372-H378 AromaticContact CD2-ND1 3.68Å; Y372-H378 AromaticContact CE2-CE1 3.25Å; Y372-H378 WeakPolarHBondContact CE2-CE1 3.37Å; Y372-H378 AromaticContact CE2-ND1 3.5Å; Y372-H378 WeakPolarHBondContact CE2-ND1 3.4Å; Y372-H378 AromaticContact CE2-NE2 3.81Å; Y372-H378 AromaticContact CZ-CE1 3.6Å; Y372-H378 AromaticContact CZ-NE2 3.9Å; Y372-H378 PolarHBondContact O-CE1 3.36Å; Y372-H378 PolarHBondContact O-ND1 3.18Å
373	K	96.1	Very high	90.5	Very high	105 Å²	105	89.8 Å²	89.8	46%	0.457	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	1.9	-178	-62.5	-64.4	-69.9	-165.8	0	115	W369 D371	W369-K373 HydrophobicContact CD2-CG 4.26Å; W369-K373 HydrophobicContact CG-CG 4.37Å; W369-K373 HydrophobicContact CZ2-CD 3.96Å; W369-K373 HydrophobicContact CZ2-CG 4.25Å; W369-K373 WeakPolarHBondContact O-CB 3.44Å; W369-K373 WeakPolarHBondContact O-CG 3.29Å; W369-K373 PolarHBondContact O-N 3.1Å; D371-K373 VanDerWaalsContact C-N 3.29Å; D371-K373 PolarHBondContact O-N 3.01Å
374	K	96.5	Very high	90.2	Very high	110 Å²	110	87.1 Å²	87.1	48%	0.478	47%	0.465	S	S	.	.	S	Bend	trans	-54.9	150.4	173.2	-76	175.4	-177.7	164.6	0	111.1	R348 D371 Y372	R348-K374 PolarHBondContact NH2-O 3.37Å; D371-K374 WeakPolarHBondContact O-CB 3.47Å; D371-K374 WeakPolarHBondContact O-CG 3.39Å; D371-K374 PolarHBondContact O-N 3.44Å; D371-K374 VanDerWaalsContact O-N 3.09Å; D371-K374 WeakPolarHBondContact OD1-CD 3.45Å; D371-K374 WeakPolarHBondContact OD1-CE 3.38Å; D371-K374 IonicContact OD1-NZ 2.78Å; D371-K374 PolarHBondContact OD1-NZ 2.94Å; Y372-K374 VanDerWaalsContact C-N 3.3Å; Y372-K374 PolarHBondContact O-N 3.5Å
375	P	95.5	Very high	89.9	Confident	128 Å²	128	90.1 Å²	90.1	83%	0.831	48%	0.481	S	S	*	.	S	Bend	trans	-62.2	159.8	172.5	-23	34.1	0	0	0	112.9
376	G	93.2	Very high	89.4	Confident	54 Å²	54	94.9 Å²	94.9	56%	0.557	51%	0.508	S	S	*	.	S	Bend	trans	89.5	171.5	179.4	0	0	0	0	0	113.5	R348	R348-G376 PolarHBondContact NH2-O 3.03Å
377	P	93.3	Very high	88.9	Confident	90 Å²	90	97.2 Å²	97.2	58%	0.584	52%	0.521	S	S	*	.			trans	-62.5	143.9	-175.2	28.2	-35.5	0	0	0	111	R348 C379	R348-P377 PolarHBondContact NH1-O 3.09Å; P377-C379 VanDerWaalsContact C-N 3.31Å; P377-C379 WeakPolarHBondContact CB-O 3.36Å
378	H	93.3	Very high	88.4	Confident	62 Å²	62	97.4 Å²	97.4	29%	0.287	52%	0.521	S	S	.	.	S	Bend	trans	-68.5	-35.3	174.9	-67	-67.6	0	0	0	111.9	R348 C349 Y372	R348-H378 HydrophobicContact CG-CB 4.25Å; R348-H378 PolarHBondContact NE-ND1 3.43Å; R348-H378 PolarHBondContact NH2-ND1 3.04Å; C349-H378 PolarHBondContact N-O 3.12Å; Y372-H378 AromaticContact CD2-CE1 3.65Å; Y372-H378 AromaticContact CD2-ND1 3.68Å; Y372-H378 AromaticContact CE2-CE1 3.25Å; Y372-H378 WeakPolarHBondContact CE2-CE1 3.37Å; Y372-H378 AromaticContact CE2-ND1 3.5Å; Y372-H378 WeakPolarHBondContact CE2-ND1 3.4Å; Y372-H378 AromaticContact CE2-NE2 3.81Å; Y372-H378 AromaticContact CZ-CE1 3.6Å; Y372-H378 AromaticContact CZ-NE2 3.9Å; Y372-H378 PolarHBondContact O-CE1 3.36Å; Y372-H378 PolarHBondContact O-ND1 3.18Å
379	C	93.6	Very high	87.9	Confident	45 Å²	45	100.7 Å²	100.7	30%	0.304	54%	0.544	S	S	.	.	S	Bend	trans	-99.9	123.1	177.6	-56.4	0	0	0	0	109.1	C349 P377	C349-C379 VanDerWaalsContact CA-SG 3.58Å; C349-C379 HydrophobicContact CB-CB 3.79Å; C349-C379 WeakPolarHBondContact CB-SG 3.39Å; C349-C379 WeakPolarHBondContact SG-CB 3.32Å; C349-C379 CovalentContact SG-SG 2.04Å; C349-C379 PolarHBondContact SG-SG 3.32Å; P377-C379 VanDerWaalsContact C-N 3.31Å; P377-C379 WeakPolarHBondContact CB-O 3.36Å
380	L	85.6	Confident	87.1	Confident	153 Å²	153	106.1 Å²	106.1	80%	0.801	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-73.6	133.4	166.8	-61.9	175.2	0	0	0	107.8	K382	L380-K382 PolarHBondContact O-N 3.06Å; L380-K382 VanDerWaalsContact O-N 3.14Å
381	D	78.4	Confident	86.3	Confident	149 Å²	149	107.8 Å²	107.8	80%	0.797	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-58	121.5	169.4	-66.5	-38	0	0	0	107.8	L383	D381-L383 VanDerWaalsContact C-N 3.32Å; D381-L383 PolarHBondContact O-N 3.46Å
382	K	61.4	Low	85.5	Confident	209 Å²	209	113.2 Å²	113.2	91%	0.909	61%	0.609	S	S	*	*			trans	-70.1	96.9	169.8	-73.6	-177.4	178.8	-179.9	0	106.4	L380	L380-K382 PolarHBondContact O-N 3.06Å; L380-K382 VanDerWaalsContact O-N 3.14Å
383	L	42.2	Very low	84.4	Confident	240 Å²	240	122.3 Å²	122.3	100%	1.257	66%	0.66	S	S	*	*			trans	-57.6	0	168.2	-78.5	166.1	0	0	0	111.2	D381	D381-L383 VanDerWaalsContact C-N 3.32Å; D381-L383 PolarHBondContact O-N 3.46Å

Retrieved 383 of 383 residues in 89.6 ms (Link to these results)

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