A0A087YHD1_POEFO Loading...

Threonine aspartase 1

AlphaFold DB , UniProt , Accession A0A087YHD1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 419 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	S	39.6	Very low	29.3	Very low	160 Å²	160	151.8 Å²	151.8	100%	1.119	84%	0.84	S	S	*	*				0	100.9	0	171.6	0	0	0	0	108.2
2	Y	31.1	Very low	28.9	Very low	236 Å²	236	150.1 Å²	150.1	93%	0.925	84%	0.844	S	S	*	*			trans	143.4	101.8	159.4	-88	-74.3	0	0	0	108
3	A	30.2	Very low	28.5	Very low	87 Å²	87	147.6 Å²	147.6	72%	0.719	83%	0.834	S	S	*	*			trans	-96.5	179.1	175.3	0	0	0	0	0	109.5
4	E	33.3	Very low	28.3	Very low	199 Å²	199	150.1 Å²	150.1	93%	0.93	84%	0.836	S	S	*	*			trans	87.4	125.7	171.3	-55	179.1	173.6	0	0	114.2
5	G	28.2	Very low	28.1	Very low	67 Å²	67	152.1 Å²	152.1	69%	0.691	84%	0.836	S	S	*	*			cis	150.2	134.4	7.6	0	0	0	0	0	107.5
6	M	27.8	Very low	27.9	Very low	192 Å²	192	154.8 Å²	154.8	95%	0.946	84%	0.841	S	S	*	*			trans	175.3	104.5	144.8	-99.1	174.1	97.7	0	0	109.8
7	E	27.8	Very low	27.8	Very low	181 Å²	181	156.1 Å²	156.1	85%	0.846	84%	0.84	S	S	*	*			trans	-74.8	142.1	153.6	-72.5	177.1	142.2	0	0	109.2
8	S	26.6	Very low	27.7	Very low	112 Å²	112	154.3 Å²	154.3	78%	0.783	84%	0.838	S	S	*	*			trans	-146.3	114.2	145.2	71.3	0	0	0	0	109.8
9	L	25.4	Very low	27.7	Very low	139 Å²	139	152.2 Å²	152.2	73%	0.728	84%	0.836	S	S	*	*			trans	-62.8	139	168.7	-71.4	103.5	0	0	0	111.4
10	I	28.7	Very low	27.7	Very low	163 Å²	163	150.1 Å²	150.1	84%	0.836	83%	0.832	S	S	*	*			trans	-132.2	112	145.3	-63.1	-177.9	0	0	0	107.2
11	N	23.7	Very low	27.7	Very low	134 Å²	134	148.4 Å²	148.4	72%	0.717	83%	0.826	S	S	*	*			trans	-74.6	134.6	165.9	-96.5	-15.6	0	0	0	109.5
12	C	24.1	Very low	27.2	Very low	131 Å²	131	150.1 Å²	150.1	89%	0.885	82%	0.819	S	S	*	*			trans	-143.2	120.4	144.9	-95.1	0	0	0	0	108.5
13	T	24.6	Very low	26.9	Very low	118 Å²	118	143.7 Å²	143.7	72%	0.724	80%	0.804	S	S	*	*			trans	-80.1	162.6	177	37.4	0	0	0	0	112.3
14	E	24.9	Very low	26.9	Very low	182 Å²	182	146.1 Å²	146.1	85%	0.85	81%	0.805	S	S	*	*			trans	82	126.1	168.8	-59.1	173.9	170.1	0	0	114.1
15	E	25.1	Very low	26.6	Very low	180 Å²	180	142 Å²	142	84%	0.841	80%	0.798	S	S	*	*			cis	-141.2	143.1	38.4	-70.9	176.2	141.1	0	0	113.1
16	Q	25.8	Very low	26.7	Very low	196 Å²	196	148.8 Å²	148.8	92%	0.916	80%	0.803	S	S	*	*			trans	-75.5	123.1	162.9	-72.3	173.2	-29	0	0	109.5
17	Q	25.5	Very low	26.7	Very low	176 Å²	176	149 Å²	149	82%	0.822	80%	0.795	S	S	*	*			trans	-118.9	135.6	152.1	-87.2	-172.3	-15.3	0	0	109.1	S19	Q17-S19 PolarHBondContact O-N 3.43Å
18	P	27	Very low	26.7	Very low	125 Å²	125	147.6 Å²	147.6	81%	0.812	79%	0.793	S	S	*	*			trans	-70.2	128.2	-168.9	27.3	-31.9	0	0	0	110.5	S20	P18-S20 PolarHBondContact O-N 3.13Å
19	S	27.3	Very low	26.9	Very low	114 Å²	114	151.8 Å²	151.8	80%	0.797	80%	0.8	S	S	*	*			trans	-54.5	110.8	165.2	53.6	0	0	0	0	108.4	Q17 V21	Q17-S19 PolarHBondContact O-N 3.43Å; S19-V21 PolarHBondContact O-N 2.79Å
20	S	26.6	Very low	27.3	Very low	109 Å²	109	154 Å²	154	76%	0.762	81%	0.807	S	S	*	*			trans	-54.6	115.3	175.3	56.2	0	0	0	0	109.1	P18 M22	P18-S20 PolarHBondContact O-N 3.13Å; S20-M22 PolarHBondContact O-N 3.39Å; S20-M22 VanDerWaalsContact O-N 3.15Å
21	V	28.2	Very low	27.6	Very low	116 Å²	116	150.8 Å²	150.8	70%	0.703	81%	0.805	S	S	*	*			trans	-48.1	117.8	166	-177.7	0	0	0	0	107.6	S19 T23	S19-V21 PolarHBondContact O-N 2.79Å; V21-T23 HydrophobicContact CG1-CG2 3.85Å; V21-T23 PolarHBondContact O-N 3.4Å
22	M	28.6	Very low	28	Very low	195 Å²	195	150.5 Å²	150.5	96%	0.961	81%	0.812	S	S	*	*			trans	-69.3	80.7	168.7	-78.6	-153.8	-162.5	0	0	108.6	S20	S20-M22 PolarHBondContact O-N 3.39Å; S20-M22 VanDerWaalsContact O-N 3.15Å
23	T	25.6	Very low	28.8	Very low	101 Å²	101	155.6 Å²	155.6	62%	0.62	81%	0.812	S	S	*	*			trans	-79.7	126	163.5	41.6	0	0	0	0	109.6	V21	V21-T23 HydrophobicContact CG1-CG2 3.85Å; V21-T23 PolarHBondContact O-N 3.4Å
24	N	30.2	Very low	29.4	Very low	139 Å²	139	155.9 Å²	155.9	74%	0.743	82%	0.819	S	S	*	*			trans	64.4	89.7	151.1	-58.3	-16.1	0	0	0	118.3
25	S	27.9	Very low	30.1	Very low	112 Å²	112	155.9 Å²	155.9	78%	0.783	82%	0.819	S	S	*	*	S	Bend	trans	-93.4	11.4	158.8	76.6	0	0	0	0	114.3
26	W	30.5	Very low	30.7	Very low	209 Å²	209	156.9 Å²	156.9	79%	0.792	82%	0.821	S	S	*	*	S	Bend	trans	-96.8	13.4	176.5	-78.9	30.1	0	0	0	113.7
27	Y	27.7	Very low	31.5	Very low	198 Å²	198	152.4 Å²	152.4	78%	0.776	82%	0.817	S	S	*	*	S	Bend	trans	-135.3	10	-178.1	-119.4	-84.3	0	0	0	116.2
28	N	27.5	Very low	32.7	Very low	151 Å²	151	150 Å²	150	81%	0.807	80%	0.804	S	S	*	*			trans	-136.6	73.1	175.3	-88.3	-28.7	0	0	0	111.4
29	Q	30.1	Very low	33.8	Very low	199 Å²	199	148.1 Å²	148.1	93%	0.93	79%	0.793	S	S	*	*			trans	-126.1	24.2	155.3	-91.4	-174.6	-0.5	0	0	111.5
30	E	33.9	Very low	35.6	Very low	187 Å²	187	143.5 Å²	143.5	87%	0.874	76%	0.762	S	S	*	*			trans	-102.9	66.5	169	-72.2	-174.1	157.7	0	0	110.1
31	A	35.4	Very low	38.3	Very low	95 Å²	95	138.4 Å²	138.4	79%	0.785	73%	0.727	S	S	*	*	S	Bend	trans	-154	120.4	161.6	0	0	0	0	0	110.1
32	C	31	Very low	41.5	Very low	128 Å²	128	132.9 Å²	132.9	87%	0.865	69%	0.693	S	S	*	*	S	Bend	trans	86.4	52.5	177.8	-148.1	0	0	0	0	117.7
33	R	41.8	Very low	44.8	Very low	237 Å²	237	123.8 Å²	123.8	89%	0.894	65%	0.648	S	S	*	*			trans	-129.2	68.8	146.4	-73.9	-173.8	-178.5	179.7	1.2	110.1	Q35	R33-Q35 PolarHBondContact O-N 3.47Å
34	S	37.4	Very low	48.3	Very low	124 Å²	124	119 Å²	119	87%	0.867	62%	0.618	S	S	*	*			trans	-90.7	81.8	160.6	-178.3	0	0	0	0	108.1
35	Q	39.6	Very low	51.6	Low	183 Å²	183	112.3 Å²	112.3	86%	0.855	58%	0.583	S	S	*	*	S	Bend	trans	-129.6	129.8	159.3	-83.2	-179.8	-21.8	0	0	106.2	R33 A37	R33-Q35 PolarHBondContact O-N 3.47Å; Q35-A37 PolarHBondContact O-N 3.24Å
36	K	38	Very low	54.9	Low	200 Å²	200	107 Å²	107	87%	0.87	55%	0.546	S	S	*	.			trans	-38.4	129.8	-178.8	-72.9	172.3	174.6	175.3	0	110.9	K38	K36-K38 VanDerWaalsContact C-N 3.34Å; K36-K38 PolarHBondContact O-N 2.98Å
37	A	41.7	Very low	58.2	Low	102 Å²	102	97 Å²	97	84%	0.843	51%	0.508	S	S	*	.			trans	-55.9	97.5	173.2	0	0	0	0	0	109.3	Q35	Q35-A37 PolarHBondContact O-N 3.24Å
38	K	50.3	Low	61.5	Low	126 Å²	126	87.7 Å²	87.7	55%	0.548	47%	0.472	S	S	.	.			trans	-64.7	134.6	168.4	-72.3	-179.2	174.7	-178.1	0	106.4	K36 A40 D419	K36-K38 VanDerWaalsContact C-N 3.34Å; K36-K38 PolarHBondContact O-N 2.98Å; K38-A40 PolarHBondContact O-N 3.27Å; K38-D419 WeakPolarHBondContact CE-OD1 3.31Å; K38-D419 VanDerWaalsContact CE-OD2 3.22Å; K38-D419 WeakPolarHBondContact CE-OD2 3.37Å; K38-D419 VanDerWaalsContact NZ-CG 3.29Å; K38-D419 IonicContact NZ-OD1 3.49Å; K38-D419 PolarHBondContact NZ-OD1 2.87Å; K38-D419 IonicContact NZ-OD2 2.61Å; K38-D419 PolarHBondContact NZ-OD2 3.14Å
39	C	51.4	Low	64.5	Low	86 Å²	86	80.5 Å²	80.5	58%	0.581	43%	0.433	S	S	*	.			trans	-68.5	83.9	172.3	-163.3	0	0	0	0	107.6	G41	C39-G41 PolarHBondContact O-N 3.17Å
40	A	63.9	Low	67.4	Low	17 Å²	17	71 Å²	71	14%	0.14	39%	0.389	C	S	.	.			trans	-70.5	116.2	-178.9	0	0	0	0	0	108.7	K38 L76 A383	K38-A40 PolarHBondContact O-N 3.27Å; A40-L76 VanDerWaalsContact CB-O 3.24Å; A40-L76 WeakPolarHBondContact CB-O 3.35Å; A40-A383 WeakPolarHBondContact O-CB 3.47Å
41	G	84.1	Confident	70	Confident	2 Å²	2	62.1 Å²	62.1	2%	0.021	35%	0.348	C	S	.	.			trans	-62.3	158.2	169.6	0	0	0	0	0	111.2	C39 S242	C39-G41 PolarHBondContact O-N 3.17Å; G41-S242 VanDerWaalsContact O-CA 3.28Å; G41-S242 WeakPolarHBondContact O-CA 3.35Å; G41-S242 VanDerWaalsContact O-CB 3.25Å; G41-S242 WeakPolarHBondContact O-CB 3.12Å; G41-S242 PolarHBondContact O-N 2.79Å
42	G	94.9	Very high	72.5	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	166.2	161.8	177.6	0	0	0	0	0	111.2	V240 A383 L414	G42-V240 CarbonylContact C-O 3.55Å; G42-V240 WeakPolarHBondContact CA-O 3.36Å; G42-A383 PolarHBondContact O-N 2.98Å; G42-L414 WeakPolarHBondContact O-CD2 3.29Å
43	F	98.2	Very high	75.3	Confident	3 Å²	3	55.5 Å²	55.5	1%	0.013	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	144.2	-179.8	-175.3	-88.3	0	0	0	110.5	L45 V239 V240 L346 V365 F367 Y380 C412 L414	F43-L45 HydrophobicContact CE1-CB 4.05Å; F43-V239 WeakPolarHBondContact O-CA 3.21Å; F43-V240 HydrophobicContact CB-CG1 3.8Å; F43-V240 PolarHBondContact N-O 3.4Å; F43-V240 PolarHBondContact O-N 3.12Å; F43-L346 HydrophobicContact CD1-CD1 3.77Å; F43-L346 HydrophobicContact CE1-CD1 4.48Å; F43-V365 HydrophobicContact CB-CG1 4.37Å; F43-V365 HydrophobicContact CD1-CG1 4Å; F43-V365 HydrophobicContact CG-CG1 4.2Å; F43-F367 HydrophobicContact CE1-CB 3.67Å; F43-F367 AromaticContact CE1-CD1 3.77Å; F43-F367 HydrophobicContact CE1-CD1 3.77Å; F43-F367 HydrophobicContact CE1-CD2 4.31Å; F43-F367 AromaticContact CE1-CG 3.66Å; F43-F367 HydrophobicContact CE1-CG 3.66Å; F43-F367 AromaticContact CE2-CD1 3.91Å; F43-F367 HydrophobicContact CE2-CD1 3.91Å; F43-F367 AromaticContact CE2-CE1 3.88Å; F43-F367 HydrophobicContact CE2-CE1 3.88Å; F43-F367 HydrophobicContact CE2-CG 4.46Å; F43-F367 HydrophobicContact CE2-CZ 4.43Å; F43-F367 HydrophobicContact CZ-CB 4Å; F43-F367 AromaticContact CZ-CD1 3.27Å; F43-F367 HydrophobicContact CZ-CD1 3.27Å; F43-F367 AromaticContact CZ-CD2 3.86Å; F43-F367 HydrophobicContact CZ-CD2 3.86Å; F43-F367 AromaticContact CZ-CE1 3.59Å; F43-F367 HydrophobicContact CZ-CE1 3.59Å; F43-F367 HydrophobicContact CZ-CE2 4.14Å; F43-F367 AromaticContact CZ-CG 3.42Å; F43-F367 HydrophobicContact CZ-CG 3.42Å; F43-F367 VanDerWaalsContact CZ-CG 3.42Å; F43-F367 HydrophobicContact CZ-CZ 4.01Å; F43-Y380 HydrophobicContact CE2-CD2 4.26Å; F43-Y380 HydrophobicContact CZ-CD2 4.04Å; F43-Y380 HydrophobicContact CZ-CG 4.27Å; F43-C412 HydrophobicContact CD2-CB 3.93Å; F43-C412 HydrophobicContact CE2-CB 4.01Å; F43-L414 HydrophobicContact CB-CD1 4.33Å; F43-L414 HydrophobicContact CB-CD2 4.26Å
44	V	98.9	Very high	77.4	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	140.1	174.6	60.7	0	0	0	0	110.3	V46 C69 A72 V73 V238 V239 Y380 M381	V44-V46 HydrophobicContact CG2-CG1 3.69Å; V44-C69 HydrophobicContact CG1-CB 3.97Å; V44-A72 HydrophobicContact CB-CB 3.96Å; V44-A72 HydrophobicContact CG1-CB 4.08Å; V44-A72 HydrophobicContact CG2-CB 3.74Å; V44-V73 HydrophobicContact CG1-CG2 3.89Å; V44-V238 WeakPolarHBondContact CA-O 3.33Å; V44-V239 HydrophobicContact CB-CG2 4.05Å; V44-V239 HydrophobicContact CG2-CG2 3.73Å; V44-Y380 CarbonylContact O-C 3.44Å; V44-Y380 WeakPolarHBondContact O-CA 3.49Å; V44-Y380 WeakPolarHBondContact O-CB 3.36Å; V44-M381 HydrophobicContact CG1-CB 4.07Å; V44-M381 PolarHBondContact N-O 2.94Å; V44-M381 PolarHBondContact O-N 2.85Å
45	L	98.9	Very high	79.9	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	132.8	165.1	170.5	65	0	0	0	107.8	F43 A237 V238 I344 F367 L368 W369 V378 G379 Y380	F43-L45 HydrophobicContact CE1-CB 4.05Å; L45-A237 CarbonylContact O-C 3.52Å; L45-A237 VanDerWaalsContact O-CA 3.31Å; L45-A237 WeakPolarHBondContact O-CA 3.15Å; L45-V238 HydrophobicContact CB-CG2 3.79Å; L45-V238 HydrophobicContact CD2-CG2 4.34Å; L45-V238 HydrophobicContact CG-CG2 4.3Å; L45-V238 PolarHBondContact N-O 3.19Å; L45-V238 PolarHBondContact O-N 3.1Å; L45-I344 HydrophobicContact CD1-CG2 4.31Å; L45-I344 HydrophobicContact CD2-CB 3.64Å; L45-I344 HydrophobicContact CD2-CG2 4.04Å; L45-I344 HydrophobicContact CG-CB 3.86Å; L45-I344 HydrophobicContact CG-CD1 4.08Å; L45-I344 HydrophobicContact CG-CG2 4Å; L45-I344 VanDerWaalsContact O-CD1 3.32Å; L45-I344 WeakPolarHBondContact O-CD1 3.42Å; L45-F367 HydrophobicContact CD2-CB 4.17Å; L45-L368 WeakPolarHBondContact CD2-O 3.48Å; L45-W369 HydrophobicContact CD1-CE3 4.29Å; L45-V378 HydrophobicContact CD1-CB 4.3Å; L45-G379 CarbonylContact C-O 3.56Å; L45-G379 WeakPolarHBondContact CA-O 3.41Å; L45-G379 WeakPolarHBondContact CD1-O 3.32Å; L45-Y380 HydrophobicContact CD1-CD1 4.45Å
46	V	98.9	Very high	82.2	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	157.2	179.8	-49.4	0	0	0	0	110.8	V44 C65 A68 A89 L93 G236 A237 V378 G379	V44-V46 HydrophobicContact CG2-CG1 3.69Å; V46-C65 HydrophobicContact CG2-CB 3.77Å; V46-A68 HydrophobicContact CG1-CB 4.28Å; V46-A68 HydrophobicContact CG2-CB 4.34Å; V46-A89 HydrophobicContact CG1-CB 4.17Å; V46-L93 HydrophobicContact CB-CD1 4.25Å; V46-G236 CarbonylContact C-O 3.57Å; V46-G236 VanDerWaalsContact CA-O 3.3Å; V46-G236 WeakPolarHBondContact CA-O 3.34Å; V46-A237 HydrophobicContact CB-CB 4.28Å; V46-A237 HydrophobicContact CG1-CB 3.73Å; V46-V378 CarbonylContact O-C 3.47Å; V46-V378 VanDerWaalsContact O-CA 3.27Å; V46-V378 WeakPolarHBondContact O-CA 3.25Å; V46-G379 PolarHBondContact N-O 3.31Å; V46-G379 PolarHBondContact O-N 2.97Å
47	H	98.8	Very high	84.6	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	151.4	167.7	72.4	88.7	0	0	0	112.6	T234 V235 G236 S289 I344 M376 C377 V378	H47-T234 PolarHBondContact CE1-O 3.5Å; H47-T234 PolarHBondContact ND1-O 3.34Å; H47-V235 WeakPolarHBondContact O-CA 3.46Å; H47-G236 PolarHBondContact CD2-O 3.36Å; H47-G236 PolarHBondContact CE1-N 2.99Å; H47-G236 VanDerWaalsContact CE1-N 3.34Å; H47-G236 PolarHBondContact N-O 3.03Å; H47-G236 VanDerWaalsContact NE2-CA 3.3Å; H47-G236 WeakPolarHBondContact NE2-CA 3.11Å; H47-G236 PolarHBondContact NE2-N 3.4Å; H47-G236 PolarHBondContact O-N 2.92Å; H47-S289 PolarHBondContact NE2-OG 3Å; H47-I344 HydrophobicContact CB-CD1 4.47Å; H47-I344 HydrophobicContact CB-CG2 3.93Å; H47-M376 HydrophobicContact CB-CE 3.44Å; H47-M376 VanDerWaalsContact CB-CE 3.44Å; H47-C377 CarbonylContact C-O 3.55Å; H47-C377 WeakPolarHBondContact CA-O 3.24Å; H47-C377 WeakPolarHBondContact CB-O 3.4Å; H47-V378 HydrophobicContact CB-CG1 4.43Å
48	A	97.1	Very high	86.9	Confident	1 Å²	1	34.1 Å²	34.1	1%	0.008	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	69.6	171.9	0	0	0	0	0	109.8	H53 Y61 V64 C65 L93 T99 C377	A48-H53 PolarHBondContact O-NE2 2.97Å; A48-Y61 HydrophobicContact CB-CD1 4.11Å; A48-V64 HydrophobicContact CB-CG1 4.27Å; A48-C65 WeakPolarHBondContact CB-SG 3.38Å; A48-L93 HydrophobicContact CB-CD2 4.25Å; A48-T99 HydrophobicContact CB-CG2 4.48Å; A48-C377 HydrophobicContact CB-CB 4.31Å; A48-C377 PolarHBondContact N-O 2.98Å
49	G	90.8	Very high	89.1	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	89.1	139.1	178.4	0	0	0	0	0	115.3	H53 T234 M376 C377	G49-H53 PolarHBondContact O-CE1 2.99Å; G49-H53 PolarHBondContact O-NE2 3.24Å; G49-T234 WeakPolarHBondContact CA-O 3.3Å; G49-T234 PolarHBondContact N-O 3.21Å; G49-M376 WeakPolarHBondContact O-CA 3.41Å; G49-M376 WeakPolarHBondContact O-CG 3.3Å; G49-C377 PolarHBondContact O-N 3.21Å
50	A	89.6	Confident	91.1	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	116.8	158.4	0	0	0	0	0	107	S291 T373 M376	A50-S291 PolarHBondContact N-OG 2.93Å; A50-T373 HydrophobicContact CB-CG2 4.15Å; A50-M376 HydrophobicContact CB-CB 4.31Å; A50-M376 HydrophobicContact CB-CG 4.04Å; A50-M376 HydrophobicContact CB-SD 4.13Å
51	G	89.8	Confident	92.6	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.01	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.7	-130.7	-168.6	0	0	0	0	0	110.5	T373 E374 S375	G51-T373 PolarHBondContact N-OG1 3.02Å; G51-E374 PolarHBondContact O-N 2.81Å; G51-S375 PolarHBondContact N-O 2.69Å; G51-S375 PolarHBondContact O-N 3.22Å; G51-S375 PolarHBondContact O-OG 3.08Å; G51-S375 VanDerWaalsContact O-OG 3.09Å
52	Y	87.4	Confident	93.3	Very high	83 Å²	83	39.1 Å²	39.1	33%	0.325	19%	0.191	S	C	.	.			trans	-118.7	115.6	177.3	177.7	-107.3	0	0	0	112.5	E374	Y52-E374 HydrophobicContact CD2-CB 4.27Å; Y52-E374 WeakPolarHBondContact CD2-OE2 3.45Å; Y52-E374 WeakPolarHBondContact CE2-OE2 3.31Å
53	H	89.1	Confident	93.5	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.21	C	C	.	.			trans	-105	99.4	175.5	-57.5	78.4	0	0	0	109.9	A48 G49 Y61 S375 I392 R394	A48-H53 PolarHBondContact O-NE2 2.97Å; G49-H53 PolarHBondContact O-CE1 2.99Å; G49-H53 PolarHBondContact O-NE2 3.24Å; H53-Y61 AromaticContact CD2-CD2 3.59Å; H53-Y61 AromaticContact CD2-CE2 3.8Å; H53-Y61 AromaticContact CD2-CG 3.73Å; H53-S375 PolarHBondContact N-OG 2.93Å; H53-S375 PolarHBondContact ND1-OG 3.23Å; H53-I392 HydrophobicContact CB-CD1 4.21Å; H53-I392 HydrophobicContact CB-CG2 4.26Å; H53-R394 PolarHBondContact O-NH1 3.47Å; H53-R394 PolarHBondContact O-NH2 3.37Å
54	S	87.3	Confident	93.5	Very high	26 Å²	26	43.2 Å²	43.2	18%	0.182	21%	0.21	C	C	.	.			trans	-58.4	146	172.5	74.5	0	0	0	0	110.9	S56 K57 A58	S54-S56 PolarHBondContact O-N 3.1Å; S54-S56 PolarHBondContact OG-OG 3.39Å; S54-K57 PolarHBondContact O-N 3.22Å; S54-K57 VanDerWaalsContact O-N 3.1Å; S54-K57 PolarHBondContact OG-N 3.4Å; S54-A58 PolarHBondContact O-N 3.04Å
55	E	88.6	Confident	93.4	Very high	166 Å²	166	43.2 Å²	43.2	78%	0.776	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-35.3	178.5	-62.1	-169.8	165.7	0	0	112.5	K57 A58	E55-K57 VanDerWaalsContact C-N 3.31Å; E55-K57 PolarHBondContact O-N 3.37Å; E55-A58 PolarHBondContact O-N 3.14Å
56	S	88.7	Confident	93.4	Very high	100 Å²	100	48 Å²	48	70%	0.699	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-35.1	178.6	70.1	0	0	0	0	113.7	S54	S54-S56 PolarHBondContact O-N 3.1Å; S54-S56 PolarHBondContact OG-OG 3.39Å
57	K	87.5	Confident	93.4	Very high	90 Å²	90	52.4 Å²	52.4	39%	0.391	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-10	-178.3	-65.8	-174.9	177.4	-176.1	0	113.5	S54 E55 K59 E60 Y61	S54-K57 PolarHBondContact O-N 3.22Å; S54-K57 VanDerWaalsContact O-N 3.1Å; S54-K57 PolarHBondContact OG-N 3.4Å; E55-K57 VanDerWaalsContact C-N 3.31Å; E55-K57 PolarHBondContact O-N 3.37Å; K57-K59 PolarHBondContact O-N 2.92Å; K57-K59 VanDerWaalsContact O-N 3.1Å; K57-E60 WeakPolarHBondContact O-CB 3.29Å; K57-E60 PolarHBondContact O-N 3.14Å; K57-Y61 HydrophobicContact CB-CD2 4.03Å; K57-Y61 HydrophobicContact CB-CE2 3.72Å; K57-Y61 HydrophobicContact CD-CE2 4.39Å; K57-Y61 VanDerWaalsContact O-CD2 3.25Å; K57-Y61 WeakPolarHBondContact O-CD2 3.33Å; K57-Y61 PolarHBondContact O-N 3.38Å
58	A	91.3	Very high	93.4	Very high	15 Å²	15	52.4 Å²	52.4	12%	0.124	25%	0.248	C	C	.	.	H	α-helix	trans	-55.2	-33.3	-176.9	0	0	0	0	0	113	S54 E55 K62 I392	S54-A58 PolarHBondContact O-N 3.04Å; E55-A58 PolarHBondContact O-N 3.14Å; A58-K62 WeakPolarHBondContact O-CB 3.14Å; A58-K62 VanDerWaalsContact O-CG 3.31Å; A58-K62 WeakPolarHBondContact O-CG 3.31Å; A58-K62 PolarHBondContact O-N 3.34Å; A58-I392 HydrophobicContact CB-CD1 4.43Å; A58-I392 HydrophobicContact CB-CG1 4.31Å
59	K	95.4	Very high	93.5	Very high	169 Å²	169	52.4 Å²	52.4	74%	0.735	25%	0.247	S	C	*	.	H	α-helix	trans	-64.8	-39.9	175.9	-69.8	-177	-179.2	176.4	0	112.7	K57 H63	K57-K59 PolarHBondContact O-N 2.92Å; K57-K59 VanDerWaalsContact O-N 3.1Å; K59-H63 VanDerWaalsContact O-CB 3.29Å; K59-H63 WeakPolarHBondContact O-CB 3.28Å; K59-H63 PolarHBondContact O-N 2.95Å
60	E	94.8	Very high	93.9	Very high	81 Å²	81	55 Å²	55	38%	0.379	26%	0.26	S	S	.	.	H	α-helix	trans	-68.5	-45.2	-179.9	-57.5	-54.1	141.2	0	0	111.4	K57 K62 H63 V64 F98	K57-E60 WeakPolarHBondContact O-CB 3.29Å; K57-E60 PolarHBondContact O-N 3.14Å; E60-K62 PolarHBondContact O-N 3.05Å; E60-H63 WeakPolarHBondContact O-CB 3.27Å; E60-H63 PolarHBondContact O-N 3.06Å; E60-H63 VanDerWaalsContact O-N 3.16Å; E60-V64 PolarHBondContact O-N 2.92Å; E60-F98 HydrophobicContact CB-CD2 3.83Å; E60-F98 HydrophobicContact CB-CE2 3.97Å; E60-F98 HydrophobicContact CB-CG 4.15Å; E60-F98 HydrophobicContact CB-CZ 4.43Å; E60-F98 HydrophobicContact CG-CD2 4.21Å; E60-F98 HydrophobicContact CG-CE1 4.35Å; E60-F98 HydrophobicContact CG-CE2 3.84Å; E60-F98 HydrophobicContact CG-CZ 3.92Å; E60-F98 WeakPolarHBondContact OE2-CE2 3.32Å
61	Y	95.6	Very high	94.3	Very high	11 Å²	11	61.5 Å²	61.5	4%	0.043	28%	0.284	C	S	.	.	H	α-helix	trans	-62.9	-43.1	176.2	-68.3	-73.4	0	0	0	112.1	A48 H53 K57 H63 V64 C65 D233 C377	A48-Y61 HydrophobicContact CB-CD1 4.11Å; H53-Y61 AromaticContact CD2-CD2 3.59Å; H53-Y61 AromaticContact CD2-CE2 3.8Å; H53-Y61 AromaticContact CD2-CG 3.73Å; K57-Y61 HydrophobicContact CB-CD2 4.03Å; K57-Y61 HydrophobicContact CB-CE2 3.72Å; K57-Y61 HydrophobicContact CD-CE2 4.39Å; K57-Y61 VanDerWaalsContact O-CD2 3.25Å; K57-Y61 WeakPolarHBondContact O-CD2 3.33Å; K57-Y61 PolarHBondContact O-N 3.38Å; Y61-H63 VanDerWaalsContact C-N 3.32Å; Y61-H63 PolarHBondContact O-N 3.14Å; Y61-V64 VanDerWaalsContact O-CG1 3.24Å; Y61-V64 WeakPolarHBondContact O-CG1 3.49Å; Y61-V64 PolarHBondContact O-N 3.32Å; Y61-C65 PolarHBondContact O-N 3.06Å; Y61-C65 PolarHBondContact O-SG 3.01Å; Y61-C65 VanDerWaalsContact O-SG 3.41Å; Y61-D233 PolarHBondContact OH-OD2 3.06Å; Y61-C377 VanDerWaalsContact C-SG 3.54Å
62	K	97.8	Very high	94.7	Very high	75 Å²	75	61.4 Å²	61.4	33%	0.326	28%	0.284	S	S	.	.	H	α-helix	trans	-62	-41.6	172.7	-73.8	-176	-178.5	-169.9	0	111.4	A58 E60 C65 K66 T390 I392	A58-K62 WeakPolarHBondContact O-CB 3.14Å; A58-K62 VanDerWaalsContact O-CG 3.31Å; A58-K62 WeakPolarHBondContact O-CG 3.31Å; A58-K62 PolarHBondContact O-N 3.34Å; E60-K62 PolarHBondContact O-N 3.05Å; K62-C65 PolarHBondContact O-N 3.37Å; K62-K66 WeakPolarHBondContact O-CB 3.46Å; K62-K66 PolarHBondContact O-N 3.1Å; K62-T390 WeakPolarHBondContact O-CG2 3.36Å; K62-I392 HydrophobicContact CD-CG1 4.36Å; K62-I392 HydrophobicContact CG-CD1 4.38Å; K62-I392 HydrophobicContact CG-CG1 4.15Å
63	H	98.1	Very high	95.2	Very high	88 Å²	88	57.5 Å²	57.5	41%	0.407	27%	0.268	S	S	.	.	H	α-helix	trans	-61.9	-47.2	-179.7	-176.5	71.7	0	0	0	111.9	K59 E60 Y61 K66 R67	K59-H63 VanDerWaalsContact O-CB 3.29Å; K59-H63 WeakPolarHBondContact O-CB 3.28Å; K59-H63 PolarHBondContact O-N 2.95Å; E60-H63 WeakPolarHBondContact O-CB 3.27Å; E60-H63 PolarHBondContact O-N 3.06Å; E60-H63 VanDerWaalsContact O-N 3.16Å; Y61-H63 VanDerWaalsContact C-N 3.32Å; Y61-H63 PolarHBondContact O-N 3.14Å; H63-K66 WeakPolarHBondContact O-CB 3.44Å; H63-K66 PolarHBondContact O-N 3.19Å; H63-R67 WeakPolarHBondContact NE2-CD 3.31Å; H63-R67 PolarHBondContact NE2-NH1 3.27Å; H63-R67 WeakPolarHBondContact O-CG 3.31Å; H63-R67 PolarHBondContact O-N 3.14Å
64	V	98.2	Very high	95.6	Very high	2 Å²	2	60.6 Å²	60.6	1%	0.012	29%	0.285	C	S	.	.	H	α-helix	trans	-65.3	-42.5	177.7	67.9	0	0	0	0	111.7	A48 E60 Y61 K66 R67 A68 E92 L93 T99	A48-V64 HydrophobicContact CB-CG1 4.27Å; E60-V64 PolarHBondContact O-N 2.92Å; Y61-V64 VanDerWaalsContact O-CG1 3.24Å; Y61-V64 WeakPolarHBondContact O-CG1 3.49Å; Y61-V64 PolarHBondContact O-N 3.32Å; V64-K66 VanDerWaalsContact C-N 3.27Å; V64-K66 PolarHBondContact O-N 3.26Å; V64-R67 PolarHBondContact O-N 3.43Å; V64-R67 VanDerWaalsContact O-N 3.15Å; V64-A68 WeakPolarHBondContact O-CB 3.44Å; V64-A68 PolarHBondContact O-N 3.16Å; V64-E92 WeakPolarHBondContact CG2-O 3.33Å; V64-L93 HydrophobicContact CG1-CD2 4.25Å; V64-L93 HydrophobicContact CG2-CD2 3.94Å; V64-T99 HydrophobicContact CG1-CG2 4.29Å
65	C	98.6	Very high	96	Very high	0 Å²	0	63 Å²	63	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-58.9	-40.4	174.8	-72.5	0	0	0	0	111.8	V46 A48 Y61 K62 A68 C69 C377 T390	V46-C65 HydrophobicContact CG2-CB 3.77Å; A48-C65 WeakPolarHBondContact CB-SG 3.38Å; Y61-C65 PolarHBondContact O-N 3.06Å; Y61-C65 PolarHBondContact O-SG 3.01Å; Y61-C65 VanDerWaalsContact O-SG 3.41Å; K62-C65 PolarHBondContact O-N 3.37Å; C65-A68 PolarHBondContact O-N 3.2Å; C65-C69 PolarHBondContact O-N 3.31Å; C65-C69 PolarHBondContact O-SG 2.89Å; C65-C377 VanDerWaalsContact SG-SG 3.69Å; C65-T390 HydrophobicContact CB-CG2 4.25Å
66	K	98.7	Very high	96.4	Very high	99 Å²	99	55.2 Å²	55.2	43%	0.43	26%	0.257	S	S	.	.	H	α-helix	trans	-60.2	-47.1	176	-173.6	-170.5	173.9	-174.9	0	111.5	K62 H63 V64 Q70 A388 T390	K62-K66 WeakPolarHBondContact O-CB 3.46Å; K62-K66 PolarHBondContact O-N 3.1Å; H63-K66 WeakPolarHBondContact O-CB 3.44Å; H63-K66 PolarHBondContact O-N 3.19Å; V64-K66 VanDerWaalsContact C-N 3.27Å; V64-K66 PolarHBondContact O-N 3.26Å; K66-Q70 PolarHBondContact O-N 3.34Å; K66-Q70 VanDerWaalsContact O-N 3.11Å; K66-A388 HydrophobicContact CG-CB 4.07Å; K66-T390 HydrophobicContact CB-CG2 3.85Å
67	R	98.7	Very high	96.6	Very high	94 Å²	94	55 Å²	55	36%	0.355	24%	0.241	S	C	.	.	H	α-helix	trans	-66	-41.8	179.2	-64.8	-167.2	-46.2	-158.4	13.9	111.4	H63 V64 C69 Q70 R71 E92	H63-R67 WeakPolarHBondContact NE2-CD 3.31Å; H63-R67 PolarHBondContact NE2-NH1 3.27Å; H63-R67 WeakPolarHBondContact O-CG 3.31Å; H63-R67 PolarHBondContact O-N 3.14Å; V64-R67 PolarHBondContact O-N 3.43Å; V64-R67 VanDerWaalsContact O-N 3.15Å; R67-C69 PolarHBondContact O-N 3.32Å; R67-Q70 WeakPolarHBondContact O-CB 3.46Å; R67-Q70 PolarHBondContact O-N 2.84Å; R67-Q70 VanDerWaalsContact O-N 3.11Å; R67-R71 WeakPolarHBondContact O-CG 3.48Å; R67-R71 PolarHBondContact O-N 3.07Å; R67-E92 HydrophobicContact CB-CG 3.69Å; R67-E92 IonicContact CZ-OE1 3.92Å; R67-E92 IonicContact NE-OE1 3.17Å; R67-E92 PolarHBondContact NE-OE1 2.69Å; R67-E92 IonicContact NH2-OE1 3.72Å; R67-E92 PolarHBondContact NH2-OE1 3.34Å
68	A	98.8	Very high	96.9	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-60.7	-44.5	178.4	0	0	0	0	0	111.9	V46 V64 C65 Q70 R71 A72 A89 E92 L93	V46-A68 HydrophobicContact CG1-CB 4.28Å; V46-A68 HydrophobicContact CG2-CB 4.34Å; V64-A68 WeakPolarHBondContact O-CB 3.44Å; V64-A68 PolarHBondContact O-N 3.16Å; C65-A68 PolarHBondContact O-N 3.2Å; A68-Q70 VanDerWaalsContact C-N 3.33Å; A68-Q70 PolarHBondContact O-N 2.95Å; A68-R71 PolarHBondContact O-N 3.48Å; A68-A72 PolarHBondContact O-N 3.27Å; A68-A89 HydrophobicContact CB-CB 4.28Å; A68-E92 HydrophobicContact CB-CB 4.28Å; A68-E92 HydrophobicContact CB-CG 4.24Å; A68-L93 HydrophobicContact CB-CD1 4.04Å; A68-L93 HydrophobicContact CB-CD2 4.03Å; A68-L93 HydrophobicContact CB-CG 3.69Å
69	C	98.8	Very high	97	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-59.4	-44.1	172.2	-69.4	0	0	0	0	112.2	V44 C65 R67 R71 A72 V73 G379 Y380 M381 A388	V44-C69 HydrophobicContact CG1-CB 3.97Å; C65-C69 PolarHBondContact O-N 3.31Å; C65-C69 PolarHBondContact O-SG 2.89Å; R67-C69 PolarHBondContact O-N 3.32Å; C69-R71 VanDerWaalsContact C-N 3.35Å; C69-R71 PolarHBondContact O-N 3.49Å; C69-A72 PolarHBondContact O-N 3.14Å; C69-V73 WeakPolarHBondContact O-CB 3.34Å; C69-V73 WeakPolarHBondContact O-CG2 3.42Å; C69-V73 PolarHBondContact O-N 3.46Å; C69-G379 PolarHBondContact SG-O 3.35Å; C69-G379 VanDerWaalsContact SG-O 3.38Å; C69-Y380 PolarHBondContact SG-N 2.98Å; C69-M381 HydrophobicContact CB-CB 3.86Å; C69-M381 HydrophobicContact CB-SD 4.49Å; C69-A388 HydrophobicContact CB-CB 3.61Å
70	Q	98.5	Very high	97	Very high	56 Å²	56	48.8 Å²	48.8	26%	0.262	24%	0.243	S	C	.	.	H	α-helix	trans	-61	-44.8	178.5	-170.5	62.5	60.4	0	0	111.1	K66 R67 A68 A72 V73 D74	K66-Q70 PolarHBondContact O-N 3.34Å; K66-Q70 VanDerWaalsContact O-N 3.11Å; R67-Q70 WeakPolarHBondContact O-CB 3.46Å; R67-Q70 PolarHBondContact O-N 2.84Å; R67-Q70 VanDerWaalsContact O-N 3.11Å; A68-Q70 VanDerWaalsContact C-N 3.33Å; A68-Q70 PolarHBondContact O-N 2.95Å; Q70-A72 PolarHBondContact O-N 2.94Å; Q70-V73 PolarHBondContact O-N 2.87Å; Q70-D74 PolarHBondContact NE2-OD1 3.19Å; Q70-D74 WeakPolarHBondContact O-CB 3.5Å; Q70-D74 PolarHBondContact O-N 2.87Å
71	R	98.4	Very high	97.1	Very high	135 Å²	135	49.8 Å²	49.8	51%	0.509	25%	0.251	S	S	.	.	H	α-helix	trans	-60.4	-45.9	177.5	-70.5	-55.9	-168.8	179.3	2.9	112.8	R67 A68 C69 D74 Q75 A88 E92	R67-R71 WeakPolarHBondContact O-CG 3.48Å; R67-R71 PolarHBondContact O-N 3.07Å; A68-R71 PolarHBondContact O-N 3.48Å; C69-R71 VanDerWaalsContact C-N 3.35Å; C69-R71 PolarHBondContact O-N 3.49Å; R71-D74 PolarHBondContact O-N 3.13Å; R71-Q75 WeakPolarHBondContact O-CG 3.15Å; R71-Q75 PolarHBondContact O-N 2.89Å; R71-A88 HydrophobicContact CB-CB 4.45Å; R71-E92 HydrophobicContact CG-CB 4.07Å; R71-E92 HydrophobicContact CG-CG 4.04Å; R71-E92 IonicContact NE-OE2 2.59Å; R71-E92 PolarHBondContact NE-OE2 3.21Å
72	A	98.6	Very high	97.2	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-62.6	-45.3	175.6	0	0	0	0	0	112.1	V44 A68 C69 Q70 D74 Q75 L76 A85 A89 V239	V44-A72 HydrophobicContact CB-CB 3.96Å; V44-A72 HydrophobicContact CG1-CB 4.08Å; V44-A72 HydrophobicContact CG2-CB 3.74Å; A68-A72 PolarHBondContact O-N 3.27Å; C69-A72 PolarHBondContact O-N 3.14Å; Q70-A72 PolarHBondContact O-N 2.94Å; A72-D74 VanDerWaalsContact C-N 3.34Å; A72-D74 PolarHBondContact O-N 2.97Å; A72-Q75 WeakPolarHBondContact O-CB 3.38Å; A72-Q75 PolarHBondContact O-N 3.06Å; A72-L76 WeakPolarHBondContact O-CG 3.41Å; A72-L76 PolarHBondContact O-N 3.43Å; A72-A85 HydrophobicContact CB-CB 4.49Å; A72-A85 WeakPolarHBondContact CB-O 3.49Å; A72-A89 HydrophobicContact CB-CB 3.98Å; A72-V239 HydrophobicContact CB-CG2 4.43Å
73	V	97.7	Very high	97.2	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-64.9	-37.3	178.8	164.4	0	0	0	0	112.2	V44 C69 Q70 Q75 L76 R77 M381 A383	V44-V73 HydrophobicContact CG1-CG2 3.89Å; C69-V73 WeakPolarHBondContact O-CB 3.34Å; C69-V73 WeakPolarHBondContact O-CG2 3.42Å; C69-V73 PolarHBondContact O-N 3.46Å; Q70-V73 PolarHBondContact O-N 2.87Å; V73-Q75 VanDerWaalsContact C-N 3.29Å; V73-Q75 PolarHBondContact O-N 3.27Å; V73-L76 PolarHBondContact O-N 3.03Å; V73-R77 HydrophobicContact CG1-CG 4.2Å; V73-R77 VanDerWaalsContact CG1-CZ 3.48Å; V73-R77 WeakPolarHBondContact O-CB 3.2Å; V73-R77 VanDerWaalsContact O-CG 3.31Å; V73-R77 WeakPolarHBondContact O-CG 3.44Å; V73-R77 PolarHBondContact O-N 3.22Å; V73-M381 HydrophobicContact CB-CE 4.37Å; V73-M381 HydrophobicContact CB-SD 4.16Å; V73-M381 HydrophobicContact CG1-CE 3.98Å; V73-M381 HydrophobicContact CG1-SD 4.41Å; V73-M381 HydrophobicContact CG2-CB 4.02Å; V73-M381 HydrophobicContact CG2-CE 4.45Å; V73-M381 HydrophobicContact CG2-CG 3.87Å; V73-M381 HydrophobicContact CG2-SD 3.91Å; V73-A383 HydrophobicContact CG1-CB 4.21Å
74	D	96.6	Very high	97.2	Very high	65 Å²	65	47 Å²	47	35%	0.348	24%	0.241	S	C	.	.	H	α-helix	trans	-61.4	-40.9	175.5	-66.9	-18.7	0	0	0	110.9	Q70 R71 A72 R77 A78	Q70-D74 PolarHBondContact NE2-OD1 3.19Å; Q70-D74 WeakPolarHBondContact O-CB 3.5Å; Q70-D74 PolarHBondContact O-N 2.87Å; R71-D74 PolarHBondContact O-N 3.13Å; A72-D74 VanDerWaalsContact C-N 3.34Å; A72-D74 PolarHBondContact O-N 2.97Å; D74-R77 PolarHBondContact O-N 2.85Å; D74-A78 WeakPolarHBondContact O-CB 3.48Å; D74-A78 PolarHBondContact O-N 3.08Å
75	Q	97.3	Very high	97.3	Very high	76 Å²	76	46.9 Å²	46.9	36%	0.355	24%	0.24	S	C	.	.	H	α-helix	trans	-63.7	-46.6	173.5	-67.8	-64.2	-3.6	0	0	112	R71 A72 V73 R77 A78 G79 A80 A85 A88	R71-Q75 WeakPolarHBondContact O-CG 3.15Å; R71-Q75 PolarHBondContact O-N 2.89Å; A72-Q75 WeakPolarHBondContact O-CB 3.38Å; A72-Q75 PolarHBondContact O-N 3.06Å; V73-Q75 VanDerWaalsContact C-N 3.29Å; V73-Q75 PolarHBondContact O-N 3.27Å; Q75-R77 VanDerWaalsContact C-N 3.34Å; Q75-R77 PolarHBondContact O-N 2.98Å; Q75-A78 CarbonylContact O-C 3.56Å; Q75-A78 WeakPolarHBondContact O-CB 3.39Å; Q75-A78 PolarHBondContact O-N 2.88Å; Q75-A78 VanDerWaalsContact O-N 3.09Å; Q75-G79 PolarHBondContact O-N 2.8Å; Q75-A80 HydrophobicContact CB-CB 3.87Å; Q75-A80 WeakPolarHBondContact O-CB 3.32Å; Q75-A80 PolarHBondContact O-N 2.8Å; Q75-A85 HydrophobicContact CB-CB 3.9Å; Q75-A88 HydrophobicContact CG-CB 3.63Å
76	L	95.4	Very high	97.3	Very high	4 Å²	4	46.9 Å²	46.9	2%	0.021	24%	0.24	C	C	.	.	H	α-helix	trans	-60.6	-43.5	177.9	-67.1	170.2	0	0	0	111.5	A40 A72 V73 A78 G79 A85 V239 D241	A40-L76 VanDerWaalsContact CB-O 3.24Å; A40-L76 WeakPolarHBondContact CB-O 3.35Å; A72-L76 WeakPolarHBondContact O-CG 3.41Å; A72-L76 PolarHBondContact O-N 3.43Å; V73-L76 PolarHBondContact O-N 3.03Å; L76-A78 PolarHBondContact O-N 3.15Å; L76-G79 PolarHBondContact O-N 3.04Å; L76-A85 HydrophobicContact CD2-CB 3.75Å; L76-A85 HydrophobicContact CG-CB 3.78Å; L76-V239 HydrophobicContact CD1-CG1 3.94Å; L76-V239 HydrophobicContact CD2-CG1 3.95Å; L76-V239 HydrophobicContact CG-CG1 4.38Å; L76-D241 HydrophobicContact CD2-CB 3.92Å
77	R	93.7	Very high	97.3	Very high	94 Å²	94	42.7 Å²	42.7	36%	0.355	22%	0.223	S	C	.	.	H	α-helix	trans	-63.6	-29.3	175.6	-74.4	173.1	176.9	163	-0.2	112.9	V73 D74 Q75 G79 A383 D385	V73-R77 HydrophobicContact CG1-CG 4.2Å; V73-R77 VanDerWaalsContact CG1-CZ 3.48Å; V73-R77 WeakPolarHBondContact O-CB 3.2Å; V73-R77 VanDerWaalsContact O-CG 3.31Å; V73-R77 WeakPolarHBondContact O-CG 3.44Å; V73-R77 PolarHBondContact O-N 3.22Å; D74-R77 PolarHBondContact O-N 2.85Å; Q75-R77 VanDerWaalsContact C-N 3.34Å; Q75-R77 PolarHBondContact O-N 2.98Å; R77-G79 PolarHBondContact O-N 3.33Å; R77-A383 HydrophobicContact CG-CB 4.47Å; R77-A383 PolarHBondContact NE-O 3.18Å; R77-A383 VanDerWaalsContact NE-O 3.09Å; R77-A383 PolarHBondContact NH2-O 2.98Å; R77-D385 PolarHBondContact NH2-O 2.63Å
78	A	94.4	Very high	97.3	Very high	75 Å²	75	39.1 Å²	39.1	62%	0.62	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-2	173.7	0	0	0	0	0	113.4	D74 Q75 L76	D74-A78 WeakPolarHBondContact O-CB 3.48Å; D74-A78 PolarHBondContact O-N 3.08Å; Q75-A78 CarbonylContact O-C 3.56Å; Q75-A78 WeakPolarHBondContact O-CB 3.39Å; Q75-A78 PolarHBondContact O-N 2.88Å; Q75-A78 VanDerWaalsContact O-N 3.09Å; L76-A78 PolarHBondContact O-N 3.15Å
79	G	92.9	Very high	97.3	Very high	54 Å²	54	39.1 Å²	39.1	56%	0.557	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.5	23.3	-178	0	0	0	0	0	113.7	Q75 L76 R77	Q75-G79 PolarHBondContact O-N 2.8Å; L76-G79 PolarHBondContact O-N 3.04Å; R77-G79 PolarHBondContact O-N 3.33Å
80	A	95.7	Very high	97.3	Very high	16 Å²	16	39.1 Å²	39.1	13%	0.132	21%	0.213	C	C	.	.			trans	-69.6	158.6	173.9	0	0	0	0	0	111.5	Q75 E84	Q75-A80 HydrophobicContact CB-CB 3.87Å; Q75-A80 WeakPolarHBondContact O-CB 3.32Å; Q75-A80 PolarHBondContact O-N 2.8Å; A80-E84 WeakPolarHBondContact CA-OE2 3.45Å; A80-E84 HydrophobicContact CB-CB 4.08Å; A80-E84 WeakPolarHBondContact CB-OE2 3.19Å
81	L	96.2	Very high	97.3	Very high	102 Å²	102	38 Å²	38	53%	0.534	21%	0.21	S	C	.	.			trans	-67.7	153.4	175.4	-59.3	176.5	0	0	0	111	V83 E84 A85	L81-V83 PolarHBondContact O-N 3.07Å; L81-V83 VanDerWaalsContact O-N 3.15Å; L81-E84 HydrophobicContact CB-CG 4.17Å; L81-E84 PolarHBondContact N-OE2 2.99Å; L81-E84 WeakPolarHBondContact O-CB 3.41Å; L81-E84 PolarHBondContact O-N 3.21Å; L81-A85 PolarHBondContact O-N 2.98Å
82	A	97.9	Very high	97.3	Very high	3 Å²	3	32.9 Å²	32.9	3%	0.025	19%	0.192	C	C	.	.	H	α-helix	trans	-53.3	-37.7	175.6	0	0	0	0	0	112.8	A85 V86 V239 D241 A247	A82-A85 PolarHBondContact O-N 3.49Å; A82-V86 PolarHBondContact O-N 3.22Å; A82-V239 HydrophobicContact CB-CG1 4.31Å; A82-D241 HydrophobicContact CB-CB 4.31Å; A82-A247 HydrophobicContact CB-CB 3.82Å
83	V	98.5	Very high	97.3	Very high	11 Å²	11	32.9 Å²	32.9	7%	0.067	19%	0.192	C	C	.	.	H	α-helix	trans	-64.1	-39.8	176.2	-177.9	0	0	0	0	111.9	L81 V86 T87 I119 D121 L147 A247	L81-V83 PolarHBondContact O-N 3.07Å; L81-V83 VanDerWaalsContact O-N 3.15Å; V83-V86 WeakPolarHBondContact O-CG1 3.3Å; V83-T87 VanDerWaalsContact O-CB 3.29Å; V83-T87 WeakPolarHBondContact O-CB 3.5Å; V83-T87 PolarHBondContact O-N 3.08Å; V83-T87 PolarHBondContact O-OG1 3.19Å; V83-I119 HydrophobicContact CG1-CD1 3.61Å; V83-I119 HydrophobicContact CG1-CG1 4.29Å; V83-D121 HydrophobicContact CG2-CB 3.54Å; V83-L147 HydrophobicContact CG1-CD1 4.46Å; V83-L147 HydrophobicContact CG1-CD2 4.27Å; V83-A247 HydrophobicContact CG2-CB 4.13Å
84	E	98.6	Very high	97.4	Very high	101 Å²	101	32.9 Å²	32.9	47%	0.472	19%	0.192	S	C	.	.	H	α-helix	trans	-69.5	-41.6	177.6	-64.6	174.4	142.4	0	0	110.6	A80 L81 T87 A88	A80-E84 WeakPolarHBondContact CA-OE2 3.45Å; A80-E84 HydrophobicContact CB-CB 4.08Å; A80-E84 WeakPolarHBondContact CB-OE2 3.19Å; L81-E84 HydrophobicContact CB-CG 4.17Å; L81-E84 PolarHBondContact N-OE2 2.99Å; L81-E84 WeakPolarHBondContact O-CB 3.41Å; L81-E84 PolarHBondContact O-N 3.21Å; E84-T87 PolarHBondContact O-N 2.98Å; E84-A88 PolarHBondContact O-N 3.46Å
85	A	98.8	Very high	97.5	Very high	0 Å²	0	32 Å²	32	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-64	-45.4	176.9	0	0	0	0	0	112.7	A72 Q75 L76 L81 A82 T87 A88 A89 V239	A72-A85 HydrophobicContact CB-CB 4.49Å; A72-A85 WeakPolarHBondContact CB-O 3.49Å; Q75-A85 HydrophobicContact CB-CB 3.9Å; L76-A85 HydrophobicContact CD2-CB 3.75Å; L76-A85 HydrophobicContact CG-CB 3.78Å; L81-A85 PolarHBondContact O-N 2.98Å; A82-A85 PolarHBondContact O-N 3.49Å; A85-T87 VanDerWaalsContact C-N 3.34Å; A85-A88 PolarHBondContact O-N 2.92Å; A85-A89 PolarHBondContact O-N 3.47Å; A85-A89 VanDerWaalsContact O-N 3.16Å; A85-V239 HydrophobicContact CB-CG1 4.06Å
86	V	98.9	Very high	97.4	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-67.1	-37.6	177.1	79.1	0	0	0	0	111	A82 V83 A88 A89 L90 I119 A237 V239 A247 A249	A82-V86 PolarHBondContact O-N 3.22Å; V83-V86 WeakPolarHBondContact O-CG1 3.3Å; V86-A88 PolarHBondContact O-N 2.88Å; V86-A89 PolarHBondContact O-N 3.25Å; V86-L90 HydrophobicContact CG2-CD2 4.31Å; V86-L90 WeakPolarHBondContact O-CD2 3.26Å; V86-L90 PolarHBondContact O-N 2.75Å; V86-L90 VanDerWaalsContact O-N 3.08Å; V86-I119 HydrophobicContact CG1-CD1 3.65Å; V86-I119 HydrophobicContact CG1-CG1 4.16Å; V86-A237 HydrophobicContact CG2-CB 3.64Å; V86-A237 WeakPolarHBondContact CG2-O 3.37Å; V86-V239 HydrophobicContact CB-CB 4.21Å; V86-V239 HydrophobicContact CB-CG2 3.75Å; V86-V239 HydrophobicContact CG2-CG2 4.02Å; V86-A247 HydrophobicContact CB-CB 4.36Å; V86-A247 HydrophobicContact CG1-CB 3.85Å; V86-A249 HydrophobicContact CG1-CB 4.14Å; V86-A249 HydrophobicContact CG2-CB 3.94Å
87	T	98.9	Very high	97.3	Very high	11 Å²	11	30.7 Å²	30.7	7%	0.067	19%	0.186	C	C	.	.	H	α-helix	trans	-59.6	-45.2	174	-59.5	0	0	0	0	110.9	V83 E84 A85 A89 L90 V91 I119 V140 L141 S144	V83-T87 VanDerWaalsContact O-CB 3.29Å; V83-T87 WeakPolarHBondContact O-CB 3.5Å; V83-T87 PolarHBondContact O-N 3.08Å; V83-T87 PolarHBondContact O-OG1 3.19Å; E84-T87 PolarHBondContact O-N 2.98Å; A85-T87 VanDerWaalsContact C-N 3.34Å; T87-A89 PolarHBondContact O-N 3.04Å; T87-L90 PolarHBondContact O-N 3.02Å; T87-V91 HydrophobicContact CG2-CG2 4.48Å; T87-V91 WeakPolarHBondContact O-CG2 3.42Å; T87-V91 PolarHBondContact O-N 3.41Å; T87-I119 VanDerWaalsContact OG1-CD1 3.23Å; T87-I119 WeakPolarHBondContact OG1-CD1 3.48Å; T87-V140 HydrophobicContact CG2-CG1 4.29Å; T87-L141 HydrophobicContact CG2-CD2 3.65Å; T87-S144 PolarHBondContact OG1-OG 3.05Å; T87-S144 VanDerWaalsContact OG1-OG 3.08Å
88	A	98.9	Very high	97.2	Very high	18 Å²	18	28.9 Å²	28.9	15%	0.149	18%	0.18	C	C	.	.	H	α-helix	trans	-63.5	-37	179.2	0	0	0	0	0	113.4	R71 Q75 E84 A85 V86 E92	R71-A88 HydrophobicContact CB-CB 4.45Å; Q75-A88 HydrophobicContact CG-CB 3.63Å; E84-A88 PolarHBondContact O-N 3.46Å; A85-A88 PolarHBondContact O-N 2.92Å; V86-A88 PolarHBondContact O-N 2.88Å; A88-E92 PolarHBondContact O-N 3.15Å
89	A	98.9	Very high	97.2	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-63.6	-43.7	172.1	0	0	0	0	0	112.1	V46 A68 A72 A85 V86 T87 E92 L93 A237	V46-A89 HydrophobicContact CG1-CB 4.17Å; A68-A89 HydrophobicContact CB-CB 4.28Å; A72-A89 HydrophobicContact CB-CB 3.98Å; A85-A89 PolarHBondContact O-N 3.47Å; A85-A89 VanDerWaalsContact O-N 3.16Å; V86-A89 PolarHBondContact O-N 3.25Å; T87-A89 PolarHBondContact O-N 3.04Å; A89-E92 PolarHBondContact O-N 3.42Å; A89-L93 WeakPolarHBondContact O-CG 3.45Å; A89-L93 PolarHBondContact O-N 3.36Å; A89-L93 VanDerWaalsContact O-N 3.09Å; A89-A237 HydrophobicContact CB-CB 4.06Å
90	L	98.9	Very high	97.4	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-66.8	-39.8	179.9	-93.3	-66.5	0	0	0	112.4	V86 T87 E92 L93 E94 V140 V235 A237 A249	V86-L90 HydrophobicContact CG2-CD2 4.31Å; V86-L90 WeakPolarHBondContact O-CD2 3.26Å; V86-L90 PolarHBondContact O-N 2.75Å; V86-L90 VanDerWaalsContact O-N 3.08Å; T87-L90 PolarHBondContact O-N 3.02Å; L90-E92 VanDerWaalsContact C-N 3.28Å; L90-E92 PolarHBondContact O-N 3.26Å; L90-L93 CarbonylContact O-C 3.51Å; L90-L93 WeakPolarHBondContact O-CB 3.47Å; L90-L93 PolarHBondContact O-N 3.1Å; L90-L93 VanDerWaalsContact O-N 3.08Å; L90-E94 WeakPolarHBondContact O-CB 3.48Å; L90-E94 WeakPolarHBondContact O-CG 3.19Å; L90-E94 PolarHBondContact O-N 3.02Å; L90-V140 HydrophobicContact CB-CB 3.95Å; L90-V140 HydrophobicContact CB-CG1 3.79Å; L90-V140 HydrophobicContact CB-CG2 3.7Å; L90-V140 HydrophobicContact CG-CG2 4.01Å; L90-V235 HydrophobicContact CD1-CB 4.49Å; L90-V235 HydrophobicContact CD1-CG2 3.69Å; L90-A237 HydrophobicContact CD2-CB 3.42Å; L90-A237 VanDerWaalsContact CD2-CB 3.42Å; L90-A249 HydrophobicContact CD2-CB 3.83Å; L90-A249 HydrophobicContact CG-CB 3.88Å
91	V	98.9	Very high	97.4	Very high	34 Å²	34	22.2 Å²	22.2	21%	0.206	12%	0.12	C	C	.	.	H	α-helix	trans	-57.1	-44.5	174.4	169.4	0	0	0	0	110.8	T87 L93 E94 D95 N138 V140 L141	T87-V91 HydrophobicContact CG2-CG2 4.48Å; T87-V91 WeakPolarHBondContact O-CG2 3.42Å; T87-V91 PolarHBondContact O-N 3.41Å; V91-L93 VanDerWaalsContact C-N 3.29Å; V91-L93 PolarHBondContact O-N 2.98Å; V91-E94 PolarHBondContact O-N 3.22Å; V91-D95 VanDerWaalsContact O-CB 3.28Å; V91-D95 WeakPolarHBondContact O-CB 3.5Å; V91-D95 VanDerWaalsContact O-CG 3.31Å; V91-D95 PolarHBondContact O-N 3.13Å; V91-N138 HydrophobicContact CG2-CB 4.46Å; V91-V140 HydrophobicContact CG2-CG1 3.83Å; V91-L141 HydrophobicContact CG2-CD1 4.38Å; V91-L141 HydrophobicContact CG2-CD2 3.73Å; V91-L141 HydrophobicContact CG2-CG 3.93Å
92	E	98.8	Very high	97.5	Very high	26 Å²	26	17.3 Å²	17.3	12%	0.121	9%	0.094	C	C	.	.	H	α-helix	trans	-65.1	-32.5	177.7	-174.9	63.7	-128.4	0	0	112.6	V64 R67 A68 R71 A88 A89 L90	V64-E92 WeakPolarHBondContact CG2-O 3.33Å; R67-E92 HydrophobicContact CB-CG 3.69Å; R67-E92 IonicContact CZ-OE1 3.92Å; R67-E92 IonicContact NE-OE1 3.17Å; R67-E92 PolarHBondContact NE-OE1 2.69Å; R67-E92 IonicContact NH2-OE1 3.72Å; R67-E92 PolarHBondContact NH2-OE1 3.34Å; A68-E92 HydrophobicContact CB-CB 4.28Å; A68-E92 HydrophobicContact CB-CG 4.24Å; R71-E92 HydrophobicContact CG-CB 4.07Å; R71-E92 HydrophobicContact CG-CG 4.04Å; R71-E92 IonicContact NE-OE2 2.59Å; R71-E92 PolarHBondContact NE-OE2 3.21Å; A88-E92 PolarHBondContact O-N 3.15Å; A89-E92 PolarHBondContact O-N 3.42Å; L90-E92 VanDerWaalsContact C-N 3.28Å; L90-E92 PolarHBondContact O-N 3.26Å
93	L	98.6	Very high	97.3	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-74.6	-41.5	175.1	-70.9	160.3	0	0	0	112.4	V46 A48 V64 A68 A89 L90 V91 D95 S96 T99 V235	V46-L93 HydrophobicContact CB-CD1 4.25Å; A48-L93 HydrophobicContact CB-CD2 4.25Å; V64-L93 HydrophobicContact CG1-CD2 4.25Å; V64-L93 HydrophobicContact CG2-CD2 3.94Å; A68-L93 HydrophobicContact CB-CD1 4.04Å; A68-L93 HydrophobicContact CB-CD2 4.03Å; A68-L93 HydrophobicContact CB-CG 3.69Å; A89-L93 WeakPolarHBondContact O-CG 3.45Å; A89-L93 PolarHBondContact O-N 3.36Å; A89-L93 VanDerWaalsContact O-N 3.09Å; L90-L93 CarbonylContact O-C 3.51Å; L90-L93 WeakPolarHBondContact O-CB 3.47Å; L90-L93 PolarHBondContact O-N 3.1Å; L90-L93 VanDerWaalsContact O-N 3.08Å; V91-L93 VanDerWaalsContact C-N 3.29Å; V91-L93 PolarHBondContact O-N 2.98Å; L93-D95 VanDerWaalsContact C-N 3.33Å; L93-S96 WeakPolarHBondContact O-CB 3.38Å; L93-S96 PolarHBondContact O-N 2.81Å; L93-T99 PolarHBondContact O-OG1 2.84Å; L93-V235 HydrophobicContact CB-CB 3.76Å; L93-V235 HydrophobicContact CB-CG1 4.01Å; L93-V235 HydrophobicContact CB-CG2 3.81Å; L93-V235 HydrophobicContact CD1-CB 4.12Å; L93-V235 HydrophobicContact CD2-CB 4.44Å; L93-V235 HydrophobicContact CD2-CG1 4.4Å; L93-V235 HydrophobicContact CG-CB 4.31Å
94	E	98.6	Very high	97.1	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-70	-27.3	177.4	-74.1	179	156.7	0	0	113.1	L90 V91 S96 A101 M103 N138 P139 V140 S251	L90-E94 WeakPolarHBondContact O-CB 3.48Å; L90-E94 WeakPolarHBondContact O-CG 3.19Å; L90-E94 PolarHBondContact O-N 3.02Å; V91-E94 PolarHBondContact O-N 3.22Å; E94-S96 PolarHBondContact O-N 2.92Å; E94-A101 HydrophobicContact CG-CB 4.13Å; E94-M103 PolarHBondContact O-N 2.8Å; E94-N138 WeakPolarHBondContact OE2-CA 3.41Å; E94-N138 WeakPolarHBondContact OE2-CB 3.23Å; E94-N138 PolarHBondContact OE2-ND2 3.05Å; E94-N138 VanDerWaalsContact OE2-ND2 3.16Å; E94-P139 WeakPolarHBondContact OE1-CD 3.4Å; E94-V140 PolarHBondContact OE1-N 3.43Å; E94-V140 WeakPolarHBondContact OE2-CG1 3.48Å; E94-S251 WeakPolarHBondContact OE1-CB 3.34Å; E94-S251 PolarHBondContact OE1-OG 3.07Å
95	D	97.9	Very high	97	Very high	47 Å²	47	14.4 Å²	14.4	25%	0.251	8%	0.082	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-8.6	177.3	-83	8.3	0	0	0	112.9	V91 L93 M103 K137 N138	V91-D95 VanDerWaalsContact O-CB 3.28Å; V91-D95 WeakPolarHBondContact O-CB 3.5Å; V91-D95 VanDerWaalsContact O-CG 3.31Å; V91-D95 PolarHBondContact O-N 3.13Å; L93-D95 VanDerWaalsContact C-N 3.33Å; D95-M103 VanDerWaalsContact O-CE 3.22Å; D95-M103 WeakPolarHBondContact O-CE 3.48Å; D95-K137 WeakPolarHBondContact OD1-CE 3.3Å; D95-K137 IonicContact OD1-NZ 2.8Å; D95-K137 PolarHBondContact OD1-NZ 3.33Å; D95-K137 IonicContact OD2-NZ 2.75Å; D95-K137 PolarHBondContact OD2-NZ 2.97Å; D95-N138 PolarHBondContact OD1-ND2 2.91Å; D95-N138 PolarHBondContact OD1-OD1 3.22Å
96	S	95.9	Very high	96.8	Very high	5 Å²	5	15.1 Å²	15.1	4%	0.035	9%	0.086	C	C	.	.			trans	-80.8	125.9	177.5	-179.2	0	0	0	0	111.1	L93 E94 F98 T99	L93-S96 WeakPolarHBondContact O-CB 3.38Å; L93-S96 PolarHBondContact O-N 2.81Å; E94-S96 PolarHBondContact O-N 2.92Å; S96-F98 PolarHBondContact O-N 3.03Å; S96-F98 PolarHBondContact OG-N 2.73Å; S96-T99 PolarHBondContact O-N 3.04Å; S96-T99 PolarHBondContact O-OG1 2.88Å
97	P	93.6	Very high	96.7	Very high	48 Å²	48	15.5 Å²	15.5	31%	0.312	9%	0.088	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-2.4	179.1	32	-37.9	0	0	0	113.8	T189	P97-T189 HydrophobicContact CB-CG2 3.65Å
98	F	91.2	Very high	96.6	Very high	55 Å²	55	15 Å²	15	24%	0.241	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-12.5	-178.5	-61.9	-68.2	0	0	0	113.4	E60 S96 F191	E60-F98 HydrophobicContact CB-CD2 3.83Å; E60-F98 HydrophobicContact CB-CE2 3.97Å; E60-F98 HydrophobicContact CB-CG 4.15Å; E60-F98 HydrophobicContact CB-CZ 4.43Å; E60-F98 HydrophobicContact CG-CD2 4.21Å; E60-F98 HydrophobicContact CG-CE1 4.35Å; E60-F98 HydrophobicContact CG-CE2 3.84Å; E60-F98 HydrophobicContact CG-CZ 3.92Å; E60-F98 WeakPolarHBondContact OE2-CE2 3.32Å; S96-F98 PolarHBondContact O-N 3.03Å; S96-F98 PolarHBondContact OG-N 2.73Å; F98-F191 HydrophobicContact CE1-CD2 4.38Å; F98-F191 AromaticContact CE1-CE2 3.87Å; F98-F191 HydrophobicContact CE1-CE2 3.87Å; F98-F191 HydrophobicContact CE1-CZ 4.2Å; F98-F191 HydrophobicContact CZ-CE2 4.37Å
99	T	94.6	Very high	96.5	Very high	3 Å²	3	17.2 Å²	17.2	2%	0.018	9%	0.093	C	C	.	.	S	Bend	trans	-94.2	149.6	179.1	55.5	0	0	0	0	109.5	A48 V64 L93 S96 A101 V235	A48-T99 HydrophobicContact CB-CG2 4.48Å; V64-T99 HydrophobicContact CG1-CG2 4.29Å; L93-T99 PolarHBondContact O-OG1 2.84Å; S96-T99 PolarHBondContact O-N 3.04Å; S96-T99 PolarHBondContact O-OG1 2.88Å; T99-A101 VanDerWaalsContact C-N 3.26Å; T99-A101 PolarHBondContact O-N 2.8Å; T99-V235 HydrophobicContact CG2-CG1 3.59Å
100	N	96.4	Very high	96.4	Very high	2 Å²	2	20.9 Å²	20.9	1%	0.011	12%	0.119	C	C	.	.	S	Bend	trans	-91.2	65.1	172.6	169.8	46.7	0	0	0	109.3	N106 D233 S252 G253 G254	N100-N106 VanDerWaalsContact CG-ND2 3.29Å; N100-N106 PolarHBondContact ND2-ND2 3.28Å; N100-N106 WeakPolarHBondContact OD1-CB 3.47Å; N100-N106 PolarHBondContact OD1-N 3.44Å; N100-N106 PolarHBondContact OD1-ND2 3.07Å; N100-D233 HydrophobicContact CB-CB 4.28Å; N100-D233 VanDerWaalsContact CB-O 3.24Å; N100-D233 WeakPolarHBondContact CB-O 3.49Å; N100-D233 PolarHBondContact ND2-O 2.95Å; N100-S252 CarbonylContact O-C 3.59Å; N100-S252 WeakPolarHBondContact O-CA 3.27Å; N100-G253 PolarHBondContact O-N 3.44Å; N100-G253 WeakPolarHBondContact OD1-CA 3.32Å; N100-G254 PolarHBondContact ND2-O 3.36Å
101	A	97.2	Very high	96.3	Very high	0 Å²	0	22 Å²	22	0%	0	13%	0.131	C	C	.	.	S	Bend	trans	-161.3	140.1	175.8	0	0	0	0	0	109.5	E94 T99 M103 S105 V235 S251	E94-A101 HydrophobicContact CG-CB 4.13Å; T99-A101 VanDerWaalsContact C-N 3.26Å; T99-A101 PolarHBondContact O-N 2.8Å; A101-M103 PolarHBondContact O-N 3.27Å; A101-M103 VanDerWaalsContact O-N 3.17Å; A101-S105 VanDerWaalsContact C-OG 3.26Å; A101-S105 VanDerWaalsContact CA-OG 3.24Å; A101-S105 WeakPolarHBondContact CA-OG 3.28Å; A101-S105 PolarHBondContact N-OG 3.49Å; A101-V235 HydrophobicContact CB-CB 4.48Å; A101-V235 HydrophobicContact CB-CG1 4.3Å; A101-V235 HydrophobicContact CB-CG2 3.46Å; A101-V235 VanDerWaalsContact CB-CG2 3.46Å; A101-S251 WeakPolarHBondContact CB-O 3.46Å
102	G	97.3	Very high	96.2	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.145	C	C	.	.	S	Bend	trans	56.6	-117.5	-175.8	0	0	0	0	0	112.6	S105 K137 M187	G102-S105 PolarHBondContact N-OG 3.41Å; G102-S105 WeakPolarHBondContact O-CB 3.48Å; G102-S105 PolarHBondContact O-OG 3Å; G102-K137 WeakPolarHBondContact CA-O 3.24Å; G102-M187 WeakPolarHBondContact O-CE 3.34Å
103	M	95	Very high	96.2	Very high	45 Å²	45	24.6 Å²	24.6	22%	0.222	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	130	178.3	177.5	167.6	36.1	0	0	110.9	E94 D95 A101 T189	E94-M103 PolarHBondContact O-N 2.8Å; D95-M103 VanDerWaalsContact O-CE 3.22Å; D95-M103 WeakPolarHBondContact O-CE 3.48Å; A101-M103 PolarHBondContact O-N 3.27Å; A101-M103 VanDerWaalsContact O-N 3.17Å; M103-T189 HydrophobicContact CG-CG2 4.15Å
104	G	92.6	Very high	96.2	Very high	8 Å²	8	25.5 Å²	25.5	8%	0.082	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.1	3	-176.5	0	0	0	0	0	114.7	M187	G104-M187 PolarHBondContact N-O 3.04Å
105	S	96.6	Very high	96.2	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.145	C	C	.	.	P	Polyproline II helix	trans	-49.8	150	169.5	-79.8	0	0	0	0	113.3	A101 G102 S192 G253	A101-S105 VanDerWaalsContact C-OG 3.26Å; A101-S105 VanDerWaalsContact CA-OG 3.24Å; A101-S105 WeakPolarHBondContact CA-OG 3.28Å; A101-S105 PolarHBondContact N-OG 3.49Å; G102-S105 PolarHBondContact N-OG 3.41Å; G102-S105 WeakPolarHBondContact O-CB 3.48Å; G102-S105 PolarHBondContact O-OG 3Å; S105-S192 WeakPolarHBondContact O-CB 3.31Å; S105-G253 WeakPolarHBondContact OG-CA 3.32Å
106	N	96.1	Very high	96.2	Very high	15 Å²	15	23.3 Å²	23.3	8%	0.08	13%	0.134	C	C	.	.	P	Polyproline II helix	trans	-57	142	172.3	-77.4	-32.4	0	0	0	111.1	N100 C231 G254 A256	N100-N106 VanDerWaalsContact CG-ND2 3.29Å; N100-N106 PolarHBondContact ND2-ND2 3.28Å; N100-N106 WeakPolarHBondContact OD1-CB 3.47Å; N100-N106 PolarHBondContact OD1-N 3.44Å; N100-N106 PolarHBondContact OD1-ND2 3.07Å; N106-C231 PolarHBondContact ND2-O 2.92Å; N106-G254 PolarHBondContact ND2-O 3.14Å; N106-A256 HydrophobicContact CB-CB 4.21Å; N106-A256 PolarHBondContact ND2-N 3.45Å
107	L	96.6	Very high	96.4	Very high	8 Å²	8	23 Å²	23	4%	0.042	13%	0.132	C	C	.	.	B	Isolated β-bridge	trans	-85.6	141.1	174.1	-73.4	70.6	0	0	0	110.2	G111 E112 I113 L193 Y196 M257	L107-G111 WeakPolarHBondContact CD2-O 3.37Å; L107-E112 CarbonylContact C-O 3.53Å; L107-E112 WeakPolarHBondContact CA-O 3.47Å; L107-I113 HydrophobicContact CD1-CG1 4.35Å; L107-I113 HydrophobicContact CG-CG1 4.36Å; L107-L193 HydrophobicContact CD2-CD2 3.77Å; L107-Y196 HydrophobicContact CB-CD2 3.58Å; L107-Y196 HydrophobicContact CB-CE2 4.31Å; L107-Y196 HydrophobicContact CB-CG 3.91Å; L107-Y196 HydrophobicContact CD2-CD1 4.1Å; L107-Y196 HydrophobicContact CD2-CD2 4.24Å; L107-Y196 HydrophobicContact CD2-CG 3.8Å; L107-Y196 HydrophobicContact CG-CG 4.44Å; L107-M257 PolarHBondContact O-N 3.2Å
108	N	97.1	Very high	96.6	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.117	C	C	.	.			trans	-75.2	-179.1	173.5	74.8	11.1	0	0	0	111.3	S110 G111 E112 E114 Y196 K258	N108-S110 PolarHBondContact O-N 2.72Å; N108-S110 WeakPolarHBondContact OD1-CA 3.5Å; N108-S110 WeakPolarHBondContact OD1-CB 3.44Å; N108-S110 PolarHBondContact OD1-N 2.73Å; N108-G111 PolarHBondContact O-N 2.75Å; N108-G111 PolarHBondContact OD1-N 2.8Å; N108-G111 VanDerWaalsContact OD1-N 3.17Å; N108-E112 VanDerWaalsContact CG-O 3.29Å; N108-E112 PolarHBondContact N-O 3.46Å; N108-E112 PolarHBondContact OD1-N 2.59Å; N108-E112 PolarHBondContact OD1-O 3.5Å; N108-E114 PolarHBondContact ND2-OE2 3.36Å; N108-Y196 WeakPolarHBondContact O-CE2 3.25Å; N108-K258 CarbonylContact C-O 3.57Å; N108-K258 WeakPolarHBondContact CA-O 3.41Å; N108-K258 HydrophobicContact CB-CG 3.8Å; N108-K258 VanDerWaalsContact CB-O 3.3Å; N108-K258 WeakPolarHBondContact CB-O 3.4Å
109	L	96.9	Very high	97	Very high	65 Å²	65	18.1 Å²	18.1	34%	0.34	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-38.1	179.5	-68.9	176.2	0	0	0	113.3	G111 Y196 M203 M257 K258 H259	L109-G111 PolarHBondContact O-N 2.72Å; L109-Y196 PolarHBondContact O-OH 3.41Å; L109-M203 HydrophobicContact CD2-CE 3.48Å; L109-M203 VanDerWaalsContact CD2-CE 3.48Å; L109-M257 HydrophobicContact CD2-CB 3.99Å; L109-M257 HydrophobicContact CD2-CE 4.09Å; L109-M257 WeakPolarHBondContact CD2-O 3.28Å; L109-M257 VanDerWaalsContact CG-O 3.29Å; L109-M257 WeakPolarHBondContact CG-O 3.1Å; L109-K258 WeakPolarHBondContact CG-O 3.36Å; L109-K258 PolarHBondContact N-O 3.15Å; L109-H259 HydrophobicContact CD1-CB 4.31Å
110	S	96.6	Very high	97.2	Very high	77 Å²	77	18.1 Å²	18.1	54%	0.538	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-6.1	179	-56.9	0	0	0	0	113.6	N108 P260	N108-S110 PolarHBondContact O-N 2.72Å; N108-S110 WeakPolarHBondContact OD1-CA 3.5Å; N108-S110 WeakPolarHBondContact OD1-CB 3.44Å; N108-S110 PolarHBondContact OD1-N 2.73Å; S110-P260 WeakPolarHBondContact OG-CG 3.44Å
111	G	96	Very high	97.3	Very high	25 Å²	25	18.7 Å²	18.7	26%	0.258	11%	0.108	S	C	.	.	S	Bend	trans	80.3	19.2	-175.1	0	0	0	0	0	113.4	L107 N108 L109 Y196	L107-G111 WeakPolarHBondContact CD2-O 3.37Å; N108-G111 PolarHBondContact O-N 2.75Å; N108-G111 PolarHBondContact OD1-N 2.8Å; N108-G111 VanDerWaalsContact OD1-N 3.17Å; L109-G111 PolarHBondContact O-N 2.72Å; G111-Y196 PolarHBondContact N-OH 2.79Å
112	E	97.1	Very high	97.4	Very high	107 Å²	107	18.7 Å²	18.7	50%	0.5	11%	0.109	S	C	.	.			trans	-105.3	157.3	179.6	-60	-176.5	143.9	0	0	111.1	L107 N108	L107-E112 CarbonylContact C-O 3.53Å; L107-E112 WeakPolarHBondContact CA-O 3.47Å; N108-E112 VanDerWaalsContact CG-O 3.29Å; N108-E112 PolarHBondContact N-O 3.46Å; N108-E112 PolarHBondContact OD1-N 2.59Å; N108-E112 PolarHBondContact OD1-O 3.5Å
113	I	97.8	Very high	97.4	Very high	6 Å²	6	24.7 Å²	24.7	3%	0.031	14%	0.135	C	C	.	.	B	Isolated β-bridge	trans	-96	128.5	174.1	-67.4	171.2	0	0	0	108.9	L107 S134 M187 A188	L107-I113 HydrophobicContact CD1-CG1 4.35Å; L107-I113 HydrophobicContact CG-CG1 4.36Å; I113-S134 WeakPolarHBondContact O-CB 3.36Å; I113-M187 HydrophobicContact CD1-CB 3.77Å; I113-M187 HydrophobicContact CG2-CE 3.86Å; I113-A188 HydrophobicContact CD1-CB 4.13Å
114	E	98.4	Very high	97.5	Very high	20 Å²	20	24.5 Å²	24.5	9%	0.093	14%	0.138	C	C	.	.			trans	-132.7	120.3	172.9	-73.3	176.9	123	0	0	108.2	N108 A132 I133 G253 K258 P260 G261	N108-E114 PolarHBondContact ND2-OE2 3.36Å; E114-A132 HydrophobicContact CB-CB 4.45Å; E114-I133 WeakPolarHBondContact CA-O 3.24Å; E114-G253 VanDerWaalsContact O-O 3.12Å; E114-K258 PolarHBondContact O-NZ 3.47Å; E114-P260 WeakPolarHBondContact OE2-CA 3.4Å; E114-G261 PolarHBondContact OE1-N 2.95Å; E114-G261 PolarHBondContact OE2-N 3.19Å; E114-G261 VanDerWaalsContact OE2-N 3.14Å
115	C	98.6	Very high	97.8	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	156.4	-176.5	-58.6	0	0	0	0	112.1	G131 A132 I133 P139 S252	C115-G131 CarbonylContact O-C 3.57Å; C115-A132 PolarHBondContact O-N 2.94Å; C115-I133 HydrophobicContact CB-CG2 4.17Å; C115-I133 PolarHBondContact N-O 3.49Å; C115-I133 WeakPolarHBondContact O-CG2 3.37Å; C115-I133 PolarHBondContact O-N 3.23Å; C115-P139 HydrophobicContact CB-CB 4.1Å; C115-P139 HydrophobicContact CB-CG 3.35Å; C115-S252 CarbonylContact C-O 3.56Å; C115-S252 VanDerWaalsContact CA-O 3.28Å; C115-S252 WeakPolarHBondContact CA-O 3.47Å
116	D	98.9	Very high	97.9	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	131.2	174.1	-59.9	-40.2	0	0	0	107.7	V130 G131 A132 S251 S252 G264 A266 A267	D116-V130 WeakPolarHBondContact CA-O 3.32Å; D116-G131 VanDerWaalsContact OD1-CA 3.28Å; D116-G131 WeakPolarHBondContact OD1-CA 3.39Å; D116-A132 PolarHBondContact OD1-N 3.31Å; D116-S251 CarbonylContact O-C 3.49Å; D116-S251 WeakPolarHBondContact O-CA 3.43Å; D116-S252 PolarHBondContact N-O 2.78Å; D116-S252 PolarHBondContact O-N 3.34Å; D116-G264 PolarHBondContact OD2-N 3.19Å; D116-A266 HydrophobicContact CB-CB 3.94Å; D116-A266 WeakPolarHBondContact O-CB 3.21Å; D116-A267 HydrophobicContact CB-CB 4.01Å
117	A	98.9	Very high	98	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	150.9	177.1	0	0	0	0	0	112	A129 V130 P139 V250 A266	A117-A129 CarbonylContact O-C 3.57Å; A117-A129 VanDerWaalsContact O-CA 3.25Å; A117-A129 WeakPolarHBondContact O-CA 3.42Å; A117-V130 HydrophobicContact CB-CG2 4.14Å; A117-V130 PolarHBondContact N-O 3.47Å; A117-V130 PolarHBondContact O-N 2.83Å; A117-P139 HydrophobicContact CB-CB 3.65Å; A117-V250 CarbonylContact C-O 3.56Å; A117-V250 VanDerWaalsContact CA-O 3.25Å; A117-V250 WeakPolarHBondContact CA-O 3.17Å; A117-A266 CarbonylContact C-O 3.59Å; A117-A266 WeakPolarHBondContact CA-O 3.22Å
118	S	98.9	Very high	98.1	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	160.4	175.1	59.8	0	0	0	0	112.6	F127 G128 A249 V250 A266	S118-F127 VanDerWaalsContact CB-CE2 3.47Å; S118-F127 VanDerWaalsContact CB-CZ 3.47Å; S118-G128 CarbonylContact C-O 3.59Å; S118-G128 VanDerWaalsContact CA-O 3.23Å; S118-G128 WeakPolarHBondContact CA-O 3.25Å; S118-G128 WeakPolarHBondContact CB-O 3.46Å; S118-A249 CarbonylContact O-C 3.55Å; S118-A249 VanDerWaalsContact O-CA 3.26Å; S118-A249 WeakPolarHBondContact O-CA 3.44Å; S118-V250 PolarHBondContact N-O 3.18Å; S118-V250 PolarHBondContact O-N 3.43Å; S118-V250 WeakPolarHBondContact OG-CG1 3.25Å; S118-A266 WeakPolarHBondContact CB-O 3.26Å; S118-A266 PolarHBondContact N-O 3.3Å; S118-A266 PolarHBondContact OG-O 2.98Å
119	I	98.9	Very high	98.2	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	144.9	-179.7	-174.7	164.5	0	0	0	110	V83 V86 T87 F127 G128 A143 L147 A248 A249	V83-I119 HydrophobicContact CG1-CD1 3.61Å; V83-I119 HydrophobicContact CG1-CG1 4.29Å; V86-I119 HydrophobicContact CG1-CD1 3.65Å; V86-I119 HydrophobicContact CG1-CG1 4.16Å; T87-I119 VanDerWaalsContact OG1-CD1 3.23Å; T87-I119 WeakPolarHBondContact OG1-CD1 3.48Å; I119-F127 WeakPolarHBondContact O-CA 3.45Å; I119-F127 VanDerWaalsContact O-CD2 3.25Å; I119-F127 WeakPolarHBondContact O-CD2 3.05Å; I119-G128 PolarHBondContact N-O 2.92Å; I119-G128 PolarHBondContact O-N 2.83Å; I119-A143 VanDerWaalsContact CG2-C 3.48Å; I119-A143 HydrophobicContact CG2-CB 3.93Å; I119-A143 WeakPolarHBondContact CG2-O 3.21Å; I119-L147 HydrophobicContact CG1-CD1 4.37Å; I119-L147 HydrophobicContact CG2-CB 4.27Å; I119-L147 HydrophobicContact CG2-CD1 3.98Å; I119-A248 CarbonylContact C-O 3.6Å; I119-A248 WeakPolarHBondContact CA-O 3.37Å; I119-A249 HydrophobicContact CB-CB 3.98Å; I119-A249 HydrophobicContact CD1-CB 4.14Å; I119-A249 HydrophobicContact CG1-CB 3.9Å
120	M	98.9	Very high	98.3	Very high	2 Å²	2	28.3 Å²	28.3	1%	0.01	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	138.3	178.3	-164.8	168.9	179.3	0	0	110.7	H126 F127 A247 A248 Y269 W274 A275	M120-H126 WeakPolarHBondContact CA-O 3.22Å; M120-F127 HydrophobicContact CB-CD2 4.19Å; M120-F127 HydrophobicContact CG-CD2 4.49Å; M120-A247 WeakPolarHBondContact O-CA 3.46Å; M120-A248 PolarHBondContact N-O 2.84Å; M120-A248 PolarHBondContact O-N 3.08Å; M120-A248 VanDerWaalsContact O-N 3.12Å; M120-Y269 HydrophobicContact CE-CE2 3.94Å; M120-Y269 WeakPolarHBondContact CE-OH 3.48Å; M120-Y269 HydrophobicContact SD-CE2 3.98Å; M120-W274 HydrophobicContact CE-CD2 4.15Å; M120-W274 HydrophobicContact CE-CE3 4.13Å; M120-W274 HydrophobicContact CE-CH2 4.18Å; M120-W274 HydrophobicContact CE-CZ2 4.15Å; M120-W274 HydrophobicContact CE-CZ3 4.16Å; M120-W274 HydrophobicContact SD-CD2 3.87Å; M120-W274 HydrophobicContact SD-CE3 3.73Å; M120-W274 HydrophobicContact SD-CG 4.24Å; M120-W274 HydrophobicContact SD-CZ3 4.24Å; M120-A275 HydrophobicContact CB-CB 4.06Å; M120-A275 WeakPolarHBondContact CE-O 3.31Å; M120-A275 HydrophobicContact CG-CB 4.19Å; M120-A275 WeakPolarHBondContact O-CB 3.49Å; M120-A275 PolarHBondContact SD-N 2.92Å; M120-A275 VanDerWaalsContact SD-N 3.4Å
121	D	98.9	Very high	98.4	Very high	14 Å²	14	24.7 Å²	24.7	8%	0.075	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	121.4	174.1	174.9	30.3	0	0	0	110.5	V83 K123 S124 L125 H126 L147 Q151	V83-D121 HydrophobicContact CG2-CB 3.54Å; D121-K123 VanDerWaalsContact C-N 3.3Å; D121-K123 PolarHBondContact O-N 3.25Å; D121-K123 PolarHBondContact OD1-N 3.04Å; D121-K123 VanDerWaalsContact OD1-N 3.13Å; D121-S124 WeakPolarHBondContact OD2-CB 3.07Å; D121-S124 PolarHBondContact OD2-N 3.23Å; D121-S124 PolarHBondContact OD2-OG 3.17Å; D121-L125 WeakPolarHBondContact O-CA 3.45Å; D121-L125 PolarHBondContact O-N 3.22Å; D121-H126 PolarHBondContact N-O 3.2Å; D121-L147 HydrophobicContact CB-CD1 4.11Å; D121-L147 HydrophobicContact CB-CD2 4.41Å; D121-Q151 PolarHBondContact OD2-NE2 3.37Å
122	G	98.4	Very high	98.5	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.01	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-24.2	179.5	0	0	0	0	0	114	L125 V246 A275 N277	G122-L125 WeakPolarHBondContact O-CD2 3.13Å; G122-V246 VanDerWaalsContact CA-O 3.31Å; G122-V246 WeakPolarHBondContact CA-O 3.33Å; G122-V246 PolarHBondContact N-O 3.25Å; G122-A275 WeakPolarHBondContact CA-O 3.31Å; G122-N277 VanDerWaalsContact O-CB 3.28Å; G122-N277 WeakPolarHBondContact O-CB 3.49Å; G122-N277 PolarHBondContact O-N 3.03Å
123	K	97.3	Very high	98.6	Very high	125 Å²	125	18.9 Å²	18.9	54%	0.543	10%	0.095	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-50.2	-179.1	-172.6	178	-167.9	161.3	0	112	D121 E243 N245	D121-K123 VanDerWaalsContact C-N 3.3Å; D121-K123 PolarHBondContact O-N 3.25Å; D121-K123 PolarHBondContact OD1-N 3.04Å; D121-K123 VanDerWaalsContact OD1-N 3.13Å; K123-E243 IonicContact NZ-OE2 2.84Å; K123-E243 PolarHBondContact NZ-OE2 3.47Å; K123-N245 HydrophobicContact CB-CB 4.4Å; K123-N245 WeakPolarHBondContact CD-OD1 3.5Å
124	S	97.9	Very high	98.6	Very high	42 Å²	42	20.9 Å²	20.9	29%	0.294	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-10.7	-177.7	72	0	0	0	0	113.9	D121 H126 Q151	D121-S124 WeakPolarHBondContact OD2-CB 3.07Å; D121-S124 PolarHBondContact OD2-N 3.23Å; D121-S124 PolarHBondContact OD2-OG 3.17Å; S124-H126 VanDerWaalsContact CB-ND1 3.3Å; S124-H126 WeakPolarHBondContact CB-ND1 3.38Å; S124-H126 PolarHBondContact O-N 2.81Å; S124-H126 VanDerWaalsContact O-N 3.12Å; S124-H126 PolarHBondContact O-ND1 2.84Å; S124-H126 VanDerWaalsContact O-ND1 3.13Å; S124-H126 PolarHBondContact OG-N 2.99Å; S124-H126 PolarHBondContact OG-ND1 3.18Å; S124-H126 VanDerWaalsContact OG-ND1 3.09Å; S124-Q151 PolarHBondContact OG-NE2 2.95Å
125	L	98.2	Very high	98.5	Very high	90 Å²	90	20.5 Å²	20.5	47%	0.471	11%	0.111	S	C	.	.			trans	59.5	13.8	-173.5	-50.7	178.9	0	0	0	114.2	D121 G122 E276	D121-L125 WeakPolarHBondContact O-CA 3.45Å; D121-L125 PolarHBondContact O-N 3.22Å; G122-L125 WeakPolarHBondContact O-CD2 3.13Å; L125-E276 HydrophobicContact CD2-CB 4.31Å; L125-E276 HydrophobicContact CD2-CG 4.07Å
126	H	98.7	Very high	98.5	Very high	69 Å²	69	20.6 Å²	20.6	32%	0.319	11%	0.112	S	C	.	.			trans	-74	150.9	174.6	-72	79.3	0	0	0	110.9	M120 D121 S124 L147 Q151	M120-H126 WeakPolarHBondContact CA-O 3.22Å; D121-H126 PolarHBondContact N-O 3.2Å; S124-H126 VanDerWaalsContact CB-ND1 3.3Å; S124-H126 WeakPolarHBondContact CB-ND1 3.38Å; S124-H126 PolarHBondContact O-N 2.81Å; S124-H126 VanDerWaalsContact O-N 3.12Å; S124-H126 PolarHBondContact O-ND1 2.84Å; S124-H126 VanDerWaalsContact O-ND1 3.13Å; S124-H126 PolarHBondContact OG-N 2.99Å; S124-H126 PolarHBondContact OG-ND1 3.18Å; S124-H126 VanDerWaalsContact OG-ND1 3.09Å; H126-L147 HydrophobicContact CB-CD2 4.4Å; H126-L147 HydrophobicContact CB-CG 3.98Å; H126-L147 WeakPolarHBondContact O-CD1 3.28Å; H126-Q151 HydrophobicContact CB-CG 4.12Å
127	F	98.9	Very high	98.5	Very high	17 Å²	17	24 Å²	24	8%	0.075	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	144.7	-177.8	175.2	-100.7	0	0	0	109.7	S118 I119 M120 A129 C163 Y269	S118-F127 VanDerWaalsContact CB-CE2 3.47Å; S118-F127 VanDerWaalsContact CB-CZ 3.47Å; I119-F127 WeakPolarHBondContact O-CA 3.45Å; I119-F127 VanDerWaalsContact O-CD2 3.25Å; I119-F127 WeakPolarHBondContact O-CD2 3.05Å; M120-F127 HydrophobicContact CB-CD2 4.19Å; M120-F127 HydrophobicContact CG-CD2 4.49Å; F127-A129 HydrophobicContact CD1-CB 4.37Å; F127-A129 HydrophobicContact CE1-CB 3.39Å; F127-A129 HydrophobicContact CZ-CB 3.54Å; F127-C163 HydrophobicContact CD1-CB 4.46Å; F127-C163 VanDerWaalsContact O-CB 3.3Å; F127-C163 WeakPolarHBondContact O-CB 3.34Å; F127-Y269 HydrophobicContact CB-CD2 3.95Å; F127-Y269 HydrophobicContact CB-CE2 3.84Å; F127-Y269 AromaticContact CD1-CD2 3.74Å; F127-Y269 HydrophobicContact CD1-CD2 3.74Å; F127-Y269 HydrophobicContact CD1-CE2 4.48Å; F127-Y269 HydrophobicContact CD1-CG 4.5Å; F127-Y269 AromaticContact CD2-CD2 3.57Å; F127-Y269 HydrophobicContact CD2-CD2 3.57Å; F127-Y269 HydrophobicContact CD2-CE2 4.04Å; F127-Y269 HydrophobicContact CE1-CD2 4.02Å; F127-Y269 HydrophobicContact CE1-CG 4.5Å; F127-Y269 AromaticContact CE2-CD2 3.85Å; F127-Y269 HydrophobicContact CE2-CD2 3.85Å; F127-Y269 AromaticContact CG-CD2 3.48Å; F127-Y269 HydrophobicContact CG-CD2 3.48Å; F127-Y269 VanDerWaalsContact CG-CD2 3.48Å; F127-Y269 AromaticContact CG-CE2 3.89Å; F127-Y269 HydrophobicContact CG-CE2 3.89Å; F127-Y269 HydrophobicContact CZ-CD2 4.06Å
128	G	98.9	Very high	98.5	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	140.6	170.9	0	0	0	0	0	110.4	S118 I119 A143 C163	S118-G128 CarbonylContact C-O 3.59Å; S118-G128 VanDerWaalsContact CA-O 3.23Å; S118-G128 WeakPolarHBondContact CA-O 3.25Å; S118-G128 WeakPolarHBondContact CB-O 3.46Å; I119-G128 PolarHBondContact N-O 2.92Å; I119-G128 PolarHBondContact O-N 2.83Å; G128-A143 WeakPolarHBondContact CA-O 3.45Å; G128-C163 CarbonylContact C-O 3.51Å; G128-C163 WeakPolarHBondContact CA-O 3.25Å
129	A	98.9	Very high	98.5	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	153.9	-179.9	0	0	0	0	0	113.6	A117 F127 L146 C163 F164 L165 A267	A117-A129 CarbonylContact O-C 3.57Å; A117-A129 VanDerWaalsContact O-CA 3.25Å; A117-A129 WeakPolarHBondContact O-CA 3.42Å; F127-A129 HydrophobicContact CD1-CB 4.37Å; F127-A129 HydrophobicContact CE1-CB 3.39Å; F127-A129 HydrophobicContact CZ-CB 3.54Å; A129-L146 WeakPolarHBondContact O-CD1 3.47Å; A129-C163 PolarHBondContact N-O 2.8Å; A129-F164 HydrophobicContact CB-CB 4.41Å; A129-F164 HydrophobicContact CB-CD2 3.66Å; A129-F164 HydrophobicContact CB-CE2 4.32Å; A129-F164 HydrophobicContact CB-CG 4.31Å; A129-F164 WeakPolarHBondContact O-CA 3.43Å; A129-L165 PolarHBondContact O-N 2.76Å; A129-A267 WeakPolarHBondContact CB-O 3.39Å
130	V	98.9	Very high	98.5	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	144.2	168.7	-67.6	0	0	0	0	110.8	D116 A117 I133 P139 V142 L146 L165 A170 A267	D116-V130 WeakPolarHBondContact CA-O 3.32Å; A117-V130 HydrophobicContact CB-CG2 4.14Å; A117-V130 PolarHBondContact N-O 3.47Å; A117-V130 PolarHBondContact O-N 2.83Å; V130-I133 HydrophobicContact CB-CB 4.32Å; V130-I133 HydrophobicContact CB-CD1 4.36Å; V130-I133 HydrophobicContact CB-CG2 4.13Å; V130-I133 HydrophobicContact CG1-CD1 4.3Å; V130-I133 HydrophobicContact CG2-CB 4.5Å; V130-I133 HydrophobicContact CG2-CG2 3.77Å; V130-P139 HydrophobicContact CG2-CB 4.12Å; V130-V142 HydrophobicContact CG1-CB 3.82Å; V130-V142 HydrophobicContact CG1-CG1 3.51Å; V130-V142 HydrophobicContact CG2-CB 4.5Å; V130-L146 HydrophobicContact CG1-CD1 3.91Å; V130-L165 WeakPolarHBondContact CA-O 3.44Å; V130-A170 HydrophobicContact CG1-CB 4.17Å; V130-A267 VanDerWaalsContact O-CB 3.23Å; V130-A267 WeakPolarHBondContact O-CB 3.48Å
131	G	98.8	Very high	98.5	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	144.2	-179.6	0	0	0	0	0	111.9	C115 D116 I133 L165 V166 G167	C115-G131 CarbonylContact O-C 3.57Å; D116-G131 VanDerWaalsContact OD1-CA 3.28Å; D116-G131 WeakPolarHBondContact OD1-CA 3.39Å; G131-I133 PolarHBondContact O-N 3.29Å; G131-L165 PolarHBondContact N-O 3.23Å; G131-L165 VanDerWaalsContact N-O 3.07Å; G131-V166 CarbonylContact O-C 3.54Å; G131-V166 WeakPolarHBondContact O-CA 3.48Å; G131-V166 VanDerWaalsContact O-CB 3.25Å; G131-V166 WeakPolarHBondContact O-CB 3.23Å; G131-G167 PolarHBondContact O-N 2.94Å
132	A	98.6	Very high	98.5	Very high	7 Å²	7	27.1 Å²	27.1	6%	0.058	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	45.6	35.7	-174	0	0	0	0	0	113.3	E114 C115 D116 G167 V263	E114-A132 HydrophobicContact CB-CB 4.45Å; C115-A132 PolarHBondContact O-N 2.94Å; D116-A132 PolarHBondContact OD1-N 3.31Å; A132-G167 WeakPolarHBondContact O-CA 3.25Å; A132-V263 HydrophobicContact CB-CG2 4.08Å
133	I	98.5	Very high	98.5	Very high	3 Å²	3	27.1 Å²	27.1	2%	0.015	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	131.8	179.9	-166.8	173.8	0	0	0	109.4	E114 C115 V130 G131 I136 P139 V142 A170	E114-I133 WeakPolarHBondContact CA-O 3.24Å; C115-I133 HydrophobicContact CB-CG2 4.17Å; C115-I133 PolarHBondContact N-O 3.49Å; C115-I133 WeakPolarHBondContact O-CG2 3.37Å; C115-I133 PolarHBondContact O-N 3.23Å; V130-I133 HydrophobicContact CB-CB 4.32Å; V130-I133 HydrophobicContact CB-CD1 4.36Å; V130-I133 HydrophobicContact CB-CG2 4.13Å; V130-I133 HydrophobicContact CG1-CD1 4.3Å; V130-I133 HydrophobicContact CG2-CB 4.5Å; V130-I133 HydrophobicContact CG2-CG2 3.77Å; G131-I133 PolarHBondContact O-N 3.29Å; I133-I136 HydrophobicContact CD1-CB 4.28Å; I133-I136 HydrophobicContact CD1-CG1 3.76Å; I133-I136 HydrophobicContact CG1-CG1 4.17Å; I133-P139 HydrophobicContact CG2-CB 4.13Å; I133-P139 HydrophobicContact CG2-CG 4.29Å; I133-V142 HydrophobicContact CD1-CG1 4.39Å; I133-V142 HydrophobicContact CD1-CG2 4.06Å; I133-A170 HydrophobicContact CB-CB 4.44Å; I133-A170 HydrophobicContact CD1-CB 3.82Å; I133-A170 HydrophobicContact CG1-CB 4.1Å
134	S	97.9	Very high	98.6	Very high	48 Å²	48	21.9 Å²	21.9	34%	0.336	12%	0.122	S	C	.	.			trans	-119	163.7	175.2	62.7	0	0	0	0	110.1	I113 I136 H171	I113-S134 WeakPolarHBondContact O-CB 3.36Å; S134-I136 VanDerWaalsContact C-N 3.27Å; S134-I136 PolarHBondContact O-N 3.1Å; S134-H171 PolarHBondContact O-CD2 2.93Å
135	G	97.3	Very high	98.6	Very high	12 Å²	12	21.1 Å²	21.1	12%	0.124	12%	0.116	C	C	.	.	S	Bend	trans	71.2	15.2	174.4	0	0	0	0	0	115.4	P181 C182	G135-P181 CarbonylContact O-C 3.58Å; G135-P181 WeakPolarHBondContact O-CA 3.46Å; G135-C182 CarbonylContact C-O 3.47Å; G135-C182 VanDerWaalsContact CA-O 3.31Å; G135-C182 WeakPolarHBondContact CA-O 3.46Å; G135-C182 PolarHBondContact O-N 2.64Å
136	I	98.3	Very high	98.6	Very high	3 Å²	3	16.9 Å²	16.9	2%	0.015	9%	0.094	C	C	.	.	B	Isolated β-bridge	trans	-125	126	175.4	-59.7	-64.9	0	0	0	108.8	I133 S134 N138 V142 A174 I179 M187	I133-I136 HydrophobicContact CD1-CB 4.28Å; I133-I136 HydrophobicContact CD1-CG1 3.76Å; I133-I136 HydrophobicContact CG1-CG1 4.17Å; S134-I136 VanDerWaalsContact C-N 3.27Å; S134-I136 PolarHBondContact O-N 3.1Å; I136-N138 PolarHBondContact O-N 3.03Å; I136-V142 HydrophobicContact CG2-CG2 3.77Å; I136-A174 HydrophobicContact CD1-CB 3.94Å; I136-A174 HydrophobicContact CG1-CB 4.33Å; I136-I179 HydrophobicContact CD1-CG2 4.42Å; I136-I179 HydrophobicContact CG2-CG2 3.99Å; I136-M187 WeakPolarHBondContact O-CE 3.41Å
137	K	98.2	Very high	98.6	Very high	72 Å²	72	13.6 Å²	13.6	31%	0.313	8%	0.079	S	C	.	.	S	Bend	trans	-61.9	-44.2	-176	-174.7	-177.4	172.6	-120.3	0	112.5	D95 G102 P139 C182	D95-K137 WeakPolarHBondContact OD1-CE 3.3Å; D95-K137 IonicContact OD1-NZ 2.8Å; D95-K137 PolarHBondContact OD1-NZ 3.33Å; D95-K137 IonicContact OD2-NZ 2.75Å; D95-K137 PolarHBondContact OD2-NZ 2.97Å; G102-K137 WeakPolarHBondContact CA-O 3.24Å; K137-P139 WeakPolarHBondContact O-CD 3.28Å; K137-C182 HydrophobicContact CB-CB 3.94Å
138	N	98.7	Very high	98.6	Very high	14 Å²	14	15.6 Å²	15.6	8%	0.075	9%	0.092	C	C	.	.			trans	-124.6	86	-173.7	-63.6	106	0	0	0	111.1	V91 E94 D95 I136 V140 L141	V91-N138 HydrophobicContact CG2-CB 4.46Å; E94-N138 WeakPolarHBondContact OE2-CA 3.41Å; E94-N138 WeakPolarHBondContact OE2-CB 3.23Å; E94-N138 PolarHBondContact OE2-ND2 3.05Å; E94-N138 VanDerWaalsContact OE2-ND2 3.16Å; D95-N138 PolarHBondContact OD1-ND2 2.91Å; D95-N138 PolarHBondContact OD1-OD1 3.22Å; I136-N138 PolarHBondContact O-N 3.03Å; N138-V140 PolarHBondContact O-N 3.25Å; N138-L141 HydrophobicContact CB-CB 4.44Å; N138-L141 HydrophobicContact CB-CD1 3.75Å; N138-L141 HydrophobicContact CB-CG 3.84Å; N138-L141 WeakPolarHBondContact O-CB 3.33Å; N138-L141 PolarHBondContact O-N 2.95Å
139	P	98.8	Very high	98.5	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-50.9	-35.8	177.9	-29.3	34.6	0	0	0	114.5	E94 C115 A117 V130 I133 K137 L141 V142 A143	E94-P139 WeakPolarHBondContact OE1-CD 3.4Å; C115-P139 HydrophobicContact CB-CB 4.1Å; C115-P139 HydrophobicContact CB-CG 3.35Å; A117-P139 HydrophobicContact CB-CB 3.65Å; V130-P139 HydrophobicContact CG2-CB 4.12Å; I133-P139 HydrophobicContact CG2-CB 4.13Å; I133-P139 HydrophobicContact CG2-CG 4.29Å; K137-P139 WeakPolarHBondContact O-CD 3.28Å; P139-L141 PolarHBondContact O-N 3.06Å; P139-V142 PolarHBondContact O-N 2.97Å; P139-V142 VanDerWaalsContact O-N 3.08Å; P139-A143 PolarHBondContact O-N 3.3Å
140	V	98.9	Very high	98.4	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-59.6	-31.6	177.6	75.7	0	0	0	0	113.1	T87 L90 V91 E94 N138 V142 A143 S144 A249	T87-V140 HydrophobicContact CG2-CG1 4.29Å; L90-V140 HydrophobicContact CB-CB 3.95Å; L90-V140 HydrophobicContact CB-CG1 3.79Å; L90-V140 HydrophobicContact CB-CG2 3.7Å; L90-V140 HydrophobicContact CG-CG2 4.01Å; V91-V140 HydrophobicContact CG2-CG1 3.83Å; E94-V140 PolarHBondContact OE1-N 3.43Å; E94-V140 WeakPolarHBondContact OE2-CG1 3.48Å; N138-V140 PolarHBondContact O-N 3.25Å; V140-V142 VanDerWaalsContact C-N 3.29Å; V140-V142 PolarHBondContact O-N 3.15Å; V140-A143 PolarHBondContact O-N 2.68Å; V140-S144 VanDerWaalsContact O-CB 3.28Å; V140-S144 WeakPolarHBondContact O-CB 3.41Å; V140-S144 PolarHBondContact O-N 3.43Å; V140-A249 HydrophobicContact CG2-CB 4.23Å
141	L	98.9	Very high	98.4	Very high	67 Å²	67	22 Å²	22	35%	0.351	12%	0.124	S	C	.	.	H	α-helix	trans	-66.3	-34.7	178	-67.4	-179.4	0	0	0	111.3	T87 V91 N138 P139 C145 I179	T87-L141 HydrophobicContact CG2-CD2 3.65Å; V91-L141 HydrophobicContact CG2-CD1 4.38Å; V91-L141 HydrophobicContact CG2-CD2 3.73Å; V91-L141 HydrophobicContact CG2-CG 3.93Å; N138-L141 HydrophobicContact CB-CB 4.44Å; N138-L141 HydrophobicContact CB-CD1 3.75Å; N138-L141 HydrophobicContact CB-CG 3.84Å; N138-L141 WeakPolarHBondContact O-CB 3.33Å; N138-L141 PolarHBondContact O-N 2.95Å; P139-L141 PolarHBondContact O-N 3.06Å; L141-C145 VanDerWaalsContact O-CB 3.26Å; L141-C145 WeakPolarHBondContact O-CB 3.46Å; L141-C145 PolarHBondContact O-N 3.45Å; L141-I179 HydrophobicContact CB-CD1 4.35Å
142	V	98.9	Very high	98.3	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-70.3	-44.4	176.3	-166.7	0	0	0	0	110.2	V130 I133 I136 P139 V140 S144 C145 L146 W173 A174 I179	V130-V142 HydrophobicContact CG1-CB 3.82Å; V130-V142 HydrophobicContact CG1-CG1 3.51Å; V130-V142 HydrophobicContact CG2-CB 4.5Å; I133-V142 HydrophobicContact CD1-CG1 4.39Å; I133-V142 HydrophobicContact CD1-CG2 4.06Å; I136-V142 HydrophobicContact CG2-CG2 3.77Å; P139-V142 PolarHBondContact O-N 2.97Å; P139-V142 VanDerWaalsContact O-N 3.08Å; V140-V142 VanDerWaalsContact C-N 3.29Å; V140-V142 PolarHBondContact O-N 3.15Å; V142-S144 VanDerWaalsContact C-N 3.35Å; V142-S144 PolarHBondContact O-N 3.24Å; V142-C145 PolarHBondContact O-N 2.79Å; V142-L146 WeakPolarHBondContact O-CG 3.43Å; V142-L146 PolarHBondContact O-N 3.3Å; V142-W173 HydrophobicContact CG1-CE3 3.98Å; V142-W173 HydrophobicContact CG1-CZ3 4.02Å; V142-A174 HydrophobicContact CB-CB 4.42Å; V142-A174 HydrophobicContact CG1-CB 3.78Å; V142-A174 HydrophobicContact CG2-CB 3.72Å; V142-I179 HydrophobicContact CB-CD1 4.2Å; V142-I179 HydrophobicContact CG2-CD1 3.82Å; V142-I179 HydrophobicContact CG2-CG2 4.38Å
143	A	98.9	Very high	98.1	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-59.9	-43.8	175.2	0	0	0	0	0	111.9	I119 G128 P139 V140 L146 L147	I119-A143 VanDerWaalsContact CG2-C 3.48Å; I119-A143 HydrophobicContact CG2-CB 3.93Å; I119-A143 WeakPolarHBondContact CG2-O 3.21Å; G128-A143 WeakPolarHBondContact CA-O 3.45Å; P139-A143 PolarHBondContact O-N 3.3Å; V140-A143 PolarHBondContact O-N 2.68Å; A143-L146 PolarHBondContact O-N 2.92Å; A143-L147 PolarHBondContact O-N 3.11Å; A143-L147 VanDerWaalsContact O-N 3.09Å
144	S	98.8	Very high	97.9	Very high	16 Å²	16	37.8 Å²	37.8	11%	0.112	20%	0.201	C	C	.	.	H	α-helix	trans	-63.5	-43	176.3	-167	0	0	0	0	111.7	T87 V140 V142 L146 L147 T148	T87-S144 PolarHBondContact OG1-OG 3.05Å; T87-S144 VanDerWaalsContact OG1-OG 3.08Å; V140-S144 VanDerWaalsContact O-CB 3.28Å; V140-S144 WeakPolarHBondContact O-CB 3.41Å; V140-S144 PolarHBondContact O-N 3.43Å; V142-S144 VanDerWaalsContact C-N 3.35Å; V142-S144 PolarHBondContact O-N 3.24Å; S144-L146 PolarHBondContact O-N 3.49Å; S144-L147 WeakPolarHBondContact O-CB 3.28Å; S144-L147 PolarHBondContact O-N 3.09Å; S144-T148 PolarHBondContact O-N 3.07Å; S144-T148 PolarHBondContact O-OG1 2.63Å
145	C	98.8	Very high	97.7	Very high	26 Å²	26	38.6 Å²	38.6	18%	0.176	20%	0.202	C	C	.	.	H	α-helix	trans	-62	-43.3	175.3	-172.3	0	0	0	0	112.1	L141 V142 L147 T148 E149 W173 I179	L141-C145 VanDerWaalsContact O-CB 3.26Å; L141-C145 WeakPolarHBondContact O-CB 3.46Å; L141-C145 PolarHBondContact O-N 3.45Å; V142-C145 PolarHBondContact O-N 2.79Å; C145-L147 VanDerWaalsContact C-N 3.33Å; C145-L147 PolarHBondContact O-N 3.27Å; C145-T148 PolarHBondContact O-N 2.76Å; C145-E149 WeakPolarHBondContact O-CG 3.36Å; C145-E149 PolarHBondContact O-N 3.43Å; C145-W173 HydrophobicContact CB-CH2 4.03Å; C145-W173 HydrophobicContact CB-CZ3 4.03Å; C145-W173 VanDerWaalsContact SG-CH2 3.51Å; C145-I179 HydrophobicContact CB-CD1 4.14Å
146	L	98.8	Very high	97.6	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-58.6	-44	174.7	-74.8	166.6	0	0	0	112.1	A129 V130 V142 A143 S144 E149 A150 P162 L165 W173	A129-L146 WeakPolarHBondContact O-CD1 3.47Å; V130-L146 HydrophobicContact CG1-CD1 3.91Å; V142-L146 WeakPolarHBondContact O-CG 3.43Å; V142-L146 PolarHBondContact O-N 3.3Å; A143-L146 PolarHBondContact O-N 2.92Å; S144-L146 PolarHBondContact O-N 3.49Å; L146-E149 PolarHBondContact O-N 2.92Å; L146-A150 WeakPolarHBondContact O-CB 3.35Å; L146-A150 PolarHBondContact O-N 2.88Å; L146-P162 HydrophobicContact CD2-CG 4.09Å; L146-P162 WeakPolarHBondContact CD2-O 3.49Å; L146-L165 HydrophobicContact CD1-CG 4.42Å; L146-L165 HydrophobicContact CD2-CD1 3.79Å; L146-L165 HydrophobicContact CD2-CG 4.17Å; L146-W173 HydrophobicContact CB-CH2 4.43Å; L146-W173 HydrophobicContact CD2-CD2 4.07Å; L146-W173 HydrophobicContact CD2-CE3 4.08Å; L146-W173 HydrophobicContact CD2-CH2 3.57Å; L146-W173 HydrophobicContact CD2-CZ2 3.52Å; L146-W173 HydrophobicContact CD2-CZ3 3.85Å; L146-W173 HydrophobicContact CG-CE3 4.31Å; L146-W173 HydrophobicContact CG-CH2 3.76Å; L146-W173 HydrophobicContact CG-CZ2 4.24Å; L146-W173 HydrophobicContact CG-CZ3 3.79Å
147	L	98.6	Very high	97.4	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-60.4	-48.1	175.8	-177.2	159.1	0	0	0	110.9	V83 I119 D121 H126 A143 S144 C145 A150 Q151	V83-L147 HydrophobicContact CG1-CD1 4.46Å; V83-L147 HydrophobicContact CG1-CD2 4.27Å; I119-L147 HydrophobicContact CG1-CD1 4.37Å; I119-L147 HydrophobicContact CG2-CB 4.27Å; I119-L147 HydrophobicContact CG2-CD1 3.98Å; D121-L147 HydrophobicContact CB-CD1 4.11Å; D121-L147 HydrophobicContact CB-CD2 4.41Å; H126-L147 HydrophobicContact CB-CD2 4.4Å; H126-L147 HydrophobicContact CB-CG 3.98Å; H126-L147 WeakPolarHBondContact O-CD1 3.28Å; A143-L147 PolarHBondContact O-N 3.11Å; A143-L147 VanDerWaalsContact O-N 3.09Å; S144-L147 WeakPolarHBondContact O-CB 3.28Å; S144-L147 PolarHBondContact O-N 3.09Å; C145-L147 VanDerWaalsContact C-N 3.33Å; C145-L147 PolarHBondContact O-N 3.27Å; L147-A150 WeakPolarHBondContact O-CB 3.43Å; L147-A150 PolarHBondContact O-N 3.16Å; L147-Q151 HydrophobicContact CD2-CG 4.21Å; L147-Q151 WeakPolarHBondContact O-CG 3.47Å; L147-Q151 PolarHBondContact O-N 3.4Å
148	T	98.2	Very high	97.3	Very high	59 Å²	59	45.5 Å²	45.5	36%	0.362	27%	0.27	S	S	.	.	H	α-helix	trans	-64.1	-41.4	179.2	-58.6	0	0	0	0	112.4	S144 C145 A150 Q151 K152	S144-T148 PolarHBondContact O-N 3.07Å; S144-T148 PolarHBondContact O-OG1 2.63Å; C145-T148 PolarHBondContact O-N 2.76Å; T148-A150 VanDerWaalsContact C-N 3.29Å; T148-A150 PolarHBondContact O-N 2.9Å; T148-Q151 PolarHBondContact O-N 3.26Å; T148-K152 PolarHBondContact O-N 3.38Å
149	E	97.6	Very high	97.2	Very high	43 Å²	43	51.5 Å²	51.5	20%	0.201	29%	0.292	C	S	.	.	H	α-helix	trans	-62.7	-38	174.5	-69.5	-49.2	128.1	0	0	111.5	C145 L146 Q151 K152 W173	C145-E149 WeakPolarHBondContact O-CG 3.36Å; C145-E149 PolarHBondContact O-N 3.43Å; L146-E149 PolarHBondContact O-N 2.92Å; E149-Q151 VanDerWaalsContact C-N 3.33Å; E149-Q151 PolarHBondContact O-N 3.05Å; E149-K152 WeakPolarHBondContact O-CB 3.48Å; E149-K152 PolarHBondContact O-N 3.46Å; E149-K152 WeakPolarHBondContact OE1-CE 3.17Å; E149-K152 IonicContact OE1-NZ 3.36Å; E149-K152 PolarHBondContact OE1-NZ 3.14Å; E149-K152 WeakPolarHBondContact OE2-CD 3.48Å; E149-K152 IonicContact OE2-NZ 2.79Å; E149-K152 PolarHBondContact OE2-NZ 3.1Å; E149-K152 VanDerWaalsContact OE2-NZ 3.14Å; E149-W173 HydrophobicContact CB-CZ2 4.49Å; E149-W173 HydrophobicContact CG-CH2 4.08Å; E149-W173 HydrophobicContact CG-CZ2 3.91Å
150	A	97	Very high	97.1	Very high	13 Å²	13	58.5 Å²	58.5	11%	0.107	33%	0.328	C	S	.	.	H	α-helix	trans	-62.7	-39.7	175.4	0	0	0	0	0	112.4	L146 L147 T148 K152 G153 P161	L146-A150 WeakPolarHBondContact O-CB 3.35Å; L146-A150 PolarHBondContact O-N 2.88Å; L147-A150 WeakPolarHBondContact O-CB 3.43Å; L147-A150 PolarHBondContact O-N 3.16Å; T148-A150 VanDerWaalsContact C-N 3.29Å; T148-A150 PolarHBondContact O-N 2.9Å; A150-K152 VanDerWaalsContact C-N 3.26Å; A150-K152 PolarHBondContact O-N 3.25Å; A150-G153 PolarHBondContact O-N 3.32Å; A150-G153 VanDerWaalsContact O-N 3.1Å; A150-P161 HydrophobicContact CB-CB 4.32Å
151	Q	97.1	Very high	97	Very high	77 Å²	77	59.1 Å²	59.1	36%	0.36	33%	0.332	S	S	.	.	H	α-helix	trans	-65.8	-23.6	177.2	-72	178.3	-26.8	0	0	113.9	D121 S124 H126 L147 T148 E149 G153	D121-Q151 PolarHBondContact OD2-NE2 3.37Å; S124-Q151 PolarHBondContact OG-NE2 2.95Å; H126-Q151 HydrophobicContact CB-CG 4.12Å; L147-Q151 HydrophobicContact CD2-CG 4.21Å; L147-Q151 WeakPolarHBondContact O-CG 3.47Å; L147-Q151 PolarHBondContact O-N 3.4Å; T148-Q151 PolarHBondContact O-N 3.26Å; E149-Q151 VanDerWaalsContact C-N 3.33Å; E149-Q151 PolarHBondContact O-N 3.05Å; Q151-G153 PolarHBondContact O-N 3.25Å
152	K	97	Very high	97	Very high	144 Å²	144	58.2 Å²	58.2	63%	0.626	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-12.5	174	-65.1	174.7	-171.9	173.5	0	112.8	T148 E149 A150	T148-K152 PolarHBondContact O-N 3.38Å; E149-K152 WeakPolarHBondContact O-CB 3.48Å; E149-K152 PolarHBondContact O-N 3.46Å; E149-K152 WeakPolarHBondContact OE1-CE 3.17Å; E149-K152 IonicContact OE1-NZ 3.36Å; E149-K152 PolarHBondContact OE1-NZ 3.14Å; E149-K152 WeakPolarHBondContact OE2-CD 3.48Å; E149-K152 IonicContact OE2-NZ 2.79Å; E149-K152 PolarHBondContact OE2-NZ 3.1Å; E149-K152 VanDerWaalsContact OE2-NZ 3.14Å; A150-K152 VanDerWaalsContact C-N 3.26Å; A150-K152 PolarHBondContact O-N 3.25Å
153	G	94.8	Very high	97	Very high	34 Å²	34	61.3 Å²	61.3	35%	0.351	35%	0.351	S	S	.	.			trans	99.2	-156.6	176.1	0	0	0	0	0	113.2	A150 Q151 P161	A150-G153 PolarHBondContact O-N 3.32Å; A150-G153 VanDerWaalsContact O-N 3.1Å; Q151-G153 PolarHBondContact O-N 3.25Å; G153-P161 WeakPolarHBondContact O-CD 3.4Å; G153-P161 WeakPolarHBondContact O-CG 3.46Å
154	K	95.3	Very high	97	Very high	164 Å²	164	65.2 Å²	65.2	71%	0.713	37%	0.368	S	S	*	.			trans	-68.9	142.4	-174.1	-66.6	178.7	178.7	-179.2	0	111.5	R159	K154-R159 WeakPolarHBondContact CA-O 3.44Å
155	L	93.8	Very high	97	Very high	66 Å²	66	66.2 Å²	66.2	35%	0.346	37%	0.372	S	S	.	.			trans	-73.6	178.9	168.9	-54.4	179.7	0	0	0	111.1	G158 R159 P161	L155-G158 PolarHBondContact O-N 3.46Å; L155-R159 HydrophobicContact CB-CB 4.22Å; L155-R159 PolarHBondContact N-O 3.45Å; L155-P161 HydrophobicContact CD1-CB 4.45Å; L155-P161 HydrophobicContact CD2-CB 4.38Å; L155-P161 HydrophobicContact CD2-CG 3.99Å; L155-P161 HydrophobicContact CG-CB 4.28Å; L155-P161 HydrophobicContact CG-CG 3.87Å
156	S	93.6	Very high	97	Very high	85 Å²	85	68.5 Å²	68.5	59%	0.594	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-49.3	140.6	172	58.6	0	0	0	0	112.4	G158 R159	S156-G158 PolarHBondContact O-N 2.85Å; S156-R159 WeakPolarHBondContact O-CG 3.45Å; S156-R159 PolarHBondContact O-NE 3.31Å; S156-R159 PolarHBondContact OG-NH2 3.46Å
157	A	94.8	Very high	97	Very high	104 Å²	104	69.4 Å²	69.4	86%	0.86	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	60.7	24.4	-173.3	0	0	0	0	0	114.6	R159	A157-R159 VanDerWaalsContact C-N 3.26Å; A157-R159 PolarHBondContact O-N 3.25Å
158	G	95.1	Very high	96.9	Very high	42 Å²	42	78.9 Å²	78.9	43%	0.433	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	73.8	14.9	175.5	0	0	0	0	0	114.4	L155 S156	L155-G158 PolarHBondContact O-N 3.46Å; S156-G158 PolarHBondContact O-N 2.85Å
159	R	96.7	Very high	97	Very high	140 Å²	140	78.2 Å²	78.2	53%	0.528	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-69.2	143.5	-179.8	-64.6	-178.9	-64.4	148	0.7	110.9	K154 L155 S156 A157	K154-R159 WeakPolarHBondContact CA-O 3.44Å; L155-R159 HydrophobicContact CB-CB 4.22Å; L155-R159 PolarHBondContact N-O 3.45Å; S156-R159 WeakPolarHBondContact O-CG 3.45Å; S156-R159 PolarHBondContact O-NE 3.31Å; S156-R159 PolarHBondContact OG-NH2 3.46Å; A157-R159 VanDerWaalsContact C-N 3.26Å; A157-R159 PolarHBondContact O-N 3.25Å
160	I	97.1	Very high	97	Very high	148 Å²	148	76.2 Å²	76.2	76%	0.759	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-78.5	129	175.4	-57.5	176.2	0	0	0	108.2
161	P	97.6	Very high	97.1	Very high	13 Å²	13	77.7 Å²	77.7	8%	0.084	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-58	145.8	173	-22.3	32.3	0	0	0	111.9	A150 G153 L155 C163	A150-P161 HydrophobicContact CB-CB 4.32Å; G153-P161 WeakPolarHBondContact O-CD 3.4Å; G153-P161 WeakPolarHBondContact O-CG 3.46Å; L155-P161 HydrophobicContact CD1-CB 4.45Å; L155-P161 HydrophobicContact CD2-CB 4.38Å; L155-P161 HydrophobicContact CD2-CG 3.99Å; L155-P161 HydrophobicContact CG-CB 4.28Å; L155-P161 HydrophobicContact CG-CG 3.87Å; P161-C163 PolarHBondContact O-N 3.15Å
162	P	98.2	Very high	97.2	Very high	48 Å²	48	77.7 Å²	77.7	31%	0.312	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-67.7	134.2	176	29	-33.4	0	0	0	110.5	L146 L165	L146-P162 HydrophobicContact CD2-CG 4.09Å; L146-P162 WeakPolarHBondContact CD2-O 3.49Å; P162-L165 HydrophobicContact CB-CD2 3.8Å; P162-L165 HydrophobicContact CB-CG 4.14Å; P162-L165 HydrophobicContact CG-CD1 4.32Å; P162-L165 HydrophobicContact CG-CD2 4.19Å; P162-L165 HydrophobicContact CG-CG 4.35Å
163	C	98.4	Very high	97.3	Very high	65 Å²	65	73.1 Å²	73.1	44%	0.439	41%	0.412	S	S	.	.	S	Bend	trans	-98.2	-9.9	170.4	62.6	0	0	0	0	113	F127 G128 A129 P161	F127-C163 HydrophobicContact CD1-CB 4.46Å; F127-C163 VanDerWaalsContact O-CB 3.3Å; F127-C163 WeakPolarHBondContact O-CB 3.34Å; G128-C163 CarbonylContact C-O 3.51Å; G128-C163 WeakPolarHBondContact CA-O 3.25Å; A129-C163 PolarHBondContact N-O 2.8Å; P161-C163 PolarHBondContact O-N 3.15Å
164	F	98.9	Very high	97.4	Very high	81 Å²	81	71.5 Å²	71.5	36%	0.355	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	124.3	179.9	-179.2	-147.3	0	0	0	110.5	A129 V166 V263 A267	A129-F164 HydrophobicContact CB-CB 4.41Å; A129-F164 HydrophobicContact CB-CD2 3.66Å; A129-F164 HydrophobicContact CB-CE2 4.32Å; A129-F164 HydrophobicContact CB-CG 4.31Å; A129-F164 WeakPolarHBondContact O-CA 3.43Å; F164-V166 HydrophobicContact CD2-CG1 4.34Å; F164-V166 HydrophobicContact CE1-CG1 4.09Å; F164-V166 HydrophobicContact CE2-CG1 3.53Å; F164-V166 HydrophobicContact CZ-CG1 3.38Å; F164-V263 HydrophobicContact CZ-CG1 4.34Å; F164-A267 HydrophobicContact CE2-CB 3.76Å; F164-A267 HydrophobicContact CZ-CB 4.05Å
165	L	98.9	Very high	97.6	Very high	38 Å²	38	66.6 Å²	66.6	20%	0.199	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	153.1	174.8	-64.7	178.8	0	0	0	110.5	A129 V130 G131 L146 P162 A170 W173	A129-L165 PolarHBondContact O-N 2.76Å; V130-L165 WeakPolarHBondContact CA-O 3.44Å; G131-L165 PolarHBondContact N-O 3.23Å; G131-L165 VanDerWaalsContact N-O 3.07Å; L146-L165 HydrophobicContact CD1-CG 4.42Å; L146-L165 HydrophobicContact CD2-CD1 3.79Å; L146-L165 HydrophobicContact CD2-CG 4.17Å; P162-L165 HydrophobicContact CB-CD2 3.8Å; P162-L165 HydrophobicContact CB-CG 4.14Å; P162-L165 HydrophobicContact CG-CD1 4.32Å; P162-L165 HydrophobicContact CG-CD2 4.19Å; P162-L165 HydrophobicContact CG-CG 4.35Å; L165-A170 HydrophobicContact CB-CB 3.71Å; L165-W173 HydrophobicContact CD1-CB 3.71Å; L165-W173 HydrophobicContact CD1-CD2 3.81Å; L165-W173 HydrophobicContact CD1-CE3 4.4Å; L165-W173 HydrophobicContact CD1-CG 3.46Å; L165-W173 VanDerWaalsContact CD1-CG 3.46Å
166	V	98.9	Very high	97.8	Very high	74 Å²	74	66.6 Å²	66.6	45%	0.448	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	157.9	-179.8	-60.5	0	0	0	0	113.6	G131 F164 G169 A170	G131-V166 CarbonylContact O-C 3.54Å; G131-V166 WeakPolarHBondContact O-CA 3.48Å; G131-V166 VanDerWaalsContact O-CB 3.25Å; G131-V166 WeakPolarHBondContact O-CB 3.23Å; F164-V166 HydrophobicContact CD2-CG1 4.34Å; F164-V166 HydrophobicContact CE1-CG1 4.09Å; F164-V166 HydrophobicContact CE2-CG1 3.53Å; F164-V166 HydrophobicContact CZ-CG1 3.38Å; V166-G169 PolarHBondContact O-N 3.24Å; V166-A170 PolarHBondContact O-N 2.83Å
167	G	98.4	Very high	98	Very high	20 Å²	20	66.4 Å²	66.4	21%	0.206	38%	0.384	C	S	.	.	H	α-helix	trans	53.8	-138.8	170.1	0	0	0	0	0	113.7	G131 A132 G169 A170 H171	G131-G167 PolarHBondContact O-N 2.94Å; A132-G167 WeakPolarHBondContact O-CA 3.25Å; G167-G169 VanDerWaalsContact C-N 3.29Å; G167-G169 PolarHBondContact O-N 3.08Å; G167-A170 WeakPolarHBondContact O-CB 3.43Å; G167-A170 PolarHBondContact O-N 2.57Å; G167-A170 VanDerWaalsContact O-N 3.16Å; G167-H171 PolarHBondContact O-N 2.8Å; G167-H171 VanDerWaalsContact O-N 3.14Å
168	R	98.3	Very high	98.2	Very high	198 Å²	198	63.5 Å²	63.5	75%	0.747	37%	0.365	S	S	*	.	H	α-helix	trans	-59.3	-36.9	-179	-176.4	172.6	-178.9	-175.2	6.8	113.3	A170 H171 D172	R168-A170 VanDerWaalsContact C-N 3.31Å; R168-A170 PolarHBondContact O-N 3.42Å; R168-H171 PolarHBondContact O-N 2.94Å; R168-D172 WeakPolarHBondContact CG-OD2 3.26Å; R168-D172 IonicContact NE-OD2 2.69Å; R168-D172 PolarHBondContact NE-OD2 3.27Å; R168-D172 WeakPolarHBondContact O-CB 3.41Å; R168-D172 PolarHBondContact O-N 2.66Å
169	G	98.7	Very high	98.3	Very high	46 Å²	46	62.5 Å²	62.5	47%	0.474	35%	0.349	S	S	.	.	H	α-helix	trans	-62.5	-39.2	178.1	0	0	0	0	0	112.3	V166 G167 W173	V166-G169 PolarHBondContact O-N 3.24Å; G167-G169 VanDerWaalsContact C-N 3.29Å; G167-G169 PolarHBondContact O-N 3.08Å; G169-W173 WeakPolarHBondContact O-CB 3.43Å; G169-W173 PolarHBondContact O-N 2.98Å
170	A	98.8	Very high	98.3	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-67.4	-42.7	174.4	0	0	0	0	0	112.3	V130 I133 L165 V166 G167 R168 A174	V130-A170 HydrophobicContact CG1-CB 4.17Å; I133-A170 HydrophobicContact CB-CB 4.44Å; I133-A170 HydrophobicContact CD1-CB 3.82Å; I133-A170 HydrophobicContact CG1-CB 4.1Å; L165-A170 HydrophobicContact CB-CB 3.71Å; V166-A170 PolarHBondContact O-N 2.83Å; G167-A170 WeakPolarHBondContact O-CB 3.43Å; G167-A170 PolarHBondContact O-N 2.57Å; G167-A170 VanDerWaalsContact O-N 3.16Å; R168-A170 VanDerWaalsContact C-N 3.31Å; R168-A170 PolarHBondContact O-N 3.42Å; A170-A174 WeakPolarHBondContact O-CB 3.42Å; A170-A174 PolarHBondContact O-N 3.07Å
171	H	98.6	Very high	98.3	Very high	44 Å²	44	56.3 Å²	56.3	20%	0.204	34%	0.337	C	S	.	.	H	α-helix	trans	-60	-52.9	176.1	170.4	-83.3	0	0	0	111.8	S134 G167 R168 W173 A174 V175	S134-H171 PolarHBondContact O-CD2 2.93Å; G167-H171 PolarHBondContact O-N 2.8Å; G167-H171 VanDerWaalsContact O-N 3.14Å; R168-H171 PolarHBondContact O-N 2.94Å; H171-W173 VanDerWaalsContact C-N 3.28Å; H171-W173 PolarHBondContact O-N 3.5Å; H171-A174 WeakPolarHBondContact O-CB 3.33Å; H171-A174 PolarHBondContact O-N 3.08Å; H171-A174 VanDerWaalsContact O-N 3.1Å; H171-V175 WeakPolarHBondContact O-CG2 3.42Å; H171-V175 PolarHBondContact O-N 3.22Å
172	D	98.7	Very high	98.2	Very high	77 Å²	77	56.6 Å²	56.6	41%	0.412	34%	0.339	S	S	.	.	H	α-helix	trans	-65.2	-36.2	-176.6	-65.8	-9.5	0	0	0	110.8	R168 G176	R168-D172 WeakPolarHBondContact CG-OD2 3.26Å; R168-D172 IonicContact NE-OD2 2.69Å; R168-D172 PolarHBondContact NE-OD2 3.27Å; R168-D172 WeakPolarHBondContact O-CB 3.41Å; R168-D172 PolarHBondContact O-N 2.66Å; D172-G176 PolarHBondContact O-N 3.09Å
173	W	98.8	Very high	98	Very high	49 Å²	49	57.4 Å²	57.4	19%	0.186	34%	0.344	C	S	.	.	H	α-helix	trans	-62.3	-45.9	171.5	-173.4	95.7	0	0	0	111.9	V142 C145 L146 E149 L165 G169 H171 V175 G176 H177	V142-W173 HydrophobicContact CG1-CE3 3.98Å; V142-W173 HydrophobicContact CG1-CZ3 4.02Å; C145-W173 HydrophobicContact CB-CH2 4.03Å; C145-W173 HydrophobicContact CB-CZ3 4.03Å; C145-W173 VanDerWaalsContact SG-CH2 3.51Å; L146-W173 HydrophobicContact CB-CH2 4.43Å; L146-W173 HydrophobicContact CD2-CD2 4.07Å; L146-W173 HydrophobicContact CD2-CE3 4.08Å; L146-W173 HydrophobicContact CD2-CH2 3.57Å; L146-W173 HydrophobicContact CD2-CZ2 3.52Å; L146-W173 HydrophobicContact CD2-CZ3 3.85Å; L146-W173 HydrophobicContact CG-CE3 4.31Å; L146-W173 HydrophobicContact CG-CH2 3.76Å; L146-W173 HydrophobicContact CG-CZ2 4.24Å; L146-W173 HydrophobicContact CG-CZ3 3.79Å; E149-W173 HydrophobicContact CB-CZ2 4.49Å; E149-W173 HydrophobicContact CG-CH2 4.08Å; E149-W173 HydrophobicContact CG-CZ2 3.91Å; L165-W173 HydrophobicContact CD1-CB 3.71Å; L165-W173 HydrophobicContact CD1-CD2 3.81Å; L165-W173 HydrophobicContact CD1-CE3 4.4Å; L165-W173 HydrophobicContact CD1-CG 3.46Å; L165-W173 VanDerWaalsContact CD1-CG 3.46Å; G169-W173 WeakPolarHBondContact O-CB 3.43Å; G169-W173 PolarHBondContact O-N 2.98Å; H171-W173 VanDerWaalsContact C-N 3.28Å; H171-W173 PolarHBondContact O-N 3.5Å; W173-V175 PolarHBondContact O-N 2.99Å; W173-G176 PolarHBondContact O-N 3.01Å; W173-H177 AromaticContact CD1-CE1 3.72Å; W173-H177 AromaticContact CD2-CE1 3.72Å; W173-H177 AromaticContact CD2-ND1 3.54Å; W173-H177 AromaticContact CE2-CE1 3.17Å; W173-H177 AromaticContact CE2-ND1 3.45Å; W173-H177 AromaticContact CE2-NE2 3.64Å; W173-H177 AromaticContact CE3-ND1 3.93Å; W173-H177 AromaticContact CG-ND1 3.97Å; W173-H177 AromaticContact CH2-CD2 3.93Å; W173-H177 AromaticContact CH2-CG 3.93Å; W173-H177 AromaticContact CZ2-CD2 3.71Å; W173-H177 AromaticContact CZ2-CE1 3.48Å; W173-H177 VanDerWaalsContact CZ2-CE1 3.48Å; W173-H177 WeakPolarHBondContact CZ2-CE1 3.16Å; W173-H177 AromaticContact CZ2-CG 3.92Å; W173-H177 AromaticContact CZ2-ND1 3.76Å; W173-H177 AromaticContact CZ2-NE2 3.45Å; W173-H177 WeakPolarHBondContact CZ2-NE2 3.48Å; W173-H177 HydrophobicContact CZ3-CB 4.4Å; W173-H177 AromaticContact NE1-CE1 3.19Å; W173-H177 PolarHBondContact NE1-CE1 2.87Å; W173-H177 AromaticContact NE1-ND1 3.81Å; W173-H177 AromaticContact NE1-NE2 3.84Å; W173-H177 PolarHBondContact O-N 2.97Å; W173-H177 VanDerWaalsContact O-N 3.07Å; W173-H177 PolarHBondContact O-ND1 2.96Å
174	A	98.7	Very high	97.4	Very high	0 Å²	0	57 Å²	57	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-60.1	-46.7	178.9	0	0	0	0	0	111.8	I136 V142 A170 H171 G176 H177 G178 I179	I136-A174 HydrophobicContact CD1-CB 3.94Å; I136-A174 HydrophobicContact CG1-CB 4.33Å; V142-A174 HydrophobicContact CB-CB 4.42Å; V142-A174 HydrophobicContact CG1-CB 3.78Å; V142-A174 HydrophobicContact CG2-CB 3.72Å; A170-A174 WeakPolarHBondContact O-CB 3.42Å; A170-A174 PolarHBondContact O-N 3.07Å; H171-A174 WeakPolarHBondContact O-CB 3.33Å; H171-A174 PolarHBondContact O-N 3.08Å; H171-A174 VanDerWaalsContact O-N 3.1Å; A174-G176 VanDerWaalsContact C-N 3.33Å; A174-G176 PolarHBondContact O-N 2.92Å; A174-H177 CarbonylContact O-C 3.55Å; A174-H177 PolarHBondContact O-N 2.95Å; A174-H177 VanDerWaalsContact O-N 3.08Å; A174-G178 PolarHBondContact O-N 2.88Å; A174-I179 HydrophobicContact CB-CB 4.16Å; A174-I179 HydrophobicContact CB-CD1 4.35Å; A174-I179 WeakPolarHBondContact O-CB 3.26Å; A174-I179 PolarHBondContact O-N 3.39Å
175	V	98.6	Very high	97	Very high	61 Å²	61	60.4 Å²	60.4	37%	0.37	36%	0.359	S	S	.	.	H	α-helix	trans	-61.5	-42.3	175.8	175.7	0	0	0	0	111	H171 W173 H177 G178 I179 P181	H171-V175 WeakPolarHBondContact O-CG2 3.42Å; H171-V175 PolarHBondContact O-N 3.22Å; W173-V175 PolarHBondContact O-N 2.99Å; V175-H177 PolarHBondContact O-N 2.99Å; V175-G178 PolarHBondContact O-N 3Å; V175-I179 WeakPolarHBondContact CA-O 3.38Å; V175-P181 HydrophobicContact CG2-CB 4.15Å; V175-P181 HydrophobicContact CG2-CG 4.29Å
176	G	98.4	Very high	96.7	Very high	66 Å²	66	65.7 Å²	65.7	68%	0.68	38%	0.38	S	S	*	.	H	α-helix	trans	-61.5	-22.7	175	0	0	0	0	0	114.5	D172 W173 A174	D172-G176 PolarHBondContact O-N 3.09Å; W173-G176 PolarHBondContact O-N 3.01Å; A174-G176 VanDerWaalsContact C-N 3.33Å; A174-G176 PolarHBondContact O-N 2.92Å
177	H	98.3	Very high	96.5	Very high	80 Å²	80	62.2 Å²	62.2	37%	0.37	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	15.6	176.1	-68	70.4	0	0	0	112.7	W173 A174 V175	W173-H177 AromaticContact CD1-CE1 3.72Å; W173-H177 AromaticContact CD2-CE1 3.72Å; W173-H177 AromaticContact CD2-ND1 3.54Å; W173-H177 AromaticContact CE2-CE1 3.17Å; W173-H177 AromaticContact CE2-ND1 3.45Å; W173-H177 AromaticContact CE2-NE2 3.64Å; W173-H177 AromaticContact CE3-ND1 3.93Å; W173-H177 AromaticContact CG-ND1 3.97Å; W173-H177 AromaticContact CH2-CD2 3.93Å; W173-H177 AromaticContact CH2-CG 3.93Å; W173-H177 AromaticContact CZ2-CD2 3.71Å; W173-H177 AromaticContact CZ2-CE1 3.48Å; W173-H177 VanDerWaalsContact CZ2-CE1 3.48Å; W173-H177 WeakPolarHBondContact CZ2-CE1 3.16Å; W173-H177 AromaticContact CZ2-CG 3.92Å; W173-H177 AromaticContact CZ2-ND1 3.76Å; W173-H177 AromaticContact CZ2-NE2 3.45Å; W173-H177 WeakPolarHBondContact CZ2-NE2 3.48Å; W173-H177 HydrophobicContact CZ3-CB 4.4Å; W173-H177 AromaticContact NE1-CE1 3.19Å; W173-H177 PolarHBondContact NE1-CE1 2.87Å; W173-H177 AromaticContact NE1-ND1 3.81Å; W173-H177 AromaticContact NE1-NE2 3.84Å; W173-H177 PolarHBondContact O-N 2.97Å; W173-H177 VanDerWaalsContact O-N 3.07Å; W173-H177 PolarHBondContact O-ND1 2.96Å; A174-H177 CarbonylContact O-C 3.55Å; A174-H177 PolarHBondContact O-N 2.95Å; A174-H177 VanDerWaalsContact O-N 3.08Å; V175-H177 PolarHBondContact O-N 2.99Å
178	G	98.1	Very high	96.2	Very high	44 Å²	44	62.3 Å²	62.3	45%	0.454	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.3	12	173.8	0	0	0	0	0	115	A174 V175 P180	A174-G178 PolarHBondContact O-N 2.88Å; V175-G178 PolarHBondContact O-N 3Å; G178-P180 WeakPolarHBondContact O-CD 3.42Å
179	I	98.1	Very high	96	Very high	21 Å²	21	53.7 Å²	53.7	11%	0.108	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-82.5	116.8	172	-58.4	175.5	0	0	0	108	I136 L141 V142 C145 A174 V175	I136-I179 HydrophobicContact CD1-CG2 4.42Å; I136-I179 HydrophobicContact CG2-CG2 3.99Å; L141-I179 HydrophobicContact CB-CD1 4.35Å; V142-I179 HydrophobicContact CB-CD1 4.2Å; V142-I179 HydrophobicContact CG2-CD1 3.82Å; V142-I179 HydrophobicContact CG2-CG2 4.38Å; C145-I179 HydrophobicContact CB-CD1 4.14Å; A174-I179 HydrophobicContact CB-CB 4.16Å; A174-I179 HydrophobicContact CB-CD1 4.35Å; A174-I179 WeakPolarHBondContact O-CB 3.26Å; A174-I179 PolarHBondContact O-N 3.39Å; V175-I179 WeakPolarHBondContact CA-O 3.38Å
180	P	95.5	Very high	95.7	Very high	80 Å²	80	60 Å²	60	52%	0.519	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-70.4	137.7	-170.3	26.7	-34	0	0	0	111.9	G178	G178-P180 WeakPolarHBondContact O-CD 3.42Å
181	P	97.6	Very high	95.2	Very high	77 Å²	77	65.7 Å²	65.7	50%	0.5	37%	0.367	S	S	.	.	B	Isolated β-bridge	trans	-68.4	149.2	173.4	30.1	-33.7	0	0	0	110.9	G135 V175	G135-P181 CarbonylContact O-C 3.58Å; G135-P181 WeakPolarHBondContact O-CA 3.46Å; V175-P181 HydrophobicContact CG2-CB 4.15Å; V175-P181 HydrophobicContact CG2-CG 4.29Å
182	C	96.3	Very high	94.9	Very high	20 Å²	20	64 Å²	64	14%	0.135	36%	0.36	C	S	.	.			trans	-123.6	121	179.1	-169.4	0	0	0	0	110	G135 K137 M187	G135-C182 CarbonylContact C-O 3.47Å; G135-C182 VanDerWaalsContact CA-O 3.31Å; G135-C182 WeakPolarHBondContact CA-O 3.46Å; G135-C182 PolarHBondContact O-N 2.64Å; K137-C182 HydrophobicContact CB-CB 3.94Å; C182-M187 HydrophobicContact CB-CG 4.2Å; C182-M187 HydrophobicContact CB-SD 4.27Å
183	P	92.6	Very high	94.7	Very high	64 Å²	64	63.6 Å²	63.6	42%	0.416	36%	0.358	S	S	.	.			trans	-58.1	140.5	175.3	-24.6	33.2	0	0	0	112.7	E185 K186 M187	P183-E185 VanDerWaalsContact CB-OE2 3.31Å; P183-E185 WeakPolarHBondContact CB-OE2 3.21Å; P183-E185 PolarHBondContact O-N 3.31Å; P183-E185 VanDerWaalsContact O-N 3.14Å; P183-K186 HydrophobicContact CG-CD 4.47Å; P183-K186 WeakPolarHBondContact O-CB 3.35Å; P183-K186 PolarHBondContact O-N 2.73Å; P183-M187 PolarHBondContact O-N 3.26Å
184	S	87.1	Confident	94.4	Very high	57 Å²	57	64.5 Å²	64.5	40%	0.399	37%	0.371	S	S	.	.	H	α-helix	trans	-55.7	-33.3	-178.5	-60.8	0	0	0	0	113	K186 M187 A188	S184-K186 PolarHBondContact O-N 3.22Å; S184-M187 PolarHBondContact O-N 3.47Å; S184-A188 WeakPolarHBondContact O-CB 3.43Å; S184-A188 PolarHBondContact O-N 2.87Å
185	E	89.8	Confident	94.1	Very high	153 Å²	153	66 Å²	66	72%	0.715	38%	0.384	S	S	*	.	H	α-helix	trans	-66.9	-26.7	178.8	-55	76.8	-166.6	0	0	112.7	P183	P183-E185 VanDerWaalsContact CB-OE2 3.31Å; P183-E185 WeakPolarHBondContact CB-OE2 3.21Å; P183-E185 PolarHBondContact O-N 3.31Å; P183-E185 VanDerWaalsContact O-N 3.14Å
186	K	92.4	Very high	93.9	Very high	148 Å²	148	64.5 Å²	64.5	64%	0.643	37%	0.372	S	S	*	.	H	α-helix	trans	-82.7	-28.6	175.2	-65.3	-171.3	-177	176.3	0	112	P183 S184	P183-K186 HydrophobicContact CG-CD 4.47Å; P183-K186 WeakPolarHBondContact O-CB 3.35Å; P183-K186 PolarHBondContact O-N 2.73Å; S184-K186 PolarHBondContact O-N 3.22Å
187	M	93.9	Very high	93.8	Very high	2 Å²	2	67.8 Å²	67.8	1%	0.01	37%	0.367	C	S	.	.	H	α-helix	trans	-79	-35.5	176.7	-67.9	-169.2	58.4	0	0	112.5	G102 G104 I113 I136 C182 P183 S184	G102-M187 WeakPolarHBondContact O-CE 3.34Å; G104-M187 PolarHBondContact N-O 3.04Å; I113-M187 HydrophobicContact CD1-CB 3.77Å; I113-M187 HydrophobicContact CG2-CE 3.86Å; I136-M187 WeakPolarHBondContact O-CE 3.41Å; C182-M187 HydrophobicContact CB-CG 4.2Å; C182-M187 HydrophobicContact CB-SD 4.27Å; P183-M187 PolarHBondContact O-N 3.26Å; S184-M187 PolarHBondContact O-N 3.47Å
188	A	94.2	Very high	93.6	Very high	22 Å²	22	71.8 Å²	71.8	18%	0.182	38%	0.379	C	S	.	.			trans	-75.7	124.5	178.9	0	0	0	0	0	111.2	I113 S184 L193	I113-A188 HydrophobicContact CD1-CB 4.13Å; S184-A188 WeakPolarHBondContact O-CB 3.43Å; S184-A188 PolarHBondContact O-N 2.87Å; A188-L193 HydrophobicContact CB-CD1 4.33Å; A188-L193 HydrophobicContact CB-CD2 4.08Å; A188-L193 HydrophobicContact CB-CG 4.06Å
189	T	92.9	Very high	93.3	Very high	17 Å²	17	72 Å²	72	10%	0.104	37%	0.37	C	S	.	.			trans	-94.8	161.2	178.3	70.4	0	0	0	0	110.3	P97 M103 F191 S192 L193	P97-T189 HydrophobicContact CB-CG2 3.65Å; M103-T189 HydrophobicContact CG-CG2 4.15Å; T189-F191 PolarHBondContact O-N 3.4Å; T189-F191 VanDerWaalsContact O-N 3.13Å; T189-F191 PolarHBondContact OG1-N 2.98Å; T189-S192 PolarHBondContact N-OG 3.13Å; T189-S192 PolarHBondContact O-N 3.28Å; T189-S192 PolarHBondContact O-OG 3.08Å; T189-S192 PolarHBondContact OG1-N 3.05Å; T189-S192 VanDerWaalsContact OG1-N 3.1Å; T189-S192 PolarHBondContact OG1-OG 3.48Å; T189-L193 WeakPolarHBondContact O-CB 3.44Å; T189-L193 WeakPolarHBondContact O-CG 3.4Å; T189-L193 PolarHBondContact O-N 3.1Å
190	K	92.1	Very high	93.1	Very high	179 Å²	179	75.1 Å²	75.1	78%	0.778	38%	0.382	S	S	*	.	H	α-helix	trans	-54.8	-32.8	171.3	-67.7	-177.6	-179	177.1	0	111.7	S194	K190-S194 VanDerWaalsContact O-CB 3.27Å; K190-S194 WeakPolarHBondContact O-CB 3.46Å; K190-S194 PolarHBondContact O-N 3.16Å; K190-S194 VanDerWaalsContact O-N 3.15Å; K190-S194 PolarHBondContact O-OG 3.11Å
191	F	88.4	Confident	93.1	Very high	118 Å²	118	79.6 Å²	79.6	52%	0.518	39%	0.389	S	S	.	.	H	α-helix	trans	-70.5	-50.4	178.1	-57.5	-62.8	0	0	0	111.8	F98 T189 S194 A195	F98-F191 HydrophobicContact CE1-CD2 4.38Å; F98-F191 AromaticContact CE1-CE2 3.87Å; F98-F191 HydrophobicContact CE1-CE2 3.87Å; F98-F191 HydrophobicContact CE1-CZ 4.2Å; F98-F191 HydrophobicContact CZ-CE2 4.37Å; T189-F191 PolarHBondContact O-N 3.4Å; T189-F191 VanDerWaalsContact O-N 3.13Å; T189-F191 PolarHBondContact OG1-N 2.98Å; F191-S194 PolarHBondContact O-N 3.16Å; F191-A195 PolarHBondContact O-N 3.38Å
192	S	92.1	Very high	92.8	Very high	8 Å²	8	80.7 Å²	80.7	6%	0.056	39%	0.386	C	S	.	.	H	α-helix	trans	-66.3	-40.2	-178.8	67.7	0	0	0	0	112	S105 T189 S194 A195 Y196	S105-S192 WeakPolarHBondContact O-CB 3.31Å; T189-S192 PolarHBondContact N-OG 3.13Å; T189-S192 PolarHBondContact O-N 3.28Å; T189-S192 PolarHBondContact O-OG 3.08Å; T189-S192 PolarHBondContact OG1-N 3.05Å; T189-S192 VanDerWaalsContact OG1-N 3.1Å; T189-S192 PolarHBondContact OG1-OG 3.48Å; S192-S194 VanDerWaalsContact C-N 3.35Å; S192-S194 PolarHBondContact O-N 3.27Å; S192-A195 PolarHBondContact O-N 3.48Å; S192-Y196 WeakPolarHBondContact O-CB 3.46Å; S192-Y196 PolarHBondContact O-N 3.08Å
193	L	94.2	Very high	92.5	Very high	70 Å²	70	83.1 Å²	83.1	37%	0.366	40%	0.396	S	S	.	.	H	α-helix	trans	-61.6	-40.3	173.7	-71.2	171.8	0	0	0	112.7	L107 A188 T189 Y196 K197	L107-L193 HydrophobicContact CD2-CD2 3.77Å; A188-L193 HydrophobicContact CB-CD1 4.33Å; A188-L193 HydrophobicContact CB-CD2 4.08Å; A188-L193 HydrophobicContact CB-CG 4.06Å; T189-L193 WeakPolarHBondContact O-CB 3.44Å; T189-L193 WeakPolarHBondContact O-CG 3.4Å; T189-L193 PolarHBondContact O-N 3.1Å; L193-Y196 PolarHBondContact O-N 3.19Å; L193-K197 WeakPolarHBondContact O-CG 3.23Å; L193-K197 PolarHBondContact O-N 3.16Å; L193-K197 VanDerWaalsContact O-N 3.07Å
194	S	92.9	Very high	92.4	Very high	68 Å²	68	84 Å²	84	48%	0.476	40%	0.395	S	S	.	.	H	α-helix	trans	-69.2	-38.8	177.9	-62.3	0	0	0	0	111.6	K190 F191 S192 R198	K190-S194 VanDerWaalsContact O-CB 3.27Å; K190-S194 WeakPolarHBondContact O-CB 3.46Å; K190-S194 PolarHBondContact O-N 3.16Å; K190-S194 VanDerWaalsContact O-N 3.15Å; K190-S194 PolarHBondContact O-OG 3.11Å; F191-S194 PolarHBondContact O-N 3.16Å; S192-S194 VanDerWaalsContact C-N 3.35Å; S192-S194 PolarHBondContact O-N 3.27Å; S194-R198 PolarHBondContact O-N 3.3Å; S194-R198 VanDerWaalsContact O-N 3.13Å
195	A	91.8	Very high	92.6	Very high	31 Å²	31	86.3 Å²	86.3	26%	0.256	40%	0.402	S	S	.	.	H	α-helix	trans	-63.4	-44.8	173.7	0	0	0	0	0	111.3	F191 S192 K197 R198 N199	F191-A195 PolarHBondContact O-N 3.38Å; S192-A195 PolarHBondContact O-N 3.48Å; A195-K197 PolarHBondContact O-N 3.03Å; A195-R198 WeakPolarHBondContact O-CB 3.47Å; A195-R198 PolarHBondContact O-N 3.24Å; A195-N199 WeakPolarHBondContact O-CB 3.29Å; A195-N199 VanDerWaalsContact O-CG 3.27Å; A195-N199 PolarHBondContact O-N 3.47Å; A195-N199 PolarHBondContact O-ND2 3.37Å
196	Y	94.7	Very high	92.5	Very high	30 Å²	30	81.9 Å²	81.9	12%	0.118	39%	0.392	C	S	.	.	H	α-helix	trans	-56.1	-52.1	175.2	174.6	-105.4	0	0	0	112.1	L107 N108 L109 G111 S192 L193 R198 N199 K200 M257	L107-Y196 HydrophobicContact CB-CD2 3.58Å; L107-Y196 HydrophobicContact CB-CE2 4.31Å; L107-Y196 HydrophobicContact CB-CG 3.91Å; L107-Y196 HydrophobicContact CD2-CD1 4.1Å; L107-Y196 HydrophobicContact CD2-CD2 4.24Å; L107-Y196 HydrophobicContact CD2-CG 3.8Å; L107-Y196 HydrophobicContact CG-CG 4.44Å; N108-Y196 WeakPolarHBondContact O-CE2 3.25Å; L109-Y196 PolarHBondContact O-OH 3.41Å; G111-Y196 PolarHBondContact N-OH 2.79Å; S192-Y196 WeakPolarHBondContact O-CB 3.46Å; S192-Y196 PolarHBondContact O-N 3.08Å; L193-Y196 PolarHBondContact O-N 3.19Å; Y196-R198 VanDerWaalsContact C-N 3.26Å; Y196-R198 PolarHBondContact O-N 2.89Å; Y196-N199 PolarHBondContact O-N 3.35Å; Y196-K200 HydrophobicContact CE1-CD 4.15Å; Y196-K200 WeakPolarHBondContact O-CB 3.37Å; Y196-K200 PolarHBondContact O-N 3.39Å; Y196-M257 HydrophobicContact CD2-CE 4.3Å; Y196-M257 HydrophobicContact CD2-SD 3.44Å; Y196-M257 WeakPolarHBondContact CD2-SD 3.48Å; Y196-M257 HydrophobicContact CE2-CE 3.82Å; Y196-M257 HydrophobicContact CE2-SD 3.56Å; Y196-M257 VanDerWaalsContact CE2-SD 3.56Å
197	K	95.9	Very high	92.3	Very high	134 Å²	134	80.6 Å²	80.6	58%	0.583	39%	0.388	S	S	*	.	H	α-helix	trans	-58	-39	178.4	-71.9	175.2	-176.4	180	0	112.3	L193 A195 R201	L193-K197 WeakPolarHBondContact O-CG 3.23Å; L193-K197 PolarHBondContact O-N 3.16Å; L193-K197 VanDerWaalsContact O-N 3.07Å; A195-K197 PolarHBondContact O-N 3.03Å; K197-R201 VanDerWaalsContact O-CG 3.31Å; K197-R201 WeakPolarHBondContact O-CG 3.37Å; K197-R201 PolarHBondContact O-N 3.45Å
198	R	94.3	Very high	91.8	Very high	165 Å²	165	87.4 Å²	87.4	62%	0.623	42%	0.417	S	S	*	.	H	α-helix	trans	-66.2	-49.3	176.8	-175.4	-171.5	-59.2	174.4	0.2	111.4	S194 A195 Y196 R201 K202	S194-R198 PolarHBondContact O-N 3.3Å; S194-R198 VanDerWaalsContact O-N 3.13Å; A195-R198 WeakPolarHBondContact O-CB 3.47Å; A195-R198 PolarHBondContact O-N 3.24Å; Y196-R198 VanDerWaalsContact C-N 3.26Å; Y196-R198 PolarHBondContact O-N 2.89Å; R198-R201 PolarHBondContact O-N 3.31Å; R198-K202 PolarHBondContact O-N 3.13Å
199	N	93.2	Very high	91	Very high	48 Å²	48	93.8 Å²	93.8	26%	0.257	45%	0.445	S	S	.	.	H	α-helix	trans	-66.3	-40.7	-177.5	-67.1	-16.4	0	0	0	111.5	A195 Y196 R201 K202 M203 M257	A195-N199 WeakPolarHBondContact O-CB 3.29Å; A195-N199 VanDerWaalsContact O-CG 3.27Å; A195-N199 PolarHBondContact O-N 3.47Å; A195-N199 PolarHBondContact O-ND2 3.37Å; Y196-N199 PolarHBondContact O-N 3.35Å; N199-R201 PolarHBondContact O-N 3.34Å; N199-K202 PolarHBondContact O-N 3.31Å; N199-M203 WeakPolarHBondContact O-CG 3.24Å; N199-M203 PolarHBondContact O-N 2.74Å; N199-M257 HydrophobicContact CB-CG 3.61Å; N199-M257 HydrophobicContact CB-SD 3.94Å
200	K	94.2	Very high	89.8	Confident	86 Å²	86	99.8 Å²	99.8	37%	0.374	48%	0.477	S	S	.	.	H	α-helix	trans	-57	-48.8	173.9	-172.9	172.7	-175.2	167.6	0	112.2	Y196 K202 M203 E204 M257	Y196-K200 HydrophobicContact CE1-CD 4.15Å; Y196-K200 WeakPolarHBondContact O-CB 3.37Å; Y196-K200 PolarHBondContact O-N 3.39Å; K200-K202 VanDerWaalsContact C-N 3.33Å; K200-K202 PolarHBondContact O-N 2.95Å; K200-M203 PolarHBondContact O-N 3.32Å; K200-E204 VanDerWaalsContact CE-OE1 3.3Å; K200-E204 WeakPolarHBondContact CE-OE1 3.13Å; K200-E204 WeakPolarHBondContact CG-OE1 3.3Å; K200-E204 WeakPolarHBondContact O-CG 3.25Å; K200-E204 PolarHBondContact O-N 3.47Å; K200-M257 HydrophobicContact CB-CE 3.85Å; K200-M257 HydrophobicContact CG-CE 4.25Å
201	R	93.9	Very high	88.4	Confident	174 Å²	174	97 Å²	97	66%	0.657	48%	0.475	S	S	*	.	H	α-helix	trans	-60.2	-40.6	175.7	-73.2	175.1	-178.1	-165.5	-0.1	112.6	K197 R198 N199 L205	K197-R201 VanDerWaalsContact O-CG 3.31Å; K197-R201 WeakPolarHBondContact O-CG 3.37Å; K197-R201 PolarHBondContact O-N 3.45Å; R198-R201 PolarHBondContact O-N 3.31Å; N199-R201 PolarHBondContact O-N 3.34Å; R201-L205 WeakPolarHBondContact O-CD1 3.43Å; R201-L205 VanDerWaalsContact O-CG 3.28Å; R201-L205 WeakPolarHBondContact O-CG 3.44Å; R201-L205 PolarHBondContact O-N 3.02Å; R201-L205 VanDerWaalsContact O-N 3.1Å
202	K	91.6	Very high	86.7	Confident	100 Å²	100	93.6 Å²	93.6	44%	0.435	47%	0.473	S	S	.	.	H	α-helix	trans	-62.1	-44.1	176.9	-76.9	-165.5	171.3	-155.6	0	111.5	R198 N199 K200 L205 A206 E226	R198-K202 PolarHBondContact O-N 3.13Å; N199-K202 PolarHBondContact O-N 3.31Å; K200-K202 VanDerWaalsContact C-N 3.33Å; K200-K202 PolarHBondContact O-N 2.95Å; K202-L205 PolarHBondContact O-N 3.42Å; K202-A206 PolarHBondContact O-N 3.37Å; K202-A206 VanDerWaalsContact O-N 3.08Å; K202-E226 IonicContact NZ-OE2 2.72Å; K202-E226 PolarHBondContact NZ-OE2 3.04Å
203	M	90	Very high	84.8	Confident	72 Å²	72	102.1 Å²	102.1	36%	0.355	51%	0.512	S	S	.	.	H	α-helix	trans	-66.2	-45.2	177.8	-64.3	-148.5	-41.9	0	0	112.3	L109 N199 K200 L205 A206 E207 M257	L109-M203 HydrophobicContact CD2-CE 3.48Å; L109-M203 VanDerWaalsContact CD2-CE 3.48Å; N199-M203 WeakPolarHBondContact O-CG 3.24Å; N199-M203 PolarHBondContact O-N 2.74Å; K200-M203 PolarHBondContact O-N 3.32Å; M203-L205 PolarHBondContact O-N 3.31Å; M203-A206 PolarHBondContact O-N 2.69Å; M203-E207 WeakPolarHBondContact O-CG 3.18Å; M203-E207 PolarHBondContact O-N 3.18Å; M203-M257 HydrophobicContact CE-CB 4.25Å; M203-M257 HydrophobicContact CE-CE 3.85Å; M203-M257 HydrophobicContact SD-CB 4.22Å
204	E	91.1	Very high	82.4	Confident	82 Å²	82	105.8 Å²	105.8	38%	0.383	53%	0.532	S	S	.	.	H	α-helix	trans	-58.9	-33.3	176.9	-71.2	169.5	-177.3	0	0	112.4	K200 K208	K200-E204 VanDerWaalsContact CE-OE1 3.3Å; K200-E204 WeakPolarHBondContact CE-OE1 3.13Å; K200-E204 WeakPolarHBondContact CG-OE1 3.3Å; K200-E204 WeakPolarHBondContact O-CG 3.25Å; K200-E204 PolarHBondContact O-N 3.47Å; E204-K208 WeakPolarHBondContact O-CD 3.41Å; E204-K208 VanDerWaalsContact O-CG 3.27Å; E204-K208 WeakPolarHBondContact O-CG 3.48Å; E204-K208 PolarHBondContact O-N 2.66Å
205	L	90.7	Very high	80.3	Confident	106 Å²	106	112 Å²	112	56%	0.555	55%	0.553	S	S	*	*	H	α-helix	trans	-71.2	-41.3	174.1	-74.2	166.4	0	0	0	112	R201 K202 M203 K208 M209	R201-L205 WeakPolarHBondContact O-CD1 3.43Å; R201-L205 VanDerWaalsContact O-CG 3.28Å; R201-L205 WeakPolarHBondContact O-CG 3.44Å; R201-L205 PolarHBondContact O-N 3.02Å; R201-L205 VanDerWaalsContact O-N 3.1Å; K202-L205 PolarHBondContact O-N 3.42Å; M203-L205 PolarHBondContact O-N 3.31Å; L205-K208 PolarHBondContact O-N 3.5Å; L205-M209 WeakPolarHBondContact O-CG 3.37Å; L205-M209 PolarHBondContact O-N 3.16Å; L205-M209 VanDerWaalsContact O-N 3.14Å
206	A	88.4	Confident	78.1	Confident	60 Å²	60	114.9 Å²	114.9	50%	0.496	58%	0.577	S	S	.	*	H	α-helix	trans	-65.5	-42.3	178.2	0	0	0	0	0	112.1	K202 M203 K208 M209 D210	K202-A206 PolarHBondContact O-N 3.37Å; K202-A206 VanDerWaalsContact O-N 3.08Å; M203-A206 PolarHBondContact O-N 2.69Å; A206-K208 VanDerWaalsContact C-N 3.31Å; A206-K208 PolarHBondContact O-N 3.25Å; A206-M209 PolarHBondContact O-N 3.49Å; A206-M209 VanDerWaalsContact O-N 3.14Å; A206-D210 PolarHBondContact O-N 3.16Å
207	E	88.1	Confident	75.7	Confident	121 Å²	121	122.6 Å²	122.6	57%	0.565	61%	0.611	S	S	*	*	H	α-helix	trans	-62.1	-37.5	176.5	-71.1	173.3	175.4	0	0	112.2	M203 M209 D210 T211	M203-E207 WeakPolarHBondContact O-CG 3.18Å; M203-E207 PolarHBondContact O-N 3.18Å; E207-M209 VanDerWaalsContact C-N 3.35Å; E207-D210 PolarHBondContact O-N 3.08Å; E207-T211 WeakPolarHBondContact O-CG2 3.37Å; E207-T211 PolarHBondContact O-N 3.09Å; E207-T211 VanDerWaalsContact O-N 3.13Å; E207-T211 PolarHBondContact O-OG1 2.96Å
208	K	83.7	Confident	73.2	Confident	145 Å²	145	125.8 Å²	125.8	63%	0.63	63%	0.625	S	S	*	*	H	α-helix	trans	-68.3	-33	175	-74.3	172.9	-174.8	175.9	0	112.9	E204 L205 A206 T211 G212	E204-K208 WeakPolarHBondContact O-CD 3.41Å; E204-K208 VanDerWaalsContact O-CG 3.27Å; E204-K208 WeakPolarHBondContact O-CG 3.48Å; E204-K208 PolarHBondContact O-N 2.66Å; L205-K208 PolarHBondContact O-N 3.5Å; A206-K208 VanDerWaalsContact C-N 3.31Å; A206-K208 PolarHBondContact O-N 3.25Å; K208-T211 WeakPolarHBondContact CA-OG1 3.3Å; K208-T211 PolarHBondContact O-OG1 2.96Å; K208-G212 PolarHBondContact O-N 3.1Å
209	M	76.9	Confident	70.6	Confident	156 Å²	156	129.2 Å²	129.2	77%	0.768	64%	0.638	S	S	*	*	H	α-helix	trans	-73.1	-33.1	176.6	-75.4	-179.3	146	0	0	112.2	L205 A206 E207	L205-M209 WeakPolarHBondContact O-CG 3.37Å; L205-M209 PolarHBondContact O-N 3.16Å; L205-M209 VanDerWaalsContact O-N 3.14Å; A206-M209 PolarHBondContact O-N 3.49Å; A206-M209 VanDerWaalsContact O-N 3.14Å; E207-M209 VanDerWaalsContact C-N 3.35Å
210	D	67.9	Low	68.2	Low	142 Å²	142	138 Å²	138	76%	0.759	67%	0.667	S	S	*	*	H	α-helix	trans	-80	-28.6	-179.3	-149.8	29.2	0	0	0	112.7	A206 E207 G212	A206-D210 PolarHBondContact O-N 3.16Å; E207-D210 PolarHBondContact O-N 3.08Å; D210-G212 VanDerWaalsContact C-N 3.32Å
211	T	61.7	Low	65.6	Low	122 Å²	122	142.7 Å²	142.7	75%	0.748	69%	0.691	S	S	*	*	H	α-helix	trans	-77.7	-14.4	173.8	45.1	0	0	0	0	113.7	E207 K208	E207-T211 WeakPolarHBondContact O-CG2 3.37Å; E207-T211 PolarHBondContact O-N 3.09Å; E207-T211 VanDerWaalsContact O-N 3.13Å; E207-T211 PolarHBondContact O-OG1 2.96Å; K208-T211 WeakPolarHBondContact CA-OG1 3.3Å; K208-T211 PolarHBondContact O-OG1 2.96Å
212	G	53.5	Low	62.8	Low	45 Å²	45	139.7 Å²	139.7	46%	0.464	70%	0.696	S	S	.	*	S	Bend	trans	-92.7	105.9	172.7	0	0	0	0	0	112.1	K208 D210 N214	K208-G212 PolarHBondContact O-N 3.1Å; D210-G212 VanDerWaalsContact C-N 3.32Å; G212-N214 PolarHBondContact O-N 2.88Å
213	Q	51.1	Low	60.2	Low	187 Å²	187	139.8 Å²	139.8	87%	0.874	71%	0.71	S	S	*	*			trans	-47.9	109.4	172.4	-77.1	176.4	-24.6	0	0	112.4
214	N	45.4	Very low	57.7	Low	148 Å²	148	143.5 Å²	143.5	79%	0.791	73%	0.726	S	S	*	*			trans	-160.3	74.4	151.1	-98.8	-32.3	0	0	0	110.7	G212 A216	G212-N214 PolarHBondContact O-N 2.88Å; N214-A216 PolarHBondContact O-N 3.27Å
215	Q	48.8	Very low	55	Low	199 Å²	199	147.8 Å²	147.8	93%	0.93	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.8	3.2	173.2	-73.7	-174.3	-7.1	0	0	114.4
216	A	45.4	Very low	52.5	Low	90 Å²	90	148.1 Å²	148.1	74%	0.744	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98	4.2	-170.9	0	0	0	0	0	116.6	N214	N214-A216 PolarHBondContact O-N 3.27Å
217	K	43.3	Very low	50	Low	192 Å²	192	151.8 Å²	151.8	84%	0.835	76%	0.762	S	S	*	*			trans	-127.8	20.3	178.7	-80.9	-173.5	179.2	176.3	0	115.5	R219	K217-R219 PolarHBondContact O-N 3.09Å
218	K	44.7	Very low	47.6	Very low	202 Å²	202	149 Å²	149	88%	0.878	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	29.7	-175.4	-141.5	176.2	-172.3	175.7	0	115.4
219	R	40.1	Very low	45.8	Very low	237 Å²	237	144.1 Å²	144.1	89%	0.894	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.8	0.9	-175	-134.1	174	167	-175.9	-4.7	117.1	K217	K217-R219 PolarHBondContact O-N 3.09Å
220	R	40.8	Very low	44.6	Very low	233 Å²	233	138.9 Å²	138.9	88%	0.879	74%	0.735	S	S	*	*	S	Bend	trans	-146.8	69.9	178.8	-66.6	-179.3	97.5	155.6	3.2	112.4
221	Q	40.2	Very low	44.1	Very low	184 Å²	184	134.4 Å²	134.4	86%	0.86	72%	0.715	S	S	*	*			trans	170.7	83.9	146	-101.3	168	-14.2	0	0	108.8
222	S	36.2	Very low	44.3	Very low	111 Å²	111	129.7 Å²	129.7	78%	0.776	68%	0.684	S	S	*	*			trans	-115.1	57.1	153.6	61.6	0	0	0	0	107.2	E224	S222-E224 PolarHBondContact O-N 3.13Å
223	S	36	Very low	45.5	Very low	102 Å²	102	127.8 Å²	127.8	71%	0.713	66%	0.664	S	S	*	*			trans	-84.2	63.7	156.7	58.8	0	0	0	0	107	N225	S223-N225 VanDerWaalsContact C-N 3.26Å; S223-N225 PolarHBondContact O-N 2.56Å; S223-N225 VanDerWaalsContact O-N 3.07Å
224	E	37.5	Very low	47.5	Very low	150 Å²	150	119 Å²	119	70%	0.701	62%	0.623	S	S	*	*			trans	-78.9	85.1	169.1	-75.4	-173.8	169.3	0	0	107.5	S222 E226	S222-E224 PolarHBondContact O-N 3.13Å; E224-E226 HydrophobicContact CB-CB 4.34Å; E224-E226 PolarHBondContact O-N 3.36Å; E224-E226 VanDerWaalsContact O-N 3.11Å
225	N	33.6	Very low	50	Low	171 Å²	171	112 Å²	112	91%	0.914	59%	0.585	S	S	*	*			trans	-74.3	46.5	147.1	-95.8	-4.1	0	0	0	108.9	S223	S223-N225 VanDerWaalsContact C-N 3.26Å; S223-N225 PolarHBondContact O-N 2.56Å; S223-N225 VanDerWaalsContact O-N 3.07Å
226	E	39.4	Very low	52.4	Low	114 Å²	114	102.5 Å²	102.5	53%	0.533	54%	0.541	S	S	.	.			trans	-97.2	118.1	170.3	-69.3	-145.4	173.5	0	0	107.3	K202 E224 G228	K202-E226 IonicContact NZ-OE2 2.72Å; K202-E226 PolarHBondContact NZ-OE2 3.04Å; E224-E226 HydrophobicContact CB-CB 4.34Å; E224-E226 PolarHBondContact O-N 3.36Å; E224-E226 VanDerWaalsContact O-N 3.11Å; E226-G228 PolarHBondContact O-N 2.88Å
227	N	36.1	Very low	55	Low	137 Å²	137	98.2 Å²	98.2	73%	0.733	51%	0.505	S	S	*	.			trans	-61.5	58.5	161.8	-75.4	-19.9	0	0	0	110	S229	N227-S229 PolarHBondContact O-N 3.12Å
228	G	37	Very low	57.6	Low	61 Å²	61	89 Å²	89	63%	0.629	47%	0.466	S	S	*	.			trans	-80	11.4	-179.5	0	0	0	0	0	113	E226 G230	E226-G228 PolarHBondContact O-N 2.88Å; G228-G230 PolarHBondContact O-N 3.25Å
229	S	45.4	Very low	60.2	Low	43 Å²	43	79.4 Å²	79.4	30%	0.301	42%	0.424	S	S	.	.			trans	-66.1	86.2	166.1	-164.6	0	0	0	0	107.6	N227	N227-S229 PolarHBondContact O-N 3.12Å
230	G	51.8	Low	62.9	Low	47 Å²	47	68.1 Å²	68.1	49%	0.485	38%	0.381	S	S	.	.			trans	-50.4	148.6	169.8	0	0	0	0	0	109.3	G228 L232	G228-G230 PolarHBondContact O-N 3.25Å; G230-L232 PolarHBondContact O-N 2.82Å
231	C	59.2	Low	65.5	Low	48 Å²	48	57.6 Å²	57.6	32%	0.324	34%	0.342	S	S	.	.			trans	-62.7	88.4	177.5	-178	0	0	0	0	108.9	N106 D233	N106-C231 PolarHBondContact ND2-O 2.92Å; C231-D233 PolarHBondContact O-N 2.98Å; C231-D233 VanDerWaalsContact SG-CB 3.57Å; C231-D233 PolarHBondContact SG-OD2 3.47Å
232	L	65	Low	67.9	Low	22 Å²	22	51.7 Å²	51.7	12%	0.115	32%	0.322	C	S	.	.			trans	-76.3	13.3	170.4	-66.7	174.6	0	0	0	111.2	G230 T234 L255 S291 L340	G230-L232 PolarHBondContact O-N 2.82Å; L232-T234 PolarHBondContact O-N 3.3Å; L232-L255 HydrophobicContact CD2-CD2 3.86Å; L232-S291 PolarHBondContact O-OG 3.28Å; L232-L340 HydrophobicContact CD1-CB 4.06Å; L232-L340 HydrophobicContact CD1-CD1 3.74Å
233	D	78.8	Confident	70.5	Confident	5 Å²	5	51.2 Å²	51.2	3%	0.027	31%	0.307	C	S	.	.			trans	-69.4	125.9	-169.7	-56.1	-14.2	0	0	0	108.6	Y61 N100 C231	Y61-D233 PolarHBondContact OH-OD2 3.06Å; N100-D233 HydrophobicContact CB-CB 4.28Å; N100-D233 VanDerWaalsContact CB-O 3.24Å; N100-D233 WeakPolarHBondContact CB-O 3.49Å; N100-D233 PolarHBondContact ND2-O 2.95Å; C231-D233 PolarHBondContact O-N 2.98Å; C231-D233 VanDerWaalsContact SG-CB 3.57Å; C231-D233 PolarHBondContact SG-OD2 3.47Å
234	T	92.6	Very high	73.2	Confident	2 Å²	2	46.6 Å²	46.6	1%	0.012	28%	0.275	C	S	.	.			trans	-130	147.6	171.5	-66.5	0	0	0	0	105.8	H47 G49 L232 V250 S251 S252 S291	H47-T234 PolarHBondContact CE1-O 3.5Å; H47-T234 PolarHBondContact ND1-O 3.34Å; G49-T234 WeakPolarHBondContact CA-O 3.3Å; G49-T234 PolarHBondContact N-O 3.21Å; L232-T234 PolarHBondContact O-N 3.3Å; T234-V250 HydrophobicContact CG2-CG2 3.4Å; T234-S251 VanDerWaalsContact CG2-O 3.26Å; T234-S251 WeakPolarHBondContact CG2-O 3.2Å; T234-S252 PolarHBondContact OG1-OG 3.17Å; T234-S291 WeakPolarHBondContact CB-OG 3.37Å; T234-S291 PolarHBondContact N-OG 3.43Å
235	V	98.7	Very high	76	Confident	1 Å²	1	40 Å²	40	1%	0.006	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	153	178.2	-57	0	0	0	0	110.2	H47 L90 L93 T99 A101 V250 S251	H47-V235 WeakPolarHBondContact O-CA 3.46Å; L90-V235 HydrophobicContact CD1-CB 4.49Å; L90-V235 HydrophobicContact CD1-CG2 3.69Å; L93-V235 HydrophobicContact CB-CB 3.76Å; L93-V235 HydrophobicContact CB-CG1 4.01Å; L93-V235 HydrophobicContact CB-CG2 3.81Å; L93-V235 HydrophobicContact CD1-CB 4.12Å; L93-V235 HydrophobicContact CD2-CB 4.44Å; L93-V235 HydrophobicContact CD2-CG1 4.4Å; L93-V235 HydrophobicContact CG-CB 4.31Å; T99-V235 HydrophobicContact CG2-CG1 3.59Å; A101-V235 HydrophobicContact CB-CB 4.48Å; A101-V235 HydrophobicContact CB-CG1 4.3Å; A101-V235 HydrophobicContact CB-CG2 3.46Å; A101-V235 VanDerWaalsContact CB-CG2 3.46Å; V235-V250 CarbonylContact O-C 3.49Å; V235-V250 WeakPolarHBondContact O-CA 3.47Å; V235-V250 WeakPolarHBondContact O-CG2 3.49Å; V235-S251 WeakPolarHBondContact CG2-O 3.36Å; V235-S251 PolarHBondContact N-O 3.23Å; V235-S251 PolarHBondContact O-N 3.5Å
236	G	98.9	Very high	79.1	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.9	166.1	179.3	0	0	0	0	0	113	V46 H47 A249 S289	V46-G236 CarbonylContact C-O 3.57Å; V46-G236 VanDerWaalsContact CA-O 3.3Å; V46-G236 WeakPolarHBondContact CA-O 3.34Å; H47-G236 PolarHBondContact CD2-O 3.36Å; H47-G236 PolarHBondContact CE1-N 2.99Å; H47-G236 VanDerWaalsContact CE1-N 3.34Å; H47-G236 PolarHBondContact N-O 3.03Å; H47-G236 VanDerWaalsContact NE2-CA 3.3Å; H47-G236 WeakPolarHBondContact NE2-CA 3.11Å; H47-G236 PolarHBondContact NE2-N 3.4Å; H47-G236 PolarHBondContact O-N 2.92Å; G236-A249 CarbonylContact C-O 3.07Å; G236-A249 WeakPolarHBondContact CA-O 3.42Å; G236-S289 WeakPolarHBondContact CA-OG 3.5Å
237	A	98.9	Very high	82	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	151.7	-175.5	0	0	0	0	0	111.2	L45 V46 V86 A89 L90 A248 A249	L45-A237 CarbonylContact O-C 3.52Å; L45-A237 VanDerWaalsContact O-CA 3.31Å; L45-A237 WeakPolarHBondContact O-CA 3.15Å; V46-A237 HydrophobicContact CB-CB 4.28Å; V46-A237 HydrophobicContact CG1-CB 3.73Å; V86-A237 HydrophobicContact CG2-CB 3.64Å; V86-A237 WeakPolarHBondContact CG2-O 3.37Å; A89-A237 HydrophobicContact CB-CB 4.06Å; L90-A237 HydrophobicContact CD2-CB 3.42Å; L90-A237 VanDerWaalsContact CD2-CB 3.42Å; A237-A248 WeakPolarHBondContact O-CA 3.29Å; A237-A249 PolarHBondContact N-O 3.02Å; A237-A249 PolarHBondContact O-N 2.76Å
238	V	98.9	Very high	85	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	137.2	170.2	-61.6	0	0	0	0	108.2	V44 L45 A247 A248 A287 I344 L346	V44-V238 WeakPolarHBondContact CA-O 3.33Å; L45-V238 HydrophobicContact CB-CG2 3.79Å; L45-V238 HydrophobicContact CD2-CG2 4.34Å; L45-V238 HydrophobicContact CG-CG2 4.3Å; L45-V238 PolarHBondContact N-O 3.19Å; L45-V238 PolarHBondContact O-N 3.1Å; V238-A247 WeakPolarHBondContact CA-O 3.45Å; V238-A248 HydrophobicContact CG1-CB 4.01Å; V238-A287 HydrophobicContact CB-CB 3.81Å; V238-A287 HydrophobicContact CG1-CB 3.92Å; V238-I344 HydrophobicContact CG1-CD1 4.28Å; V238-I344 HydrophobicContact CG1-CG1 4.19Å; V238-I344 HydrophobicContact CG2-CD1 4.07Å; V238-I344 HydrophobicContact CG2-CG1 4.31Å; V238-L346 HydrophobicContact CB-CB 4.1Å; V238-L346 HydrophobicContact CG2-CB 3.59Å; V238-L346 HydrophobicContact CG2-CD1 4.31Å
239	V	98.8	Very high	87.9	Confident	0 Å²	0	17 Å²	17	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	147.3	-174.9	172.4	0	0	0	0	109.6	F43 V44 A72 L76 A82 A85 V86 V246 A247	F43-V239 WeakPolarHBondContact O-CA 3.21Å; V44-V239 HydrophobicContact CB-CG2 4.05Å; V44-V239 HydrophobicContact CG2-CG2 3.73Å; A72-V239 HydrophobicContact CB-CG2 4.43Å; L76-V239 HydrophobicContact CD1-CG1 3.94Å; L76-V239 HydrophobicContact CD2-CG1 3.95Å; L76-V239 HydrophobicContact CG-CG1 4.38Å; A82-V239 HydrophobicContact CB-CG1 4.31Å; A85-V239 HydrophobicContact CB-CG1 4.06Å; V86-V239 HydrophobicContact CB-CB 4.21Å; V86-V239 HydrophobicContact CB-CG2 3.75Å; V86-V239 HydrophobicContact CG2-CG2 4.02Å; V239-V246 CarbonylContact O-C 3.55Å; V239-V246 WeakPolarHBondContact O-CA 2.98Å; V239-A247 PolarHBondContact N-O 3.12Å; V239-A247 PolarHBondContact O-N 2.95Å
240	V	98	Very high	90.5	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	134.6	162	65.9	0	0	0	0	109.8	G42 F43 N245 V246 L346 C348 V365 L414	G42-V240 CarbonylContact C-O 3.55Å; G42-V240 WeakPolarHBondContact CA-O 3.36Å; F43-V240 HydrophobicContact CB-CG1 3.8Å; F43-V240 PolarHBondContact N-O 3.4Å; F43-V240 PolarHBondContact O-N 3.12Å; V240-N245 VanDerWaalsContact CA-O 3.32Å; V240-N245 WeakPolarHBondContact CA-O 3.27Å; V240-V246 HydrophobicContact CB-CG1 3.95Å; V240-V246 HydrophobicContact CG2-CG1 3.8Å; V240-L346 HydrophobicContact CB-CD1 4.08Å; V240-L346 HydrophobicContact CB-CD2 3.82Å; V240-L346 HydrophobicContact CG1-CD1 3.82Å; V240-L346 HydrophobicContact CG1-CD2 4.03Å; V240-L346 HydrophobicContact CG1-CG 4.5Å; V240-C348 HydrophobicContact CG2-CB 4.08Å; V240-V365 HydrophobicContact CG1-CG1 4.37Å; V240-V365 HydrophobicContact CG1-CG2 3.82Å; V240-L414 HydrophobicContact CG1-CD1 3.84Å
241	D	95.4	Very high	92.7	Very high	11 Å²	11	12.7 Å²	12.7	6%	0.059	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	-179.3	176.8	70.9	17.5	0	0	0	112.7	L76 A82 E243 G244 N245	L76-D241 HydrophobicContact CD2-CB 3.92Å; A82-D241 HydrophobicContact CB-CB 4.31Å; D241-E243 PolarHBondContact O-N 3Å; D241-E243 WeakPolarHBondContact OD1-CA 3.41Å; D241-E243 WeakPolarHBondContact OD1-CB 3.33Å; D241-E243 PolarHBondContact OD1-N 3.01Å; D241-G244 PolarHBondContact O-N 2.93Å; D241-G244 PolarHBondContact OD1-N 2.93Å; D241-N245 PolarHBondContact N-O 2.93Å; D241-N245 PolarHBondContact OD1-N 3.14Å; D241-N245 PolarHBondContact OD1-ND2 3.24Å; D241-N245 WeakPolarHBondContact OD2-CB 3.47Å; D241-N245 PolarHBondContact OD2-ND2 2.93Å
242	S	90.7	Very high	94.6	Very high	61 Å²	61	10.5 Å²	10.5	43%	0.427	6%	0.059	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-19.5	179.5	51.7	0	0	0	0	114	G41 G244	G41-S242 VanDerWaalsContact O-CA 3.28Å; G41-S242 WeakPolarHBondContact O-CA 3.35Å; G41-S242 VanDerWaalsContact O-CB 3.25Å; G41-S242 WeakPolarHBondContact O-CB 3.12Å; G41-S242 PolarHBondContact O-N 2.79Å; S242-G244 VanDerWaalsContact C-N 3.34Å
243	E	90.3	Very high	96.1	Very high	100 Å²	100	9.4 Å²	9.4	47%	0.467	5%	0.053	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-5.3	176.7	-60.4	-177.5	179.4	0	0	111.5	K123 D241 N245 R350	K123-E243 IonicContact NZ-OE2 2.84Å; K123-E243 PolarHBondContact NZ-OE2 3.47Å; D241-E243 PolarHBondContact O-N 3Å; D241-E243 WeakPolarHBondContact OD1-CA 3.41Å; D241-E243 WeakPolarHBondContact OD1-CB 3.33Å; D241-E243 PolarHBondContact OD1-N 3.01Å; E243-N245 VanDerWaalsContact C-N 3.32Å; E243-N245 WeakPolarHBondContact CB-ND2 3.2Å; E243-N245 PolarHBondContact OE2-ND2 3.12Å; E243-R350 PolarHBondContact O-NE 3.13Å; E243-R350 PolarHBondContact O-NH2 3.33Å
244	G	92.8	Very high	97	Very high	5 Å²	5	9.5 Å²	9.5	5%	0.052	6%	0.056	C	C	.	.			trans	78.2	16.4	-173.7	0	0	0	0	0	113.4	D241 S242 S285	D241-G244 PolarHBondContact O-N 2.93Å; D241-G244 PolarHBondContact OD1-N 2.93Å; S242-G244 VanDerWaalsContact C-N 3.34Å; G244-S285 PolarHBondContact O-OG 2.87Å
245	N	96.6	Very high	97.1	Very high	11 Å²	11	12.1 Å²	12.1	6%	0.059	7%	0.069	C	C	.	.			trans	-76.9	133.4	168.6	-48.8	-60.3	0	0	0	108.9	K123 V240 D241 E243 N277	K123-N245 HydrophobicContact CB-CB 4.4Å; K123-N245 WeakPolarHBondContact CD-OD1 3.5Å; V240-N245 VanDerWaalsContact CA-O 3.32Å; V240-N245 WeakPolarHBondContact CA-O 3.27Å; D241-N245 PolarHBondContact N-O 2.93Å; D241-N245 PolarHBondContact OD1-N 3.14Å; D241-N245 PolarHBondContact OD1-ND2 3.24Å; D241-N245 WeakPolarHBondContact OD2-CB 3.47Å; D241-N245 PolarHBondContact OD2-ND2 2.93Å; E243-N245 VanDerWaalsContact C-N 3.32Å; E243-N245 WeakPolarHBondContact CB-ND2 3.2Å; E243-N245 PolarHBondContact OE2-ND2 3.12Å; N245-N277 WeakPolarHBondContact CA-OD1 3.31Å; N245-N277 PolarHBondContact OD1-ND2 3.45Å
246	V	98.6	Very high	96.9	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	149.8	-178.7	-62.4	0	0	0	0	111.8	G122 V239 V240 A275 N277 T286 A287 L346	G122-V246 VanDerWaalsContact CA-O 3.31Å; G122-V246 WeakPolarHBondContact CA-O 3.33Å; G122-V246 PolarHBondContact N-O 3.25Å; V239-V246 CarbonylContact O-C 3.55Å; V239-V246 WeakPolarHBondContact O-CA 2.98Å; V240-V246 HydrophobicContact CB-CG1 3.95Å; V240-V246 HydrophobicContact CG2-CG1 3.8Å; V246-A275 HydrophobicContact CG2-CB 4.38Å; V246-N277 WeakPolarHBondContact CG2-OD1 3.39Å; V246-N277 PolarHBondContact N-OD1 3.09Å; V246-T286 WeakPolarHBondContact CG2-O 3.27Å; V246-A287 HydrophobicContact CB-CB 3.95Å; V246-A287 HydrophobicContact CG2-CB 4.31Å; V246-L346 HydrophobicContact CG1-CD2 3.89Å
247	A	98.9	Very high	96.7	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	151.5	172	0	0	0	0	0	110.4	A82 V83 V86 M120 V238 V239	A82-A247 HydrophobicContact CB-CB 3.82Å; V83-A247 HydrophobicContact CG2-CB 4.13Å; V86-A247 HydrophobicContact CB-CB 4.36Å; V86-A247 HydrophobicContact CG1-CB 3.85Å; M120-A247 WeakPolarHBondContact O-CA 3.46Å; V238-A247 WeakPolarHBondContact CA-O 3.45Å; V239-A247 PolarHBondContact N-O 3.12Å; V239-A247 PolarHBondContact O-N 2.95Å
248	A	98.9	Very high	96.6	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	144.3	178.4	0	0	0	0	0	110.8	I119 M120 A237 V238 C273 W274 A275 A287 V288	I119-A248 CarbonylContact C-O 3.6Å; I119-A248 WeakPolarHBondContact CA-O 3.37Å; M120-A248 PolarHBondContact N-O 2.84Å; M120-A248 PolarHBondContact O-N 3.08Å; M120-A248 VanDerWaalsContact O-N 3.12Å; A237-A248 WeakPolarHBondContact O-CA 3.29Å; V238-A248 HydrophobicContact CG1-CB 4.01Å; A248-C273 HydrophobicContact CB-CB 3.9Å; A248-W274 WeakPolarHBondContact CB-O 3.37Å; A248-A275 HydrophobicContact CB-CB 4.13Å; A248-A287 HydrophobicContact CB-CB 4.14Å; A248-V288 WeakPolarHBondContact CB-O 3.35Å
249	A	98.9	Very high	96.5	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	152.9	175.1	0	0	0	0	0	111.7	V86 L90 S118 I119 V140 G236 A237 S289	V86-A249 HydrophobicContact CG1-CB 4.14Å; V86-A249 HydrophobicContact CG2-CB 3.94Å; L90-A249 HydrophobicContact CD2-CB 3.83Å; L90-A249 HydrophobicContact CG-CB 3.88Å; S118-A249 CarbonylContact O-C 3.55Å; S118-A249 VanDerWaalsContact O-CA 3.26Å; S118-A249 WeakPolarHBondContact O-CA 3.44Å; I119-A249 HydrophobicContact CB-CB 3.98Å; I119-A249 HydrophobicContact CD1-CB 4.14Å; I119-A249 HydrophobicContact CG1-CB 3.9Å; V140-A249 HydrophobicContact CG2-CB 4.23Å; G236-A249 CarbonylContact C-O 3.07Å; G236-A249 WeakPolarHBondContact CA-O 3.42Å; A237-A249 PolarHBondContact N-O 3.02Å; A237-A249 PolarHBondContact O-N 2.76Å; A249-S289 PolarHBondContact O-OG 2.89Å
250	V	98.9	Very high	96.5	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	146.3	-180	65.5	0	0	0	0	110.1	A117 S118 T234 V235 A266 C273 T290	A117-V250 CarbonylContact C-O 3.56Å; A117-V250 VanDerWaalsContact CA-O 3.25Å; A117-V250 WeakPolarHBondContact CA-O 3.17Å; S118-V250 PolarHBondContact N-O 3.18Å; S118-V250 PolarHBondContact O-N 3.43Å; S118-V250 WeakPolarHBondContact OG-CG1 3.25Å; T234-V250 HydrophobicContact CG2-CG2 3.4Å; V235-V250 CarbonylContact O-C 3.49Å; V235-V250 WeakPolarHBondContact O-CA 3.47Å; V235-V250 WeakPolarHBondContact O-CG2 3.49Å; V250-A266 HydrophobicContact CG1-CB 4.02Å; V250-A266 WeakPolarHBondContact CG1-O 3.41Å; V250-A266 HydrophobicContact CG2-CB 4.13Å; V250-C273 HydrophobicContact CB-CB 4.39Å; V250-C273 HydrophobicContact CG1-CB 4.09Å; V250-T290 WeakPolarHBondContact CG2-O 3.34Å
251	S	98.9	Very high	96.5	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	140.5	177.1	-173.2	0	0	0	0	111.8	E94 A101 D116 T234 V235	E94-S251 WeakPolarHBondContact OE1-CB 3.34Å; E94-S251 PolarHBondContact OE1-OG 3.07Å; A101-S251 WeakPolarHBondContact CB-O 3.46Å; D116-S251 CarbonylContact O-C 3.49Å; D116-S251 WeakPolarHBondContact O-CA 3.43Å; T234-S251 VanDerWaalsContact CG2-O 3.26Å; T234-S251 WeakPolarHBondContact CG2-O 3.2Å; V235-S251 WeakPolarHBondContact CG2-O 3.36Å; V235-S251 PolarHBondContact N-O 3.23Å; V235-S251 PolarHBondContact O-N 3.5Å
252	S	98.5	Very high	96.7	Very high	2 Å²	2	27 Å²	27	1%	0.014	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	148.1	-174.5	-161.5	0	0	0	0	112.6	N100 C115 D116 T234 G254	N100-S252 CarbonylContact O-C 3.59Å; N100-S252 WeakPolarHBondContact O-CA 3.27Å; C115-S252 CarbonylContact C-O 3.56Å; C115-S252 VanDerWaalsContact CA-O 3.28Å; C115-S252 WeakPolarHBondContact CA-O 3.47Å; D116-S252 PolarHBondContact N-O 2.78Å; D116-S252 PolarHBondContact O-N 3.34Å; T234-S252 PolarHBondContact OG1-OG 3.17Å; S252-G254 VanDerWaalsContact C-N 3.33Å; S252-G254 PolarHBondContact OG-N 2.89Å
253	G	97.5	Very high	97.1	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	15%	0.148	C	C	.	.			trans	-84.3	-9.7	161.1	0	0	0	0	0	113.1	N100 S105 E114 K258	N100-G253 PolarHBondContact O-N 3.44Å; N100-G253 WeakPolarHBondContact OD1-CA 3.32Å; S105-G253 WeakPolarHBondContact OG-CA 3.32Å; E114-G253 VanDerWaalsContact O-O 3.12Å; G253-K258 WeakPolarHBondContact O-CE 3.16Å; G253-K258 PolarHBondContact O-NZ 3.35Å
254	G	96.5	Very high	97.5	Very high	7 Å²	7	21.1 Å²	21.1	7%	0.072	13%	0.126	C	C	.	.			trans	74.9	-165	-174.8	0	0	0	0	0	113.5	N100 N106 S252	N100-G254 PolarHBondContact ND2-O 3.36Å; N106-G254 PolarHBondContact ND2-O 3.14Å; S252-G254 VanDerWaalsContact C-N 3.33Å; S252-G254 PolarHBondContact OG-N 2.89Å
255	L	95.2	Very high	97.7	Very high	57 Å²	57	21 Å²	21	30%	0.298	12%	0.124	S	C	.	.	S	Bend	trans	-68.9	141.3	-177.9	-66.6	176.3	0	0	0	110.9	L232 K258 R262	L232-L255 HydrophobicContact CD2-CD2 3.86Å; L255-K258 HydrophobicContact CB-CB 4.33Å; L255-K258 WeakPolarHBondContact O-CB 3.37Å; L255-K258 WeakPolarHBondContact O-CG 3.45Å; L255-K258 PolarHBondContact O-N 3.06Å; L255-R262 VanDerWaalsContact CG-CZ 3.47Å; L255-R262 VanDerWaalsContact CG-NH1 3.33Å; L255-R262 VanDerWaalsContact CG-NH2 3.32Å
256	A	94.4	Very high	97.8	Very high	35 Å²	35	20.5 Å²	20.5	29%	0.289	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	140.5	166.3	0	0	0	0	0	110.6	N106 K258	N106-A256 HydrophobicContact CB-CB 4.21Å; N106-A256 PolarHBondContact ND2-N 3.45Å; A256-K258 PolarHBondContact O-N 3.47Å
257	M	94.8	Very high	97.8	Very high	22 Å²	22	20.5 Å²	20.5	11%	0.108	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.1	25	-178	-49.7	-58.2	-67.8	0	0	113.3	L107 L109 Y196 N199 K200 M203	L107-M257 PolarHBondContact O-N 3.2Å; L109-M257 HydrophobicContact CD2-CB 3.99Å; L109-M257 HydrophobicContact CD2-CE 4.09Å; L109-M257 WeakPolarHBondContact CD2-O 3.28Å; L109-M257 VanDerWaalsContact CG-O 3.29Å; L109-M257 WeakPolarHBondContact CG-O 3.1Å; Y196-M257 HydrophobicContact CD2-CE 4.3Å; Y196-M257 HydrophobicContact CD2-SD 3.44Å; Y196-M257 WeakPolarHBondContact CD2-SD 3.48Å; Y196-M257 HydrophobicContact CE2-CE 3.82Å; Y196-M257 HydrophobicContact CE2-SD 3.56Å; Y196-M257 VanDerWaalsContact CE2-SD 3.56Å; N199-M257 HydrophobicContact CB-CG 3.61Å; N199-M257 HydrophobicContact CB-SD 3.94Å; K200-M257 HydrophobicContact CB-CE 3.85Å; K200-M257 HydrophobicContact CG-CE 4.25Å; M203-M257 HydrophobicContact CE-CB 4.25Å; M203-M257 HydrophobicContact CE-CE 3.85Å; M203-M257 HydrophobicContact SD-CB 4.22Å
258	K	96.3	Very high	97.8	Very high	8 Å²	8	23.9 Å²	23.9	4%	0.035	14%	0.137	C	C	.	.	P	Polyproline II helix	trans	-59.9	148.9	172.7	66.7	-177.3	-172	-177.3	0	111.2	N108 L109 E114 G253 L255 A256 R262	N108-K258 CarbonylContact C-O 3.57Å; N108-K258 WeakPolarHBondContact CA-O 3.41Å; N108-K258 HydrophobicContact CB-CG 3.8Å; N108-K258 VanDerWaalsContact CB-O 3.3Å; N108-K258 WeakPolarHBondContact CB-O 3.4Å; L109-K258 WeakPolarHBondContact CG-O 3.36Å; L109-K258 PolarHBondContact N-O 3.15Å; E114-K258 PolarHBondContact O-NZ 3.47Å; G253-K258 WeakPolarHBondContact O-CE 3.16Å; G253-K258 PolarHBondContact O-NZ 3.35Å; L255-K258 HydrophobicContact CB-CB 4.33Å; L255-K258 WeakPolarHBondContact O-CB 3.37Å; L255-K258 WeakPolarHBondContact O-CG 3.45Å; L255-K258 PolarHBondContact O-N 3.06Å; A256-K258 PolarHBondContact O-N 3.47Å; K258-R262 HydrophobicContact CB-CB 4.17Å; K258-R262 HydrophobicContact CD-CB 4.23Å; K258-R262 HydrophobicContact CG-CB 4.47Å; K258-R262 PolarHBondContact NZ-O 2.8Å
259	H	98.3	Very high	97.8	Very high	131 Å²	131	29.1 Å²	29.1	61%	0.606	16%	0.158	S	C	*	.	P	Polyproline II helix	trans	-59.5	137.6	167	-168.3	-75.2	0	0	0	109.8	L109 G261 R262	L109-H259 HydrophobicContact CD1-CB 4.31Å; H259-G261 PolarHBondContact O-N 3.17Å; H259-R262 VanDerWaalsContact O-CB 3.26Å; H259-R262 WeakPolarHBondContact O-CB 3.45Å; H259-R262 PolarHBondContact O-N 2.58Å
260	P	98.6	Very high	97.8	Very high	41 Å²	41	29.1 Å²	29.1	27%	0.266	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52	138.3	174.7	-27	34.8	0	0	0	111.7	S110 E114 R262	S110-P260 WeakPolarHBondContact OG-CG 3.44Å; E114-P260 WeakPolarHBondContact OE2-CA 3.4Å; P260-R262 VanDerWaalsContact C-N 3.29Å; P260-R262 PolarHBondContact O-N 2.81Å
261	G	98.3	Very high	97.8	Very high	44 Å²	44	29.4 Å²	29.4	45%	0.454	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.8	1.3	-175.4	0	0	0	0	0	115.6	E114 H259 V263	E114-G261 PolarHBondContact OE1-N 2.95Å; E114-G261 PolarHBondContact OE2-N 3.19Å; E114-G261 VanDerWaalsContact OE2-N 3.14Å; H259-G261 PolarHBondContact O-N 3.17Å; G261-V263 PolarHBondContact O-N 2.94Å
262	R	98.6	Very high	97.8	Very high	43 Å²	43	29.4 Å²	29.4	16%	0.162	16%	0.159	C	C	.	.			trans	-66.7	120.8	169.6	175.2	-178	168.3	-90.7	4.3	109.8	L255 K258 H259 P260 E295	L255-R262 VanDerWaalsContact CG-CZ 3.47Å; L255-R262 VanDerWaalsContact CG-NH1 3.33Å; L255-R262 VanDerWaalsContact CG-NH2 3.32Å; K258-R262 HydrophobicContact CB-CB 4.17Å; K258-R262 HydrophobicContact CD-CB 4.23Å; K258-R262 HydrophobicContact CG-CB 4.47Å; K258-R262 PolarHBondContact NZ-O 2.8Å; H259-R262 VanDerWaalsContact O-CB 3.26Å; H259-R262 WeakPolarHBondContact O-CB 3.45Å; H259-R262 PolarHBondContact O-N 2.58Å; P260-R262 VanDerWaalsContact C-N 3.29Å; P260-R262 PolarHBondContact O-N 2.81Å; R262-E295 IonicContact CZ-OE1 3.27Å; R262-E295 IonicContact CZ-OE2 3.12Å; R262-E295 IonicContact NE-OE1 2.73Å; R262-E295 PolarHBondContact NE-OE1 3.21Å; R262-E295 IonicContact NH2-OE1 3.81Å; R262-E295 PolarHBondContact NH2-OE1 3.46Å; R262-E295 IonicContact NH2-OE2 2.72Å; R262-E295 PolarHBondContact NH2-OE2 3.23Å
263	V	98.8	Very high	97.8	Very high	36 Å²	36	29.3 Å²	29.3	22%	0.218	16%	0.159	C	C	.	.			trans	-102.2	129.3	175	179.5	0	0	0	0	110	A132 F164 G261 A267	A132-V263 HydrophobicContact CB-CG2 4.08Å; F164-V263 HydrophobicContact CZ-CG1 4.34Å; G261-V263 PolarHBondContact O-N 2.94Å; V263-A267 HydrophobicContact CG1-CB 3.59Å
264	G	98.3	Very high	97.9	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.01	16%	0.162	C	C	.	.			trans	-96.4	-174.8	176.6	0	0	0	0	0	114	D116 A266 A267 H268	D116-G264 PolarHBondContact OD2-N 3.19Å; G264-A266 PolarHBondContact O-N 3.37Å; G264-A266 VanDerWaalsContact O-N 3.15Å; G264-A267 PolarHBondContact O-N 3.38Å; G264-H268 PolarHBondContact O-CD2 3.49Å
265	Q	98.6	Very high	98	Very high	4 Å²	4	29.9 Å²	29.9	2%	0.019	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-59	-29.7	-176.7	86.8	-66.9	0.7	0	0	113.2	A267 H268 C271 G272 L297 I298	Q265-A267 PolarHBondContact O-N 3.12Å; Q265-A267 VanDerWaalsContact O-N 3.1Å; Q265-H268 PolarHBondContact O-N 3.35Å; Q265-C271 HydrophobicContact CB-CB 4.16Å; Q265-G272 WeakPolarHBondContact O-CA 3.4Å; Q265-G272 PolarHBondContact O-N 3.5Å; Q265-G272 VanDerWaalsContact O-N 3.1Å; Q265-L297 HydrophobicContact CB-CB 3.81Å; Q265-L297 HydrophobicContact CB-CD1 4.42Å; Q265-L297 HydrophobicContact CG-CB 3.89Å; Q265-L297 HydrophobicContact CG-CD1 3.63Å; Q265-L297 HydrophobicContact CG-CG 4.4Å; Q265-I298 HydrophobicContact CB-CD1 4.46Å; Q265-I298 HydrophobicContact CB-CG1 3.84Å
266	A	98.8	Very high	98.1	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-63.9	-17.3	-174.1	0	0	0	0	0	113.2	D116 A117 S118 V250 G264	D116-A266 HydrophobicContact CB-CB 3.94Å; D116-A266 WeakPolarHBondContact O-CB 3.21Å; A117-A266 CarbonylContact C-O 3.59Å; A117-A266 WeakPolarHBondContact CA-O 3.22Å; S118-A266 WeakPolarHBondContact CB-O 3.26Å; S118-A266 PolarHBondContact N-O 3.3Å; S118-A266 PolarHBondContact OG-O 2.98Å; V250-A266 HydrophobicContact CG1-CB 4.02Å; V250-A266 WeakPolarHBondContact CG1-O 3.41Å; V250-A266 HydrophobicContact CG2-CB 4.13Å; G264-A266 PolarHBondContact O-N 3.37Å; G264-A266 VanDerWaalsContact O-N 3.15Å
267	A	98.8	Very high	98.3	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-101.9	-14.1	172.5	0	0	0	0	0	113.8	D116 A129 V130 F164 V263 G264 Q265	D116-A267 HydrophobicContact CB-CB 4.01Å; A129-A267 WeakPolarHBondContact CB-O 3.39Å; V130-A267 VanDerWaalsContact O-CB 3.23Å; V130-A267 WeakPolarHBondContact O-CB 3.48Å; F164-A267 HydrophobicContact CE2-CB 3.76Å; F164-A267 HydrophobicContact CZ-CB 4.05Å; V263-A267 HydrophobicContact CG1-CB 3.59Å; G264-A267 PolarHBondContact O-N 3.38Å; Q265-A267 PolarHBondContact O-N 3.12Å; Q265-A267 VanDerWaalsContact O-N 3.1Å
268	H	98.5	Very high	98.3	Very high	71 Å²	71	30.1 Å²	30.1	33%	0.329	16%	0.161	S	C	.	.	S	Bend	trans	-85.9	123.7	-173.7	-89.7	-81.8	0	0	0	111.9	G264 Q265 G270 C271 G272 I298	G264-H268 PolarHBondContact O-CD2 3.49Å; Q265-H268 PolarHBondContact O-N 3.35Å; H268-G270 PolarHBondContact O-N 2.83Å; H268-C271 HydrophobicContact CB-CB 3.78Å; H268-C271 WeakPolarHBondContact O-CB 3.41Å; H268-C271 PolarHBondContact O-N 3.17Å; H268-G272 PolarHBondContact O-N 3.17Å; H268-I298 HydrophobicContact CB-CG1 4.38Å
269	Y	98.9	Very high	97.9	Very high	109 Å²	109	32.9 Å²	32.9	43%	0.427	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	131.4	174.8	-174.5	-113.3	0	0	0	111.7	M120 F127 C271 W274	M120-Y269 HydrophobicContact CE-CE2 3.94Å; M120-Y269 WeakPolarHBondContact CE-OH 3.48Å; M120-Y269 HydrophobicContact SD-CE2 3.98Å; F127-Y269 HydrophobicContact CB-CD2 3.95Å; F127-Y269 HydrophobicContact CB-CE2 3.84Å; F127-Y269 AromaticContact CD1-CD2 3.74Å; F127-Y269 HydrophobicContact CD1-CD2 3.74Å; F127-Y269 HydrophobicContact CD1-CE2 4.48Å; F127-Y269 HydrophobicContact CD1-CG 4.5Å; F127-Y269 AromaticContact CD2-CD2 3.57Å; F127-Y269 HydrophobicContact CD2-CD2 3.57Å; F127-Y269 HydrophobicContact CD2-CE2 4.04Å; F127-Y269 HydrophobicContact CE1-CD2 4.02Å; F127-Y269 HydrophobicContact CE1-CG 4.5Å; F127-Y269 AromaticContact CE2-CD2 3.85Å; F127-Y269 HydrophobicContact CE2-CD2 3.85Å; F127-Y269 AromaticContact CG-CD2 3.48Å; F127-Y269 HydrophobicContact CG-CD2 3.48Å; F127-Y269 VanDerWaalsContact CG-CD2 3.48Å; F127-Y269 AromaticContact CG-CE2 3.89Å; F127-Y269 HydrophobicContact CG-CE2 3.89Å; F127-Y269 HydrophobicContact CZ-CD2 4.06Å; Y269-C271 PolarHBondContact O-N 3.45Å; Y269-W274 HydrophobicContact CD1-CZ3 4.25Å; Y269-W274 HydrophobicContact CD2-CZ3 4.45Å; Y269-W274 AromaticContact CE1-CH2 3.92Å; Y269-W274 HydrophobicContact CE1-CH2 3.92Å; Y269-W274 AromaticContact CE1-CZ3 3.61Å; Y269-W274 HydrophobicContact CE1-CZ3 3.61Å; Y269-W274 HydrophobicContact CE2-CE3 4.47Å; Y269-W274 HydrophobicContact CE2-CH2 4.48Å; Y269-W274 AromaticContact CE2-CZ3 3.84Å; Y269-W274 HydrophobicContact CE2-CZ3 3.84Å; Y269-W274 AromaticContact CZ-CH2 3.67Å; Y269-W274 AromaticContact CZ-CZ3 3.38Å; Y269-W274 WeakPolarHBondContact OH-CH2 3.44Å
270	G	98.6	Very high	97.1	Very high	0 Å²	0	35 Å²	35	0%	0	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.5	-4.5	-178.1	0	0	0	0	0	115.9	H268 M301 A303 R304	H268-G270 PolarHBondContact O-N 2.83Å; G270-M301 CarbonylContact O-C 3.45Å; G270-M301 VanDerWaalsContact O-O 3.14Å; G270-A303 PolarHBondContact O-N 2.84Å; G270-R304 PolarHBondContact O-N 2.72Å
271	C	98.8	Very high	96.3	Very high	6 Å²	6	41 Å²	41	4%	0.041	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.4	-51.5	-177	-53.3	0	0	0	0	111.4	Q265 H268 Y269 T290 I298 A303	Q265-C271 HydrophobicContact CB-CB 4.16Å; H268-C271 HydrophobicContact CB-CB 3.78Å; H268-C271 WeakPolarHBondContact O-CB 3.41Å; H268-C271 PolarHBondContact O-N 3.17Å; Y269-C271 PolarHBondContact O-N 3.45Å; C271-T290 WeakPolarHBondContact O-CG2 3.29Å; C271-T290 PolarHBondContact O-OG1 3.22Å; C271-I298 HydrophobicContact CB-CG1 4.33Å; C271-A303 WeakPolarHBondContact O-CB 3.43Å
272	G	98.7	Very high	95.5	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.211	C	C	.	.	S	Bend	trans	-77.8	-51.8	-176.3	0	0	0	0	0	113.5	Q265 H268 T290	Q265-G272 WeakPolarHBondContact O-CA 3.4Å; Q265-G272 PolarHBondContact O-N 3.5Å; Q265-G272 VanDerWaalsContact O-N 3.1Å; H268-G272 PolarHBondContact O-N 3.17Å; G272-T290 PolarHBondContact O-N 3.31Å; G272-T290 PolarHBondContact O-OG1 3.41Å; G272-T290 VanDerWaalsContact O-OG1 3.12Å
273	C	98.9	Very high	95.2	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	163.3	175.9	66.6	0	0	0	0	111.6	A248 V250 V288	A248-C273 HydrophobicContact CB-CB 3.9Å; V250-C273 HydrophobicContact CB-CB 4.39Å; V250-C273 HydrophobicContact CG1-CB 4.09Å; C273-V288 CarbonylContact C-O 3.43Å; C273-V288 WeakPolarHBondContact CA-O 3.46Å; C273-V288 WeakPolarHBondContact CB-O 3.41Å
274	W	98.9	Very high	95.1	Very high	19 Å²	19	43.1 Å²	43.1	7%	0.072	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	143.3	173.1	-166.1	-95.2	0	0	0	109.8	M120 A248 Y269 E276 A287 V288 A303 R304 S307	M120-W274 HydrophobicContact CE-CD2 4.15Å; M120-W274 HydrophobicContact CE-CE3 4.13Å; M120-W274 HydrophobicContact CE-CH2 4.18Å; M120-W274 HydrophobicContact CE-CZ2 4.15Å; M120-W274 HydrophobicContact CE-CZ3 4.16Å; M120-W274 HydrophobicContact SD-CD2 3.87Å; M120-W274 HydrophobicContact SD-CE3 3.73Å; M120-W274 HydrophobicContact SD-CG 4.24Å; M120-W274 HydrophobicContact SD-CZ3 4.24Å; A248-W274 WeakPolarHBondContact CB-O 3.37Å; Y269-W274 HydrophobicContact CD1-CZ3 4.25Å; Y269-W274 HydrophobicContact CD2-CZ3 4.45Å; Y269-W274 AromaticContact CE1-CH2 3.92Å; Y269-W274 HydrophobicContact CE1-CH2 3.92Å; Y269-W274 AromaticContact CE1-CZ3 3.61Å; Y269-W274 HydrophobicContact CE1-CZ3 3.61Å; Y269-W274 HydrophobicContact CE2-CE3 4.47Å; Y269-W274 HydrophobicContact CE2-CH2 4.48Å; Y269-W274 AromaticContact CE2-CZ3 3.84Å; Y269-W274 HydrophobicContact CE2-CZ3 3.84Å; Y269-W274 AromaticContact CZ-CH2 3.67Å; Y269-W274 AromaticContact CZ-CZ3 3.38Å; Y269-W274 WeakPolarHBondContact OH-CH2 3.44Å; W274-E276 PolarHBondContact NE1-OE2 3.11Å; W274-E276 VanDerWaalsContact NE1-OE2 3.08Å; W274-A287 CarbonylContact O-C 3.58Å; W274-A287 VanDerWaalsContact O-CA 3.27Å; W274-A287 WeakPolarHBondContact O-CA 3.49Å; W274-V288 HydrophobicContact CB-CB 4.46Å; W274-V288 PolarHBondContact N-O 3.06Å; W274-V288 PolarHBondContact O-N 3.44Å; W274-A303 HydrophobicContact CB-CB 4.13Å; W274-R304 HydrophobicContact CD2-CB 4.12Å; W274-R304 HydrophobicContact CD2-CG 4.18Å; W274-R304 HydrophobicContact CE3-CB 3.99Å; W274-R304 HydrophobicContact CE3-CG 4.21Å; W274-R304 HydrophobicContact CH2-CG 4.09Å; W274-R304 HydrophobicContact CZ2-CG 4.1Å; W274-R304 HydrophobicContact CZ3-CB 4.27Å; W274-R304 HydrophobicContact CZ3-CG 4.15Å; W274-S307 VanDerWaalsContact CD1-CB 3.42Å
275	A	98.8	Very high	95	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	131.7	171.6	0	0	0	0	0	109.7	M120 G122 V246 A248 T286 A287	M120-A275 HydrophobicContact CB-CB 4.06Å; M120-A275 WeakPolarHBondContact CE-O 3.31Å; M120-A275 HydrophobicContact CG-CB 4.19Å; M120-A275 WeakPolarHBondContact O-CB 3.49Å; M120-A275 PolarHBondContact SD-N 2.92Å; M120-A275 VanDerWaalsContact SD-N 3.4Å; G122-A275 WeakPolarHBondContact CA-O 3.31Å; V246-A275 HydrophobicContact CG2-CB 4.38Å; A248-A275 HydrophobicContact CB-CB 4.13Å; A275-T286 CarbonylContact C-O 3.57Å; A275-T286 WeakPolarHBondContact CA-O 3.19Å; A275-A287 HydrophobicContact CB-CB 4.44Å
276	E	98.5	Very high	95	Very high	43 Å²	43	43.4 Å²	43.4	20%	0.201	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	121	-176.7	-178.6	166.5	-167.4	0	0	109.8	L125 W274 N282 S285 T286	L125-E276 HydrophobicContact CD2-CB 4.31Å; L125-E276 HydrophobicContact CD2-CG 4.07Å; W274-E276 PolarHBondContact NE1-OE2 3.11Å; W274-E276 VanDerWaalsContact NE1-OE2 3.08Å; E276-N282 VanDerWaalsContact CD-ND2 3.26Å; E276-N282 PolarHBondContact OE1-ND2 3.31Å; E276-S285 CarbonylContact O-C 3.55Å; E276-S285 VanDerWaalsContact O-CA 3.26Å; E276-S285 WeakPolarHBondContact O-CA 3.33Å; E276-T286 PolarHBondContact N-O 2.88Å; E276-T286 PolarHBondContact O-N 3.48Å
277	N	97.7	Very high	95	Very high	28 Å²	28	43.4 Å²	43.4	15%	0.15	23%	0.233	C	C	.	.			trans	-72.1	155.3	173.7	-80.8	10.8	0	0	0	111.1	G122 N245 V246 C279 S285	G122-N277 VanDerWaalsContact O-CB 3.28Å; G122-N277 WeakPolarHBondContact O-CB 3.49Å; G122-N277 PolarHBondContact O-N 3.03Å; N245-N277 WeakPolarHBondContact CA-OD1 3.31Å; N245-N277 PolarHBondContact OD1-ND2 3.45Å; V246-N277 WeakPolarHBondContact CG2-OD1 3.39Å; V246-N277 PolarHBondContact N-OD1 3.09Å; N277-C279 PolarHBondContact O-N 3.11Å; N277-S285 WeakPolarHBondContact CA-OG 3.32Å
278	A	93.8	Very high	95	Very high	48 Å²	48	43.4 Å²	43.4	40%	0.397	23%	0.233	S	C	.	.			trans	-54.2	139.5	169.7	0	0	0	0	0	111.2	N282 S285	A278-N282 CarbonylContact C-O 3.59Å; A278-N282 VanDerWaalsContact CA-O 3.26Å; A278-N282 WeakPolarHBondContact CA-O 3.4Å; A278-N282 WeakPolarHBondContact CB-O 3.47Å; A278-S285 PolarHBondContact N-OG 3.41Å
279	C	89.3	Confident	95.1	Very high	67 Å²	67	40 Å²	40	45%	0.453	22%	0.217	S	C	.	.	B	Isolated β-bridge	trans	-146.1	-178	176	72.6	0	0	0	0	109.8	N277 M281 N282	N277-C279 PolarHBondContact O-N 3.11Å; C279-M281 PolarHBondContact O-N 3.41Å; C279-N282 PolarHBondContact N-O 3.47Å; C279-N282 CarbonylContact O-C 3.44Å; C279-N282 PolarHBondContact O-N 2.87Å
280	N	81.4	Confident	95.1	Very high	176 Å²	176	34.9 Å²	34.9	94%	0.941	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-23.3	-178.1	-67.1	-12.4	0	0	0	114.2
281	M	80.8	Confident	95.1	Very high	167 Å²	167	34.9 Å²	34.9	82%	0.823	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-17.3	178.4	-61.2	-61.3	-64.5	0	0	113.3	C279	C279-M281 PolarHBondContact O-N 3.41Å
282	N	82.9	Confident	95	Very high	35 Å²	35	34.8 Å²	34.8	19%	0.187	20%	0.197	C	C	.	.	B	Isolated β-bridge	trans	-129.5	113.9	-173.9	-71.5	-33.1	0	0	0	110.2	E276 A278 C279 Y284	E276-N282 VanDerWaalsContact CD-ND2 3.26Å; E276-N282 PolarHBondContact OE1-ND2 3.31Å; A278-N282 CarbonylContact C-O 3.59Å; A278-N282 VanDerWaalsContact CA-O 3.26Å; A278-N282 WeakPolarHBondContact CA-O 3.4Å; A278-N282 WeakPolarHBondContact CB-O 3.47Å; C279-N282 PolarHBondContact N-O 3.47Å; C279-N282 CarbonylContact O-C 3.44Å; C279-N282 PolarHBondContact O-N 2.87Å; N282-Y284 PolarHBondContact O-N 3.15Å
283	S	91.1	Very high	94.9	Very high	89 Å²	89	35.6 Å²	35.6	62%	0.622	20%	0.203	S	C	*	.	S	Bend	trans	-68	-23.9	-176.5	-59.1	0	0	0	0	113.4	Q311	S283-Q311 VanDerWaalsContact N-OE1 3.11Å
284	Y	95.9	Very high	94.8	Very high	42 Å²	42	35.7 Å²	35.7	17%	0.165	20%	0.204	C	C	.	.	S	Bend	trans	-125.8	139.3	-172.5	-54.5	-89.4	0	0	0	112.4	N282 Q311 R347 C349	N282-Y284 PolarHBondContact O-N 3.15Å; Y284-Q311 VanDerWaalsContact N-OE1 3.09Å; Y284-Q311 PolarHBondContact O-NE2 3.06Å; Y284-R347 HydrophobicContact CD1-CG 3.78Å; Y284-R347 HydrophobicContact CG-CG 3.83Å; Y284-C349 HydrophobicContact CD1-CB 3.72Å; Y284-C349 HydrophobicContact CE1-CB 3.99Å
285	S	97.9	Very high	94.7	Very high	12 Å²	12	38.3 Å²	38.3	8%	0.084	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	128.3	162.3	-61.8	0	0	0	0	108.3	G244 E276 N277 A278 R347 C348	G244-S285 PolarHBondContact O-OG 2.87Å; E276-S285 CarbonylContact O-C 3.55Å; E276-S285 VanDerWaalsContact O-CA 3.26Å; E276-S285 WeakPolarHBondContact O-CA 3.33Å; N277-S285 WeakPolarHBondContact CA-OG 3.32Å; A278-S285 PolarHBondContact N-OG 3.41Å; S285-R347 CarbonylContact O-C 3.52Å; S285-R347 WeakPolarHBondContact O-CA 3.31Å; S285-C348 PolarHBondContact N-O 2.59Å; S285-C348 PolarHBondContact O-N 3.27Å
286	T	98.6	Very high	94.7	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	138.3	-173.5	49.4	0	0	0	0	111.5	V246 A275 E276 S307 M310 L346 R347	V246-T286 WeakPolarHBondContact CG2-O 3.27Å; A275-T286 CarbonylContact C-O 3.57Å; A275-T286 WeakPolarHBondContact CA-O 3.19Å; E276-T286 PolarHBondContact N-O 2.88Å; E276-T286 PolarHBondContact O-N 3.48Å; T286-S307 WeakPolarHBondContact CB-OG 3.27Å; T286-S307 PolarHBondContact OG1-OG 2.93Å; T286-M310 HydrophobicContact CG2-CB 3.69Å; T286-L346 CarbonylContact C-O 3.37Å; T286-L346 WeakPolarHBondContact CA-O 3.32Å; T286-R347 HydrophobicContact CG2-CB 4.38Å; T286-R347 HydrophobicContact CG2-CG 4.1Å
287	A	98.9	Very high	94.7	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	137.3	174.3	0	0	0	0	0	110.5	V238 V246 A248 W274 A275 V345 L346	V238-A287 HydrophobicContact CB-CB 3.81Å; V238-A287 HydrophobicContact CG1-CB 3.92Å; V246-A287 HydrophobicContact CB-CB 3.95Å; V246-A287 HydrophobicContact CG2-CB 4.31Å; A248-A287 HydrophobicContact CB-CB 4.14Å; W274-A287 CarbonylContact O-C 3.58Å; W274-A287 VanDerWaalsContact O-CA 3.27Å; W274-A287 WeakPolarHBondContact O-CA 3.49Å; A275-A287 HydrophobicContact CB-CB 4.44Å; A287-V345 WeakPolarHBondContact O-CA 3.36Å; A287-L346 HydrophobicContact CB-CB 4.49Å; A287-L346 PolarHBondContact N-O 2.99Å; A287-L346 PolarHBondContact O-N 2.96Å
288	V	98.9	Very high	94.8	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	139.6	-174.2	-174.4	0	0	0	0	110.2	A248 C273 W274 T290 A303 C306 V343 I344 V345	A248-V288 WeakPolarHBondContact CB-O 3.35Å; C273-V288 CarbonylContact C-O 3.43Å; C273-V288 WeakPolarHBondContact CA-O 3.46Å; C273-V288 WeakPolarHBondContact CB-O 3.41Å; W274-V288 HydrophobicContact CB-CB 4.46Å; W274-V288 PolarHBondContact N-O 3.06Å; W274-V288 PolarHBondContact O-N 3.44Å; V288-T290 HydrophobicContact CG1-CG2 4.42Å; V288-A303 HydrophobicContact CB-CB 4.36Å; V288-A303 HydrophobicContact CG1-CB 4.12Å; V288-C306 HydrophobicContact CG1-CB 4.11Å; V288-C306 HydrophobicContact CG2-CB 4.25Å; V288-V343 HydrophobicContact CG1-CB 4.46Å; V288-I344 WeakPolarHBondContact CA-O 3.47Å; V288-V345 HydrophobicContact CG1-CG2 4.18Å; V288-V345 HydrophobicContact CG2-CG1 4.27Å; V288-V345 HydrophobicContact CG2-CG2 4.21Å
289	S	98.9	Very high	95	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	141.5	169.3	179.8	0	0	0	0	110.7	H47 G236 A249 V343 I344	H47-S289 PolarHBondContact NE2-OG 3Å; G236-S289 WeakPolarHBondContact CA-OG 3.5Å; A249-S289 PolarHBondContact O-OG 2.89Å; S289-V343 WeakPolarHBondContact O-CA 3.28Å; S289-I344 PolarHBondContact N-O 3.15Å; S289-I344 PolarHBondContact O-N 2.93Å
290	T	98.9	Very high	95.5	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	155.8	-171.1	73.6	0	0	0	0	113.8	V250 C271 G272 V288 L302 A303 G342 V343	V250-T290 WeakPolarHBondContact CG2-O 3.34Å; C271-T290 WeakPolarHBondContact O-CG2 3.29Å; C271-T290 PolarHBondContact O-OG1 3.22Å; G272-T290 PolarHBondContact O-N 3.31Å; G272-T290 PolarHBondContact O-OG1 3.41Å; G272-T290 VanDerWaalsContact O-OG1 3.12Å; V288-T290 HydrophobicContact CG1-CG2 4.42Å; T290-L302 HydrophobicContact CG2-CB 4.48Å; T290-A303 HydrophobicContact CG2-CB 3.79Å; T290-G342 CarbonylContact C-O 3.58Å; T290-G342 WeakPolarHBondContact CA-O 3.43Å; T290-V343 HydrophobicContact CG2-CG1 3.84Å
291	S	98.6	Very high	96.3	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	156.7	173.2	-175.3	0	0	0	0	110.9	A50 L232 T234 G341 G342	A50-S291 PolarHBondContact N-OG 2.93Å; L232-S291 PolarHBondContact O-OG 3.28Å; T234-S291 WeakPolarHBondContact CB-OG 3.37Å; T234-S291 PolarHBondContact N-OG 3.43Å; S291-G341 CarbonylContact O-C 3.56Å; S291-G341 VanDerWaalsContact O-CA 3.31Å; S291-G341 WeakPolarHBondContact O-CA 3.27Å; S291-G342 PolarHBondContact N-O 3.44Å; S291-G342 PolarHBondContact O-N 3.24Å
292	G	96.5	Very high	97.1	Very high	5 Å²	5	25.3 Å²	25.3	5%	0.052	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	127.5	-145.4	174.7	0	0	0	0	0	112.4	G294	G292-G294 PolarHBondContact O-N 2.88Å
293	C	97	Very high	97.9	Very high	17 Å²	17	23.6 Å²	23.6	12%	0.115	12%	0.122	C	C	.	.			trans	-71.8	113	178.1	-177	0	0	0	0	110.4	E295 H296 L297 L340	C293-E295 VanDerWaalsContact C-N 3.29Å; C293-E295 PolarHBondContact O-N 2.93Å; C293-H296 HydrophobicContact CB-CB 4.13Å; C293-H296 VanDerWaalsContact CB-ND1 3.31Å; C293-H296 WeakPolarHBondContact CB-ND1 3.39Å; C293-H296 PolarHBondContact O-N 3.13Å; C293-H296 VanDerWaalsContact O-N 3.09Å; C293-H296 VanDerWaalsContact SG-CD2 3.55Å; C293-H296 PolarHBondContact SG-NE2 3.46Å; C293-L297 WeakPolarHBondContact O-CG 3.05Å; C293-L297 PolarHBondContact O-N 2.78Å; C293-L297 VanDerWaalsContact O-N 3.16Å; C293-L340 HydrophobicContact CB-CB 4.35Å; C293-L340 WeakPolarHBondContact CB-O 3.48Å; C293-L340 PolarHBondContact N-O 3.07Å
294	G	97	Very high	98.3	Very high	2 Å²	2	24.9 Å²	24.9	2%	0.021	11%	0.113	C	C	.	.	H	α-helix	trans	-55.9	-41.2	-175.9	0	0	0	0	0	113.5	G292 H296 L297 I298	G292-G294 PolarHBondContact O-N 2.88Å; G294-H296 VanDerWaalsContact C-N 3.33Å; G294-H296 PolarHBondContact O-N 3.42Å; G294-L297 PolarHBondContact O-N 3.07Å; G294-I298 WeakPolarHBondContact O-CB 3.18Å; G294-I298 VanDerWaalsContact O-CG1 3.28Å; G294-I298 WeakPolarHBondContact O-CG1 3.38Å; G294-I298 PolarHBondContact O-N 3.41Å
295	E	97.9	Very high	98.4	Very high	73 Å²	73	25.2 Å²	25.2	34%	0.341	12%	0.116	S	C	.	.	H	α-helix	trans	-62.4	-39.3	178.3	-73.8	70.6	-162	0	0	112.1	R262 C293 R299	R262-E295 IonicContact CZ-OE1 3.27Å; R262-E295 IonicContact CZ-OE2 3.12Å; R262-E295 IonicContact NE-OE1 2.73Å; R262-E295 PolarHBondContact NE-OE1 3.21Å; R262-E295 IonicContact NH2-OE1 3.81Å; R262-E295 PolarHBondContact NH2-OE1 3.46Å; R262-E295 IonicContact NH2-OE2 2.72Å; R262-E295 PolarHBondContact NH2-OE2 3.23Å; C293-E295 VanDerWaalsContact C-N 3.29Å; C293-E295 PolarHBondContact O-N 2.93Å; E295-R299 WeakPolarHBondContact O-CB 3.36Å; E295-R299 WeakPolarHBondContact O-CD 3.44Å; E295-R299 WeakPolarHBondContact O-CG 3.18Å; E295-R299 PolarHBondContact O-N 2.8Å
296	H	98.5	Very high	98.4	Very high	13 Å²	13	24.7 Å²	24.7	6%	0.06	11%	0.112	C	C	.	.	H	α-helix	trans	-65.5	-46.9	177.9	-58.4	170.2	0	0	0	110.4	C293 G294 I298 R299 T300 F327 L333 E336 R338 L340	C293-H296 HydrophobicContact CB-CB 4.13Å; C293-H296 VanDerWaalsContact CB-ND1 3.31Å; C293-H296 WeakPolarHBondContact CB-ND1 3.39Å; C293-H296 PolarHBondContact O-N 3.13Å; C293-H296 VanDerWaalsContact O-N 3.09Å; C293-H296 VanDerWaalsContact SG-CD2 3.55Å; C293-H296 PolarHBondContact SG-NE2 3.46Å; G294-H296 VanDerWaalsContact C-N 3.33Å; G294-H296 PolarHBondContact O-N 3.42Å; H296-I298 PolarHBondContact O-N 2.91Å; H296-R299 PolarHBondContact O-N 2.89Å; H296-T300 PolarHBondContact O-N 2.96Å; H296-T300 PolarHBondContact O-OG1 2.98Å; H296-F327 HydrophobicContact CB-CE2 3.81Å; H296-F327 HydrophobicContact CB-CZ 4.01Å; H296-L333 HydrophobicContact CB-CD1 3.86Å; H296-L333 HydrophobicContact CB-CD2 4.25Å; H296-E336 IonicContact NE2-OE2 3.58Å; H296-R338 PolarHBondContact CE1-O 2.84Å; H296-L340 PolarHBondContact ND1-N 2.8Å; H296-L340 PolarHBondContact ND1-O 2.85Å
297	L	98.7	Very high	98.4	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-66.9	-35.9	-177.1	-60.2	170	0	0	0	112.4	Q265 C293 G294 M301 L302 F327	Q265-L297 HydrophobicContact CB-CB 3.81Å; Q265-L297 HydrophobicContact CB-CD1 4.42Å; Q265-L297 HydrophobicContact CG-CB 3.89Å; Q265-L297 HydrophobicContact CG-CD1 3.63Å; Q265-L297 HydrophobicContact CG-CG 4.4Å; C293-L297 WeakPolarHBondContact O-CG 3.05Å; C293-L297 PolarHBondContact O-N 2.78Å; C293-L297 VanDerWaalsContact O-N 3.16Å; G294-L297 PolarHBondContact O-N 3.07Å; L297-M301 PolarHBondContact O-N 3.05Å; L297-M301 VanDerWaalsContact O-N 3.13Å; L297-L302 HydrophobicContact CD2-CB 4.03Å; L297-L302 HydrophobicContact CD2-CD2 3.34Å; L297-L302 HydrophobicContact CD2-CG 4.31Å; L297-L302 PolarHBondContact O-N 2.95Å; L297-F327 HydrophobicContact CD2-CE2 3.97Å; L297-F327 HydrophobicContact CD2-CZ 3.92Å
298	I	98.8	Very high	98.4	Very high	47 Å²	47	28.4 Å²	28.4	24%	0.241	14%	0.136	C	C	.	.	H	α-helix	trans	-67.4	-51.2	174	-71	167.2	0	0	0	110.5	Q265 H268 C271 G294 H296 T300 M301	Q265-I298 HydrophobicContact CB-CD1 4.46Å; Q265-I298 HydrophobicContact CB-CG1 3.84Å; H268-I298 HydrophobicContact CB-CG1 4.38Å; C271-I298 HydrophobicContact CB-CG1 4.33Å; G294-I298 WeakPolarHBondContact O-CB 3.18Å; G294-I298 VanDerWaalsContact O-CG1 3.28Å; G294-I298 WeakPolarHBondContact O-CG1 3.38Å; G294-I298 PolarHBondContact O-N 3.41Å; H296-I298 PolarHBondContact O-N 2.91Å; I298-T300 PolarHBondContact O-N 2.89Å; I298-T300 VanDerWaalsContact O-N 3.08Å; I298-M301 PolarHBondContact O-N 2.84Å; I298-M301 VanDerWaalsContact O-N 3.11Å
299	R	98.7	Very high	98.4	Very high	102 Å²	102	29.4 Å²	29.4	39%	0.385	14%	0.144	S	C	.	.	H	α-helix	trans	-62.3	-19.8	-175.4	-74.8	169	76.3	177	3.9	113.3	E295 H296 F332 L333 S335 E336	E295-R299 WeakPolarHBondContact O-CB 3.36Å; E295-R299 WeakPolarHBondContact O-CD 3.44Å; E295-R299 WeakPolarHBondContact O-CG 3.18Å; E295-R299 PolarHBondContact O-N 2.8Å; H296-R299 PolarHBondContact O-N 2.89Å; R299-F332 HydrophobicContact CB-CB 4.33Å; R299-F332 PolarHBondContact NE-O 2.87Å; R299-F332 PolarHBondContact NH2-O 2.91Å; R299-L333 HydrophobicContact CB-CD2 3.89Å; R299-S335 PolarHBondContact NH2-OG 2.81Å; R299-E336 IonicContact CZ-OE1 3.47Å; R299-E336 IonicContact NH1-OE1 2.72Å; R299-E336 PolarHBondContact NH1-OE1 2.88Å
300	T	98.8	Very high	98.3	Very high	13 Å²	13	29.4 Å²	29.4	8%	0.08	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.9	0.8	177.8	66.4	0	0	0	0	114.3	H296 I298 L302 F327 L333	H296-T300 PolarHBondContact O-N 2.96Å; H296-T300 PolarHBondContact O-OG1 2.98Å; I298-T300 PolarHBondContact O-N 2.89Å; I298-T300 VanDerWaalsContact O-N 3.08Å; T300-L302 PolarHBondContact O-N 2.94Å; T300-F327 HydrophobicContact CG2-CD2 4.01Å; T300-F327 WeakPolarHBondContact OG1-CD2 3.21Å; T300-L333 HydrophobicContact CG2-CD1 3.66Å; T300-L333 HydrophobicContact CG2-CG 3.91Å
301	M	98.7	Very high	98.2	Very high	80 Å²	80	31.2 Å²	31.2	39%	0.394	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.3	47.1	-174.3	-62	-170.2	70.9	0	0	112.9	G270 L297 I298 A303 R304 E305	G270-M301 CarbonylContact O-C 3.45Å; G270-M301 VanDerWaalsContact O-O 3.14Å; L297-M301 PolarHBondContact O-N 3.05Å; L297-M301 VanDerWaalsContact O-N 3.13Å; I298-M301 PolarHBondContact O-N 2.84Å; I298-M301 VanDerWaalsContact O-N 3.11Å; M301-A303 VanDerWaalsContact C-N 3.33Å; M301-A303 PolarHBondContact O-N 3.28Å; M301-A303 VanDerWaalsContact O-N 3.15Å; M301-R304 PolarHBondContact O-N 2.79Å; M301-E305 PolarHBondContact O-N 2.79Å; M301-E305 VanDerWaalsContact O-N 3.14Å
302	L	98.8	Very high	98.1	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-58.9	-39.1	-158	-170.3	62.5	0	0	0	113.8	T290 L297 T300 R304 E305 C306 M323 F327 V343	T290-L302 HydrophobicContact CG2-CB 4.48Å; L297-L302 HydrophobicContact CD2-CB 4.03Å; L297-L302 HydrophobicContact CD2-CD2 3.34Å; L297-L302 HydrophobicContact CD2-CG 4.31Å; L297-L302 PolarHBondContact O-N 2.95Å; T300-L302 PolarHBondContact O-N 2.94Å; L302-R304 PolarHBondContact O-N 3.05Å; L302-E305 PolarHBondContact O-N 3.01Å; L302-C306 WeakPolarHBondContact O-CB 3.42Å; L302-C306 PolarHBondContact O-N 2.88Å; L302-C306 PolarHBondContact O-SG 3.45Å; L302-C306 VanDerWaalsContact O-SG 3.35Å; L302-M323 HydrophobicContact CD1-SD 4.2Å; L302-M323 HydrophobicContact CD2-SD 4.11Å; L302-F327 HydrophobicContact CD1-CB 3.87Å; L302-F327 HydrophobicContact CD1-CD2 3.97Å; L302-F327 HydrophobicContact CD1-CG 3.99Å; L302-F327 HydrophobicContact CD2-CD1 4.28Å; L302-F327 HydrophobicContact CD2-CD2 3.95Å; L302-F327 HydrophobicContact CD2-CE1 4.32Å; L302-F327 HydrophobicContact CD2-CE2 4Å; L302-F327 HydrophobicContact CD2-CG 4.1Å; L302-F327 HydrophobicContact CD2-CZ 4.2Å; L302-F327 HydrophobicContact CG-CD2 4.45Å; L302-V343 HydrophobicContact CD2-CG1 3.54Å; L302-V343 HydrophobicContact CG-CG1 3.96Å
303	A	98.9	Very high	97.9	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-59.5	-48.8	-178.4	0	0	0	0	0	112.1	G270 C271 W274 V288 T290 M301 S307	G270-A303 PolarHBondContact O-N 2.84Å; C271-A303 WeakPolarHBondContact O-CB 3.43Å; W274-A303 HydrophobicContact CB-CB 4.13Å; V288-A303 HydrophobicContact CB-CB 4.36Å; V288-A303 HydrophobicContact CG1-CB 4.12Å; T290-A303 HydrophobicContact CG2-CB 3.79Å; M301-A303 VanDerWaalsContact C-N 3.33Å; M301-A303 PolarHBondContact O-N 3.28Å; M301-A303 VanDerWaalsContact O-N 3.15Å; A303-S307 PolarHBondContact O-N 3.08Å
304	R	98.8	Very high	97.9	Very high	115 Å²	115	46 Å²	46	43%	0.434	23%	0.229	S	C	.	.	H	α-helix	trans	-67.6	-40.1	179.3	-177.4	178.9	178.6	-113.6	-2.7	112	G270 W274 M301 L302 S307 T308	G270-R304 PolarHBondContact O-N 2.72Å; W274-R304 HydrophobicContact CD2-CB 4.12Å; W274-R304 HydrophobicContact CD2-CG 4.18Å; W274-R304 HydrophobicContact CE3-CB 3.99Å; W274-R304 HydrophobicContact CE3-CG 4.21Å; W274-R304 HydrophobicContact CH2-CG 4.09Å; W274-R304 HydrophobicContact CZ2-CG 4.1Å; W274-R304 HydrophobicContact CZ3-CB 4.27Å; W274-R304 HydrophobicContact CZ3-CG 4.15Å; M301-R304 PolarHBondContact O-N 2.79Å; L302-R304 PolarHBondContact O-N 3.05Å; R304-S307 WeakPolarHBondContact O-CB 3.47Å; R304-S307 PolarHBondContact O-N 2.99Å; R304-T308 PolarHBondContact O-N 3.27Å; R304-T308 PolarHBondContact O-OG1 2.77Å
305	E	98.7	Very high	97.9	Very high	50 Å²	50	46.1 Å²	46.1	23%	0.234	23%	0.229	C	C	.	.	H	α-helix	trans	-63.9	-43.7	179.4	-169	67.1	-169.2	0	0	111.3	M301 L302 T308 A309 K326	M301-E305 PolarHBondContact O-N 2.79Å; M301-E305 VanDerWaalsContact O-N 3.14Å; L302-E305 PolarHBondContact O-N 3.01Å; E305-T308 PolarHBondContact O-N 3.29Å; E305-A309 PolarHBondContact O-N 3.17Å; E305-K326 HydrophobicContact CG-CB 3.75Å; E305-K326 HydrophobicContact CG-CG 3.89Å; E305-K326 WeakPolarHBondContact OE1-CG 3.32Å; E305-K326 IonicContact OE1-NZ 3.89Å; E305-K326 PolarHBondContact OE1-NZ 3.16Å
306	C	98.8	Very high	97.9	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-59.8	-47.2	172	-71.6	0	0	0	0	111.1	V288 L302 T308 A309 M310 L319	V288-C306 HydrophobicContact CG1-CB 4.11Å; V288-C306 HydrophobicContact CG2-CB 4.25Å; L302-C306 WeakPolarHBondContact O-CB 3.42Å; L302-C306 PolarHBondContact O-N 2.88Å; L302-C306 PolarHBondContact O-SG 3.45Å; L302-C306 VanDerWaalsContact O-SG 3.35Å; C306-T308 PolarHBondContact O-N 3.25Å; C306-A309 PolarHBondContact O-N 2.88Å; C306-A309 VanDerWaalsContact O-N 3.13Å; C306-M310 VanDerWaalsContact O-CG 3.25Å; C306-M310 WeakPolarHBondContact O-CG 3.32Å; C306-M310 PolarHBondContact O-N 2.72Å; C306-L319 HydrophobicContact CB-CD1 4.23Å
307	S	98.6	Very high	97.9	Very high	2 Å²	2	49.5 Å²	49.5	1%	0.014	24%	0.244	C	C	.	.	H	α-helix	trans	-58.2	-37.2	178.5	-152.3	0	0	0	0	113	W274 T286 A303 R304 M310	W274-S307 VanDerWaalsContact CD1-CB 3.42Å; T286-S307 WeakPolarHBondContact CB-OG 3.27Å; T286-S307 PolarHBondContact OG1-OG 2.93Å; A303-S307 PolarHBondContact O-N 3.08Å; R304-S307 WeakPolarHBondContact O-CB 3.47Å; R304-S307 PolarHBondContact O-N 2.99Å; S307-M310 PolarHBondContact O-N 2.88Å
308	T	98.3	Very high	97.9	Very high	77 Å²	77	49.8 Å²	49.8	47%	0.472	25%	0.247	S	C	.	.	H	α-helix	trans	-67.9	-45.8	176.4	-55.7	0	0	0	0	110.7	R304 E305 C306 M310 Q311	R304-T308 PolarHBondContact O-N 3.27Å; R304-T308 PolarHBondContact O-OG1 2.77Å; E305-T308 PolarHBondContact O-N 3.29Å; C306-T308 PolarHBondContact O-N 3.25Å; T308-M310 VanDerWaalsContact C-N 3.25Å; T308-M310 PolarHBondContact O-N 2.97Å; T308-Q311 WeakPolarHBondContact O-CB 3.5Å; T308-Q311 PolarHBondContact O-N 3.41Å
309	A	98.1	Very high	97.9	Very high	21 Å²	21	47.6 Å²	47.6	17%	0.174	24%	0.236	C	C	.	.	H	α-helix	trans	-61	-35.1	177	0	0	0	0	0	112.2	E305 C306 Q311 S312 A318 A322	E305-A309 PolarHBondContact O-N 3.17Å; C306-A309 PolarHBondContact O-N 2.88Å; C306-A309 VanDerWaalsContact O-N 3.13Å; A309-Q311 PolarHBondContact O-N 2.9Å; A309-S312 WeakPolarHBondContact O-CB 3.13Å; A309-S312 PolarHBondContact O-N 2.69Å; A309-S312 VanDerWaalsContact O-N 3.1Å; A309-S312 PolarHBondContact O-OG 3.4Å; A309-A318 HydrophobicContact CB-CB 4.38Å; A309-A318 VanDerWaalsContact O-CB 3.26Å; A309-A318 WeakPolarHBondContact O-CB 3.45Å; A309-A322 HydrophobicContact CB-CB 3.84Å
310	M	97.4	Very high	97.9	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-9.7	179.3	-69.6	-42	-56.1	0	0	115.2	T286 C306 S307 T308 S312 A315 L319 V345 R347 L368	T286-M310 HydrophobicContact CG2-CB 3.69Å; C306-M310 VanDerWaalsContact O-CG 3.25Å; C306-M310 WeakPolarHBondContact O-CG 3.32Å; C306-M310 PolarHBondContact O-N 2.72Å; S307-M310 PolarHBondContact O-N 2.88Å; T308-M310 VanDerWaalsContact C-N 3.25Å; T308-M310 PolarHBondContact O-N 2.97Å; M310-S312 VanDerWaalsContact C-N 3.26Å; M310-A315 HydrophobicContact CE-CB 3.38Å; M310-L319 HydrophobicContact SD-CB 4.12Å; M310-V345 HydrophobicContact CE-CG1 4.26Å; M310-V345 HydrophobicContact CG-CG1 3.49Å; M310-V345 VanDerWaalsContact CG-CG1 3.49Å; M310-V345 HydrophobicContact SD-CG1 3.75Å; M310-R347 HydrophobicContact CE-CB 4.09Å; M310-R347 WeakPolarHBondContact O-CD 3.47Å; M310-R347 PolarHBondContact O-NH1 3.45Å; M310-L368 HydrophobicContact CE-CD1 4.28Å
311	Q	96.9	Very high	97.9	Very high	37 Å²	37	47.8 Å²	47.8	17%	0.173	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-13.7	174.9	-59.1	-58.5	-39	0	0	113.1	S283 Y284 T308 A309	S283-Q311 VanDerWaalsContact N-OE1 3.11Å; Y284-Q311 VanDerWaalsContact N-OE1 3.09Å; Y284-Q311 PolarHBondContact O-NE2 3.06Å; T308-Q311 WeakPolarHBondContact O-CB 3.5Å; T308-Q311 PolarHBondContact O-N 3.41Å; A309-Q311 PolarHBondContact O-N 2.9Å
312	S	95.6	Very high	97.9	Very high	64 Å²	64	44.2 Å²	44.2	45%	0.448	22%	0.224	S	C	.	.	S	Bend	trans	-67.7	153.8	172	-62.8	0	0	0	0	111.8	A309 M310 D314 R347	A309-S312 WeakPolarHBondContact O-CB 3.13Å; A309-S312 PolarHBondContact O-N 2.69Å; A309-S312 VanDerWaalsContact O-N 3.1Å; A309-S312 PolarHBondContact O-OG 3.4Å; M310-S312 VanDerWaalsContact C-N 3.26Å; S312-D314 PolarHBondContact O-N 3.3Å; S312-R347 PolarHBondContact O-NH1 2.94Å
313	E	92.8	Very high	97.9	Very high	175 Å²	175	44.1 Å²	44.1	82%	0.818	22%	0.224	S	C	*	.	S	Bend	trans	-59.8	-48.5	-177.2	-65.8	-171.5	163.9	0	0	113.2	A315 R347	E313-A315 PolarHBondContact O-N 3.46Å; E313-R347 PolarHBondContact O-NH1 2.91Å; E313-R347 PolarHBondContact O-NH2 3.05Å
314	D	96.8	Very high	97.8	Very high	95 Å²	95	47.9 Å²	47.9	51%	0.508	24%	0.241	S	C	.	.			trans	-86	101.2	177.9	-170.6	-30.4	0	0	0	111.2	S312 H316 Q317 A318	S312-D314 PolarHBondContact O-N 3.3Å; D314-H316 VanDerWaalsContact C-N 3.34Å; D314-H316 PolarHBondContact O-N 3.42Å; D314-H316 PolarHBondContact OD1-N 3.43Å; D314-Q317 HydrophobicContact CB-CB 4.04Å; D314-Q317 PolarHBondContact OD1-N 3.45Å; D314-A318 WeakPolarHBondContact O-CB 3.22Å; D314-A318 PolarHBondContact O-N 2.79Å
315	A	97.3	Very high	97.8	Very high	3 Å²	3	46.6 Å²	46.6	3%	0.025	24%	0.243	C	C	.	.	H	α-helix	trans	-55.9	-44.8	177.5	0	0	0	0	0	113.5	M310 E313 L319 E366 L368	M310-A315 HydrophobicContact CE-CB 3.38Å; E313-A315 PolarHBondContact O-N 3.46Å; A315-L319 WeakPolarHBondContact O-CB 3.35Å; A315-L319 PolarHBondContact O-N 3.09Å; A315-L319 VanDerWaalsContact O-N 3.08Å; A315-E366 VanDerWaalsContact CB-OE2 3.32Å; A315-E366 WeakPolarHBondContact CB-OE2 3.38Å; A315-L368 HydrophobicContact CB-CD1 4.04Å
316	H	98.3	Very high	97.8	Very high	81 Å²	81	49 Å²	49	38%	0.375	25%	0.253	S	S	.	.	H	α-helix	trans	-71.1	-48.5	-172.5	-178.7	-76	0	0	0	110.1	D314 L319 L320 L368	D314-H316 VanDerWaalsContact C-N 3.34Å; D314-H316 PolarHBondContact O-N 3.42Å; D314-H316 PolarHBondContact OD1-N 3.43Å; H316-L319 PolarHBondContact O-N 3.05Å; H316-L320 WeakPolarHBondContact O-CB 3.41Å; H316-L320 PolarHBondContact O-N 3.42Å; H316-L368 HydrophobicContact CB-CD2 4.06Å
317	Q	98.4	Very high	97.8	Very high	76 Å²	76	49 Å²	49	36%	0.355	25%	0.253	S	S	.	.	H	α-helix	trans	-64.3	-41.2	178.5	-173.3	58.5	30.1	0	0	111.5	D314 L319 L320 E321	D314-Q317 HydrophobicContact CB-CB 4.04Å; D314-Q317 PolarHBondContact OD1-N 3.45Å; Q317-L319 PolarHBondContact O-N 3.49Å; Q317-L320 WeakPolarHBondContact O-CB 3.26Å; Q317-L320 PolarHBondContact O-N 2.86Å; Q317-E321 WeakPolarHBondContact CG-OE1 3.4Å; Q317-E321 PolarHBondContact NE2-OE1 2.97Å; Q317-E321 WeakPolarHBondContact O-CG 3.24Å; Q317-E321 PolarHBondContact O-N 3.28Å
318	A	98.4	Very high	97.8	Very high	7 Å²	7	50.6 Å²	50.6	6%	0.058	26%	0.26	C	S	.	.	H	α-helix	trans	-64.4	-42.3	178.9	0	0	0	0	0	112.8	A309 D314 E321 A322	A309-A318 HydrophobicContact CB-CB 4.38Å; A309-A318 VanDerWaalsContact O-CB 3.26Å; A309-A318 WeakPolarHBondContact O-CB 3.45Å; D314-A318 WeakPolarHBondContact O-CB 3.22Å; D314-A318 PolarHBondContact O-N 2.79Å; A318-E321 PolarHBondContact O-N 3.28Å; A318-A322 WeakPolarHBondContact O-CB 3.42Å; A318-A322 PolarHBondContact O-N 3.34Å
319	L	98.7	Very high	97.8	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-67	-40.2	175.9	-177	58.7	0	0	0	111.7	C306 M310 A315 H316 Q317 A322 M323 V343 V345 L368 I407	C306-L319 HydrophobicContact CB-CD1 4.23Å; M310-L319 HydrophobicContact SD-CB 4.12Å; A315-L319 WeakPolarHBondContact O-CB 3.35Å; A315-L319 PolarHBondContact O-N 3.09Å; A315-L319 VanDerWaalsContact O-N 3.08Å; H316-L319 PolarHBondContact O-N 3.05Å; Q317-L319 PolarHBondContact O-N 3.49Å; L319-A322 PolarHBondContact O-N 2.77Å; L319-M323 HydrophobicContact CD1-CG 4.21Å; L319-M323 HydrophobicContact CG-CG 4.49Å; L319-M323 WeakPolarHBondContact O-CB 3.24Å; L319-M323 VanDerWaalsContact O-CG 3.32Å; L319-M323 WeakPolarHBondContact O-CG 3.35Å; L319-M323 PolarHBondContact O-N 3.01Å; L319-V343 HydrophobicContact CD1-CG2 4Å; L319-V345 HydrophobicContact CD1-CG2 4.02Å; L319-V345 HydrophobicContact CD2-CB 4.42Å; L319-V345 HydrophobicContact CD2-CG2 4Å; L319-L368 HydrophobicContact CD2-CB 3.7Å; L319-L368 HydrophobicContact CD2-CD2 4.25Å; L319-I407 HydrophobicContact CB-CD1 3.97Å; L319-I407 HydrophobicContact CD2-CD1 3.98Å; L319-I407 HydrophobicContact CG-CD1 3.99Å
320	L	98.6	Very high	97.8	Very high	31 Å²	31	50.2 Å²	50.2	16%	0.162	26%	0.26	C	S	.	.	H	α-helix	trans	-57	-50.8	174.9	175.9	64.3	0	0	0	111	H316 Q317 A322 M323 Q324 L405 I407	H316-L320 WeakPolarHBondContact O-CB 3.41Å; H316-L320 PolarHBondContact O-N 3.42Å; Q317-L320 WeakPolarHBondContact O-CB 3.26Å; Q317-L320 PolarHBondContact O-N 2.86Å; L320-A322 PolarHBondContact O-N 2.84Å; L320-M323 PolarHBondContact O-N 2.96Å; L320-Q324 HydrophobicContact CD1-CG 4.3Å; L320-Q324 WeakPolarHBondContact O-CB 3.46Å; L320-Q324 VanDerWaalsContact O-CG 3.32Å; L320-Q324 WeakPolarHBondContact O-CG 3.43Å; L320-Q324 PolarHBondContact O-N 3.36Å; L320-L405 HydrophobicContact CD1-CD1 3.6Å; L320-L405 HydrophobicContact CD1-CD2 3.89Å; L320-L405 HydrophobicContact CD1-CG 4.19Å; L320-I407 HydrophobicContact CB-CD1 4.26Å; L320-I407 HydrophobicContact CD1-CG2 4.28Å
321	E	98.5	Very high	97.8	Very high	89 Å²	89	55.4 Å²	55.4	42%	0.416	29%	0.294	S	S	.	.	H	α-helix	trans	-65.2	-38	179.3	-73.6	175.7	-168.5	0	0	112.6	Q317 A318 Q324 N325	Q317-E321 WeakPolarHBondContact CG-OE1 3.4Å; Q317-E321 PolarHBondContact NE2-OE1 2.97Å; Q317-E321 WeakPolarHBondContact O-CG 3.24Å; Q317-E321 PolarHBondContact O-N 3.28Å; A318-E321 PolarHBondContact O-N 3.28Å; E321-Q324 PolarHBondContact O-N 2.96Å; E321-N325 VanDerWaalsContact O-CB 3.26Å; E321-N325 WeakPolarHBondContact O-CB 3.41Å; E321-N325 PolarHBondContact O-N 2.97Å; E321-N325 PolarHBondContact O-ND2 3.45Å
322	A	98.6	Very high	97.9	Very high	4 Å²	4	60.2 Å²	60.2	3%	0.033	31%	0.314	C	S	.	.	I	π-helix	trans	-61.3	-47.6	174.1	0	0	0	0	0	111.1	A309 A318 L319 L320 Q324 K326 F327	A309-A322 HydrophobicContact CB-CB 3.84Å; A318-A322 WeakPolarHBondContact O-CB 3.42Å; A318-A322 PolarHBondContact O-N 3.34Å; L319-A322 PolarHBondContact O-N 2.77Å; L320-A322 PolarHBondContact O-N 2.84Å; A322-Q324 VanDerWaalsContact C-N 3.35Å; A322-Q324 PolarHBondContact O-N 2.88Å; A322-K326 CarbonylContact O-C 3.58Å; A322-K326 WeakPolarHBondContact O-CA 3.49Å; A322-K326 VanDerWaalsContact O-CB 3.24Å; A322-K326 WeakPolarHBondContact O-CB 3.48Å; A322-K326 PolarHBondContact O-N 3.3Å; A322-F327 PolarHBondContact O-N 2.88Å
323	M	98.7	Very high	98	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.294	C	S	.	.	I	π-helix	trans	-66.7	-34.2	178.6	-68.2	-63.6	-69.7	0	0	112.5	L302 L319 L320 F327 I328 V343 T372 L405	L302-M323 HydrophobicContact CD1-SD 4.2Å; L302-M323 HydrophobicContact CD2-SD 4.11Å; L319-M323 HydrophobicContact CD1-CG 4.21Å; L319-M323 HydrophobicContact CG-CG 4.49Å; L319-M323 WeakPolarHBondContact O-CB 3.24Å; L319-M323 VanDerWaalsContact O-CG 3.32Å; L319-M323 WeakPolarHBondContact O-CG 3.35Å; L319-M323 PolarHBondContact O-N 3.01Å; L320-M323 PolarHBondContact O-N 2.96Å; M323-F327 HydrophobicContact CE-CD1 3.88Å; M323-F327 HydrophobicContact CE-CE1 4.32Å; M323-F327 WeakPolarHBondContact O-CB 3.39Å; M323-F327 HydrophobicContact SD-CD1 4.45Å; M323-I328 WeakPolarHBondContact O-CG1 3.2Å; M323-I328 PolarHBondContact O-N 3Å; M323-V343 HydrophobicContact SD-CG1 4.28Å; M323-V343 HydrophobicContact SD-CG2 4.05Å; M323-T372 HydrophobicContact CE-CG2 4.32Å; M323-L405 HydrophobicContact CB-CD2 4.04Å
324	Q	98.3	Very high	98.2	Very high	78 Å²	78	53.2 Å²	53.2	36%	0.364	29%	0.289	S	S	.	.	I	π-helix	trans	-74.6	-59.3	176	-71.1	177.6	-23.6	0	0	111.8	L320 E321 A322 I328 S329 L405	L320-Q324 HydrophobicContact CD1-CG 4.3Å; L320-Q324 WeakPolarHBondContact O-CB 3.46Å; L320-Q324 VanDerWaalsContact O-CG 3.32Å; L320-Q324 WeakPolarHBondContact O-CG 3.43Å; L320-Q324 PolarHBondContact O-N 3.36Å; E321-Q324 PolarHBondContact O-N 2.96Å; A322-Q324 VanDerWaalsContact C-N 3.35Å; A322-Q324 PolarHBondContact O-N 2.88Å; Q324-I328 PolarHBondContact O-N 2.93Å; Q324-S329 WeakPolarHBondContact O-CB 3.48Å; Q324-S329 PolarHBondContact O-N 3.01Å; Q324-S329 PolarHBondContact O-OG 2.98Å; Q324-L405 HydrophobicContact CG-CD2 3.44Å; Q324-L405 VanDerWaalsContact CG-CD2 3.44Å
325	N	98.3	Very high	98.2	Very high	88 Å²	88	52.6 Å²	52.6	47%	0.471	29%	0.293	S	S	.	.	I	π-helix	trans	-84.9	-36.4	-166	-59.8	-34.4	0	0	0	112.4	E321	E321-N325 VanDerWaalsContact O-CB 3.26Å; E321-N325 WeakPolarHBondContact O-CB 3.41Å; E321-N325 PolarHBondContact O-N 2.97Å; E321-N325 PolarHBondContact O-ND2 3.45Å
326	K	98.4	Very high	98.1	Very high	101 Å²	101	55.6 Å²	55.6	44%	0.439	31%	0.306	S	S	.	.	I	π-helix	trans	-96.7	-13.6	-175.3	-50.1	-57.5	-168.7	96.3	0	113.3	E305 A322 S330	E305-K326 HydrophobicContact CG-CB 3.75Å; E305-K326 HydrophobicContact CG-CG 3.89Å; E305-K326 WeakPolarHBondContact OE1-CG 3.32Å; E305-K326 IonicContact OE1-NZ 3.89Å; E305-K326 PolarHBondContact OE1-NZ 3.16Å; A322-K326 CarbonylContact O-C 3.58Å; A322-K326 WeakPolarHBondContact O-CA 3.49Å; A322-K326 VanDerWaalsContact O-CB 3.24Å; A322-K326 WeakPolarHBondContact O-CB 3.48Å; A322-K326 PolarHBondContact O-N 3.3Å; K326-S330 VanDerWaalsContact O-CB 3.32Å; K326-S330 WeakPolarHBondContact O-CB 3.45Å; K326-S330 PolarHBondContact O-OG 3.42Å
327	F	98.6	Very high	97.8	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	33%	0.328	C	S	.	.	I	π-helix	trans	-116.6	-72.2	177.4	-167.3	-124.4	0	0	0	112.7	H296 L297 T300 L302 A322 M323 S329 S330 L333 V339 T372	H296-F327 HydrophobicContact CB-CE2 3.81Å; H296-F327 HydrophobicContact CB-CZ 4.01Å; L297-F327 HydrophobicContact CD2-CE2 3.97Å; L297-F327 HydrophobicContact CD2-CZ 3.92Å; T300-F327 HydrophobicContact CG2-CD2 4.01Å; T300-F327 WeakPolarHBondContact OG1-CD2 3.21Å; L302-F327 HydrophobicContact CD1-CB 3.87Å; L302-F327 HydrophobicContact CD1-CD2 3.97Å; L302-F327 HydrophobicContact CD1-CG 3.99Å; L302-F327 HydrophobicContact CD2-CD1 4.28Å; L302-F327 HydrophobicContact CD2-CD2 3.95Å; L302-F327 HydrophobicContact CD2-CE1 4.32Å; L302-F327 HydrophobicContact CD2-CE2 4Å; L302-F327 HydrophobicContact CD2-CG 4.1Å; L302-F327 HydrophobicContact CD2-CZ 4.2Å; L302-F327 HydrophobicContact CG-CD2 4.45Å; A322-F327 PolarHBondContact O-N 2.88Å; M323-F327 HydrophobicContact CE-CD1 3.88Å; M323-F327 HydrophobicContact CE-CE1 4.32Å; M323-F327 WeakPolarHBondContact O-CB 3.39Å; M323-F327 HydrophobicContact SD-CD1 4.45Å; F327-S329 PolarHBondContact O-N 3.03Å; F327-S330 WeakPolarHBondContact O-CB 3.36Å; F327-S330 PolarHBondContact O-N 2.87Å; F327-L333 HydrophobicContact CD2-CD1 4.09Å; F327-L333 HydrophobicContact CE2-CD1 4.04Å; F327-V339 HydrophobicContact CD1-CG1 3.7Å; F327-V339 HydrophobicContact CD2-CG1 4.01Å; F327-V339 HydrophobicContact CE1-CG1 3.52Å; F327-V339 HydrophobicContact CE2-CG1 3.83Å; F327-V339 HydrophobicContact CG-CG1 3.94Å; F327-V339 HydrophobicContact CZ-CG1 3.58Å; F327-T372 HydrophobicContact CD1-CG2 4.23Å; F327-T372 HydrophobicContact CE1-CG2 4.3Å
328	I	98.3	Very high	97.6	Very high	35 Å²	35	61.9 Å²	61.9	18%	0.179	34%	0.335	C	S	.	.	I	π-helix	trans	-59.8	-50.4	-176	-64.3	169.2	0	0	0	112	M323 Q324 S330 T372 L405	M323-I328 WeakPolarHBondContact O-CG1 3.2Å; M323-I328 PolarHBondContact O-N 3Å; Q324-I328 PolarHBondContact O-N 2.93Å; I328-S330 VanDerWaalsContact C-N 3.28Å; I328-S330 PolarHBondContact O-N 3.47Å; I328-T372 HydrophobicContact CD1-CG2 3.69Å; I328-T372 HydrophobicContact CG1-CG2 3.65Å; I328-L405 HydrophobicContact CD1-CB 4.21Å; I328-L405 HydrophobicContact CD1-CD2 3.86Å
329	S	98.3	Very high	97.5	Very high	84 Å²	84	61.8 Å²	61.8	59%	0.587	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	16.7	-179.1	-57.1	0	0	0	0	112.9	Q324 F327	Q324-S329 WeakPolarHBondContact O-CB 3.48Å; Q324-S329 PolarHBondContact O-N 3.01Å; Q324-S329 PolarHBondContact O-OG 2.98Å; F327-S329 PolarHBondContact O-N 3.03Å
330	S	98.6	Very high	97.5	Very high	7 Å²	7	63.6 Å²	63.6	5%	0.049	34%	0.343	C	S	.	.			trans	-62.3	128.7	-178.8	-169.3	0	0	0	0	110.7	K326 F327 I328 F332 L333 A334	K326-S330 VanDerWaalsContact O-CB 3.32Å; K326-S330 WeakPolarHBondContact O-CB 3.45Å; K326-S330 PolarHBondContact O-OG 3.42Å; F327-S330 WeakPolarHBondContact O-CB 3.36Å; F327-S330 PolarHBondContact O-N 2.87Å; I328-S330 VanDerWaalsContact C-N 3.28Å; I328-S330 PolarHBondContact O-N 3.47Å; S330-F332 PolarHBondContact O-N 2.92Å; S330-F332 VanDerWaalsContact O-N 3.13Å; S330-F332 PolarHBondContact OG-N 3.03Å; S330-L333 CarbonylContact O-C 3.55Å; S330-L333 PolarHBondContact O-N 3.02Å; S330-A334 PolarHBondContact O-N 3.38Å
331	P	98.4	Very high	97.4	Very high	109 Å²	109	62.1 Å²	62.1	71%	0.708	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-57.5	-28.7	172.5	-24.7	34.2	0	0	0	112.3	L333 A334	P331-L333 PolarHBondContact O-N 3.22Å; P331-A334 WeakPolarHBondContact O-CB 3.42Å; P331-A334 PolarHBondContact O-N 2.91Å
332	F	98.5	Very high	97.4	Very high	138 Å²	138	57.9 Å²	57.9	61%	0.605	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-66.7	-16.6	176.2	-65.9	-83.3	0	0	0	113.1	R299 S330	R299-F332 HydrophobicContact CB-CB 4.33Å; R299-F332 PolarHBondContact NE-O 2.87Å; R299-F332 PolarHBondContact NH2-O 2.91Å; S330-F332 PolarHBondContact O-N 2.92Å; S330-F332 VanDerWaalsContact O-N 3.13Å; S330-F332 PolarHBondContact OG-N 3.03Å
333	L	98.3	Very high	97.5	Very high	3 Å²	3	57.7 Å²	57.7	2%	0.016	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-119.9	15.4	179.7	-57.7	-178.9	0	0	0	112.5	H296 R299 T300 F327 S330 P331 S335 E336 V339	H296-L333 HydrophobicContact CB-CD1 3.86Å; H296-L333 HydrophobicContact CB-CD2 4.25Å; R299-L333 HydrophobicContact CB-CD2 3.89Å; T300-L333 HydrophobicContact CG2-CD1 3.66Å; T300-L333 HydrophobicContact CG2-CG 3.91Å; F327-L333 HydrophobicContact CD2-CD1 4.09Å; F327-L333 HydrophobicContact CE2-CD1 4.04Å; S330-L333 CarbonylContact O-C 3.55Å; S330-L333 PolarHBondContact O-N 3.02Å; P331-L333 PolarHBondContact O-N 3.22Å; L333-S335 PolarHBondContact O-N 2.94Å; L333-E336 HydrophobicContact CB-CG 4.11Å; L333-E336 HydrophobicContact CD2-CG 4.16Å; L333-E336 WeakPolarHBondContact O-CB 3.22Å; L333-E336 PolarHBondContact O-N 3Å; L333-V339 HydrophobicContact CB-CG2 3.97Å; L333-V339 HydrophobicContact CD1-CB 4.43Å; L333-V339 HydrophobicContact CD1-CG1 3.55Å; L333-V339 HydrophobicContact CD1-CG2 4.05Å
334	A	97.1	Very high	97.5	Very high	88 Å²	88	57.7 Å²	57.7	73%	0.727	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-20	-177.9	0	0	0	0	0	114	S330 P331	S330-A334 PolarHBondContact O-N 3.38Å; P331-A334 WeakPolarHBondContact O-CB 3.42Å; P331-A334 PolarHBondContact O-N 2.91Å
335	S	95.8	Very high	97.5	Very high	82 Å²	82	54 Å²	54	57%	0.573	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-11.5	175.4	55.2	0	0	0	0	114.2	R299 L333	R299-S335 PolarHBondContact NH2-OG 2.81Å; L333-S335 PolarHBondContact O-N 2.94Å
336	E	95.4	Very high	97.5	Very high	67 Å²	67	49.8 Å²	49.8	31%	0.313	27%	0.274	S	S	.	.			trans	-91.8	127	-173.6	-50.7	-51.6	136.3	0	0	110.6	H296 R299 L333 R338 V339	H296-E336 IonicContact NE2-OE2 3.58Å; R299-E336 IonicContact CZ-OE1 3.47Å; R299-E336 IonicContact NH1-OE1 2.72Å; R299-E336 PolarHBondContact NH1-OE1 2.88Å; L333-E336 HydrophobicContact CB-CG 4.11Å; L333-E336 HydrophobicContact CD2-CG 4.16Å; L333-E336 WeakPolarHBondContact O-CB 3.22Å; L333-E336 PolarHBondContact O-N 3Å; E336-R338 PolarHBondContact O-N 2.79Å; E336-V339 HydrophobicContact CB-CG2 4.49Å
337	D	91.8	Very high	97.5	Very high	154 Å²	154	45.2 Å²	45.2	82%	0.824	25%	0.254	S	S	*	.	S	Bend	trans	-65	-28.6	178.3	-69.5	-29.5	0	0	0	112.8
338	R	93.8	Very high	97.3	Very high	134 Å²	134	45.3 Å²	45.3	51%	0.506	26%	0.255	S	S	.	.	S	Bend	trans	-144.8	122.1	-178.5	-67.7	-174.8	-176.4	-171.7	2.7	110.6	H296 E336 L340 P401	H296-R338 PolarHBondContact CE1-O 2.84Å; E336-R338 PolarHBondContact O-N 2.79Å; R338-L340 HydrophobicContact CB-CD2 4.47Å; R338-L340 HydrophobicContact CB-CG 4.4Å; R338-L340 PolarHBondContact O-N 2.81Å; R338-P401 WeakPolarHBondContact CD-O 3.32Å
339	V	97.4	Very high	96.8	Very high	5 Å²	5	45.2 Å²	45.2	3%	0.03	26%	0.257	C	S	.	.			trans	-93.3	98.3	178.7	177.5	0	0	0	0	110.2	F327 L333 E336 T372 G402	F327-V339 HydrophobicContact CD1-CG1 3.7Å; F327-V339 HydrophobicContact CD2-CG1 4.01Å; F327-V339 HydrophobicContact CE1-CG1 3.52Å; F327-V339 HydrophobicContact CE2-CG1 3.83Å; F327-V339 HydrophobicContact CG-CG1 3.94Å; F327-V339 HydrophobicContact CZ-CG1 3.58Å; L333-V339 HydrophobicContact CB-CG2 3.97Å; L333-V339 HydrophobicContact CD1-CB 4.43Å; L333-V339 HydrophobicContact CD1-CG1 3.55Å; L333-V339 HydrophobicContact CD1-CG2 4.05Å; E336-V339 HydrophobicContact CB-CG2 4.49Å; V339-T372 VanDerWaalsContact O-CB 3.25Å; V339-T372 WeakPolarHBondContact O-CB 3.39Å; V339-T372 PolarHBondContact O-OG1 3.26Å; V339-G402 PolarHBondContact N-O 2.88Å; V339-G402 WeakPolarHBondContact O-CA 3.4Å
340	L	97.6	Very high	96	Very high	39 Å²	39	48 Å²	48	20%	0.204	26%	0.255	C	S	.	.			trans	-98.8	116.7	-175.2	-59.2	176.7	0	0	0	113.1	L232 C293 H296 R338 T372 T373 P401	L232-L340 HydrophobicContact CD1-CB 4.06Å; L232-L340 HydrophobicContact CD1-CD1 3.74Å; C293-L340 HydrophobicContact CB-CB 4.35Å; C293-L340 WeakPolarHBondContact CB-O 3.48Å; C293-L340 PolarHBondContact N-O 3.07Å; H296-L340 PolarHBondContact ND1-N 2.8Å; H296-L340 PolarHBondContact ND1-O 2.85Å; R338-L340 HydrophobicContact CB-CD2 4.47Å; R338-L340 HydrophobicContact CB-CG 4.4Å; R338-L340 PolarHBondContact O-N 2.81Å; L340-T372 WeakPolarHBondContact CA-OG1 3.4Å; L340-T373 HydrophobicContact CB-CG2 4.13Å; L340-T373 HydrophobicContact CD2-CG2 4.4Å; L340-P401 HydrophobicContact CD2-CB 4.46Å
341	G	97.9	Very high	94.4	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.5	167.9	175.6	0	0	0	0	0	113	S291 H371 T372	S291-G341 CarbonylContact O-C 3.56Å; S291-G341 VanDerWaalsContact O-CA 3.31Å; S291-G341 WeakPolarHBondContact O-CA 3.27Å; G341-H371 CarbonylContact O-C 3.6Å; G341-H371 VanDerWaalsContact O-CA 3.29Å; G341-H371 WeakPolarHBondContact O-CA 3.43Å; G341-T372 PolarHBondContact N-OG1 3.21Å; G341-T372 PolarHBondContact O-N 2.91Å; G341-T372 PolarHBondContact O-OG1 3.1Å
342	G	98.5	Very high	92.4	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	157.6	173.6	0	0	0	0	0	111.4	T290 S291 S370	T290-G342 CarbonylContact C-O 3.58Å; T290-G342 WeakPolarHBondContact CA-O 3.43Å; S291-G342 PolarHBondContact N-O 3.44Å; S291-G342 PolarHBondContact O-N 3.24Å; G342-S370 CarbonylContact C-O 3.54Å; G342-S370 WeakPolarHBondContact CA-O 3.17Å
343	V	98.9	Very high	90	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	144.9	-175.2	-56.8	0	0	0	0	110.2	V288 S289 T290 L302 L319 M323 V345 W369 S370	V288-V343 HydrophobicContact CG1-CB 4.46Å; S289-V343 WeakPolarHBondContact O-CA 3.28Å; T290-V343 HydrophobicContact CG2-CG1 3.84Å; L302-V343 HydrophobicContact CD2-CG1 3.54Å; L302-V343 HydrophobicContact CG-CG1 3.96Å; L319-V343 HydrophobicContact CD1-CG2 4Å; M323-V343 HydrophobicContact SD-CG1 4.28Å; M323-V343 HydrophobicContact SD-CG2 4.05Å; V343-V345 HydrophobicContact CB-CG2 4.43Å; V343-V345 HydrophobicContact CG2-CG2 4.02Å; V343-W369 VanDerWaalsContact O-CA 3.27Å; V343-W369 WeakPolarHBondContact O-CA 3.26Å; V343-S370 PolarHBondContact N-O 3.47Å; V343-S370 PolarHBondContact O-N 2.91Å
344	I	98.9	Very high	87.5	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	141.4	157	58.8	173.7	0	0	0	108.6	L45 H47 V238 V288 S289 W369 M376 V378	L45-I344 HydrophobicContact CD1-CG2 4.31Å; L45-I344 HydrophobicContact CD2-CB 3.64Å; L45-I344 HydrophobicContact CD2-CG2 4.04Å; L45-I344 HydrophobicContact CG-CB 3.86Å; L45-I344 HydrophobicContact CG-CD1 4.08Å; L45-I344 HydrophobicContact CG-CG2 4Å; L45-I344 VanDerWaalsContact O-CD1 3.32Å; L45-I344 WeakPolarHBondContact O-CD1 3.42Å; H47-I344 HydrophobicContact CB-CD1 4.47Å; H47-I344 HydrophobicContact CB-CG2 3.93Å; V238-I344 HydrophobicContact CG1-CD1 4.28Å; V238-I344 HydrophobicContact CG1-CG1 4.19Å; V238-I344 HydrophobicContact CG2-CD1 4.07Å; V238-I344 HydrophobicContact CG2-CG1 4.31Å; V288-I344 WeakPolarHBondContact CA-O 3.47Å; S289-I344 PolarHBondContact N-O 3.15Å; S289-I344 PolarHBondContact O-N 2.93Å; I344-W369 HydrophobicContact CG2-CB 4.1Å; I344-M376 HydrophobicContact CG2-CE 3.69Å; I344-V378 HydrophobicContact CG2-CG1 4.02Å
345	V	98.8	Very high	85	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	136.6	-175.7	-178.7	0	0	0	0	109.2	A287 V288 M310 L319 V343 F367 L368	A287-V345 WeakPolarHBondContact O-CA 3.36Å; V288-V345 HydrophobicContact CG1-CG2 4.18Å; V288-V345 HydrophobicContact CG2-CG1 4.27Å; V288-V345 HydrophobicContact CG2-CG2 4.21Å; M310-V345 HydrophobicContact CE-CG1 4.26Å; M310-V345 HydrophobicContact CG-CG1 3.49Å; M310-V345 VanDerWaalsContact CG-CG1 3.49Å; M310-V345 HydrophobicContact SD-CG1 3.75Å; L319-V345 HydrophobicContact CD1-CG2 4.02Å; L319-V345 HydrophobicContact CD2-CB 4.42Å; L319-V345 HydrophobicContact CD2-CG2 4Å; V343-V345 HydrophobicContact CB-CG2 4.43Å; V343-V345 HydrophobicContact CG2-CG2 4.02Å; V345-F367 WeakPolarHBondContact O-CA 3.41Å; V345-L368 PolarHBondContact N-O 3.48Å; V345-L368 PolarHBondContact O-N 2.95Å
346	L	98.6	Very high	82.5	Confident	0 Å²	0	59 Å²	59	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	130.8	169.8	-175.6	156.6	0	0	0	108.1	F43 V238 V240 V246 T286 A287 C348 V365	F43-L346 HydrophobicContact CD1-CD1 3.77Å; F43-L346 HydrophobicContact CE1-CD1 4.48Å; V238-L346 HydrophobicContact CB-CB 4.1Å; V238-L346 HydrophobicContact CG2-CB 3.59Å; V238-L346 HydrophobicContact CG2-CD1 4.31Å; V240-L346 HydrophobicContact CB-CD1 4.08Å; V240-L346 HydrophobicContact CB-CD2 3.82Å; V240-L346 HydrophobicContact CG1-CD1 3.82Å; V240-L346 HydrophobicContact CG1-CD2 4.03Å; V240-L346 HydrophobicContact CG1-CG 4.5Å; V246-L346 HydrophobicContact CG1-CD2 3.89Å; T286-L346 CarbonylContact C-O 3.37Å; T286-L346 WeakPolarHBondContact CA-O 3.32Å; A287-L346 HydrophobicContact CB-CB 4.49Å; A287-L346 PolarHBondContact N-O 2.99Å; A287-L346 PolarHBondContact O-N 2.96Å; L346-C348 HydrophobicContact CD2-CB 4.14Å; L346-V365 HydrophobicContact CD1-CG1 4.14Å; L346-V365 HydrophobicContact CD2-CG1 4.21Å; L346-V365 HydrophobicContact CG-CG1 3.85Å
347	R	97.2	Very high	80.2	Confident	4 Å²	4	58.4 Å²	58.4	2%	0.015	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	133.9	171.9	-177.3	173.9	79.5	169.1	4.9	109.1	Y284 S285 T286 M310 S312 E313 V365 E366	Y284-R347 HydrophobicContact CD1-CG 3.78Å; Y284-R347 HydrophobicContact CG-CG 3.83Å; S285-R347 CarbonylContact O-C 3.52Å; S285-R347 WeakPolarHBondContact O-CA 3.31Å; T286-R347 HydrophobicContact CG2-CB 4.38Å; T286-R347 HydrophobicContact CG2-CG 4.1Å; M310-R347 HydrophobicContact CE-CB 4.09Å; M310-R347 WeakPolarHBondContact O-CD 3.47Å; M310-R347 PolarHBondContact O-NH1 3.45Å; S312-R347 PolarHBondContact O-NH1 2.94Å; E313-R347 PolarHBondContact O-NH1 2.91Å; E313-R347 PolarHBondContact O-NH2 3.05Å; R347-V365 CarbonylContact O-C 3.5Å; R347-V365 WeakPolarHBondContact O-CA 3.26Å; R347-E366 HydrophobicContact CB-CB 4.33Å; R347-E366 IonicContact CZ-OE1 3.37Å; R347-E366 IonicContact CZ-OE2 3.14Å; R347-E366 PolarHBondContact N-O 3.48Å; R347-E366 IonicContact NE-OE1 2.74Å; R347-E366 PolarHBondContact NE-OE1 3.07Å; R347-E366 IonicContact NE-OE2 3.02Å; R347-E366 IonicContact NH2-OE1 2.75Å; R347-E366 PolarHBondContact NH2-OE1 3.08Å; R347-E366 IonicContact NH2-OE2 2.87Å; R347-E366 PolarHBondContact NH2-OE2 3.5Å; R347-E366 PolarHBondContact O-N 3.46Å
348	C	94.9	Very high	78.2	Confident	2 Å²	2	56.4 Å²	56.4	1%	0.014	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	133.4	-179.5	179.2	0	0	0	0	110.8	V240 S285 L346 M364 V365	V240-C348 HydrophobicContact CG2-CB 4.08Å; S285-C348 PolarHBondContact N-O 2.59Å; S285-C348 PolarHBondContact O-N 3.27Å; L346-C348 HydrophobicContact CD2-CB 4.14Å; C348-M364 VanDerWaalsContact CA-O 3.31Å; C348-M364 WeakPolarHBondContact CA-O 3.34Å; C348-V365 HydrophobicContact CB-CG2 4.38Å
349	C	89.1	Confident	76	Confident	33 Å²	33	54.8 Å²	54.8	22%	0.223	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	149.5	165.3	59.9	0	0	0	0	110.4	Y284 A363 M364	Y284-C349 HydrophobicContact CD1-CB 3.72Å; Y284-C349 HydrophobicContact CE1-CB 3.99Å; C349-A363 WeakPolarHBondContact O-CA 3.39Å; C349-M364 PolarHBondContact N-O 3.23Å; C349-M364 VanDerWaalsContact N-O 3.08Å; C349-M364 PolarHBondContact O-N 2.95Å
350	R	81.4	Confident	73.9	Confident	144 Å²	144	58.7 Å²	58.7	54%	0.543	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	128.9	171.4	-67	-174.8	-179.8	-179.1	1.6	108.6	E243 V352	E243-R350 PolarHBondContact O-NE 3.13Å; E243-R350 PolarHBondContact O-NH2 3.33Å; R350-V352 PolarHBondContact O-N 3.02Å
351	C	64.5	Low	72.1	Confident	42 Å²	42	62.4 Å²	62.4	28%	0.284	35%	0.35	S	S	.	.			trans	-72.4	121.4	173.5	-61.7	0	0	0	0	108.8	A362	C351-A362 HydrophobicContact CB-CB 4.37Å; C351-A362 VanDerWaalsContact CB-O 3.29Å; C351-A362 WeakPolarHBondContact CB-O 3.38Å; C351-A362 PolarHBondContact N-O 3.32Å
352	V	55.8	Low	70.9	Confident	141 Å²	141	62.9 Å²	62.9	86%	0.855	35%	0.354	S	S	*	.			trans	-90.9	100.6	165.8	-171.8	0	0	0	0	106.5	R350	R350-V352 PolarHBondContact O-N 3.02Å
353	E	48.5	Very low	70.3	Confident	98 Å²	98	63.4 Å²	63.4	46%	0.458	36%	0.359	S	S	.	.			trans	-67.8	136.8	174.2	-72.9	-171.9	161.7	0	0	110.3	Q355 S357	E353-Q355 PolarHBondContact O-N 3.48Å; E353-Q355 VanDerWaalsContact O-N 3.14Å; E353-S357 PolarHBondContact OE2-OG 3.1Å
354	A	45.8	Very low	70	Confident	104 Å²	104	66.5 Å²	66.5	86%	0.86	37%	0.374	S	S	*	.	S	Bend	trans	-65.6	-11.1	177.9	0	0	0	0	0	113.8
355	Q	43.5	Very low	69.9	Low	160 Å²	160	66.5 Å²	66.5	75%	0.748	37%	0.374	S	S	*	.	S	Bend	trans	-131	107.1	168.5	-70.8	-71.2	-23.7	0	0	105.9	E353 S357	E353-Q355 PolarHBondContact O-N 3.48Å; E353-Q355 VanDerWaalsContact O-N 3.14Å; Q355-S357 PolarHBondContact O-N 2.95Å
356	P	44.4	Very low	69.8	Low	112 Å²	112	68.2 Å²	68.2	73%	0.727	38%	0.382	S	S	*	.			trans	-68.3	98.1	-179.5	26.1	-30.7	0	0	0	108.4	P358	P356-P358 WeakPolarHBondContact O-CD 3.35Å
357	S	46.3	Very low	69.8	Low	55 Å²	55	68.8 Å²	68.8	39%	0.385	38%	0.384	S	S	.	.			trans	-66.1	118.7	157.6	60.6	0	0	0	0	106.1	E353 Q355 N359	E353-S357 PolarHBondContact OE2-OG 3.1Å; Q355-S357 PolarHBondContact O-N 2.95Å; S357-N359 PolarHBondContact O-N 3.26Å
358	P	49.6	Very low	69.9	Low	111 Å²	111	69 Å²	69	72%	0.721	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-5.5	-165.3	20.1	-30.4	0	0	0	114.9	P356	P356-P358 WeakPolarHBondContact O-CD 3.35Å
359	N	48.9	Very low	70.1	Confident	101 Å²	101	69.3 Å²	69.3	54%	0.54	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.3	-1.6	-162.9	-65.3	2.6	0	0	0	115.3	S357 V418	S357-N359 PolarHBondContact O-N 3.26Å; N359-V418 PolarHBondContact O-N 3.23Å
360	I	52.5	Low	70.6	Confident	87 Å²	87	67.8 Å²	67.8	45%	0.446	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	105.3	-177.9	-53.7	178	0	0	0	110.8
361	Q	61.1	Low	71.4	Confident	116 Å²	116	60.9 Å²	60.9	54%	0.542	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	108.5	160.6	-80.6	-174.8	-2.3	0	0	108.3	G416 V418	Q361-G416 PolarHBondContact O-N 2.99Å; Q361-V418 HydrophobicContact CB-CG2 4.42Å; Q361-V418 HydrophobicContact CG-CG2 4.37Å
362	A	72.4	Confident	73	Confident	10 Å²	10	58.9 Å²	58.9	8%	0.083	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	133	171.1	0	0	0	0	0	109.9	C351 R413 L414	C351-A362 HydrophobicContact CB-CB 4.37Å; C351-A362 VanDerWaalsContact CB-O 3.29Å; C351-A362 WeakPolarHBondContact CB-O 3.38Å; C351-A362 PolarHBondContact N-O 3.32Å; A362-R413 HydrophobicContact CB-CG 4.27Å; A362-L414 CarbonylContact C-O 3.43Å; A362-L414 VanDerWaalsContact CA-O 3.29Å; A362-L414 WeakPolarHBondContact CA-O 3.48Å
363	A	85.1	Confident	75	Confident	11 Å²	11	52.3 Å²	52.3	9%	0.091	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	136.5	168.4	0	0	0	0	0	109.4	C349 L414	C349-A363 WeakPolarHBondContact O-CA 3.39Å; A363-L414 HydrophobicContact CB-CB 4.28Å; A363-L414 PolarHBondContact N-O 2.88Å; A363-L414 PolarHBondContact O-N 3.36Å
364	M	92.5	Very high	77.2	Confident	65 Å²	65	51 Å²	51	32%	0.32	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	122.7	172.1	-171.2	177.2	-57.1	0	0	108.3	C348 C349	C348-M364 VanDerWaalsContact CA-O 3.31Å; C348-M364 WeakPolarHBondContact CA-O 3.34Å; C349-M364 PolarHBondContact N-O 3.23Å; C349-M364 VanDerWaalsContact N-O 3.08Å; C349-M364 PolarHBondContact O-N 2.95Å
365	V	96.4	Very high	79.6	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	120	176.3	-177.7	0	0	0	0	108.4	F43 V240 L346 R347 C348 V411 C412 L414	F43-V365 HydrophobicContact CB-CG1 4.37Å; F43-V365 HydrophobicContact CD1-CG1 4Å; F43-V365 HydrophobicContact CG-CG1 4.2Å; V240-V365 HydrophobicContact CG1-CG1 4.37Å; V240-V365 HydrophobicContact CG1-CG2 3.82Å; L346-V365 HydrophobicContact CD1-CG1 4.14Å; L346-V365 HydrophobicContact CD2-CG1 4.21Å; L346-V365 HydrophobicContact CG-CG1 3.85Å; R347-V365 CarbonylContact O-C 3.5Å; R347-V365 WeakPolarHBondContact O-CA 3.26Å; C348-V365 HydrophobicContact CB-CG2 4.38Å; V365-V411 CarbonylContact O-C 3.33Å; V365-V411 VanDerWaalsContact O-CA 3.31Å; V365-V411 WeakPolarHBondContact O-CA 3.25Å; V365-C412 HydrophobicContact CB-CB 4.35Å; V365-C412 PolarHBondContact N-O 3.42Å; V365-C412 PolarHBondContact O-N 2.84Å; V365-L414 HydrophobicContact CG2-CD1 3.54Å; V365-L414 HydrophobicContact CG2-CG 3.77Å
366	E	98.3	Very high	82.2	Confident	37 Å²	37	38.4 Å²	38.4	17%	0.173	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	132.5	165.2	-72.5	164.7	-80.7	0	0	108	A315 R347 L368 V411	A315-E366 VanDerWaalsContact CB-OE2 3.32Å; A315-E366 WeakPolarHBondContact CB-OE2 3.38Å; R347-E366 HydrophobicContact CB-CB 4.33Å; R347-E366 IonicContact CZ-OE1 3.37Å; R347-E366 IonicContact CZ-OE2 3.14Å; R347-E366 PolarHBondContact N-O 3.48Å; R347-E366 IonicContact NE-OE1 2.74Å; R347-E366 PolarHBondContact NE-OE1 3.07Å; R347-E366 IonicContact NE-OE2 3.02Å; R347-E366 IonicContact NH2-OE1 2.75Å; R347-E366 PolarHBondContact NH2-OE1 3.08Å; R347-E366 IonicContact NH2-OE2 2.87Å; R347-E366 PolarHBondContact NH2-OE2 3.5Å; R347-E366 PolarHBondContact O-N 3.46Å; E366-L368 HydrophobicContact CB-CD1 4.45Å; E366-V411 HydrophobicContact CG-CG1 3.91Å
367	F	98.7	Very high	84.7	Confident	11 Å²	11	33 Å²	33	5%	0.048	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	133.3	-179.9	63.3	-89.4	0	0	0	109.5	F43 L45 V345 W369 Y380 G409 G410 C412	F43-F367 HydrophobicContact CE1-CB 3.67Å; F43-F367 AromaticContact CE1-CD1 3.77Å; F43-F367 HydrophobicContact CE1-CD1 3.77Å; F43-F367 HydrophobicContact CE1-CD2 4.31Å; F43-F367 AromaticContact CE1-CG 3.66Å; F43-F367 HydrophobicContact CE1-CG 3.66Å; F43-F367 AromaticContact CE2-CD1 3.91Å; F43-F367 HydrophobicContact CE2-CD1 3.91Å; F43-F367 AromaticContact CE2-CE1 3.88Å; F43-F367 HydrophobicContact CE2-CE1 3.88Å; F43-F367 HydrophobicContact CE2-CG 4.46Å; F43-F367 HydrophobicContact CE2-CZ 4.43Å; F43-F367 HydrophobicContact CZ-CB 4Å; F43-F367 AromaticContact CZ-CD1 3.27Å; F43-F367 HydrophobicContact CZ-CD1 3.27Å; F43-F367 AromaticContact CZ-CD2 3.86Å; F43-F367 HydrophobicContact CZ-CD2 3.86Å; F43-F367 AromaticContact CZ-CE1 3.59Å; F43-F367 HydrophobicContact CZ-CE1 3.59Å; F43-F367 HydrophobicContact CZ-CE2 4.14Å; F43-F367 AromaticContact CZ-CG 3.42Å; F43-F367 HydrophobicContact CZ-CG 3.42Å; F43-F367 VanDerWaalsContact CZ-CG 3.42Å; F43-F367 HydrophobicContact CZ-CZ 4.01Å; L45-F367 HydrophobicContact CD2-CB 4.17Å; V345-F367 WeakPolarHBondContact O-CA 3.41Å; F367-W369 HydrophobicContact CD2-CZ3 4.01Å; F367-W369 AromaticContact CE2-CZ3 3.94Å; F367-W369 HydrophobicContact CE2-CZ3 3.94Å; F367-Y380 HydrophobicContact CE2-CD1 4.24Å; F367-Y380 AromaticContact CE2-CD2 3.85Å; F367-Y380 HydrophobicContact CE2-CD2 3.85Å; F367-Y380 HydrophobicContact CE2-CE1 4.31Å; F367-Y380 AromaticContact CE2-CE2 3.89Å; F367-Y380 HydrophobicContact CE2-CE2 3.89Å; F367-Y380 HydrophobicContact CE2-CG 4.03Å; F367-Y380 AromaticContact CZ-CD2 3.94Å; F367-Y380 HydrophobicContact CZ-CD2 3.94Å; F367-Y380 AromaticContact CZ-CE2 3.84Å; F367-Y380 HydrophobicContact CZ-CE2 3.84Å; F367-G409 CarbonylContact O-C 3.54Å; F367-G409 WeakPolarHBondContact O-CA 3.33Å; F367-G410 WeakPolarHBondContact CD1-O 3.29Å; F367-G410 VanDerWaalsContact CE1-C 3.43Å; F367-G410 PolarHBondContact N-O 2.75Å; F367-G410 PolarHBondContact O-N 3.25Å; F367-C412 HydrophobicContact CE1-CB 4.24Å
368	L	98.9	Very high	87.2	Confident	9 Å²	9	30.4 Å²	30.4	5%	0.047	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	155.3	-175.2	-60.1	94.3	0	0	0	110.2	L45 M310 A315 H316 L319 V345 E366 I407 E408	L45-L368 WeakPolarHBondContact CD2-O 3.48Å; M310-L368 HydrophobicContact CE-CD1 4.28Å; A315-L368 HydrophobicContact CB-CD1 4.04Å; H316-L368 HydrophobicContact CB-CD2 4.06Å; L319-L368 HydrophobicContact CD2-CB 3.7Å; L319-L368 HydrophobicContact CD2-CD2 4.25Å; V345-L368 PolarHBondContact N-O 3.48Å; V345-L368 PolarHBondContact O-N 2.95Å; E366-L368 HydrophobicContact CB-CD1 4.45Å; L368-I407 HydrophobicContact CD2-CD1 4.26Å; L368-E408 WeakPolarHBondContact CA-O 3.39Å
369	W	98.9	Very high	89.6	Confident	9 Å²	9	25.1 Å²	25.1	3%	0.034	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	144.4	163.3	57.1	86.9	0	0	0	109.5	L45 V343 I344 F367 V378 Y380 S393 I407 E408	L45-W369 HydrophobicContact CD1-CE3 4.29Å; V343-W369 VanDerWaalsContact O-CA 3.27Å; V343-W369 WeakPolarHBondContact O-CA 3.26Å; I344-W369 HydrophobicContact CG2-CB 4.1Å; F367-W369 HydrophobicContact CD2-CZ3 4.01Å; F367-W369 AromaticContact CE2-CZ3 3.94Å; F367-W369 HydrophobicContact CE2-CZ3 3.94Å; W369-V378 HydrophobicContact CB-CG1 4Å; W369-V378 HydrophobicContact CD2-CG1 4.31Å; W369-V378 HydrophobicContact CD2-CG2 3.88Å; W369-V378 HydrophobicContact CE3-CG2 4.12Å; W369-V378 HydrophobicContact CG-CG1 3.97Å; W369-V378 HydrophobicContact CG-CG2 4.32Å; W369-V378 HydrophobicContact CZ2-CG2 4.29Å; W369-V378 HydrophobicContact CZ3-CG2 4.44Å; W369-Y380 HydrophobicContact CH2-CE1 4.02Å; W369-Y380 HydrophobicContact CZ3-CD1 4.16Å; W369-Y380 HydrophobicContact CZ3-CE1 4.06Å; W369-S393 PolarHBondContact NE1-OG 3.49Å; W369-I407 WeakPolarHBondContact O-CA 3.26Å; W369-E408 HydrophobicContact CD2-CB 4.43Å; W369-E408 HydrophobicContact CH2-CB 4.43Å; W369-E408 HydrophobicContact CZ2-CB 3.57Å; W369-E408 HydrophobicContact CZ2-CG 4.41Å; W369-E408 PolarHBondContact N-O 2.91Å; W369-E408 PolarHBondContact NE1-OE1 2.93Å; W369-E408 PolarHBondContact O-N 3.38Å
370	S	98.8	Very high	92	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	144.6	174.5	-176.9	0	0	0	0	110.7	G342 V343 A406	G342-S370 CarbonylContact C-O 3.54Å; G342-S370 WeakPolarHBondContact CA-O 3.17Å; V343-S370 PolarHBondContact N-O 3.47Å; V343-S370 PolarHBondContact O-N 2.91Å; S370-A406 CarbonylContact C-O 3.55Å; S370-A406 WeakPolarHBondContact CA-O 3.39Å; S370-A406 WeakPolarHBondContact CB-O 3.4Å; S370-A406 PolarHBondContact OG-O 2.79Å
371	H	98.6	Very high	94.1	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	154	177.6	66.4	85.2	0	0	0	112.6	G341 T373 M376 S393 L405 A406	G341-H371 CarbonylContact O-C 3.6Å; G341-H371 VanDerWaalsContact O-CA 3.29Å; G341-H371 WeakPolarHBondContact O-CA 3.43Å; H371-T373 PolarHBondContact CE1-O 2.9Å; H371-T373 VanDerWaalsContact CE1-O 3.23Å; H371-T373 PolarHBondContact ND1-O 2.76Å; H371-T373 PolarHBondContact ND1-OG1 3.06Å; H371-M376 HydrophobicContact CB-CB 4.19Å; H371-M376 HydrophobicContact CB-SD 4.06Å; H371-M376 WeakPolarHBondContact CD2-CB 3.37Å; H371-S393 WeakPolarHBondContact NE2-CB 3.47Å; H371-S393 PolarHBondContact NE2-OG 2.77Å; H371-S393 VanDerWaalsContact NE2-OG 3.17Å; H371-L405 CarbonylContact O-C 3.54Å; H371-L405 VanDerWaalsContact O-CA 3.22Å; H371-L405 WeakPolarHBondContact O-CA 3.22Å; H371-A406 PolarHBondContact N-O 3.35Å; H371-A406 PolarHBondContact O-N 2.78Å
372	T	98.3	Very high	95.8	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	6%	0.062	C	C	.	.	S	Bend	trans	-104.8	-7.5	173	61.8	0	0	0	0	112.6	M323 F327 I328 V339 L340 G341 P401 G402 S404 L405	M323-T372 HydrophobicContact CE-CG2 4.32Å; F327-T372 HydrophobicContact CD1-CG2 4.23Å; F327-T372 HydrophobicContact CE1-CG2 4.3Å; I328-T372 HydrophobicContact CD1-CG2 3.69Å; I328-T372 HydrophobicContact CG1-CG2 3.65Å; V339-T372 VanDerWaalsContact O-CB 3.25Å; V339-T372 WeakPolarHBondContact O-CB 3.39Å; V339-T372 PolarHBondContact O-OG1 3.26Å; L340-T372 WeakPolarHBondContact CA-OG1 3.4Å; G341-T372 PolarHBondContact N-OG1 3.21Å; G341-T372 PolarHBondContact O-N 2.91Å; G341-T372 PolarHBondContact O-OG1 3.1Å; T372-P401 CarbonylContact O-C 3.6Å; T372-P401 WeakPolarHBondContact O-CA 3.49Å; T372-G402 PolarHBondContact O-N 3.09Å; T372-S404 WeakPolarHBondContact CA-O 3.43Å; T372-S404 WeakPolarHBondContact CB-O 3.5Å; T372-L405 HydrophobicContact CG2-CB 4.03Å
373	T	96.9	Very high	96.9	Very high	2 Å²	2	12.5 Å²	12.5	1%	0.012	6%	0.06	C	C	.	.	S	Bend	trans	-73.9	167.5	174.3	56.1	0	0	0	0	111.1	A50 G51 L340 H371 S375 L395	A50-T373 HydrophobicContact CB-CG2 4.15Å; G51-T373 PolarHBondContact N-OG1 3.02Å; L340-T373 HydrophobicContact CB-CG2 4.13Å; L340-T373 HydrophobicContact CD2-CG2 4.4Å; H371-T373 PolarHBondContact CE1-O 2.9Å; H371-T373 VanDerWaalsContact CE1-O 3.23Å; H371-T373 PolarHBondContact ND1-O 2.76Å; H371-T373 PolarHBondContact ND1-OG1 3.06Å; T373-S375 PolarHBondContact O-N 3.24Å; T373-S375 VanDerWaalsContact O-N 3.17Å; T373-S375 PolarHBondContact OG1-O 3.34Å; T373-L395 VanDerWaalsContact O-CD1 3.27Å; T373-L395 WeakPolarHBondContact O-CD1 3.46Å; T373-L395 WeakPolarHBondContact O-CG 3.32Å
374	E	95.4	Very high	97.1	Very high	70 Å²	70	16 Å²	16	33%	0.327	8%	0.075	S	C	.	.	S	Bend	trans	-54.9	-36.9	178	-73.5	-177	-129.5	0	0	113.3	G51 Y52 R394 L395 P401	G51-E374 PolarHBondContact O-N 2.81Å; Y52-E374 HydrophobicContact CD2-CB 4.27Å; Y52-E374 WeakPolarHBondContact CD2-OE2 3.45Å; Y52-E374 WeakPolarHBondContact CE2-OE2 3.31Å; E374-R394 WeakPolarHBondContact O-CA 3.33Å; E374-L395 PolarHBondContact O-N 3.49Å; E374-L395 VanDerWaalsContact O-N 3.16Å; E374-P401 HydrophobicContact CB-CG 4.49Å; E374-P401 HydrophobicContact CG-CB 3.99Å; E374-P401 HydrophobicContact CG-CG 3.38Å
375	S	96.4	Very high	97	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	162.8	-179.2	52.7	0	0	0	0	112.7	G51 H53 T373 S393	G51-S375 PolarHBondContact N-O 2.69Å; G51-S375 PolarHBondContact O-N 3.22Å; G51-S375 PolarHBondContact O-OG 3.08Å; G51-S375 VanDerWaalsContact O-OG 3.09Å; H53-S375 PolarHBondContact N-OG 2.93Å; H53-S375 PolarHBondContact ND1-OG 3.23Å; T373-S375 PolarHBondContact O-N 3.24Å; T373-S375 VanDerWaalsContact O-N 3.17Å; T373-S375 PolarHBondContact OG1-O 3.34Å; S375-S393 CarbonylContact C-O 3.58Å; S375-S393 WeakPolarHBondContact CA-O 3.32Å; S375-S393 WeakPolarHBondContact CB-O 3.17Å
376	M	97.7	Very high	96.7	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	128.4	171.7	-173.1	173.7	-177.5	0	0	110.2	H47 G49 A50 I344 H371 V378 S393	H47-M376 HydrophobicContact CB-CE 3.44Å; H47-M376 VanDerWaalsContact CB-CE 3.44Å; G49-M376 WeakPolarHBondContact O-CA 3.41Å; G49-M376 WeakPolarHBondContact O-CG 3.3Å; A50-M376 HydrophobicContact CB-CB 4.31Å; A50-M376 HydrophobicContact CB-CG 4.04Å; A50-M376 HydrophobicContact CB-SD 4.13Å; I344-M376 HydrophobicContact CG2-CE 3.69Å; H371-M376 HydrophobicContact CB-CB 4.19Å; H371-M376 HydrophobicContact CB-SD 4.06Å; H371-M376 WeakPolarHBondContact CD2-CB 3.37Å; M376-V378 HydrophobicContact CE-CG1 4.46Å; M376-V378 HydrophobicContact CG-CG1 4.15Å; M376-V378 HydrophobicContact SD-CG1 4.49Å; M376-S393 PolarHBondContact N-O 2.61Å; M376-S393 PolarHBondContact O-N 2.95Å
377	C	98.1	Very high	96.5	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	125.4	174.6	-172.8	0	0	0	0	110.2	H47 A48 G49 Y61 C65 I392	H47-C377 CarbonylContact C-O 3.55Å; H47-C377 WeakPolarHBondContact CA-O 3.24Å; H47-C377 WeakPolarHBondContact CB-O 3.4Å; A48-C377 HydrophobicContact CB-CB 4.31Å; A48-C377 PolarHBondContact N-O 2.98Å; G49-C377 PolarHBondContact O-N 3.21Å; Y61-C377 VanDerWaalsContact C-SG 3.54Å; C65-C377 VanDerWaalsContact SG-SG 3.69Å; C377-I392 HydrophobicContact CB-CD1 3.5Å; C377-I392 VanDerWaalsContact CB-CD1 3.5Å; C377-I392 VanDerWaalsContact SG-CD1 3.51Å
378	V	98.8	Very high	96.5	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	151.7	178.7	-60.4	0	0	0	0	111.5	L45 V46 H47 I344 W369 M376 T390 H391	L45-V378 HydrophobicContact CD1-CB 4.3Å; V46-V378 CarbonylContact O-C 3.47Å; V46-V378 VanDerWaalsContact O-CA 3.27Å; V46-V378 WeakPolarHBondContact O-CA 3.25Å; H47-V378 HydrophobicContact CB-CG1 4.43Å; I344-V378 HydrophobicContact CG2-CG1 4.02Å; W369-V378 HydrophobicContact CB-CG1 4Å; W369-V378 HydrophobicContact CD2-CG1 4.31Å; W369-V378 HydrophobicContact CD2-CG2 3.88Å; W369-V378 HydrophobicContact CE3-CG2 4.12Å; W369-V378 HydrophobicContact CG-CG1 3.97Å; W369-V378 HydrophobicContact CG-CG2 4.32Å; W369-V378 HydrophobicContact CZ2-CG2 4.29Å; W369-V378 HydrophobicContact CZ3-CG2 4.44Å; M376-V378 HydrophobicContact CE-CG1 4.46Å; M376-V378 HydrophobicContact CG-CG1 4.15Å; M376-V378 HydrophobicContact SD-CG1 4.49Å; V378-T390 WeakPolarHBondContact O-CA 3.28Å; V378-H391 HydrophobicContact CG2-CB 3.95Å; V378-H391 PolarHBondContact N-O 3Å; V378-H391 PolarHBondContact O-N 2.81Å
379	G	98.8	Very high	96.4	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	146	168.2	0	0	0	0	0	110.5	L45 V46 C69 K389	L45-G379 CarbonylContact C-O 3.56Å; L45-G379 WeakPolarHBondContact CA-O 3.41Å; L45-G379 WeakPolarHBondContact CD1-O 3.32Å; V46-G379 PolarHBondContact N-O 3.31Å; V46-G379 PolarHBondContact O-N 2.97Å; C69-G379 PolarHBondContact SG-O 3.35Å; C69-G379 VanDerWaalsContact SG-O 3.38Å; G379-K389 CarbonylContact C-O 3.52Å; G379-K389 WeakPolarHBondContact CA-O 3.36Å
380	Y	98.8	Very high	96.4	Very high	44 Å²	44	32.4 Å²	32.4	17%	0.173	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	154.6	178.5	59.4	-87.9	0	0	0	111.6	F43 V44 L45 C69 F367 W369 K389	F43-Y380 HydrophobicContact CE2-CD2 4.26Å; F43-Y380 HydrophobicContact CZ-CD2 4.04Å; F43-Y380 HydrophobicContact CZ-CG 4.27Å; V44-Y380 CarbonylContact O-C 3.44Å; V44-Y380 WeakPolarHBondContact O-CA 3.49Å; V44-Y380 WeakPolarHBondContact O-CB 3.36Å; L45-Y380 HydrophobicContact CD1-CD1 4.45Å; C69-Y380 PolarHBondContact SG-N 2.98Å; F367-Y380 HydrophobicContact CE2-CD1 4.24Å; F367-Y380 AromaticContact CE2-CD2 3.85Å; F367-Y380 HydrophobicContact CE2-CD2 3.85Å; F367-Y380 HydrophobicContact CE2-CE1 4.31Å; F367-Y380 AromaticContact CE2-CE2 3.89Å; F367-Y380 HydrophobicContact CE2-CE2 3.89Å; F367-Y380 HydrophobicContact CE2-CG 4.03Å; F367-Y380 AromaticContact CZ-CD2 3.94Å; F367-Y380 HydrophobicContact CZ-CD2 3.94Å; F367-Y380 AromaticContact CZ-CE2 3.84Å; F367-Y380 HydrophobicContact CZ-CE2 3.84Å; W369-Y380 HydrophobicContact CH2-CE1 4.02Å; W369-Y380 HydrophobicContact CZ3-CD1 4.16Å; W369-Y380 HydrophobicContact CZ3-CE1 4.06Å; Y380-K389 HydrophobicContact CD1-CB 4.48Å; Y380-K389 HydrophobicContact CD2-CB 4.33Å; Y380-K389 HydrophobicContact CD2-CD 4.45Å; Y380-K389 HydrophobicContact CE1-CB 3.99Å; Y380-K389 HydrophobicContact CE2-CB 3.84Å; Y380-K389 HydrophobicContact CE2-CD 3.5Å; Y380-K389 VanDerWaalsContact CE2-CD 3.5Å; Y380-K389 HydrophobicContact CE2-CG 4.25Å; Y380-K389 PolarHBondContact N-O 3.35Å; Y380-K389 PolarHBondContact O-N 3.39Å; Y380-K389 WeakPolarHBondContact OH-CD 3.33Å
381	M	98.3	Very high	96.4	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	133	-177.4	-168.2	174.9	171.4	0	0	110.8	V44 C69 V73 D385 A388	V44-M381 HydrophobicContact CG1-CB 4.07Å; V44-M381 PolarHBondContact N-O 2.94Å; V44-M381 PolarHBondContact O-N 2.85Å; C69-M381 HydrophobicContact CB-CB 3.86Å; C69-M381 HydrophobicContact CB-SD 4.49Å; V73-M381 HydrophobicContact CB-CE 4.37Å; V73-M381 HydrophobicContact CB-SD 4.16Å; V73-M381 HydrophobicContact CG1-CE 3.98Å; V73-M381 HydrophobicContact CG1-SD 4.41Å; V73-M381 HydrophobicContact CG2-CB 4.02Å; V73-M381 HydrophobicContact CG2-CE 4.45Å; V73-M381 HydrophobicContact CG2-CG 3.87Å; V73-M381 HydrophobicContact CG2-SD 3.91Å; M381-D385 VanDerWaalsContact CE-O 3.24Å; M381-D385 WeakPolarHBondContact CE-O 3.44Å; M381-D385 HydrophobicContact CG-CB 4.33Å; M381-A388 HydrophobicContact CB-CB 3.9Å; M381-A388 HydrophobicContact CG-CB 4.12Å; M381-A388 HydrophobicContact SD-CB 3.8Å
382	S	96.9	Very high	96.3	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	146.7	162	177.6	0	0	0	0	110.1	Q384 D385	S382-Q384 PolarHBondContact O-N 3.3Å; S382-Q384 VanDerWaalsContact O-N 3.1Å; S382-Q384 PolarHBondContact OG-N 2.84Å; S382-D385 WeakPolarHBondContact CB-OD2 3.31Å; S382-D385 PolarHBondContact N-OD2 2.97Å; S382-D385 WeakPolarHBondContact O-CB 3.44Å; S382-D385 PolarHBondContact O-N 3.44Å
383	A	94	Very high	96.3	Very high	4 Å²	4	36.3 Å²	36.3	3%	0.033	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-19.3	170.9	0	0	0	0	0	112.8	A40 G42 V73 R77	A40-A383 WeakPolarHBondContact O-CB 3.47Å; G42-A383 PolarHBondContact O-N 2.98Å; V73-A383 HydrophobicContact CG1-CB 4.21Å; R77-A383 HydrophobicContact CG-CB 4.47Å; R77-A383 PolarHBondContact NE-O 3.18Å; R77-A383 VanDerWaalsContact NE-O 3.09Å; R77-A383 PolarHBondContact NH2-O 2.98Å
384	Q	89.9	Confident	96.4	Very high	86 Å²	86	41 Å²	41	40%	0.402	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-16.6	174.6	-57.9	176.8	-6	0	0	113.1	S382	S382-Q384 PolarHBondContact O-N 3.3Å; S382-Q384 VanDerWaalsContact O-N 3.1Å; S382-Q384 PolarHBondContact OG-N 2.84Å
385	D	90.6	Very high	96.4	Very high	54 Å²	54	38.7 Å²	38.7	29%	0.289	19%	0.191	S	C	.	.			trans	-80.5	146.3	178.7	-68	-31.3	0	0	0	111	R77 M381 S382	R77-D385 PolarHBondContact NH2-O 2.63Å; M381-D385 VanDerWaalsContact CE-O 3.24Å; M381-D385 WeakPolarHBondContact CE-O 3.44Å; M381-D385 HydrophobicContact CG-CB 4.33Å; S382-D385 WeakPolarHBondContact CB-OD2 3.31Å; S382-D385 PolarHBondContact N-OD2 2.97Å; S382-D385 WeakPolarHBondContact O-CB 3.44Å; S382-D385 PolarHBondContact O-N 3.44Å
386	S	89.6	Confident	96.3	Very high	106 Å²	106	41.8 Å²	41.8	74%	0.741	21%	0.211	S	C	*	.	S	Bend	trans	-79	-20	173.8	59.6	0	0	0	0	113.3
387	K	94.1	Very high	96	Very high	149 Å²	149	48.3 Å²	48.3	65%	0.648	25%	0.254	S	S	*	.	S	Bend	trans	-148.6	138.2	-174.8	-65.6	-179.4	-177.6	172.6	0	111.4
388	A	97.9	Very high	95.7	Very high	13 Å²	13	52.5 Å²	52.5	11%	0.107	30%	0.297	C	S	.	.			trans	-65.7	145.3	168.5	0	0	0	0	0	111.9	K66 C69 M381	K66-A388 HydrophobicContact CG-CB 4.07Å; C69-A388 HydrophobicContact CB-CB 3.61Å; M381-A388 HydrophobicContact CB-CB 3.9Å; M381-A388 HydrophobicContact CG-CB 4.12Å; M381-A388 HydrophobicContact SD-CB 3.8Å
389	K	98.6	Very high	95.5	Very high	110 Å²	110	54.9 Å²	54.9	48%	0.478	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	144.2	172.1	-66.7	168.4	-175	166.6	0	108.8	G379 Y380	G379-K389 CarbonylContact C-O 3.52Å; G379-K389 WeakPolarHBondContact CA-O 3.36Å; Y380-K389 HydrophobicContact CD1-CB 4.48Å; Y380-K389 HydrophobicContact CD2-CB 4.33Å; Y380-K389 HydrophobicContact CD2-CD 4.45Å; Y380-K389 HydrophobicContact CE1-CB 3.99Å; Y380-K389 HydrophobicContact CE2-CB 3.84Å; Y380-K389 HydrophobicContact CE2-CD 3.5Å; Y380-K389 VanDerWaalsContact CE2-CD 3.5Å; Y380-K389 HydrophobicContact CE2-CG 4.25Å; Y380-K389 PolarHBondContact N-O 3.35Å; Y380-K389 PolarHBondContact O-N 3.39Å; Y380-K389 WeakPolarHBondContact OH-CD 3.33Å
390	T	98.6	Very high	95.2	Very high	43 Å²	43	57.5 Å²	57.5	26%	0.264	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	138.1	-177.9	60.1	0	0	0	0	110.9	K62 C65 K66 V378	K62-T390 WeakPolarHBondContact O-CG2 3.36Å; C65-T390 HydrophobicContact CB-CG2 4.25Å; K66-T390 HydrophobicContact CB-CG2 3.85Å; V378-T390 WeakPolarHBondContact O-CA 3.28Å
391	H	98.1	Very high	95	Very high	66 Å²	66	56.6 Å²	56.6	31%	0.306	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	148.4	-173.1	-176.5	71.3	0	0	0	110.4	V378 S393 E408	V378-H391 HydrophobicContact CG2-CB 3.95Å; V378-H391 PolarHBondContact N-O 3Å; V378-H391 PolarHBondContact O-N 2.81Å; H391-S393 PolarHBondContact CD2-N 2.98Å; H391-S393 VanDerWaalsContact CD2-N 3.28Å; H391-S393 WeakPolarHBondContact NE2-CA 3.05Å; H391-S393 PolarHBondContact NE2-N 2.82Å; H391-E408 IonicContact CD2-OE1 3.79Å; H391-E408 IonicContact NE2-OE1 3.83Å; H391-E408 PolarHBondContact NE2-OE1 3.43Å; H391-E408 IonicContact NE2-OE2 2.76Å
392	I	97.7	Very high	94.9	Very high	15 Å²	15	56.8 Å²	56.8	8%	0.077	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	98.6	169.6	-62.2	-80.4	0	0	0	104.2	H53 A58 K62 C377 R394	H53-I392 HydrophobicContact CB-CD1 4.21Å; H53-I392 HydrophobicContact CB-CG2 4.26Å; A58-I392 HydrophobicContact CB-CD1 4.43Å; A58-I392 HydrophobicContact CB-CG1 4.31Å; K62-I392 HydrophobicContact CD-CG1 4.36Å; K62-I392 HydrophobicContact CG-CD1 4.38Å; K62-I392 HydrophobicContact CG-CG1 4.15Å; C377-I392 HydrophobicContact CB-CD1 3.5Å; C377-I392 VanDerWaalsContact CB-CD1 3.5Å; C377-I392 VanDerWaalsContact SG-CD1 3.51Å; I392-R394 HydrophobicContact CG2-CG 4.12Å
393	S	98.1	Very high	94.7	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	139.8	174.3	-169.6	0	0	0	0	108.1	W369 H371 S375 M376 H391 E408	W369-S393 PolarHBondContact NE1-OG 3.49Å; H371-S393 WeakPolarHBondContact NE2-CB 3.47Å; H371-S393 PolarHBondContact NE2-OG 2.77Å; H371-S393 VanDerWaalsContact NE2-OG 3.17Å; S375-S393 CarbonylContact C-O 3.58Å; S375-S393 WeakPolarHBondContact CA-O 3.32Å; S375-S393 WeakPolarHBondContact CB-O 3.17Å; M376-S393 PolarHBondContact N-O 2.61Å; M376-S393 PolarHBondContact O-N 2.95Å; H391-S393 PolarHBondContact CD2-N 2.98Å; H391-S393 VanDerWaalsContact CD2-N 3.28Å; H391-S393 WeakPolarHBondContact NE2-CA 3.05Å; H391-S393 PolarHBondContact NE2-N 2.82Å; S393-E408 WeakPolarHBondContact CB-OE1 3.13Å; S393-E408 PolarHBondContact OG-OE1 2.87Å
394	R	97.3	Very high	94.8	Very high	100 Å²	100	64 Å²	64	38%	0.377	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	146.6	-178.3	-63.6	-167.5	179.5	-77	2.3	108.7	H53 E374 I392	H53-R394 PolarHBondContact O-NH1 3.47Å; H53-R394 PolarHBondContact O-NH2 3.37Å; E374-R394 WeakPolarHBondContact O-CA 3.33Å; I392-R394 HydrophobicContact CG2-CG 4.12Å
395	L	96.7	Very high	95.1	Very high	22 Å²	22	61.2 Å²	61.2	12%	0.115	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-60.4	146.3	171.2	-70.2	175.6	0	0	0	111	T373 E374 T399 P401 A406	T373-L395 VanDerWaalsContact O-CD1 3.27Å; T373-L395 WeakPolarHBondContact O-CD1 3.46Å; T373-L395 WeakPolarHBondContact O-CG 3.32Å; E374-L395 PolarHBondContact O-N 3.49Å; E374-L395 VanDerWaalsContact O-N 3.16Å; L395-T399 WeakPolarHBondContact CB-OG1 3.4Å; L395-P401 HydrophobicContact CD1-CB 4.05Å; L395-P401 HydrophobicContact CD1-CG 3.98Å; L395-A406 HydrophobicContact CD2-CB 4.03Å
396	P	93.7	Very high	95.5	Very high	66 Å²	66	59.1 Å²	59.1	43%	0.429	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-58.5	148.9	176.8	-23.9	33.4	0	0	0	112.4	G398 T399	P396-G398 PolarHBondContact O-N 3.03Å; P396-T399 HydrophobicContact CB-CG2 4.01Å; P396-T399 HydrophobicContact CG-CG2 4.34Å; P396-T399 WeakPolarHBondContact O-CB 3.49Å; P396-T399 PolarHBondContact O-N 2.91Å; P396-T399 PolarHBondContact O-OG1 2.95Å
397	P	92.4	Very high	95.9	Very high	137 Å²	137	55.5 Å²	55.5	89%	0.89	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	135.9	175.2	-24.7	33.9	0	0	0	112.1
398	G	91.9	Very high	96.1	Very high	88 Å²	88	51.8 Å²	51.8	91%	0.907	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.7	1	178.5	0	0	0	0	0	115.5	P396	P396-G398 PolarHBondContact O-N 3.03Å
399	T	93.5	Very high	96.2	Very high	49 Å²	49	53.1 Å²	53.1	30%	0.301	32%	0.316	S	S	.	.			trans	-91.6	161.4	174.6	63.2	0	0	0	0	112.4	L395 P396	L395-T399 WeakPolarHBondContact CB-OG1 3.4Å; P396-T399 HydrophobicContact CB-CG2 4.01Å; P396-T399 HydrophobicContact CG-CG2 4.34Å; P396-T399 WeakPolarHBondContact O-CB 3.49Å; P396-T399 PolarHBondContact O-N 2.91Å; P396-T399 PolarHBondContact O-OG1 2.95Å
400	V	92.9	Very high	96.1	Very high	56 Å²	56	49.3 Å²	49.3	34%	0.339	31%	0.307	S	S	.	.			trans	-108.8	122.1	-177.5	-178.5	0	0	0	0	110	G402 Q403 S404	V400-G402 PolarHBondContact O-N 2.91Å; V400-Q403 HydrophobicContact CB-CB 4.3Å; V400-Q403 HydrophobicContact CG1-CG 4.29Å; V400-Q403 PolarHBondContact O-N 2.82Å; V400-Q403 VanDerWaalsContact O-N 3.12Å; V400-S404 PolarHBondContact O-N 2.83Å
401	P	94.9	Very high	96	Very high	25 Å²	25	52.4 Å²	52.4	16%	0.162	33%	0.326	C	S	.	.	B	Isolated β-bridge	trans	-55.6	131.7	174.2	-24.2	32.8	0	0	0	112	R338 L340 T372 E374 L395 Q403	R338-P401 WeakPolarHBondContact CD-O 3.32Å; L340-P401 HydrophobicContact CD2-CB 4.46Å; T372-P401 CarbonylContact O-C 3.6Å; T372-P401 WeakPolarHBondContact O-CA 3.49Å; E374-P401 HydrophobicContact CB-CG 4.49Å; E374-P401 HydrophobicContact CG-CB 3.99Å; E374-P401 HydrophobicContact CG-CG 3.38Å; L395-P401 HydrophobicContact CD1-CB 4.05Å; L395-P401 HydrophobicContact CD1-CG 3.98Å; P401-Q403 VanDerWaalsContact C-N 3.33Å
402	G	95.1	Very high	95.9	Very high	3 Å²	3	50.3 Å²	50.3	3%	0.031	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.6	-1.8	-178.7	0	0	0	0	0	115.7	V339 T372 V400	V339-G402 PolarHBondContact N-O 2.88Å; V339-G402 WeakPolarHBondContact O-CA 3.4Å; T372-G402 PolarHBondContact O-N 3.09Å; V400-G402 PolarHBondContact O-N 2.91Å
403	Q	94.3	Very high	95.6	Very high	119 Å²	119	56.8 Å²	56.8	56%	0.556	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.2	-17.9	174.6	-61.6	-176.9	-7	0	0	112.7	V400 P401	V400-Q403 HydrophobicContact CB-CB 4.3Å; V400-Q403 HydrophobicContact CG1-CG 4.29Å; V400-Q403 PolarHBondContact O-N 2.82Å; V400-Q403 VanDerWaalsContact O-N 3.12Å; P401-Q403 VanDerWaalsContact C-N 3.33Å
404	S	95.6	Very high	95	Very high	38 Å²	38	57 Å²	57	27%	0.266	34%	0.343	S	S	.	.	B	Isolated β-bridge	trans	-123.1	168	174.5	-52.5	0	0	0	0	109.5	T372 V400	T372-S404 WeakPolarHBondContact CA-O 3.43Å; T372-S404 WeakPolarHBondContact CB-O 3.5Å; V400-S404 PolarHBondContact O-N 2.83Å
405	L	96.6	Very high	93.9	Very high	26 Å²	26	57.2 Å²	57.2	14%	0.136	35%	0.35	C	S	.	.			trans	-134.1	154.9	175	71.6	98.9	0	0	0	111.5	L320 M323 Q324 I328 H371 T372 I407	L320-L405 HydrophobicContact CD1-CD1 3.6Å; L320-L405 HydrophobicContact CD1-CD2 3.89Å; L320-L405 HydrophobicContact CD1-CG 4.19Å; M323-L405 HydrophobicContact CB-CD2 4.04Å; Q324-L405 HydrophobicContact CG-CD2 3.44Å; Q324-L405 VanDerWaalsContact CG-CD2 3.44Å; I328-L405 HydrophobicContact CD1-CB 4.21Å; I328-L405 HydrophobicContact CD1-CD2 3.86Å; H371-L405 CarbonylContact O-C 3.54Å; H371-L405 VanDerWaalsContact O-CA 3.22Å; H371-L405 WeakPolarHBondContact O-CA 3.22Å; T372-L405 HydrophobicContact CG2-CB 4.03Å; L405-I407 HydrophobicContact CD1-CB 4Å; L405-I407 HydrophobicContact CD1-CG2 3.98Å
406	A	98.2	Very high	92.2	Very high	10 Å²	10	56.8 Å²	56.8	8%	0.083	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	146.4	162.2	0	0	0	0	0	108.9	S370 H371 L395	S370-A406 CarbonylContact C-O 3.55Å; S370-A406 WeakPolarHBondContact CA-O 3.39Å; S370-A406 WeakPolarHBondContact CB-O 3.4Å; S370-A406 PolarHBondContact OG-O 2.79Å; H371-A406 PolarHBondContact N-O 3.35Å; H371-A406 PolarHBondContact O-N 2.78Å; L395-A406 HydrophobicContact CD2-CB 4.03Å
407	I	98.4	Very high	89.8	Confident	31 Å²	31	60.7 Å²	60.7	16%	0.159	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	132.5	173.4	-177.8	169	0	0	0	108.2	L319 L320 L368 W369 L405	L319-I407 HydrophobicContact CB-CD1 3.97Å; L319-I407 HydrophobicContact CD2-CD1 3.98Å; L319-I407 HydrophobicContact CG-CD1 3.99Å; L320-I407 HydrophobicContact CB-CD1 4.26Å; L320-I407 HydrophobicContact CD1-CG2 4.28Å; L368-I407 HydrophobicContact CD2-CD1 4.26Å; W369-I407 WeakPolarHBondContact O-CA 3.26Å; L405-I407 HydrophobicContact CD1-CB 4Å; L405-I407 HydrophobicContact CD1-CG2 3.98Å
408	E	98.7	Very high	87.6	Confident	70 Å²	70	57.4 Å²	57.4	33%	0.327	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	163.6	174.4	-57.4	167.2	-107.4	0	0	108.4	L368 W369 H391 S393	L368-E408 WeakPolarHBondContact CA-O 3.39Å; W369-E408 HydrophobicContact CD2-CB 4.43Å; W369-E408 HydrophobicContact CH2-CB 4.43Å; W369-E408 HydrophobicContact CZ2-CB 3.57Å; W369-E408 HydrophobicContact CZ2-CG 4.41Å; W369-E408 PolarHBondContact N-O 2.91Å; W369-E408 PolarHBondContact NE1-OE1 2.93Å; W369-E408 PolarHBondContact O-N 3.38Å; H391-E408 IonicContact CD2-OE1 3.79Å; H391-E408 IonicContact NE2-OE1 3.83Å; H391-E408 PolarHBondContact NE2-OE1 3.43Å; H391-E408 IonicContact NE2-OE2 2.76Å; S393-E408 WeakPolarHBondContact CB-OE1 3.13Å; S393-E408 PolarHBondContact OG-OE1 2.87Å
409	G	98.1	Very high	85.2	Confident	42 Å²	42	61.6 Å²	61.6	43%	0.433	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.7	-172.2	178.4	0	0	0	0	0	113	F367	F367-G409 CarbonylContact O-C 3.54Å; F367-G409 WeakPolarHBondContact O-CA 3.33Å
410	G	98	Very high	84.8	Confident	29 Å²	29	62.2 Å²	62.2	30%	0.299	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.6	-177.8	177.3	0	0	0	0	0	112.4	F367	F367-G410 WeakPolarHBondContact CD1-O 3.29Å; F367-G410 VanDerWaalsContact CE1-C 3.43Å; F367-G410 PolarHBondContact N-O 2.75Å; F367-G410 PolarHBondContact O-N 3.25Å
411	V	96.9	Very high	84.3	Confident	108 Å²	108	62.5 Å²	62.5	66%	0.655	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.4	144.9	178.4	-63.4	0	0	0	0	110.4	V365 E366	V365-V411 CarbonylContact O-C 3.33Å; V365-V411 VanDerWaalsContact O-CA 3.31Å; V365-V411 WeakPolarHBondContact O-CA 3.25Å; E366-V411 HydrophobicContact CG-CG1 3.91Å
412	C	94.3	Very high	83.8	Confident	23 Å²	23	64.6 Å²	64.6	16%	0.155	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	131.3	172.7	-175.5	0	0	0	0	108.7	F43 V365 F367	F43-C412 HydrophobicContact CD2-CB 3.93Å; F43-C412 HydrophobicContact CE2-CB 4.01Å; V365-C412 HydrophobicContact CB-CB 4.35Å; V365-C412 PolarHBondContact N-O 3.42Å; V365-C412 PolarHBondContact O-N 2.84Å; F367-C412 HydrophobicContact CE1-CB 4.24Å
413	R	91	Very high	83.1	Confident	150 Å²	150	68.2 Å²	68.2	57%	0.566	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.3	116.7	171.1	-176.1	175	-72.7	170.8	-4	108.3	A362	A362-R413 HydrophobicContact CB-CG 4.27Å
414	L	86.3	Confident	82.4	Confident	4 Å²	4	65.1 Å²	65.1	2%	0.021	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	130.2	171.2	-60.6	-178.4	0	0	0	108.8	G42 F43 V240 A362 A363 V365	G42-L414 WeakPolarHBondContact O-CD2 3.29Å; F43-L414 HydrophobicContact CB-CD1 4.33Å; F43-L414 HydrophobicContact CB-CD2 4.26Å; V240-L414 HydrophobicContact CG1-CD1 3.84Å; A362-L414 CarbonylContact C-O 3.43Å; A362-L414 VanDerWaalsContact CA-O 3.29Å; A362-L414 WeakPolarHBondContact CA-O 3.48Å; A363-L414 HydrophobicContact CB-CB 4.28Å; A363-L414 PolarHBondContact N-O 2.88Å; A363-L414 PolarHBondContact O-N 3.36Å; V365-L414 HydrophobicContact CG2-CD1 3.54Å; V365-L414 HydrophobicContact CG2-CG 3.77Å
415	M	74.4	Confident	81.5	Confident	105 Å²	105	66.9 Å²	66.9	52%	0.517	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	114.8	171.2	-59.5	-169.4	177.9	0	0	107.5
416	G	60.8	Low	80.4	Confident	13 Å²	13	69.8 Å²	69.8	13%	0.134	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	130.4	164.9	0	0	0	0	0	109.6	Q361	Q361-G416 PolarHBondContact O-N 2.99Å
417	M	42.8	Very low	79.1	Confident	148 Å²	148	74.4 Å²	74.4	73%	0.729	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.5	123.6	163.5	-75.3	-177.5	161.4	0	0	108.1
418	V	46.7	Very low	77.4	Confident	68 Å²	68	78 Å²	78	41%	0.412	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-94.5	133	166.2	-172.5	0	0	0	0	107.4	N359 Q361	N359-V418 PolarHBondContact O-N 3.23Å; Q361-V418 HydrophobicContact CB-CG2 4.42Å; Q361-V418 HydrophobicContact CG-CG2 4.37Å
419	D	41.2	Very low	75.5	Confident	176 Å²	176	78.7 Å²	78.7	94%	0.941	44%	0.442	S	S	*	.			trans	-70.6	0	171.3	-84	-4.8	0	0	0	111.5	K38	K38-D419 WeakPolarHBondContact CE-OD1 3.31Å; K38-D419 VanDerWaalsContact CE-OD2 3.22Å; K38-D419 WeakPolarHBondContact CE-OD2 3.37Å; K38-D419 VanDerWaalsContact NZ-CG 3.29Å; K38-D419 IonicContact NZ-OD1 3.49Å; K38-D419 PolarHBondContact NZ-OD1 2.87Å; K38-D419 IonicContact NZ-OD2 2.61Å; K38-D419 PolarHBondContact NZ-OD2 3.14Å

Retrieved 419 of 419 residues in 80 ms (Link to these results)

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