A0A087YPJ8_POEFO Loading...

T-box transcription factor 5a

AlphaFold DB , UniProt , Accession A0A087YPJ8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 525 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.4	Very low	34.3	Very low	239 Å²	239	148.5 Å²	148.5	100%	1.177	79%	0.792	S	S	*	*				0	105	0	-70.7	164	171.4	0	0	106.7
2	A	35.2	Very low	34	Very low	73 Å²	73	149 Å²	149	60%	0.603	80%	0.795	S	S	*	*			cis	62.2	129.1	8.9	0	0	0	0	0	115.8
3	D	37.5	Very low	34.1	Very low	150 Å²	150	146.5 Å²	146.5	80%	0.802	80%	0.796	S	S	*	*			cis	-132.9	-133.2	-14.6	-78.6	-51.4	0	0	0	108.5
4	Q	38.4	Very low	35.1	Very low	147 Å²	147	144.9 Å²	144.9	69%	0.687	80%	0.797	S	S	*	*			cis	-164	166.4	2.3	-161.4	157.9	-6.2	0	0	111.1
5	E	37.6	Very low	34.8	Very low	141 Å²	141	140.7 Å²	140.7	66%	0.659	80%	0.8	S	S	*	*			trans	16.6	127.7	158.7	-70.8	144.8	-154.8	0	0	121.1
6	E	40.8	Very low	34.4	Very low	170 Å²	170	136.1 Å²	136.1	79%	0.794	79%	0.794	S	S	*	*				61.3	129.3	75.5	-63.3	-154.8	108.5	0	0	114.5
7	T	30.8	Very low	34.4	Very low	128 Å²	128	135.5 Å²	135.5	79%	0.785	80%	0.799	S	S	*	*				-172.9	151.9	86.7	-67.2	0	0	0	0	113.8
8	F	29.9	Very low	34.2	Very low	181 Å²	181	135.9 Å²	135.9	79%	0.794	80%	0.797	S	S	*	*			trans	-10.4	127	170.4	-81	-108	0	0	0	124.3
9	A	32.5	Very low	34.2	Very low	89 Å²	89	135.3 Å²	135.3	74%	0.736	80%	0.8	S	S	*	*				18.7	145.2	124.9	0	0	0	0	0	124.4
10	V	31.7	Very low	34.3	Very low	146 Å²	146	138.8 Å²	138.8	89%	0.885	80%	0.799	S	S	*	*			trans	-138.3	150.7	158.4	177.9	0	0	0	0	109.9
11	Q	29.5	Very low	34.1	Very low	170 Å²	170	139.2 Å²	139.2	79%	0.794	79%	0.794	S	S	*	*			trans	-113	-177.4	-178.9	-69.2	-174.4	-68.7	0	0	113.7
12	N	30.2	Very low	34	Very low	154 Å²	154	135.3 Å²	135.3	82%	0.824	78%	0.777	S	S	*	*			trans	89.2	145.1	172.3	-50.8	-32.3	0	0	0	114.6
13	S	36.4	Very low	33.7	Very low	116 Å²	116	140.3 Å²	140.3	81%	0.811	79%	0.788	S	S	*	*			cis	-142.2	177.4	17.4	-116.6	0	0	0	0	113.4
14	P	47.2	Very low	33.2	Very low	125 Å²	125	141.1 Å²	141.1	81%	0.812	79%	0.792	S	S	*	*			trans	-113.4	175.6	-153.8	42.9	-38.3	0	0	0	117.9
15	G	31.1	Very low	32.9	Very low	81 Å²	81	140.4 Å²	140.4	84%	0.835	79%	0.793	S	S	*	*			trans	122.1	142.8	162.7	0	0	0	0	0	114.1
16	G	28.9	Very low	32.5	Very low	68 Å²	68	141.3 Å²	141.3	70%	0.701	80%	0.802	S	S	*	*			cis	166.3	138.3	-8.7	0	0	0	0	0	113.1
17	S	33.7	Very low	32	Very low	126 Å²	126	141.9 Å²	141.9	88%	0.881	80%	0.802	S	S	*	*			trans	63.1	128.4	169.4	42.9	0	0	0	0	120.6
18	D	31.7	Very low	32.1	Very low	143 Å²	143	141.7 Å²	141.7	77%	0.765	80%	0.803	S	S	*	*			trans	-41.6	155	172.1	-67	-98	0	0	0	119.1
19	S	33.3	Very low	32.1	Very low	123 Å²	123	142.3 Å²	142.3	86%	0.86	81%	0.808	S	S	*	*				-154.1	145.7	121.1	-80.9	0	0	0	0	112.3
20	R	35.8	Very low	32	Very low	206 Å²	206	147.1 Å²	147.1	78%	0.777	81%	0.813	S	S	*	*			trans	-87.7	178.6	168.6	-44.6	-177.1	-167.6	164.4	1.7	108.5
21	E	31.6	Very low	32	Very low	148 Å²	148	149.3 Å²	149.3	69%	0.692	81%	0.813	S	S	*	*			cis	-163.3	-175.9	10.9	-147.3	152.8	-117.9	0	0	108.8
22	L	30.5	Very low	32	Very low	156 Å²	156	149.3 Å²	149.3	82%	0.817	82%	0.819	S	S	*	*			trans	114.9	153.4	159.6	-62.5	176	0	0	0	118.6
23	Q	29.1	Very low	31.9	Very low	179 Å²	179	145 Å²	145	84%	0.836	81%	0.811	S	S	*	*			trans	-95.1	163.5	-163.5	-58.3	149.2	-56.5	0	0	112.2
24	N	27.5	Very low	31.8	Very low	166 Å²	166	146.8 Å²	146.8	89%	0.888	82%	0.817	S	S	*	*			trans	-143.8	152.7	130.8	-148.9	-10.1	0	0	0	111.2
25	D	30.4	Very low	30.9	Very low	132 Å²	132	145.8 Å²	145.8	71%	0.706	81%	0.813	S	S	*	*			trans	-89.2	148.6	-173.3	-158.5	-47.5	0	0	0	110.9
26	N	29.3	Very low	31	Very low	160 Å²	160	145.4 Å²	145.4	86%	0.856	81%	0.809	S	S	*	*			trans	-158	149.8	152.3	-118.2	-52.8	0	0	0	114.4
27	K	31.4	Very low	31.2	Very low	183 Å²	183	151.8 Å²	151.8	80%	0.796	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-100	137.8	-157.6	-171	177.7	-175.8	176.1	0	111.8
28	P	32.8	Very low	31.4	Very low	123 Å²	123	150.8 Å²	150.8	80%	0.799	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-75.6	132.6	-178.7	29.9	-34.4	0	0	0	112.2
29	E	28.6	Very low	32.1	Very low	194 Å²	194	145.9 Å²	145.9	91%	0.907	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-86.1	149.3	174	-152.9	177.3	157.7	0	0	111.4
30	K	31.9	Very low	32.6	Very low	191 Å²	191	144 Å²	144	83%	0.83	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-86	130	-178.1	-73	-178.9	178	176.9	0	111.5
31	Q	30.4	Very low	33.6	Very low	192 Å²	192	139.4 Å²	139.4	90%	0.897	77%	0.773	S	S	*	*			trans	-122.6	131.6	151.7	-69.1	-167.2	-0.8	0	0	110.5	G33	Q31-G33 PolarHBondContact O-N 3.38Å
32	N	30.6	Very low	35.5	Very low	169 Å²	169	136.1 Å²	136.1	90%	0.904	76%	0.758	S	S	*	*			trans	-81	104.9	178.5	-79	-21.8	0	0	0	110
33	G	26.5	Very low	37.6	Very low	65 Å²	65	133.2 Å²	133.2	67%	0.67	75%	0.746	S	S	*	*			trans	-109.5	119.8	163.8	0	0	0	0	0	110.4	Q31 S35	Q31-G33 PolarHBondContact O-N 3.38Å; G33-S35 VanDerWaalsContact C-N 3.3Å; G33-S35 PolarHBondContact O-N 3.26Å
34	T	34.6	Very low	39.9	Very low	153 Å²	153	127.4 Å²	127.4	94%	0.939	72%	0.723	S	S	*	*			trans	-73.6	82.5	173.7	44.1	0	0	0	0	110.6	G36	T34-G36 PolarHBondContact O-N 3.08Å
35	S	29.2	Very low	42.5	Very low	103 Å²	103	125.9 Å²	125.9	72%	0.72	71%	0.706	S	S	*	*			trans	-69.6	124.4	171.1	49.9	0	0	0	0	110.7	G33 K37	G33-S35 VanDerWaalsContact C-N 3.3Å; G33-S35 PolarHBondContact O-N 3.26Å; S35-K37 PolarHBondContact O-N 3.17Å
36	G	33.5	Very low	44.8	Very low	73 Å²	73	123 Å²	123	75%	0.753	69%	0.69	S	S	*	*			trans	-59.3	123.6	164.6	0	0	0	0	0	108.7	T34 S38	T34-G36 PolarHBondContact O-N 3.08Å; G36-S38 PolarHBondContact O-N 3.37Å
37	K	33.5	Very low	47.1	Very low	202 Å²	202	118 Å²	118	88%	0.878	66%	0.662	S	S	*	*			trans	-71.1	97.9	-178.4	-71.4	-174.7	178	-178.2	0	109.7	S35	S35-K37 PolarHBondContact O-N 3.17Å
38	S	36.9	Very low	48.9	Very low	106 Å²	106	118 Å²	118	74%	0.741	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-53.6	133	161.4	41.5	0	0	0	0	109.1	G36	G36-S38 PolarHBondContact O-N 3.37Å
39	P	45.5	Very low	50.7	Low	39 Å²	39	114.1 Å²	114.1	25%	0.253	65%	0.647	S	S	.	*	P	Polyproline II helix	trans	-62.4	146.3	179.2	24.6	-32.9	0	0	0	110.2	E208	P39-E208 HydrophobicContact CG-CB 4.45Å
40	S	44.8	Very low	53.2	Low	85 Å²	85	104.9 Å²	104.9	59%	0.594	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-50.4	143.8	-177.6	51.7	0	0	0	0	112.5	P207	S40-P207 WeakPolarHBondContact O-CG 3.34Å
41	S	57.3	Low	55.4	Low	109 Å²	109	102.5 Å²	102.5	76%	0.762	60%	0.595	S	S	*	*			trans	-44.4	139.2	179.8	-55.7	0	0	0	0	113.3	T43	S41-T43 PolarHBondContact O-N 3.05Å
42	Q	70.2	Confident	58	Low	79 Å²	79	95.8 Å²	95.8	37%	0.369	58%	0.578	S	S	.	*			trans	-62.3	108.6	-177.3	-68.9	171.1	-4	0	0	111.4	T44 F206	Q42-T44 PolarHBondContact O-N 3.1Å; Q42-F206 HydrophobicContact CG-CD1 3.94Å; Q42-F206 HydrophobicContact CG-CE1 4.31Å
43	T	74.4	Confident	61	Low	94 Å²	94	88.2 Å²	88.2	58%	0.577	54%	0.537	S	S	*	.			trans	-69.6	124.5	177.5	-52.8	0	0	0	0	110.1	S41 V205	S41-T43 PolarHBondContact O-N 3.05Å; T43-V205 WeakPolarHBondContact O-CB 3.39Å; T43-V205 PolarHBondContact O-N 2.99Å
44	T	79.4	Confident	64.2	Low	57 Å²	57	90.8 Å²	90.8	35%	0.35	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	132.4	174.6	-58.6	0	0	0	0	109.9	Q42 I46 T203 H204	Q42-T44 PolarHBondContact O-N 3.1Å; T44-I46 HydrophobicContact CG2-CD1 3.88Å; T44-I46 HydrophobicContact CG2-CG1 3.5Å; T44-T203 CarbonylContact C-O 3.5Å; T44-T203 WeakPolarHBondContact CA-O 3.3Å; T44-H204 WeakPolarHBondContact CG2-CE1 3.42Å; T44-H204 WeakPolarHBondContact CG2-ND1 3.45Å; T44-H204 PolarHBondContact OG1-ND1 3.11Å; T44-H204 VanDerWaalsContact OG1-ND1 3.16Å
45	Y	80.8	Confident	67.2	Low	134 Å²	134	83.9 Å²	83.9	53%	0.525	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	127.9	168	177.5	-95.2	0	0	0	108.9	Q47 F201 C202 T203	Y45-Q47 HydrophobicContact CE1-CG 3.81Å; Y45-F201 HydrophobicContact CD1-CD2 4.47Å; Y45-F201 AromaticContact CD1-CE2 3.83Å; Y45-F201 HydrophobicContact CD1-CE2 3.83Å; Y45-F201 HydrophobicContact CD1-CZ 4.44Å; Y45-F201 AromaticContact CE1-CE2 3.69Å; Y45-F201 HydrophobicContact CE1-CE2 3.69Å; Y45-F201 AromaticContact CE1-CZ 3.85Å; Y45-F201 HydrophobicContact CE1-CZ 3.85Å; Y45-C202 CarbonylContact O-C 3.58Å; Y45-C202 WeakPolarHBondContact O-CA 3.35Å; Y45-C202 WeakPolarHBondContact O-CB 3.45Å; Y45-T203 PolarHBondContact N-O 3.1Å; Y45-T203 PolarHBondContact O-N 2.75Å
46	I	79.9	Confident	70.4	Confident	72 Å²	72	84.4 Å²	84.4	37%	0.369	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	124.6	-176	-48.8	-175.8	0	0	0	108.5	T44 M50 C202	T44-I46 HydrophobicContact CG2-CD1 3.88Å; T44-I46 HydrophobicContact CG2-CG1 3.5Å; I46-M50 HydrophobicContact CG2-CB 3.74Å; I46-M50 WeakPolarHBondContact CG2-O 3.41Å; I46-C202 HydrophobicContact CB-CB 4.43Å; I46-C202 HydrophobicContact CG1-CB 4.34Å; I46-C202 HydrophobicContact CG2-CB 4.29Å
47	Q	77.1	Confident	73.5	Confident	56 Å²	56	81.7 Å²	81.7	26%	0.262	44%	0.443	S	S	.	.			trans	-81.4	155.8	167.1	-69.1	-173.4	-37.8	0	0	111.6	Y45 G49 M50 A200 F201	Y45-Q47 HydrophobicContact CE1-CG 3.81Å; Q47-G49 PolarHBondContact O-N 3.22Å; Q47-M50 WeakPolarHBondContact O-CB 3.49Å; Q47-M50 PolarHBondContact O-N 3.44Å; Q47-M50 VanDerWaalsContact O-N 3.1Å; Q47-A200 HydrophobicContact CB-CB 4.17Å; Q47-F201 WeakPolarHBondContact CB-O 3.47Å; Q47-F201 HydrophobicContact CG-CD1 4.49Å; Q47-F201 HydrophobicContact CG-CE1 4.47Å; Q47-F201 WeakPolarHBondContact CG-O 3.3Å; Q47-F201 PolarHBondContact N-O 3.49Å; Q47-F201 VanDerWaalsContact NE2-CE1 3.29Å
48	Q	68.2	Low	76.5	Confident	181 Å²	181	75 Å²	75	85%	0.846	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.9	139.2	178.7	-72.6	177.5	-24.6	0	0	112.1	M50	Q48-M50 VanDerWaalsContact C-N 3.27Å; Q48-M50 PolarHBondContact O-N 3.39Å
49	G	71.1	Confident	79.3	Confident	42 Å²	42	73.7 Å²	73.7	43%	0.433	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.3	12.4	-176.9	0	0	0	0	0	115	Q47 E51 K187	Q47-G49 PolarHBondContact O-N 3.22Å; G49-E51 PolarHBondContact N-OE1 3.34Å; G49-K187 PolarHBondContact O-NZ 3.48Å
50	M	82.3	Confident	81.8	Confident	1 Å²	1	76.3 Å²	76.3	1%	0.005	40%	0.401	C	S	.	.			trans	-116.2	11.8	163.1	-68.9	-163.1	69.8	0	0	113.2	I46 Q47 Q48 I53 Y99 I185 K187 A200 F201 C202	I46-M50 HydrophobicContact CG2-CB 3.74Å; I46-M50 WeakPolarHBondContact CG2-O 3.41Å; Q47-M50 WeakPolarHBondContact O-CB 3.49Å; Q47-M50 PolarHBondContact O-N 3.44Å; Q47-M50 VanDerWaalsContact O-N 3.1Å; Q48-M50 VanDerWaalsContact C-N 3.27Å; Q48-M50 PolarHBondContact O-N 3.39Å; M50-I53 HydrophobicContact CB-CD1 3.95Å; M50-I53 HydrophobicContact CE-CD1 3.44Å; M50-I53 VanDerWaalsContact CE-CD1 3.44Å; M50-I53 HydrophobicContact CG-CD1 4.19Å; M50-I53 WeakPolarHBondContact O-CB 3.4Å; M50-I53 WeakPolarHBondContact O-CG1 3.35Å; M50-I53 PolarHBondContact O-N 2.81Å; M50-Y99 HydrophobicContact CE-CE1 4.42Å; M50-I185 HydrophobicContact CE-CB 3.97Å; M50-I185 HydrophobicContact CE-CG2 3.68Å; M50-I185 WeakPolarHBondContact CE-O 3.42Å; M50-K187 HydrophobicContact CE-CB 4.29Å; M50-K187 HydrophobicContact CG-CB 4.31Å; M50-K187 HydrophobicContact CG-CD 4.05Å; M50-K187 HydrophobicContact SD-CB 3.88Å; M50-A200 HydrophobicContact CG-CB 3.77Å; M50-A200 HydrophobicContact SD-CB 3.86Å; M50-A200 VanDerWaalsContact SD-O 3.34Å; M50-F201 WeakPolarHBondContact SD-CA 3.24Å; M50-C202 HydrophobicContact CB-CB 4.45Å; M50-C202 HydrophobicContact CE-CB 4.05Å; M50-C202 VanDerWaalsContact CE-SG 3.59Å; M50-C202 HydrophobicContact SD-CB 4.32Å; M50-C202 PolarHBondContact SD-N 3.29Å; M50-C202 VanDerWaalsContact SD-N 3.45Å
51	E	77.6	Confident	84.3	Confident	140 Å²	140	78.1 Å²	78.1	65%	0.654	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	147.4	172.1	-68.3	147	-111.9	0	0	111.9	G49 I53	G49-E51 PolarHBondContact N-OE1 3.34Å; E51-I53 VanDerWaalsContact C-N 3.26Å; E51-I53 PolarHBondContact O-N 3.21Å
52	G	84.9	Confident	86.2	Confident	52 Å²	52	74.3 Å²	74.3	54%	0.536	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.5	-14.3	-177.3	0	0	0	0	0	115.5	K54	G52-K54 PolarHBondContact O-N 3.48Å
53	I	93.2	Very high	87.5	Confident	9 Å²	9	70.6 Å²	70.6	5%	0.046	35%	0.354	C	S	.	.			trans	-69.2	128.7	174.7	-64.6	170.8	0	0	0	110	M50 E51 V90 T91 G92 L93 Y99 I185	M50-I53 HydrophobicContact CB-CD1 3.95Å; M50-I53 HydrophobicContact CE-CD1 3.44Å; M50-I53 VanDerWaalsContact CE-CD1 3.44Å; M50-I53 HydrophobicContact CG-CD1 4.19Å; M50-I53 WeakPolarHBondContact O-CB 3.4Å; M50-I53 WeakPolarHBondContact O-CG1 3.35Å; M50-I53 PolarHBondContact O-N 2.81Å; E51-I53 VanDerWaalsContact C-N 3.26Å; E51-I53 PolarHBondContact O-N 3.21Å; I53-V90 HydrophobicContact CG2-CG1 4.4Å; I53-T91 WeakPolarHBondContact CA-O 3.23Å; I53-G92 WeakPolarHBondContact CG1-O 3.5Å; I53-L93 HydrophobicContact CD1-CD2 3.71Å; I53-L93 HydrophobicContact CG1-CD2 3.99Å; I53-L93 HydrophobicContact CG2-CD2 4.08Å; I53-Y99 HydrophobicContact CD1-CE1 4.42Å; I53-I185 HydrophobicContact CG2-CD1 3.91Å
54	K	93.9	Very high	88.6	Confident	120 Å²	120	67.7 Å²	67.7	52%	0.522	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	137.5	179.1	-62.4	-179.9	-175.2	179.7	0	110.2	G52 Y56 V90 T91	G52-K54 PolarHBondContact O-N 3.48Å; K54-Y56 HydrophobicContact CB-CE2 3.79Å; K54-Y56 WeakPolarHBondContact CD-OH 3.2Å; K54-V90 WeakPolarHBondContact O-CA 3.4Å; K54-T91 PolarHBondContact N-O 3.31Å; K54-T91 PolarHBondContact O-N 3.3Å
55	V	96.7	Very high	89.5	Confident	7 Å²	7	70.6 Å²	70.6	4%	0.042	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	128.6	-180	-176	0	0	0	0	108.4	V88 V90 I183 I185 H204 F206	V55-V88 HydrophobicContact CG1-CB 3.64Å; V55-V88 HydrophobicContact CG1-CG1 3.69Å; V55-V88 HydrophobicContact CG1-CG2 3.92Å; V55-V90 HydrophobicContact CG1-CG2 4.46Å; V55-V90 HydrophobicContact CG2-CG1 4.22Å; V55-V90 HydrophobicContact CG2-CG2 4.3Å; V55-I183 HydrophobicContact CG1-CG2 4.3Å; V55-I185 HydrophobicContact CG2-CD1 3.71Å; V55-H204 HydrophobicContact CB-CB 4.39Å; V55-H204 WeakPolarHBondContact CG2-CD2 3.36Å; V55-H204 WeakPolarHBondContact CG2-NE2 3.46Å; V55-F206 HydrophobicContact CB-CZ 4.31Å; V55-F206 HydrophobicContact CG1-CE2 4.16Å; V55-F206 HydrophobicContact CG1-CZ 3.95Å; V55-F206 WeakPolarHBondContact O-CZ 3.5Å
56	Y	97.1	Very high	90.3	Very high	115 Å²	115	64.2 Å²	64.2	45%	0.451	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	122.8	-177.4	-55.7	-91.3	0	0	0	109.5	K54 H58 V88 K89 T91	K54-Y56 HydrophobicContact CB-CE2 3.79Å; K54-Y56 WeakPolarHBondContact CD-OH 3.2Å; Y56-H58 PolarHBondContact O-N 2.6Å; Y56-V88 CarbonylContact O-C 3.57Å; Y56-V88 VanDerWaalsContact O-CA 3.24Å; Y56-V88 WeakPolarHBondContact O-CA 3.48Å; Y56-V88 WeakPolarHBondContact O-CB 3.2Å; Y56-K89 PolarHBondContact N-O 2.79Å; Y56-K89 PolarHBondContact O-N 3Å; Y56-T91 HydrophobicContact CE2-CG2 4.27Å
57	L	97.9	Very high	91.1	Very high	15 Å²	15	64.1 Å²	64.1	8%	0.079	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	124.8	172.9	-175.7	64.9	0	0	0	110.2	R60 W63 F86 F206 E208 T209	L57-R60 HydrophobicContact CD2-CG 4.37Å; L57-W63 HydrophobicContact CD2-CB 4.14Å; L57-W63 HydrophobicContact CD2-CG 3.95Å; L57-F86 HydrophobicContact CD1-CD2 4.42Å; L57-F86 HydrophobicContact CD1-CE2 4.27Å; L57-F86 HydrophobicContact CD1-CZ 4.5Å; L57-F206 HydrophobicContact CB-CD1 3.92Å; L57-F206 HydrophobicContact CB-CD2 4.43Å; L57-F206 HydrophobicContact CB-CE1 3.96Å; L57-F206 HydrophobicContact CB-CE2 4.45Å; L57-F206 HydrophobicContact CB-CG 4.17Å; L57-F206 HydrophobicContact CB-CZ 4.23Å; L57-F206 HydrophobicContact CD1-CD2 4.47Å; L57-F206 HydrophobicContact CD2-CB 4.23Å; L57-F206 HydrophobicContact CD2-CG 4.32Å; L57-E208 HydrophobicContact CD2-CG 3.65Å; L57-T209 HydrophobicContact CD1-CG2 3.87Å; L57-T209 HydrophobicContact CD2-CG2 3.49Å; L57-T209 VanDerWaalsContact CD2-CG2 3.49Å; L57-T209 HydrophobicContact CG-CG2 4.35Å
58	H	97.7	Very high	92	Very high	61 Å²	61	68.5 Å²	68.5	28%	0.282	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	150.7	175.4	175.9	88.2	0	0	0	110.6	Y56 R60 K87 L152	Y56-H58 PolarHBondContact O-N 2.6Å; H58-R60 PolarHBondContact O-N 2.86Å; H58-K87 HydrophobicContact CB-CB 3.94Å; H58-K87 VanDerWaalsContact CD2-CD 3.41Å; H58-K87 WeakPolarHBondContact CD2-CD 3.18Å; H58-K87 PolarHBondContact N-O 3.01Å; H58-L152 HydrophobicContact CB-CD2 3.98Å; H58-L152 VanDerWaalsContact CE1-CD1 3.43Å; H58-L152 WeakPolarHBondContact CE1-CD1 3.46Å; H58-L152 WeakPolarHBondContact ND1-CD1 3.29Å
59	E	96.3	Very high	93.2	Very high	79 Å²	79	62 Å²	62	37%	0.369	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	35.8	-172.1	-69.3	154.1	160	0	0	112.7	E61 L62 W63 K87	E59-E61 VanDerWaalsContact C-N 3.3Å; E59-E61 PolarHBondContact O-N 3.38Å; E59-L62 HydrophobicContact CB-CB 4.32Å; E59-L62 WeakPolarHBondContact O-CB 3.25Å; E59-L62 PolarHBondContact O-N 3.09Å; E59-W63 PolarHBondContact O-N 2.83Å; E59-K87 IonicContact OE1-NZ 3.8Å; E59-K87 PolarHBondContact OE1-NZ 3.11Å; E59-K87 WeakPolarHBondContact OE2-CD 3.45Å; E59-K87 IonicContact OE2-NZ 2.8Å; E59-K87 PolarHBondContact OE2-NZ 3.02Å
60	R	96.9	Very high	94.3	Very high	94 Å²	94	61 Å²	61	36%	0.355	30%	0.299	S	S	.	.	H	α-helix	trans	-50.4	-44.8	-176.9	-169.1	-176.8	-163	-149.7	-2.7	113.4	L57 H58 L62 W63 I64 E208	L57-R60 HydrophobicContact CD2-CG 4.37Å; H58-R60 PolarHBondContact O-N 2.86Å; R60-L62 PolarHBondContact O-N 2.82Å; R60-W63 WeakPolarHBondContact O-CA 3.49Å; R60-W63 WeakPolarHBondContact O-CB 3.21Å; R60-W63 PolarHBondContact O-N 2.96Å; R60-I64 HydrophobicContact CG-CD1 4.05Å; R60-I64 HydrophobicContact CG-CG1 4.47Å; R60-I64 WeakPolarHBondContact O-CG1 3.32Å; R60-I64 PolarHBondContact O-N 2.9Å; R60-E208 IonicContact CZ-OE1 3.16Å; R60-E208 IonicContact NE-OE1 2.72Å; R60-E208 PolarHBondContact NE-OE1 2.98Å; R60-E208 IonicContact NH2-OE1 2.74Å; R60-E208 PolarHBondContact NH2-OE1 3.45Å
61	E	97.4	Very high	95	Very high	124 Å²	124	61.2 Å²	61.2	58%	0.579	30%	0.3	S	S	*	.	H	α-helix	trans	-62.4	-29.5	179.6	-50.7	-44	117	0	0	113	E59 K65	E59-E61 VanDerWaalsContact C-N 3.3Å; E59-E61 PolarHBondContact O-N 3.38Å; E61-K65 WeakPolarHBondContact O-CG 3.37Å; E61-K65 PolarHBondContact O-N 3.36Å
62	L	97.4	Very high	96	Very high	29 Å²	29	54.6 Å²	54.6	15%	0.152	27%	0.269	C	S	.	.	H	α-helix	trans	-73.1	-39.2	173.5	-177.1	62	0	0	0	110.9	E59 R60 K65 F66 F83 P84 N229	E59-L62 HydrophobicContact CB-CB 4.32Å; E59-L62 WeakPolarHBondContact O-CB 3.25Å; E59-L62 PolarHBondContact O-N 3.09Å; R60-L62 PolarHBondContact O-N 2.82Å; L62-K65 PolarHBondContact O-N 3.37Å; L62-F66 HydrophobicContact CD1-CD2 4.21Å; L62-F66 HydrophobicContact CD1-CE2 3.83Å; L62-F66 HydrophobicContact CG-CD2 4.22Å; L62-F66 HydrophobicContact CG-CE2 4.07Å; L62-F66 VanDerWaalsContact O-CD2 3.29Å; L62-F66 WeakPolarHBondContact O-CD2 3.4Å; L62-F66 PolarHBondContact O-N 3.06Å; L62-F83 HydrophobicContact CD2-CZ 4.32Å; L62-P84 HydrophobicContact CD2-CB 4.14Å; L62-P84 HydrophobicContact CD2-CG 3.97Å; L62-P84 HydrophobicContact CG-CG 3.89Å; L62-N229 HydrophobicContact CD1-CB 3.94Å; L62-N229 WeakPolarHBondContact CD1-OD1 3.3Å; L62-N229 HydrophobicContact CD2-CB 4.44Å
63	W	98.2	Very high	96.6	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-62.4	-42.8	172.8	-77	100.4	0	0	0	112.2	L57 E59 R60 K65 F66 H67 M73 P84 F86 E208 T209	L57-W63 HydrophobicContact CD2-CB 4.14Å; L57-W63 HydrophobicContact CD2-CG 3.95Å; E59-W63 PolarHBondContact O-N 2.83Å; R60-W63 WeakPolarHBondContact O-CA 3.49Å; R60-W63 WeakPolarHBondContact O-CB 3.21Å; R60-W63 PolarHBondContact O-N 2.96Å; W63-K65 PolarHBondContact O-N 2.92Å; W63-F66 PolarHBondContact O-N 2.91Å; W63-H67 WeakPolarHBondContact O-CB 3.48Å; W63-H67 PolarHBondContact O-N 2.96Å; W63-M73 HydrophobicContact CH2-CE 3.68Å; W63-M73 HydrophobicContact CZ3-CE 3.76Å; W63-P84 HydrophobicContact CD2-CB 4.2Å; W63-P84 HydrophobicContact CD2-CG 4.17Å; W63-P84 HydrophobicContact CE3-CG 4.46Å; W63-P84 WeakPolarHBondContact CH2-O 3.34Å; W63-P84 HydrophobicContact CZ2-CB 3.88Å; W63-P84 VanDerWaalsContact CZ2-O 3.27Å; W63-P84 WeakPolarHBondContact CZ2-O 3.41Å; W63-F86 HydrophobicContact CZ2-CB 4.3Å; W63-F86 HydrophobicContact CZ2-CD2 4.41Å; W63-E208 HydrophobicContact CB-CG 4.39Å; W63-T209 HydrophobicContact CD2-CG2 3.8Å; W63-T209 HydrophobicContact CE3-CG2 3.86Å; W63-T209 HydrophobicContact CG-CG2 4.24Å; W63-T209 HydrophobicContact CH2-CG2 4.44Å; W63-T209 HydrophobicContact CZ2-CG2 4.41Å; W63-T209 HydrophobicContact CZ3-CG2 4.17Å
64	I	97.8	Very high	96.9	Very high	33 Å²	33	53 Å²	53	17%	0.169	25%	0.248	C	C	.	.	H	α-helix	trans	-59	-47.7	176.2	-67.8	168.2	0	0	0	110.8	R60 F66 H67 E68 E208	R60-I64 HydrophobicContact CG-CD1 4.05Å; R60-I64 HydrophobicContact CG-CG1 4.47Å; R60-I64 WeakPolarHBondContact O-CG1 3.32Å; R60-I64 PolarHBondContact O-N 2.9Å; I64-F66 VanDerWaalsContact C-N 3.29Å; I64-F66 PolarHBondContact O-N 3.32Å; I64-H67 WeakPolarHBondContact O-CA 3.31Å; I64-H67 WeakPolarHBondContact O-CB 3.38Å; I64-H67 PolarHBondContact O-N 3.45Å; I64-E68 HydrophobicContact CG2-CG 4.29Å; I64-E68 WeakPolarHBondContact O-CG 3.47Å; I64-E68 PolarHBondContact O-N 3.48Å; I64-E208 HydrophobicContact CG1-CB 4.36Å
65	K	97.3	Very high	97.1	Very high	118 Å²	118	47.4 Å²	47.4	51%	0.513	22%	0.224	S	C	.	.	H	α-helix	trans	-57.8	-36.6	176	-72.8	174.7	-178.9	-172.9	0	113.8	E61 L62 W63 V69	E61-K65 WeakPolarHBondContact O-CG 3.37Å; E61-K65 PolarHBondContact O-N 3.36Å; L62-K65 PolarHBondContact O-N 3.37Å; W63-K65 PolarHBondContact O-N 2.92Å; K65-V69 WeakPolarHBondContact O-CG2 3.44Å
66	F	97.3	Very high	97.2	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-72.6	-38.3	172.7	-82.8	-70.4	0	0	0	112.2	L62 W63 I64 V69 G70 T71 F83 P84 I222 L225 K226	L62-F66 HydrophobicContact CD1-CD2 4.21Å; L62-F66 HydrophobicContact CD1-CE2 3.83Å; L62-F66 HydrophobicContact CG-CD2 4.22Å; L62-F66 HydrophobicContact CG-CE2 4.07Å; L62-F66 VanDerWaalsContact O-CD2 3.29Å; L62-F66 WeakPolarHBondContact O-CD2 3.4Å; L62-F66 PolarHBondContact O-N 3.06Å; W63-F66 PolarHBondContact O-N 2.91Å; I64-F66 VanDerWaalsContact C-N 3.29Å; I64-F66 PolarHBondContact O-N 3.32Å; F66-V69 PolarHBondContact O-N 2.98Å; F66-G70 CarbonylContact O-C 3.51Å; F66-G70 PolarHBondContact O-N 3.34Å; F66-G70 VanDerWaalsContact O-N 3.08Å; F66-T71 VanDerWaalsContact C-OG1 3.23Å; F66-T71 HydrophobicContact CB-CG2 4.13Å; F66-T71 PolarHBondContact O-N 3.47Å; F66-T71 PolarHBondContact O-OG1 3.16Å; F66-F83 HydrophobicContact CE2-CD1 4.32Å; F66-F83 AromaticContact CE2-CE1 3.93Å; F66-F83 HydrophobicContact CE2-CE1 3.93Å; F66-F83 HydrophobicContact CZ-CD1 4.18Å; F66-F83 AromaticContact CZ-CE1 3.96Å; F66-F83 HydrophobicContact CZ-CE1 3.96Å; F66-P84 HydrophobicContact CD2-CG 3.43Å; F66-P84 VanDerWaalsContact CD2-CG 3.43Å; F66-P84 HydrophobicContact CE2-CG 3.59Å; F66-P84 HydrophobicContact CG-CG 4.47Å; F66-I222 HydrophobicContact CD1-CD1 3.96Å; F66-I222 HydrophobicContact CD1-CG2 4.35Å; F66-I222 HydrophobicContact CE1-CG2 4.25Å; F66-L225 HydrophobicContact CD1-CB 4.21Å; F66-L225 HydrophobicContact CD1-CD1 4.23Å; F66-L225 HydrophobicContact CE1-CB 3.44Å; F66-L225 VanDerWaalsContact CE1-CB 3.44Å; F66-L225 HydrophobicContact CE1-CD1 4.28Å; F66-L225 HydrophobicContact CZ-CB 3.65Å; F66-K226 HydrophobicContact CE1-CD 3.62Å; F66-K226 HydrophobicContact CE1-CG 3.96Å; F66-K226 HydrophobicContact CZ-CD 3.77Å; F66-K226 HydrophobicContact CZ-CG 4.25Å
67	H	96.6	Very high	97.1	Very high	70 Å²	70	51.6 Å²	51.6	32%	0.324	25%	0.248	S	C	.	.	H	α-helix	trans	-64.6	-43.6	-179.2	-170.4	84.9	0	0	0	112.4	W63 I64 V69 G70 T71 P207	W63-H67 WeakPolarHBondContact O-CB 3.48Å; W63-H67 PolarHBondContact O-N 2.96Å; I64-H67 WeakPolarHBondContact O-CA 3.31Å; I64-H67 WeakPolarHBondContact O-CB 3.38Å; I64-H67 PolarHBondContact O-N 3.45Å; H67-V69 PolarHBondContact O-N 3.08Å; H67-G70 PolarHBondContact O-N 2.92Å; H67-T71 WeakPolarHBondContact CA-OG1 3.22Å; H67-T71 PolarHBondContact N-OG1 2.81Å; H67-P207 PolarHBondContact CE1-O 2.93Å; H67-P207 PolarHBondContact ND1-O 3.28Å
68	E	95.6	Very high	97.1	Very high	148 Å²	148	54 Å²	54	69%	0.692	27%	0.27	S	S	*	.	H	α-helix	trans	-58.1	-34.2	176.8	-72.2	172.7	164.6	0	0	113.2	I64	I64-E68 HydrophobicContact CG2-CG 4.29Å; I64-E68 WeakPolarHBondContact O-CG 3.47Å; I64-E68 PolarHBondContact O-N 3.48Å
69	V	94.3	Very high	97.1	Very high	44 Å²	44	51.5 Å²	51.5	27%	0.267	26%	0.261	S	S	.	.	H	α-helix	trans	-89.3	-12.4	179.3	-177	0	0	0	0	112.2	K65 F66 H67 N219 K221 I222 L225	K65-V69 WeakPolarHBondContact O-CG2 3.44Å; F66-V69 PolarHBondContact O-N 2.98Å; H67-V69 PolarHBondContact O-N 3.08Å; V69-N219 WeakPolarHBondContact CG1-ND2 3.19Å; V69-N219 PolarHBondContact O-ND2 2.87Å; V69-K221 HydrophobicContact CG1-CB 3.65Å; V69-I222 HydrophobicContact CB-CD1 3.73Å; V69-I222 HydrophobicContact CG1-CD1 3.54Å; V69-I222 HydrophobicContact CG1-CG1 3.84Å; V69-L225 HydrophobicContact CB-CD1 4.41Å; V69-L225 HydrophobicContact CG2-CD1 3.99Å
70	G	94.5	Very high	97.2	Very high	23 Å²	23	53.8 Å²	53.8	24%	0.237	27%	0.266	C	S	.	.			trans	88.7	90.2	-173.5	0	0	0	0	0	111.9	F66 H67 E72 I222	F66-G70 CarbonylContact O-C 3.51Å; F66-G70 PolarHBondContact O-N 3.34Å; F66-G70 VanDerWaalsContact O-N 3.08Å; H67-G70 PolarHBondContact O-N 2.92Å; G70-E72 PolarHBondContact O-N 2.67Å; G70-I222 VanDerWaalsContact O-CD1 3.24Å; G70-I222 WeakPolarHBondContact O-CD1 3.42Å
71	T	97.6	Very high	97.3	Very high	5 Å²	5	56.4 Å²	56.4	3%	0.031	28%	0.276	C	S	.	.			trans	-56.3	124.5	-174.4	-50	0	0	0	0	112.6	F66 H67 M73 A210 F211 I212	F66-T71 VanDerWaalsContact C-OG1 3.23Å; F66-T71 HydrophobicContact CB-CG2 4.13Å; F66-T71 PolarHBondContact O-N 3.47Å; F66-T71 PolarHBondContact O-OG1 3.16Å; H67-T71 WeakPolarHBondContact CA-OG1 3.22Å; H67-T71 PolarHBondContact N-OG1 2.81Å; T71-M73 HydrophobicContact CG2-CE 4.07Å; T71-A210 WeakPolarHBondContact CB-O 3.38Å; T71-A210 PolarHBondContact OG1-O 3.08Å; T71-F211 HydrophobicContact CG2-CB 3.66Å; T71-F211 CarbonylContact O-C 3.51Å; T71-F211 WeakPolarHBondContact O-CA 3.2Å; T71-F211 WeakPolarHBondContact O-CB 3.13Å; T71-I212 PolarHBondContact O-N 3.44Å
72	E	97.8	Very high	97.3	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	143.8	171.1	-56.9	173.2	-161	0	0	111.3	G70 W120 I212 V214 Y217 Q218 N219 I222 K226	G70-E72 PolarHBondContact O-N 2.67Å; E72-W120 HydrophobicContact CG-CZ2 3.77Å; E72-W120 WeakPolarHBondContact OE1-CZ2 3.46Å; E72-W120 PolarHBondContact OE1-NE1 2.84Å; E72-I212 WeakPolarHBondContact CA-O 3.18Å; E72-V214 HydrophobicContact CB-CG2 4.09Å; E72-Y217 HydrophobicContact CB-CD1 4Å; E72-Y217 HydrophobicContact CB-CE1 4.35Å; E72-Y217 WeakPolarHBondContact OE2-CA 3.09Å; E72-Q218 PolarHBondContact OE2-N 2.87Å; E72-N219 WeakPolarHBondContact OE1-CB 3.36Å; E72-N219 PolarHBondContact OE1-N 2.97Å; E72-I222 HydrophobicContact CB-CG2 4.05Å; E72-I222 HydrophobicContact CG-CG1 4.23Å; E72-I222 HydrophobicContact CG-CG2 4.39Å; E72-K226 VanDerWaalsContact O-CE 3.24Å; E72-K226 WeakPolarHBondContact O-CE 3.45Å; E72-K226 PolarHBondContact O-NZ 2.88Å
73	M	98.4	Very high	97.3	Very high	3 Å²	3	50.9 Å²	50.9	2%	0.015	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	126	172.6	-66.4	-67.5	-177.1	0	0	110.8	W63 T71 M82 F83 L160 F211 I212 V214	W63-M73 HydrophobicContact CH2-CE 3.68Å; W63-M73 HydrophobicContact CZ3-CE 3.76Å; T71-M73 HydrophobicContact CG2-CE 4.07Å; M73-M82 HydrophobicContact CE-CB 4.05Å; M73-M82 HydrophobicContact CE-CG 4.43Å; M73-M82 HydrophobicContact SD-CB 3.93Å; M73-M82 HydrophobicContact SD-CG 4.19Å; M73-F83 WeakPolarHBondContact CE-O 3.39Å; M73-F83 VanDerWaalsContact SD-O 3.42Å; M73-L160 HydrophobicContact CB-CD1 4.01Å; M73-L160 HydrophobicContact CG-CD1 4.47Å; M73-F211 HydrophobicContact CB-CD2 3.56Å; M73-F211 HydrophobicContact CB-CE2 3.7Å; M73-F211 HydrophobicContact CB-CG 4.11Å; M73-F211 HydrophobicContact CB-CZ 4.33Å; M73-F211 HydrophobicContact CE-CD1 4.43Å; M73-F211 HydrophobicContact CG-CB 3.9Å; M73-F211 HydrophobicContact CG-CD1 3.78Å; M73-F211 HydrophobicContact CG-CD2 3.44Å; M73-F211 VanDerWaalsContact CG-CD2 3.44Å; M73-F211 HydrophobicContact CG-CE1 4.09Å; M73-F211 HydrophobicContact CG-CE2 3.82Å; M73-F211 HydrophobicContact CG-CG 3.44Å; M73-F211 VanDerWaalsContact CG-CG 3.44Å; M73-F211 HydrophobicContact CG-CZ 4.13Å; M73-I212 PolarHBondContact N-O 2.98Å; M73-V214 PolarHBondContact O-N 3.49Å
74	I	98.3	Very high	97.3	Very high	26 Å²	26	51 Å²	51	13%	0.133	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	129.9	176.3	-56.7	-55.7	0	0	0	110.6	T76 R80 V214 Y217	I74-T76 HydrophobicContact CG2-CG2 3.85Å; I74-R80 HydrophobicContact CB-CG 4.09Å; I74-R80 HydrophobicContact CG2-CG 4.17Å; I74-R80 WeakPolarHBondContact O-CB 3.36Å; I74-R80 WeakPolarHBondContact O-CG 3.34Å; I74-V214 CarbonylContact C-O 3.57Å; I74-V214 VanDerWaalsContact CA-O 3.26Å; I74-V214 WeakPolarHBondContact CA-O 3.39Å; I74-V214 HydrophobicContact CD1-CG2 3.9Å; I74-Y217 HydrophobicContact CD1-CD1 3.52Å; I74-Y217 HydrophobicContact CD1-CD2 4.03Å; I74-Y217 HydrophobicContact CD1-CE1 3.49Å; I74-Y217 VanDerWaalsContact CD1-CE1 3.49Å; I74-Y217 HydrophobicContact CD1-CE2 4.02Å; I74-Y217 HydrophobicContact CD1-CG 3.78Å; I74-Y217 HydrophobicContact CG1-CD1 4.18Å; I74-Y217 HydrophobicContact CG1-CE1 3.61Å; I74-Y217 HydrophobicContact CG1-CE2 3.99Å; I74-Y217 VanDerWaalsContact CG1-CZ 3.49Å
75	I	98.1	Very high	97.3	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.01	25%	0.25	C	C	.	.			trans	-112.7	139.4	169.8	64.5	177.7	0	0	0	110.6	L160 N162 L173 A213 V214 T215	I75-L160 HydrophobicContact CG2-CB 3.76Å; I75-L160 HydrophobicContact CG2-CD1 4.5Å; I75-N162 HydrophobicContact CD1-CB 3.7Å; I75-N162 HydrophobicContact CG1-CB 3.99Å; I75-L173 HydrophobicContact CD1-CB 4.5Å; I75-L173 HydrophobicContact CG2-CB 4.47Å; I75-L173 HydrophobicContact CG2-CD1 4.28Å; I75-A213 HydrophobicContact CD1-CB 4.21Å; I75-A213 HydrophobicContact CG2-CB 4.02Å; I75-V214 PolarHBondContact N-O 3.11Å; I75-T215 HydrophobicContact CG1-CG2 4.41Å
76	T	98.1	Very high	97.3	Very high	51 Å²	51	45 Å²	45	31%	0.313	23%	0.226	S	C	.	.			trans	-143.3	157	-179.5	72.1	0	0	0	0	112.1	I74 A78 G79 R80 T161	I74-T76 HydrophobicContact CG2-CG2 3.85Å; T76-A78 PolarHBondContact O-N 3.03Å; T76-G79 PolarHBondContact O-N 2.84Å; T76-R80 HydrophobicContact CG2-CB 4.25Å; T76-T161 WeakPolarHBondContact O-CA 3.41Å; T76-T161 WeakPolarHBondContact O-CB 3.38Å; T76-T161 PolarHBondContact O-OG1 3.29Å
77	K	96.9	Very high	97.4	Very high	159 Å²	159	47 Å²	47	69%	0.691	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-31	-178.2	-175.8	174.8	-177.9	177.2	0	114.3	T161 N162 N163	K77-T161 PolarHBondContact O-OG1 3.29Å; K77-N162 PolarHBondContact N-OD1 3.13Å; K77-N163 HydrophobicContact CG-CB 4.16Å
78	A	97.2	Very high	97.4	Very high	65 Å²	65	43.6 Å²	43.6	54%	0.537	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	2.3	-180	0	0	0	0	0	114.1	T76 K159 H170	T76-A78 PolarHBondContact O-N 3.03Å; A78-K159 PolarHBondContact O-NZ 2.95Å; A78-H170 PolarHBondContact O-CE1 3.03Å
79	G	97.6	Very high	97.6	Very high	9 Å²	9	42.1 Å²	42.1	9%	0.093	21%	0.21	C	C	.	.			trans	77.3	124.1	-177	0	0	0	0	0	113.6	T76 K159 L160	T76-G79 PolarHBondContact O-N 2.84Å; G79-K159 WeakPolarHBondContact O-CD 3.49Å; G79-K159 WeakPolarHBondContact O-CE 3.45Å; G79-K159 PolarHBondContact O-NZ 2.89Å; G79-L160 CarbonylContact C-O 3.55Å; G79-L160 WeakPolarHBondContact CA-O 3.45Å
80	R	98.2	Very high	97.7	Very high	127 Å²	127	40 Å²	40	48%	0.479	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	137.6	-179	-179	63.7	175.2	-178.9	-2.5	110.9	I74 T76 K159 L160	I74-R80 HydrophobicContact CB-CG 4.09Å; I74-R80 HydrophobicContact CG2-CG 4.17Å; I74-R80 WeakPolarHBondContact O-CB 3.36Å; I74-R80 WeakPolarHBondContact O-CG 3.34Å; T76-R80 HydrophobicContact CG2-CB 4.25Å; R80-K159 CarbonylContact O-C 3.56Å; R80-K159 VanDerWaalsContact O-CA 3.31Å; R80-K159 WeakPolarHBondContact O-CA 3.48Å; R80-L160 PolarHBondContact N-O 3.36Å; R80-L160 PolarHBondContact O-N 3.06Å
81	R	98.1	Very high	97.8	Very high	148 Å²	148	41 Å²	41	56%	0.558	20%	0.199	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-72.9	144.5	176.7	-68.1	173.5	179.2	164.2	3.5	111	Q156 L158 K159	R81-Q156 WeakPolarHBondContact CD-O 3.18Å; R81-Q156 WeakPolarHBondContact CG-O 3.43Å; R81-L158 WeakPolarHBondContact CA-O 3.46Å; R81-K159 HydrophobicContact CG-CG 4.21Å
82	M	98.1	Very high	97.7	Very high	11 Å²	11	42.9 Å²	42.9	5%	0.054	22%	0.219	C	C	.	.			trans	-65.4	147.2	173.5	-64.9	-172.1	-67.9	0	0	111.7	M73 P84 F86 M103 L158 L160 F211	M73-M82 HydrophobicContact CE-CB 4.05Å; M73-M82 HydrophobicContact CE-CG 4.43Å; M73-M82 HydrophobicContact SD-CB 3.93Å; M73-M82 HydrophobicContact SD-CG 4.19Å; M82-P84 CarbonylContact C-O 3.42Å; M82-F86 HydrophobicContact CE-CB 3.94Å; M82-M103 HydrophobicContact CE-SD 4.15Å; M82-L158 HydrophobicContact CE-CD1 4.2Å; M82-L158 HydrophobicContact CE-CD2 4.11Å; M82-L160 HydrophobicContact CG-CD1 3.69Å; M82-L160 HydrophobicContact CG-CG 4.04Å; M82-L160 HydrophobicContact SD-CD1 4.19Å; M82-F211 HydrophobicContact SD-CE1 4.11Å
83	F	97.9	Very high	97.6	Very high	27 Å²	27	43.1 Å²	43.1	12%	0.118	22%	0.22	C	C	.	.	S	Bend	trans	-140.6	124.4	164	-174.3	-87.4	0	0	0	109.8	L62 F66 M73 K226 N229 N230	L62-F83 HydrophobicContact CD2-CZ 4.32Å; F66-F83 HydrophobicContact CE2-CD1 4.32Å; F66-F83 AromaticContact CE2-CE1 3.93Å; F66-F83 HydrophobicContact CE2-CE1 3.93Å; F66-F83 HydrophobicContact CZ-CD1 4.18Å; F66-F83 AromaticContact CZ-CE1 3.96Å; F66-F83 HydrophobicContact CZ-CE1 3.96Å; M73-F83 WeakPolarHBondContact CE-O 3.39Å; M73-F83 VanDerWaalsContact SD-O 3.42Å; F83-K226 HydrophobicContact CD1-CD 3.77Å; F83-K226 PolarHBondContact O-NZ 3.32Å; F83-N229 HydrophobicContact CE1-CB 4.01Å; F83-N229 VanDerWaalsContact CZ-C 3.45Å; F83-N229 HydrophobicContact CZ-CB 3.94Å; F83-N229 WeakPolarHBondContact CZ-O 3.33Å; F83-N230 HydrophobicContact CD1-CB 4.06Å; F83-N230 HydrophobicContact CD2-CB 3.9Å; F83-N230 HydrophobicContact CE1-CB 3.9Å; F83-N230 HydrophobicContact CE2-CB 3.74Å; F83-N230 HydrophobicContact CG-CB 4.07Å; F83-N230 VanDerWaalsContact CZ-CA 3.48Å; F83-N230 HydrophobicContact CZ-CB 3.75Å
84	P	97.9	Very high	97.4	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.006	24%	0.239	C	C	.	.	S	Bend	cis	-60.8	155.8	1.5	-21	33.4	0	0	0	113.1	L62 W63 F66 M82	L62-P84 HydrophobicContact CD2-CB 4.14Å; L62-P84 HydrophobicContact CD2-CG 3.97Å; L62-P84 HydrophobicContact CG-CG 3.89Å; W63-P84 HydrophobicContact CD2-CB 4.2Å; W63-P84 HydrophobicContact CD2-CG 4.17Å; W63-P84 HydrophobicContact CE3-CG 4.46Å; W63-P84 WeakPolarHBondContact CH2-O 3.34Å; W63-P84 HydrophobicContact CZ2-CB 3.88Å; W63-P84 VanDerWaalsContact CZ2-O 3.27Å; W63-P84 WeakPolarHBondContact CZ2-O 3.41Å; F66-P84 HydrophobicContact CD2-CG 3.43Å; F66-P84 VanDerWaalsContact CD2-CG 3.43Å; F66-P84 HydrophobicContact CE2-CG 3.59Å; F66-P84 HydrophobicContact CG-CG 4.47Å; M82-P84 CarbonylContact C-O 3.42Å
85	S	97.3	Very high	97.3	Very high	25 Å²	25	49 Å²	49	18%	0.175	26%	0.256	C	S	.	.			trans	-76	126	178	-63.7	0	0	0	0	109.2	K87	S85-K87 PolarHBondContact O-N 2.98Å; S85-K87 VanDerWaalsContact O-N 3.13Å
86	F	98.3	Very high	97.1	Very high	1 Å²	1	57.4 Å²	57.4	0%	0.004	29%	0.292	C	S	.	.			trans	-66.7	115.8	176.2	-165.8	-76.2	0	0	0	109.8	L57 W63 M82 V88 M103 F155 P181 I183 F206 T209	L57-F86 HydrophobicContact CD1-CD2 4.42Å; L57-F86 HydrophobicContact CD1-CE2 4.27Å; L57-F86 HydrophobicContact CD1-CZ 4.5Å; W63-F86 HydrophobicContact CZ2-CB 4.3Å; W63-F86 HydrophobicContact CZ2-CD2 4.41Å; M82-F86 HydrophobicContact CE-CB 3.94Å; F86-V88 HydrophobicContact CD1-CG1 4.29Å; F86-V88 HydrophobicContact CE1-CG1 3.58Å; F86-V88 HydrophobicContact CZ-CG1 4.19Å; F86-M103 HydrophobicContact CB-CE 4.39Å; F86-M103 HydrophobicContact CD1-CE 3.36Å; F86-M103 HydrophobicContact CD1-SD 4.4Å; F86-M103 HydrophobicContact CD2-CE 3.78Å; F86-M103 HydrophobicContact CE1-CE 3.32Å; F86-M103 HydrophobicContact CE2-CE 3.74Å; F86-M103 HydrophobicContact CG-CE 3.59Å; F86-M103 HydrophobicContact CG-SD 4.32Å; F86-M103 HydrophobicContact CZ-CE 3.51Å; F86-F155 HydrophobicContact CB-CB 4.37Å; F86-F155 AromaticContact CD1-CD2 3.96Å; F86-F155 HydrophobicContact CD1-CD2 3.96Å; F86-F155 HydrophobicContact CD1-CG 4.48Å; F86-F155 WeakPolarHBondContact O-CB 3.32Å; F86-F155 PolarHBondContact O-N 3.29Å; F86-P181 HydrophobicContact CD2-CB 4.26Å; F86-P181 HydrophobicContact CE2-CB 4.1Å; F86-I183 HydrophobicContact CE1-CB 4.25Å; F86-I183 HydrophobicContact CE1-CG2 4.46Å; F86-I183 HydrophobicContact CZ-CB 4.41Å; F86-I183 HydrophobicContact CZ-CG2 4.38Å; F86-F206 HydrophobicContact CE2-CD2 4.14Å; F86-F206 AromaticContact CZ-CD2 3.76Å; F86-F206 HydrophobicContact CZ-CD2 3.76Å; F86-F206 HydrophobicContact CZ-CE2 4.07Å; F86-T209 HydrophobicContact CD2-CG2 4.1Å; F86-T209 HydrophobicContact CE2-CG2 3.88Å
87	K	98.1	Very high	96.9	Very high	41 Å²	41	56.1 Å²	56.1	18%	0.178	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	140.8	-176.4	-66.3	162.2	178	173.6	0	108.4	H58 E59 S85 V153	H58-K87 HydrophobicContact CB-CB 3.94Å; H58-K87 VanDerWaalsContact CD2-CD 3.41Å; H58-K87 WeakPolarHBondContact CD2-CD 3.18Å; H58-K87 PolarHBondContact N-O 3.01Å; E59-K87 IonicContact OE1-NZ 3.8Å; E59-K87 PolarHBondContact OE1-NZ 3.11Å; E59-K87 WeakPolarHBondContact OE2-CD 3.45Å; E59-K87 IonicContact OE2-NZ 2.8Å; E59-K87 PolarHBondContact OE2-NZ 3.02Å; S85-K87 PolarHBondContact O-N 2.98Å; S85-K87 VanDerWaalsContact O-N 3.13Å; K87-V153 CarbonylContact C-O 3.57Å; K87-V153 VanDerWaalsContact CA-O 3.27Å; K87-V153 WeakPolarHBondContact CA-O 3.26Å
88	V	98.2	Very high	96.9	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	151.7	177.1	-63.8	0	0	0	0	112.8	V55 Y56 F86 V90 V153 I183 F206	V55-V88 HydrophobicContact CG1-CB 3.64Å; V55-V88 HydrophobicContact CG1-CG1 3.69Å; V55-V88 HydrophobicContact CG1-CG2 3.92Å; Y56-V88 CarbonylContact O-C 3.57Å; Y56-V88 VanDerWaalsContact O-CA 3.24Å; Y56-V88 WeakPolarHBondContact O-CA 3.48Å; Y56-V88 WeakPolarHBondContact O-CB 3.2Å; F86-V88 HydrophobicContact CD1-CG1 4.29Å; F86-V88 HydrophobicContact CE1-CG1 3.58Å; F86-V88 HydrophobicContact CZ-CG1 4.19Å; V88-V90 HydrophobicContact CG2-CG2 4.03Å; V88-V153 HydrophobicContact CG2-CB 4Å; V88-V153 PolarHBondContact N-O 2.9Å; V88-V153 PolarHBondContact O-N 3.3Å; V88-I183 HydrophobicContact CG2-CD1 3.64Å; V88-F206 HydrophobicContact CG1-CE2 4.15Å
89	K	97.9	Very high	96.8	Very high	116 Å²	116	49.2 Å²	49.2	50%	0.504	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	131.3	160.1	-174.2	176.5	-179	178.1	0	108.2	Y56 L152	Y56-K89 PolarHBondContact N-O 2.79Å; Y56-K89 PolarHBondContact O-N 3Å; K89-L152 HydrophobicContact CB-CD2 3.92Å
90	V	97.3	Very high	96.8	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.006	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	141.3	176.7	-170.9	0	0	0	0	109.4	I53 K54 V55 V88 L93 L101 M149 V153 I185	I53-V90 HydrophobicContact CG2-CG1 4.4Å; K54-V90 WeakPolarHBondContact O-CA 3.4Å; V55-V90 HydrophobicContact CG1-CG2 4.46Å; V55-V90 HydrophobicContact CG2-CG1 4.22Å; V55-V90 HydrophobicContact CG2-CG2 4.3Å; V88-V90 HydrophobicContact CG2-CG2 4.03Å; V90-L93 HydrophobicContact CB-CD1 4.43Å; V90-L93 HydrophobicContact CG1-CD1 3.75Å; V90-L93 HydrophobicContact CG1-CD2 4.18Å; V90-L93 HydrophobicContact CG1-CG 3.82Å; V90-L101 HydrophobicContact CG2-CD2 4.3Å; V90-M149 WeakPolarHBondContact O-CG 3.18Å; V90-V153 HydrophobicContact CG2-CG2 4.26Å; V90-I185 HydrophobicContact CG1-CD1 3.94Å
91	T	96.7	Very high	96.8	Very high	44 Å²	44	44.6 Å²	44.6	27%	0.27	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	164.3	172	65.8	0	0	0	0	110.7	I53 K54 Y56	I53-T91 WeakPolarHBondContact CA-O 3.23Å; K54-T91 PolarHBondContact N-O 3.31Å; K54-T91 PolarHBondContact O-N 3.3Å; Y56-T91 HydrophobicContact CE2-CG2 4.27Å
92	G	94.8	Very high	96.8	Very high	43 Å²	43	38.5 Å²	38.5	44%	0.443	20%	0.203	S	C	.	.	S	Bend	trans	82.2	5.2	178.1	0	0	0	0	0	115.6	I53 M149	I53-G92 WeakPolarHBondContact CG1-O 3.5Å; G92-M149 PolarHBondContact N-SD 3Å
93	L	95.5	Very high	96.8	Very high	6 Å²	6	38 Å²	38	3%	0.031	20%	0.2	C	C	.	.			trans	-72	145.4	171.7	-58.5	176	0	0	0	110.6	I53 V90 P95 Y99 W148 M149 I185	I53-L93 HydrophobicContact CD1-CD2 3.71Å; I53-L93 HydrophobicContact CG1-CD2 3.99Å; I53-L93 HydrophobicContact CG2-CD2 4.08Å; V90-L93 HydrophobicContact CB-CD1 4.43Å; V90-L93 HydrophobicContact CG1-CD1 3.75Å; V90-L93 HydrophobicContact CG1-CD2 4.18Å; V90-L93 HydrophobicContact CG1-CG 3.82Å; L93-P95 WeakPolarHBondContact O-CD 3.4Å; L93-Y99 HydrophobicContact CB-CD2 4.44Å; L93-Y99 HydrophobicContact CB-CE2 3.85Å; L93-Y99 HydrophobicContact CD1-CD2 4.4Å; L93-Y99 HydrophobicContact CD2-CD1 3.97Å; L93-Y99 HydrophobicContact CD2-CD2 4.33Å; L93-Y99 HydrophobicContact CD2-CE1 3.72Å; L93-Y99 HydrophobicContact CD2-CE2 4.13Å; L93-Y99 HydrophobicContact CD2-CG 4.26Å; L93-Y99 HydrophobicContact CG-CE2 4.42Å; L93-W148 HydrophobicContact CD1-CB 3.52Å; L93-W148 HydrophobicContact CD1-CG 4.22Å; L93-M149 HydrophobicContact CB-CE 4.17Å; L93-M149 HydrophobicContact CB-CG 4.14Å; L93-M149 HydrophobicContact CB-SD 3.92Å; L93-M149 HydrophobicContact CD1-CG 4.09Å; L93-M149 HydrophobicContact CG-CG 4.25Å; L93-M149 HydrophobicContact CG-SD 4.44Å; L93-M149 PolarHBondContact N-SD 2.93Å; L93-M149 WeakPolarHBondContact O-CE 3.36Å; L93-I185 HydrophobicContact CD2-CG2 4.09Å
94	N	94.5	Very high	96.7	Very high	77 Å²	77	37.4 Å²	37.4	41%	0.412	20%	0.198	S	C	.	.			trans	-65.3	122.6	169.3	-179.4	-40	0	0	0	108.8	K96 T97 Y99 G145	N94-K96 PolarHBondContact O-N 2.88Å; N94-K96 VanDerWaalsContact O-N 3.08Å; N94-K96 PolarHBondContact OD1-N 3.33Å; N94-T97 WeakPolarHBondContact CB-OG1 3.49Å; N94-T97 VanDerWaalsContact CG-OG1 3.27Å; N94-T97 PolarHBondContact O-N 3Å; N94-Y99 PolarHBondContact N-OH 3.12Å; N94-G145 WeakPolarHBondContact O-CA 3.36Å
95	P	96	Very high	96.7	Very high	74 Å²	74	38 Å²	38	48%	0.481	20%	0.202	S	C	.	.	S	Bend	trans	-57.2	-28.1	-175.7	-28.9	36.9	0	0	0	115.1	L93 A146 M149	L93-P95 WeakPolarHBondContact O-CD 3.4Å; P95-A146 HydrophobicContact CB-CB 4.1Å; P95-A146 VanDerWaalsContact O-CB 3.28Å; P95-A146 WeakPolarHBondContact O-CB 3.32Å; P95-A146 PolarHBondContact O-N 2.83Å; P95-A146 VanDerWaalsContact O-N 3.1Å; P95-M149 HydrophobicContact CG-CE 4.25Å
96	K	94.4	Very high	96.7	Very high	180 Å²	180	38.6 Å²	38.6	78%	0.783	21%	0.205	S	C	*	.	S	Bend	trans	-95.5	-32.1	-173.2	-62.2	-178.5	179.8	179.3	0	113.7	N94	N94-K96 PolarHBondContact O-N 2.88Å; N94-K96 VanDerWaalsContact O-N 3.08Å; N94-K96 PolarHBondContact OD1-N 3.33Å
97	T	94.1	Very high	96.6	Very high	24 Å²	24	41.7 Å²	41.7	15%	0.147	23%	0.225	C	C	.	.	S	Bend	trans	-68.4	142.7	179.5	-49.4	0	0	0	0	111.1	N94 Y99 T144 G145 K187 A188	N94-T97 WeakPolarHBondContact CB-OG1 3.49Å; N94-T97 VanDerWaalsContact CG-OG1 3.27Å; N94-T97 PolarHBondContact O-N 3Å; T97-Y99 HydrophobicContact CG2-CE2 4.33Å; T97-Y99 WeakPolarHBondContact O-CD2 3.5Å; T97-Y99 WeakPolarHBondContact O-CE2 3.48Å; T97-T144 CarbonylContact O-C 3.55Å; T97-T144 WeakPolarHBondContact O-CA 3.38Å; T97-G145 PolarHBondContact O-N 3.4Å; T97-K187 HydrophobicContact CG2-CG 4.08Å; T97-A188 HydrophobicContact CG2-CB 4.3Å
98	K	96.1	Very high	96.4	Very high	74 Å²	74	41.8 Å²	41.8	32%	0.322	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	149.4	169	-70.9	172.6	-172.5	171.2	0	111.7	P142 A143 T144 A188 N192 F194	K98-P142 HydrophobicContact CD-CB 4.47Å; K98-A143 CarbonylContact C-O 3.56Å; K98-A143 WeakPolarHBondContact CA-O 3.48Å; K98-T144 HydrophobicContact CG-CG2 4.48Å; K98-A188 HydrophobicContact CB-CB 4.02Å; K98-A188 WeakPolarHBondContact O-CB 3.39Å; K98-A188 PolarHBondContact O-N 2.95Å; K98-N192 WeakPolarHBondContact CB-OD1 3.47Å; K98-N192 WeakPolarHBondContact CE-ND2 3.26Å; K98-N192 WeakPolarHBondContact CG-OD1 3.4Å; K98-N192 PolarHBondContact N-OD1 3.12Å; K98-F194 HydrophobicContact CB-CE2 4.46Å; K98-F194 HydrophobicContact CB-CZ 4.05Å
99	Y	96.9	Very high	96.2	Very high	5 Å²	5	43.5 Å²	43.5	2%	0.02	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	144.9	172.4	-59.8	-96.7	0	0	0	109.9	M50 I53 L93 N94 T97 A143 W148 I185 V186 K187	M50-Y99 HydrophobicContact CE-CE1 4.42Å; I53-Y99 HydrophobicContact CD1-CE1 4.42Å; L93-Y99 HydrophobicContact CB-CD2 4.44Å; L93-Y99 HydrophobicContact CB-CE2 3.85Å; L93-Y99 HydrophobicContact CD1-CD2 4.4Å; L93-Y99 HydrophobicContact CD2-CD1 3.97Å; L93-Y99 HydrophobicContact CD2-CD2 4.33Å; L93-Y99 HydrophobicContact CD2-CE1 3.72Å; L93-Y99 HydrophobicContact CD2-CE2 4.13Å; L93-Y99 HydrophobicContact CD2-CG 4.26Å; L93-Y99 HydrophobicContact CG-CE2 4.42Å; N94-Y99 PolarHBondContact N-OH 3.12Å; T97-Y99 HydrophobicContact CG2-CE2 4.33Å; T97-Y99 WeakPolarHBondContact O-CD2 3.5Å; T97-Y99 WeakPolarHBondContact O-CE2 3.48Å; Y99-A143 PolarHBondContact N-O 3.28Å; Y99-A143 PolarHBondContact O-N 2.98Å; Y99-A143 VanDerWaalsContact O-N 3.15Å; Y99-W148 PolarHBondContact O-NE1 3.45Å; Y99-I185 HydrophobicContact CD1-CG2 3.65Å; Y99-I185 HydrophobicContact CE1-CG2 4.39Å; Y99-I185 HydrophobicContact CG-CG2 4.3Å; Y99-V186 CarbonylContact C-O 3.59Å; Y99-V186 WeakPolarHBondContact CA-O 3.41Å; Y99-K187 HydrophobicContact CD1-CB 3.9Å; Y99-K187 HydrophobicContact CD1-CG 4.27Å; Y99-K187 HydrophobicContact CE1-CB 3.66Å; Y99-K187 HydrophobicContact CE1-CD 4.4Å; Y99-K187 HydrophobicContact CE1-CG 3.65Å
100	I	97.5	Very high	95.9	Very high	38 Å²	38	42.1 Å²	42.1	20%	0.195	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	129.6	163.1	-67.1	167.6	0	0	0	107	L102 V137 P142 V186 F194	I100-L102 HydrophobicContact CG2-CD2 4.18Å; I100-V137 HydrophobicContact CG2-CG1 4.01Å; I100-P142 HydrophobicContact CG1-CB 3.86Å; I100-V186 HydrophobicContact CB-CB 4.38Å; I100-V186 PolarHBondContact N-O 3.41Å; I100-V186 PolarHBondContact O-N 3.07Å; I100-F194 HydrophobicContact CB-CE1 4.39Å; I100-F194 HydrophobicContact CD1-CD1 3.74Å; I100-F194 HydrophobicContact CD1-CD2 3.97Å; I100-F194 HydrophobicContact CD1-CE1 3.74Å; I100-F194 HydrophobicContact CD1-CE2 3.98Å; I100-F194 HydrophobicContact CD1-CG 3.86Å; I100-F194 HydrophobicContact CD1-CZ 3.86Å; I100-F194 HydrophobicContact CG1-CD1 4.27Å; I100-F194 HydrophobicContact CG1-CE1 3.74Å; I100-F194 HydrophobicContact CG1-CE2 4.12Å; I100-F194 HydrophobicContact CG1-CZ 3.65Å
101	L	97.9	Very high	95.7	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	127.3	170.4	-93.4	66.6	0	0	0	108.7	V90 H138 S141 W148 V153 F155 I183 I185	V90-L101 HydrophobicContact CG2-CD2 4.3Å; L101-H138 HydrophobicContact CB-CB 4.28Å; L101-H138 VanDerWaalsContact O-CB 3.24Å; L101-H138 WeakPolarHBondContact O-CB 3.34Å; L101-H138 PolarHBondContact O-N 2.88Å; L101-S141 PolarHBondContact N-OG 2.92Å; L101-S141 PolarHBondContact O-OG 3.21Å; L101-W148 HydrophobicContact CB-CH2 3.97Å; L101-W148 HydrophobicContact CB-CZ2 4.1Å; L101-W148 HydrophobicContact CB-CZ3 4.24Å; L101-W148 HydrophobicContact CD1-CD2 3.92Å; L101-W148 HydrophobicContact CD1-CE3 4.48Å; L101-W148 HydrophobicContact CD1-CG 4.13Å; L101-W148 HydrophobicContact CD1-CZ2 4.2Å; L101-W148 HydrophobicContact CD2-CD2 4.09Å; L101-W148 HydrophobicContact CD2-CE3 3.87Å; L101-W148 HydrophobicContact CD2-CZ3 4.19Å; L101-W148 HydrophobicContact CG-CD2 4.46Å; L101-V153 HydrophobicContact CD2-CB 4.36Å; L101-V153 HydrophobicContact CD2-CG1 3.88Å; L101-V153 HydrophobicContact CD2-CG2 3.95Å; L101-F155 HydrophobicContact CB-CZ 4.49Å; L101-I183 HydrophobicContact CD2-CD1 4.49Å; L101-I185 HydrophobicContact CD1-CB 4.37Å; L101-I185 HydrophobicContact CD1-CG1 4.1Å; L101-I185 HydrophobicContact CD1-CG2 3.9Å; L101-I185 HydrophobicContact CG-CG1 4.06Å
102	L	97.3	Very high	95.5	Very high	21 Å²	21	47.9 Å²	47.9	11%	0.11	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	161	179.1	67	87.2	0	0	0	111.1	I100 L135 Y136 V137 H184 V186	I100-L102 HydrophobicContact CG2-CD2 4.18Å; L102-L135 HydrophobicContact CD1-CB 4.4Å; L102-L135 HydrophobicContact CD1-CD1 4.23Å; L102-L135 HydrophobicContact CD1-CD2 4.17Å; L102-L135 HydrophobicContact CD2-CD1 4.44Å; L102-Y136 CarbonylContact C-O 3.57Å; L102-Y136 VanDerWaalsContact CA-O 3.24Å; L102-Y136 WeakPolarHBondContact CA-O 3.49Å; L102-Y136 WeakPolarHBondContact CB-O 3.44Å; L102-V137 HydrophobicContact CB-CB 4.48Å; L102-V137 HydrophobicContact CB-CG2 4.16Å; L102-H184 HydrophobicContact CD1-CB 3.74Å; L102-H184 HydrophobicContact CG-CB 4.06Å; L102-H184 PolarHBondContact N-O 3.29Å; L102-H184 PolarHBondContact O-N 2.92Å; L102-V186 HydrophobicContact CD2-CG2 4.43Å
103	M	97.9	Very high	95.3	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	140.6	-178.9	165.1	158.6	-76.9	0	0	110.2	M82 F86 Y136 F155 L158 P181 R182 I183	M82-M103 HydrophobicContact CE-SD 4.15Å; F86-M103 HydrophobicContact CB-CE 4.39Å; F86-M103 HydrophobicContact CD1-CE 3.36Å; F86-M103 HydrophobicContact CD1-SD 4.4Å; F86-M103 HydrophobicContact CD2-CE 3.78Å; F86-M103 HydrophobicContact CE1-CE 3.32Å; F86-M103 HydrophobicContact CE2-CE 3.74Å; F86-M103 HydrophobicContact CG-CE 3.59Å; F86-M103 HydrophobicContact CG-SD 4.32Å; F86-M103 HydrophobicContact CZ-CE 3.51Å; M103-Y136 PolarHBondContact N-O 3.1Å; M103-Y136 PolarHBondContact O-N 2.68Å; M103-F155 HydrophobicContact CB-CD1 3.68Å; M103-F155 HydrophobicContact CB-CE1 3.66Å; M103-F155 HydrophobicContact CB-CZ 4.48Å; M103-F155 HydrophobicContact SD-CB 4.36Å; M103-F155 HydrophobicContact SD-CD1 4.3Å; M103-F155 HydrophobicContact SD-CG 4.33Å; M103-L158 HydrophobicContact CB-CD1 4.18Å; M103-L158 HydrophobicContact CG-CD1 3.7Å; M103-L158 HydrophobicContact SD-CD1 3.52Å; M103-L158 VanDerWaalsContact SD-CD1 3.52Å; M103-P181 HydrophobicContact CE-CB 4.16Å; M103-R182 VanDerWaalsContact CA-O 3.32Å; M103-R182 WeakPolarHBondContact CA-O 3.49Å; M103-I183 HydrophobicContact CE-CB 4.39Å
104	D	96.9	Very high	95.1	Very high	15 Å²	15	52.3 Å²	52.3	8%	0.08	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	172.6	162.4	85.1	5.2	0	0	0	111.6	L135 R182 H184	D104-L135 HydrophobicContact CB-CD2 3.72Å; D104-R182 PolarHBondContact N-O 2.8Å; D104-R182 VanDerWaalsContact N-O 3.1Å; D104-R182 PolarHBondContact O-N 3.43Å; D104-R182 WeakPolarHBondContact OD1-CB 3.45Å; D104-R182 WeakPolarHBondContact OD1-CG 3.4Å; D104-R182 IonicContact OD1-CZ 3.6Å; D104-R182 IonicContact OD1-NE 2.81Å; D104-R182 PolarHBondContact OD1-NE 3.34Å; D104-R182 IonicContact OD1-NH2 3.57Å; D104-R182 IonicContact OD2-CZ 2.68Å; D104-R182 IonicContact OD2-NE 2.93Å; D104-R182 PolarHBondContact OD2-NE 3.38Å; D104-R182 IonicContact OD2-NH2 2.67Å; D104-R182 PolarHBondContact OD2-NH2 2.97Å; D104-H184 IonicContact OD1-NE2 3.55Å; D104-H184 PolarHBondContact OD1-NE2 2.87Å; D104-H184 IonicContact OD2-NE2 2.72Å
105	V	97.6	Very high	94.9	Very high	12 Å²	12	50 Å²	50	7%	0.073	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	105.7	177.3	180	0	0	0	0	106.7	I171 L173 Y179 F211	V105-I171 HydrophobicContact CB-CG2 4.15Å; V105-I171 HydrophobicContact CG2-CD1 3.96Å; V105-I171 HydrophobicContact CG2-CG2 4.37Å; V105-L173 HydrophobicContact CB-CD2 4.27Å; V105-L173 HydrophobicContact CG1-CD1 4.33Å; V105-L173 HydrophobicContact CG1-CD2 3.79Å; V105-Y179 HydrophobicContact CG1-CD1 4.01Å; V105-Y179 HydrophobicContact CG1-CG 4.02Å; V105-F211 HydrophobicContact CG1-CE1 4.34Å; V105-F211 HydrophobicContact CG1-CZ 4.01Å
106	V	96.1	Very high	94.3	Very high	39 Å²	39	47.6 Å²	47.6	24%	0.236	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	152.9	-178.4	-66.5	0	0	0	0	111.3	A108 Y179 Q180 R182	V106-A108 PolarHBondContact O-N 3.27Å; V106-Y179 CarbonylContact O-C 3.54Å; V106-Y179 WeakPolarHBondContact O-CA 3.3Å; V106-Y179 WeakPolarHBondContact O-CD1 3.28Å; V106-Q180 HydrophobicContact CG2-CB 4.32Å; V106-Q180 PolarHBondContact N-O 3.15Å; V106-Q180 VanDerWaalsContact N-O 3.09Å; V106-Q180 PolarHBondContact O-N 3.12Å; V106-R182 HydrophobicContact CG2-CG 4.16Å
107	P	96.1	Very high	93.7	Very high	66 Å²	66	46.1 Å²	46.1	43%	0.429	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.5	137.9	167.3	-23.2	33.7	0	0	0	110.7	A130 Y179	P107-A130 HydrophobicContact CG-CB 3.84Å; P107-Y179 HydrophobicContact CG-CE1 4.14Å
108	A	94.8	Very high	93	Very high	42 Å²	42	50 Å²	50	35%	0.347	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	-23.8	176.6	0	0	0	0	0	112.4	V106 K178 Q180	V106-A108 PolarHBondContact O-N 3.27Å; A108-K178 HydrophobicContact CB-CB 4.28Å; A108-K178 HydrophobicContact CB-CD 4.31Å; A108-K178 HydrophobicContact CB-CG 3.88Å; A108-K178 PolarHBondContact N-O 2.96Å; A108-Q180 HydrophobicContact CB-CB 4.46Å
109	D	93.1	Very high	92.1	Very high	37 Å²	37	53 Å²	53	20%	0.198	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.8	170.4	-177.1	45.7	69.7	0	0	0	110.2	H111 Y113 K178	D109-H111 VanDerWaalsContact C-N 3.31Å; D109-H111 PolarHBondContact O-N 2.74Å; D109-H111 IonicContact OD1-CG 3.92Å; D109-H111 IonicContact OD1-ND1 3.47Å; D109-H111 PolarHBondContact OD1-ND1 3.45Å; D109-Y113 WeakPolarHBondContact OD1-CE2 3.45Å; D109-Y113 PolarHBondContact OD1-OH 2.72Å; D109-Y113 PolarHBondContact OD2-OH 2.85Å; D109-K178 WeakPolarHBondContact OD2-CD 3.46Å; D109-K178 IonicContact OD2-NZ 3.69Å; D109-K178 PolarHBondContact OD2-NZ 3.48Å
110	D	92.6	Very high	90.7	Very high	86 Å²	86	53.3 Å²	53.3	46%	0.46	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	38	-176.7	-167.8	13.4	0	0	0	111.8	K126 A127	D110-K126 VanDerWaalsContact CG-CE 3.43Å; D110-K126 WeakPolarHBondContact O-CA 3.32Å; D110-K126 WeakPolarHBondContact OD1-CE 3.45Å; D110-K126 WeakPolarHBondContact OD1-CG 2.82Å; D110-K126 WeakPolarHBondContact OD2-CE 3.24Å; D110-K126 IonicContact OD2-NZ 3.65Å; D110-A127 PolarHBondContact O-N 2.87Å; D110-A127 WeakPolarHBondContact OD1-CB 3.34Å
111	H	92.1	Very high	89	Confident	76 Å²	76	61.7 Å²	61.7	35%	0.352	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	144.7	-175.7	-57	114	0	0	0	113.8	D109 Y113 V123 H177	D109-H111 VanDerWaalsContact C-N 3.31Å; D109-H111 PolarHBondContact O-N 2.74Å; D109-H111 IonicContact OD1-CG 3.92Å; D109-H111 IonicContact OD1-ND1 3.47Å; D109-H111 PolarHBondContact OD1-ND1 3.45Å; H111-Y113 HydrophobicContact CB-CD2 4.45Å; H111-Y113 HydrophobicContact CB-CE2 3.82Å; H111-V123 HydrophobicContact CB-CG1 4.13Å; H111-V123 HydrophobicContact CB-CG2 4.34Å; H111-H177 PolarHBondContact O-CD2 2.76Å
112	R	92.8	Very high	87.9	Confident	91 Å²	91	63.7 Å²	63.7	34%	0.343	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	118.3	168.7	-170.1	177.9	-165.3	-84.3	6	109.8	T124 G125 K126 E128	R112-T124 PolarHBondContact O-N 2.96Å; R112-G125 PolarHBondContact N-O 3.28Å; R112-K126 WeakPolarHBondContact CB-O 3.38Å; R112-E128 IonicContact CZ-OE1 3.49Å; R112-E128 VanDerWaalsContact CZ-OE1 3.27Å; R112-E128 IonicContact NE-OE1 3.3Å; R112-E128 PolarHBondContact NE-OE1 3.47Å; R112-E128 IonicContact NH2-OE1 3.65Å; R112-E128 PolarHBondContact NH2-OE1 3.42Å
113	Y	92.2	Very high	87.1	Confident	28 Å²	28	66.2 Å²	66.2	11%	0.11	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	161.9	-172.8	-71	-81.1	0	0	0	113.1	D109 H111 W120 V123 M176 K178 I212	D109-Y113 WeakPolarHBondContact OD1-CE2 3.45Å; D109-Y113 PolarHBondContact OD1-OH 2.72Å; D109-Y113 PolarHBondContact OD2-OH 2.85Å; H111-Y113 HydrophobicContact CB-CD2 4.45Å; H111-Y113 HydrophobicContact CB-CE2 3.82Å; Y113-W120 VanDerWaalsContact CD1-O 3.29Å; Y113-W120 WeakPolarHBondContact CD1-O 3.45Å; Y113-V123 HydrophobicContact CD1-CG2 4.34Å; Y113-V123 HydrophobicContact CE1-CG2 3.88Å; Y113-M176 WeakPolarHBondContact CB-O 3.43Å; Y113-M176 PolarHBondContact N-O 3.41Å; Y113-M176 WeakPolarHBondContact O-CB 3.35Å; Y113-K178 HydrophobicContact CD2-CB 4.16Å; Y113-K178 HydrophobicContact CE2-CB 3.66Å; Y113-K178 HydrophobicContact CE2-CD 4.34Å; Y113-I212 HydrophobicContact CD2-CD1 4.35Å; Y113-I212 HydrophobicContact CG-CD1 4.23Å
114	K	90.8	Very high	86.3	Confident	113 Å²	113	70.2 Å²	70.2	49%	0.491	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	139	164.8	174	-172.2	172	-161.8	0	108.3	S122 T124	K114-S122 WeakPolarHBondContact CB-OG 3.33Å; K114-S122 PolarHBondContact N-O 3.09Å; K114-S122 PolarHBondContact O-OG 3.43Å; K114-T124 WeakPolarHBondContact CB-OG1 3.47Å
115	F	89.4	Confident	85.7	Confident	28 Å²	28	71 Å²	71	12%	0.123	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	126.7	168.5	-167.7	-108.5	0	0	0	109.1	N118 K119 W120 Q218 N219	F115-N118 HydrophobicContact CZ-CB 4.45Å; F115-K119 WeakPolarHBondContact CD2-O 3.34Å; F115-W120 HydrophobicContact CB-CD2 4.29Å; F115-W120 HydrophobicContact CB-CE3 4.24Å; F115-W120 HydrophobicContact CB-CH2 4.3Å; F115-W120 HydrophobicContact CB-CZ2 4.3Å; F115-W120 HydrophobicContact CB-CZ3 4.25Å; F115-W120 HydrophobicContact CD2-CB 4.46Å; F115-W120 AromaticContact CD2-CD1 3.66Å; F115-W120 AromaticContact CD2-CD2 3.76Å; F115-W120 HydrophobicContact CD2-CD2 3.76Å; F115-W120 AromaticContact CD2-CE2 3.74Å; F115-W120 HydrophobicContact CD2-CE3 4.47Å; F115-W120 AromaticContact CD2-CG 3.73Å; F115-W120 HydrophobicContact CD2-CG 3.73Å; F115-W120 HydrophobicContact CD2-CZ2 4.45Å; F115-W120 AromaticContact CD2-NE1 3.63Å; F115-W120 AromaticContact CE2-CD1 3.82Å; F115-W120 HydrophobicContact CE2-CG 4.26Å; F115-W120 AromaticContact CE2-NE1 3.93Å; F115-W120 HydrophobicContact CG-CD2 4.49Å; F115-Q218 HydrophobicContact CB-CB 3.61Å; F115-Q218 HydrophobicContact CB-CG 4.11Å; F115-Q218 HydrophobicContact CD1-CB 3.74Å; F115-Q218 HydrophobicContact CD2-CB 4.4Å; F115-Q218 HydrophobicContact CE1-CB 4.49Å; F115-Q218 WeakPolarHBondContact CE1-O 3.42Å; F115-Q218 HydrophobicContact CG-CB 3.68Å; F115-N219 HydrophobicContact CE1-CB 4.3Å; F115-N219 HydrophobicContact CE2-CB 3.8Å; F115-N219 HydrophobicContact CZ-CB 3.6Å
116	A	84.4	Confident	85.3	Confident	25 Å²	25	77.7 Å²	77.7	21%	0.207	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	150.1	176.3	0	0	0	0	0	108.7	N118 K119	A116-N118 PolarHBondContact O-N 3.49Å; A116-N118 VanDerWaalsContact O-N 3.08Å; A116-K119 PolarHBondContact N-O 3.25Å; A116-K119 VanDerWaalsContact N-O 3.12Å; A116-K119 WeakPolarHBondContact O-CA 3.42Å; A116-K119 PolarHBondContact O-N 2.77Å
117	D	81.1	Confident	84.8	Confident	148 Å²	148	76.8 Å²	76.8	79%	0.791	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	37	172.8	-43.2	-36.9	0	0	0	113.7	K119	D117-K119 PolarHBondContact O-N 3.4Å
118	N	78.7	Confident	84.4	Confident	106 Å²	106	77.2 Å²	77.2	57%	0.567	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.7	25.7	-172.4	-66	-62.8	0	0	0	115.4	F115 A116	F115-N118 HydrophobicContact CZ-CB 4.45Å; A116-N118 PolarHBondContact O-N 3.49Å; A116-N118 VanDerWaalsContact O-N 3.08Å
119	K	77.3	Confident	84.1	Confident	136 Å²	136	81 Å²	81	59%	0.591	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.6	139.9	-177.8	-68.9	170.8	-174.7	170.9	0	111.7	F115 A116 D117 W121	F115-K119 WeakPolarHBondContact CD2-O 3.34Å; A116-K119 PolarHBondContact N-O 3.25Å; A116-K119 VanDerWaalsContact N-O 3.12Å; A116-K119 WeakPolarHBondContact O-CA 3.42Å; A116-K119 PolarHBondContact O-N 2.77Å; D117-K119 PolarHBondContact O-N 3.4Å; K119-W121 VanDerWaalsContact C-N 3.3Å; K119-W121 HydrophobicContact CB-CE3 4.37Å; K119-W121 PolarHBondContact O-N 3.47Å
120	W	69.1	Low	83.5	Confident	13 Å²	13	82 Å²	82	5%	0.049	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	-1.4	175.4	-92.7	114.1	0	0	0	114.5	E72 Y113 F115 S122 M176 I212 V214 Q218	E72-W120 HydrophobicContact CG-CZ2 3.77Å; E72-W120 WeakPolarHBondContact OE1-CZ2 3.46Å; E72-W120 PolarHBondContact OE1-NE1 2.84Å; Y113-W120 VanDerWaalsContact CD1-O 3.29Å; Y113-W120 WeakPolarHBondContact CD1-O 3.45Å; F115-W120 HydrophobicContact CB-CD2 4.29Å; F115-W120 HydrophobicContact CB-CE3 4.24Å; F115-W120 HydrophobicContact CB-CH2 4.3Å; F115-W120 HydrophobicContact CB-CZ2 4.3Å; F115-W120 HydrophobicContact CB-CZ3 4.25Å; F115-W120 HydrophobicContact CD2-CB 4.46Å; F115-W120 AromaticContact CD2-CD1 3.66Å; F115-W120 AromaticContact CD2-CD2 3.76Å; F115-W120 HydrophobicContact CD2-CD2 3.76Å; F115-W120 AromaticContact CD2-CE2 3.74Å; F115-W120 HydrophobicContact CD2-CE3 4.47Å; F115-W120 AromaticContact CD2-CG 3.73Å; F115-W120 HydrophobicContact CD2-CG 3.73Å; F115-W120 HydrophobicContact CD2-CZ2 4.45Å; F115-W120 AromaticContact CD2-NE1 3.63Å; F115-W120 AromaticContact CE2-CD1 3.82Å; F115-W120 HydrophobicContact CE2-CG 4.26Å; F115-W120 AromaticContact CE2-NE1 3.93Å; F115-W120 HydrophobicContact CG-CD2 4.49Å; W120-S122 PolarHBondContact O-N 2.88Å; W120-M176 HydrophobicContact CH2-CE 3.63Å; W120-M176 HydrophobicContact CH2-SD 4.25Å; W120-M176 HydrophobicContact CZ3-CE 3.61Å; W120-I212 HydrophobicContact CB-CD1 4.43Å; W120-I212 HydrophobicContact CD2-CD1 3.59Å; W120-I212 HydrophobicContact CE3-CD1 3.39Å; W120-I212 HydrophobicContact CE3-CG2 4.48Å; W120-I212 HydrophobicContact CG-CD1 4.07Å; W120-I212 HydrophobicContact CH2-CB 4.32Å; W120-I212 HydrophobicContact CH2-CD1 4.35Å; W120-I212 HydrophobicContact CH2-CG2 3.7Å; W120-I212 HydrophobicContact CZ2-CG2 4.36Å; W120-I212 HydrophobicContact CZ3-CB 4.48Å; W120-I212 HydrophobicContact CZ3-CD1 3.8Å; W120-I212 HydrophobicContact CZ3-CG2 3.78Å; W120-V214 HydrophobicContact CH2-CG1 3.75Å; W120-V214 HydrophobicContact CZ2-CG1 4.07Å; W120-Q218 HydrophobicContact CH2-CB 4.23Å; W120-Q218 HydrophobicContact CH2-CG 3.66Å; W120-Q218 HydrophobicContact CZ2-CB 3.74Å; W120-Q218 HydrophobicContact CZ2-CG 3.61Å
121	W	61.8	Low	83	Confident	214 Å²	214	81.4 Å²	81.4	81%	0.811	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.3	2.4	-166.2	-83	-94.5	0	0	0	116.5	K119 V123	K119-W121 VanDerWaalsContact C-N 3.3Å; K119-W121 HydrophobicContact CB-CE3 4.37Å; K119-W121 PolarHBondContact O-N 3.47Å; W121-V123 PolarHBondContact O-N 3.1Å
122	S	73.6	Confident	82.5	Confident	41 Å²	41	83.1 Å²	83.1	29%	0.287	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	84.4	174.2	68.6	0	0	0	0	111.5	K114 W120 T124	K114-S122 WeakPolarHBondContact CB-OG 3.33Å; K114-S122 PolarHBondContact N-O 3.09Å; K114-S122 PolarHBondContact O-OG 3.43Å; W120-S122 PolarHBondContact O-N 2.88Å; S122-T124 PolarHBondContact O-N 2.83Å; S122-T124 VanDerWaalsContact O-N 3.15Å; S122-T124 PolarHBondContact O-OG1 2.85Å; S122-T124 VanDerWaalsContact O-OG1 3.12Å
123	V	80.5	Confident	81.9	Confident	74 Å²	74	82 Å²	82	45%	0.448	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	114.2	165.4	175.7	0	0	0	0	107.5	H111 Y113 W121	H111-V123 HydrophobicContact CB-CG1 4.13Å; H111-V123 HydrophobicContact CB-CG2 4.34Å; Y113-V123 HydrophobicContact CD1-CG2 4.34Å; Y113-V123 HydrophobicContact CE1-CG2 3.88Å; W121-V123 PolarHBondContact O-N 3.1Å
124	T	81.9	Confident	82	Confident	84 Å²	84	84 Å²	84	52%	0.515	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	-12.4	-173.2	-59.6	0	0	0	0	111.9	R112 K114 S122	R112-T124 PolarHBondContact O-N 2.96Å; K114-T124 WeakPolarHBondContact CB-OG1 3.47Å; S122-T124 PolarHBondContact O-N 2.83Å; S122-T124 VanDerWaalsContact O-N 3.15Å; S122-T124 PolarHBondContact O-OG1 2.85Å; S122-T124 VanDerWaalsContact O-OG1 3.12Å
125	G	84.5	Confident	82.2	Confident	33 Å²	33	83.2 Å²	83.2	34%	0.34	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	170.2	-173.3	174.4	0	0	0	0	0	112	R112	R112-G125 PolarHBondContact N-O 3.28Å
126	K	87.8	Confident	82.6	Confident	151 Å²	151	84.1 Å²	84.1	66%	0.657	47%	0.466	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62	153.7	168.8	-165.7	179.6	-172.8	-175.2	0	110.9	D110 R112	D110-K126 VanDerWaalsContact CG-CE 3.43Å; D110-K126 WeakPolarHBondContact O-CA 3.32Å; D110-K126 WeakPolarHBondContact OD1-CE 3.45Å; D110-K126 WeakPolarHBondContact OD1-CG 2.82Å; D110-K126 WeakPolarHBondContact OD2-CE 3.24Å; D110-K126 IonicContact OD2-NZ 3.65Å; R112-K126 WeakPolarHBondContact CB-O 3.38Å
127	A	87.2	Confident	83.2	Confident	20 Å²	20	86.4 Å²	86.4	17%	0.165	48%	0.477	C	S	.	.	P	Polyproline II helix	trans	-62.6	149.1	172.8	0	0	0	0	0	112.9	D110 H177	D110-A127 PolarHBondContact O-N 2.87Å; D110-A127 WeakPolarHBondContact OD1-CB 3.34Å; A127-H177 WeakPolarHBondContact CA-NE2 3.24Å; A127-H177 VanDerWaalsContact CB-CD2 3.49Å; A127-H177 WeakPolarHBondContact CB-CD2 3.42Å
128	E	87.3	Confident	84	Confident	76 Å²	76	79.8 Å²	79.8	36%	0.355	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-71.1	133.9	163.5	-67.4	163.5	-158.6	0	0	108.7	R112 A130 N174 H177	R112-E128 IonicContact CZ-OE1 3.49Å; R112-E128 VanDerWaalsContact CZ-OE1 3.27Å; R112-E128 IonicContact NE-OE1 3.3Å; R112-E128 PolarHBondContact NE-OE1 3.47Å; R112-E128 IonicContact NH2-OE1 3.65Å; R112-E128 PolarHBondContact NH2-OE1 3.42Å; E128-A130 PolarHBondContact O-N 3.02Å; E128-N174 PolarHBondContact O-ND2 3.13Å; E128-H177 PolarHBondContact N-NE2 3.18Å; E128-H177 IonicContact OE1-CE1 3.61Å; E128-H177 IonicContact OE2-CE1 2.75Å
129	P	87.1	Confident	84.9	Confident	120 Å²	120	78.1 Å²	78.1	78%	0.779	44%	0.436	S	S	*	.	P	Polyproline II helix	trans	-48.9	129.2	-178.5	-30.5	35.9	0	0	0	113.1	N174	P129-N174 PolarHBondContact O-ND2 2.97Å; P129-N174 VanDerWaalsContact O-ND2 3.14Å
130	A	80.8	Confident	85.9	Confident	58 Å²	58	74.8 Å²	74.8	48%	0.479	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-70.4	132.4	-179.6	0	0	0	0	0	110.7	P107 E128	P107-A130 HydrophobicContact CG-CB 3.84Å; E128-A130 PolarHBondContact O-N 3.02Å
131	M	82.4	Confident	87.2	Confident	75 Å²	75	75.4 Å²	75.4	37%	0.369	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-61.5	151.6	168.7	-68.3	-61.9	-70.3	0	0	110.4	G133 H164 I172	M131-G133 PolarHBondContact O-N 3.15Å; M131-H164 HydrophobicContact CE-CB 4.29Å; M131-I172 HydrophobicContact CB-CG2 4.19Å; M131-I172 HydrophobicContact CG-CG2 4.07Å
132	P	81	Confident	88.9	Confident	111 Å²	111	68.4 Å²	68.4	72%	0.721	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-50.7	125.8	179.6	-29.3	36.1	0	0	0	112.6	R134	P132-R134 PolarHBondContact O-N 3.11Å; P132-R134 VanDerWaalsContact O-N 3.1Å
133	G	80.3	Confident	90	Very high	67 Å²	67	67 Å²	67	69%	0.691	40%	0.404	S	S	*	.			trans	-59.6	111.8	-171.8	0	0	0	0	0	112.6	M131	M131-G133 PolarHBondContact O-N 3.15Å
134	R	94.5	Very high	90.8	Very high	71 Å²	71	66 Å²	66	27%	0.268	40%	0.399	S	S	.	.			trans	-81.3	129.1	175.6	-73.4	178.4	169.8	-166.1	-4.3	110.6	P132 D166 H170 I172	P132-R134 PolarHBondContact O-N 3.11Å; P132-R134 VanDerWaalsContact O-N 3.1Å; R134-D166 PolarHBondContact NH1-O 3.18Å; R134-D166 VanDerWaalsContact NH1-O 3.13Å; R134-D166 IonicContact NH1-OD2 3.95Å; R134-D166 PolarHBondContact NH1-OD2 2.89Å; R134-D166 PolarHBondContact NH2-O 3.36Å; R134-H170 WeakPolarHBondContact CD-O 3.5Å; R134-H170 PolarHBondContact NH1-O 3.19Å; R134-I172 VanDerWaalsContact CZ-CD1 3.44Å
135	L	95.6	Very high	91.5	Very high	97 Å²	97	62 Å²	62	51%	0.508	37%	0.374	S	S	.	.			trans	-86.7	132.3	175.5	-53.9	-177.6	0	0	0	110.5	L102 D104	L102-L135 HydrophobicContact CD1-CB 4.4Å; L102-L135 HydrophobicContact CD1-CD1 4.23Å; L102-L135 HydrophobicContact CD1-CD2 4.17Å; L102-L135 HydrophobicContact CD2-CD1 4.44Å; D104-L135 HydrophobicContact CB-CD2 3.72Å
136	Y	97.8	Very high	92.1	Very high	46 Å²	46	62.8 Å²	62.8	18%	0.18	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	108.2	166.4	179.5	-89.7	0	0	0	109.7	L102 M103 F155 K157 L158	L102-Y136 CarbonylContact C-O 3.57Å; L102-Y136 VanDerWaalsContact CA-O 3.24Å; L102-Y136 WeakPolarHBondContact CA-O 3.49Å; L102-Y136 WeakPolarHBondContact CB-O 3.44Å; M103-Y136 PolarHBondContact N-O 3.1Å; M103-Y136 PolarHBondContact O-N 2.68Å; Y136-F155 AromaticContact CD1-CD1 3.69Å; Y136-F155 HydrophobicContact CD1-CD1 3.69Å; Y136-F155 HydrophobicContact CD1-CE1 4.21Å; Y136-F155 AromaticContact CE1-CD1 3.88Å; Y136-F155 HydrophobicContact CE1-CD1 3.88Å; Y136-K157 WeakPolarHBondContact OH-CB 3.26Å; Y136-L158 HydrophobicContact CD1-CB 4.1Å; Y136-L158 HydrophobicContact CD1-CD1 3.94Å; Y136-L158 HydrophobicContact CD1-CG 4.19Å; Y136-L158 HydrophobicContact CD2-CB 4Å; Y136-L158 HydrophobicContact CD2-CD1 4.5Å; Y136-L158 HydrophobicContact CD2-CG 3.96Å; Y136-L158 HydrophobicContact CE1-CB 4.22Å; Y136-L158 HydrophobicContact CE2-CB 4.14Å; Y136-L158 HydrophobicContact CG-CB 3.98Å; Y136-L158 HydrophobicContact CG-CD1 3.78Å; Y136-L158 HydrophobicContact CG-CG 3.73Å
137	V	97.8	Very high	92.6	Very high	73 Å²	73	58.1 Å²	58.1	44%	0.442	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	131.9	172.5	-178	0	0	0	0	109.5	I100 L102	I100-V137 HydrophobicContact CG2-CG1 4.01Å; L102-V137 HydrophobicContact CB-CB 4.48Å; L102-V137 HydrophobicContact CB-CG2 4.16Å
138	H	98	Very high	93.1	Very high	10 Å²	10	57.4 Å²	57.4	5%	0.046	35%	0.35	C	S	.	.			trans	-65.7	130.4	175.7	-168.9	-83.9	0	0	0	109.4	L101 D140 S141 W148 V153 S154 F155	L101-H138 HydrophobicContact CB-CB 4.28Å; L101-H138 VanDerWaalsContact O-CB 3.24Å; L101-H138 WeakPolarHBondContact O-CB 3.34Å; L101-H138 PolarHBondContact O-N 2.88Å; H138-D140 IonicContact CE1-OD1 3.49Å; H138-D140 IonicContact CE1-OD2 3.49Å; H138-D140 PolarHBondContact CE1-OD2 3.29Å; H138-D140 VanDerWaalsContact CE1-OD2 3.3Å; H138-D140 IonicContact ND1-OD2 2.77Å; H138-D140 PolarHBondContact O-N 2.94Å; H138-S141 WeakPolarHBondContact O-CB 3.31Å; H138-S141 PolarHBondContact O-N 3.37Å; H138-S141 PolarHBondContact O-OG 2.91Å; H138-W148 HydrophobicContact CB-CH2 4.04Å; H138-W148 HydrophobicContact CB-CZ3 4.43Å; H138-W148 AromaticContact CE1-CZ3 3.89Å; H138-W148 AromaticContact CG-CH2 3.96Å; H138-W148 AromaticContact CG-CZ3 3.95Å; H138-W148 AromaticContact ND1-CH2 3.49Å; H138-W148 WeakPolarHBondContact ND1-CH2 3.49Å; H138-W148 AromaticContact ND1-CZ3 3.42Å; H138-W148 WeakPolarHBondContact ND1-CZ3 3.37Å; H138-V153 VanDerWaalsContact CD2-CG1 3.48Å; H138-V153 WeakPolarHBondContact CD2-CG1 3.19Å; H138-S154 PolarHBondContact NE2-N 3.42Å; H138-S154 PolarHBondContact NE2-O 3.4Å; H138-F155 HydrophobicContact CB-CE1 4.1Å; H138-F155 HydrophobicContact CB-CZ 4.3Å
139	P	97.5	Very high	93.6	Very high	70 Å²	70	56.5 Å²	56.5	46%	0.455	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-25.1	-167.8	23.2	-35.3	0	0	0	114.3	S141	P139-S141 PolarHBondContact O-N 3.01Å
140	D	97.3	Very high	94.1	Very high	67 Å²	67	57.9 Å²	57.9	36%	0.358	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	1.5	177.7	-49.3	-3.7	0	0	0	112.6	H138 A143 H147 W148	H138-D140 IonicContact CE1-OD1 3.49Å; H138-D140 IonicContact CE1-OD2 3.49Å; H138-D140 PolarHBondContact CE1-OD2 3.29Å; H138-D140 VanDerWaalsContact CE1-OD2 3.3Å; H138-D140 IonicContact ND1-OD2 2.77Å; H138-D140 PolarHBondContact O-N 2.94Å; D140-A143 VanDerWaalsContact O-CB 3.25Å; D140-A143 WeakPolarHBondContact O-CB 3.25Å; D140-H147 IonicContact OD2-NE2 3.43Å; D140-W148 HydrophobicContact CB-CH2 3.93Å; D140-W148 HydrophobicContact CB-CZ3 4.2Å
141	S	96.8	Very high	94.8	Very high	25 Å²	25	60 Å²	60	18%	0.175	34%	0.336	C	S	.	.			trans	-83.3	142.2	179	-55.3	0	0	0	0	112.6	L101 H138 P139 W148	L101-S141 PolarHBondContact N-OG 2.92Å; L101-S141 PolarHBondContact O-OG 3.21Å; H138-S141 WeakPolarHBondContact O-CB 3.31Å; H138-S141 PolarHBondContact O-N 3.37Å; H138-S141 PolarHBondContact O-OG 2.91Å; P139-S141 PolarHBondContact O-N 3.01Å; S141-W148 WeakPolarHBondContact OG-CH2 3.42Å; S141-W148 WeakPolarHBondContact OG-CZ2 3.49Å
142	P	96.7	Very high	95.5	Very high	68 Å²	68	59.8 Å²	59.8	44%	0.442	34%	0.337	S	S	.	.	S	Bend	cis	-86.3	128.4	-4.1	32.4	-32.6	0	0	0	112.6	K98 I100 F194	K98-P142 HydrophobicContact CD-CB 4.47Å; I100-P142 HydrophobicContact CG1-CB 3.86Å; P142-F194 HydrophobicContact CB-CE2 3.57Å; P142-F194 HydrophobicContact CB-CZ 3.76Å; P142-F194 HydrophobicContact CG-CE2 4.13Å
143	A	97.6	Very high	96.4	Very high	12 Å²	12	54.7 Å²	54.7	10%	0.099	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	163.2	176.7	0	0	0	0	0	112.4	K98 Y99 D140 H147 W148	K98-A143 CarbonylContact C-O 3.56Å; K98-A143 WeakPolarHBondContact CA-O 3.48Å; Y99-A143 PolarHBondContact N-O 3.28Å; Y99-A143 PolarHBondContact O-N 2.98Å; Y99-A143 VanDerWaalsContact O-N 3.15Å; D140-A143 VanDerWaalsContact O-CB 3.25Å; D140-A143 WeakPolarHBondContact O-CB 3.25Å; A143-H147 HydrophobicContact CB-CB 3.9Å; A143-W148 HydrophobicContact CB-CZ2 4.06Å; A143-W148 PolarHBondContact O-NE1 3.14Å
144	T	97.3	Very high	97.2	Very high	53 Å²	53	52.9 Å²	52.9	33%	0.325	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	156.1	-178.3	57.6	0	0	0	0	112.5	T97 K98 A146 H147 W148	T97-T144 CarbonylContact O-C 3.55Å; T97-T144 WeakPolarHBondContact O-CA 3.38Å; K98-T144 HydrophobicContact CG-CG2 4.48Å; T144-A146 PolarHBondContact O-N 3.26Å; T144-H147 WeakPolarHBondContact O-CA 3.49Å; T144-H147 VanDerWaalsContact O-CB 3.3Å; T144-H147 WeakPolarHBondContact O-CB 3.46Å; T144-H147 PolarHBondContact O-N 3.22Å; T144-H147 PolarHBondContact OG1-N 2.92Å; T144-W148 PolarHBondContact O-N 3.1Å; T144-W148 VanDerWaalsContact O-N 3.12Å
145	G	96.6	Very high	97.4	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-55.9	-34.2	173.1	0	0	0	0	0	113	N94 T97 H147 W148 M149	N94-G145 WeakPolarHBondContact O-CA 3.36Å; T97-G145 PolarHBondContact O-N 3.4Å; G145-H147 VanDerWaalsContact C-N 3.29Å; G145-H147 PolarHBondContact O-N 3.34Å; G145-W148 PolarHBondContact O-N 3Å; G145-M149 WeakPolarHBondContact O-CB 3.47Å; G145-M149 WeakPolarHBondContact O-CG 3.24Å; G145-M149 PolarHBondContact O-N 2.8Å
146	A	97.8	Very high	97.4	Very high	49 Å²	49	49.6 Å²	49.6	41%	0.405	27%	0.265	S	S	.	.	H	α-helix	trans	-62.2	-33.9	172.4	0	0	0	0	0	113	P95 T144 R150	P95-A146 HydrophobicContact CB-CB 4.1Å; P95-A146 VanDerWaalsContact O-CB 3.28Å; P95-A146 WeakPolarHBondContact O-CB 3.32Å; P95-A146 PolarHBondContact O-N 2.83Å; P95-A146 VanDerWaalsContact O-N 3.1Å; T144-A146 PolarHBondContact O-N 3.26Å; A146-R150 WeakPolarHBondContact O-CB 3.36Å; A146-R150 PolarHBondContact O-N 2.92Å
147	H	98.1	Very high	97.4	Very high	53 Å²	53	53.2 Å²	53.2	25%	0.245	28%	0.282	C	S	.	.	H	α-helix	trans	-68.9	-50.2	174.2	-171.7	123.9	0	0	0	111	D140 A143 T144 G145 M149 R150	D140-H147 IonicContact OD2-NE2 3.43Å; A143-H147 HydrophobicContact CB-CB 3.9Å; T144-H147 WeakPolarHBondContact O-CA 3.49Å; T144-H147 VanDerWaalsContact O-CB 3.3Å; T144-H147 WeakPolarHBondContact O-CB 3.46Å; T144-H147 PolarHBondContact O-N 3.22Å; T144-H147 PolarHBondContact OG1-N 2.92Å; G145-H147 VanDerWaalsContact C-N 3.29Å; G145-H147 PolarHBondContact O-N 3.34Å; H147-M149 PolarHBondContact O-N 3.07Å; H147-R150 PolarHBondContact CD2-NH2 2.97Å; H147-R150 PolarHBondContact CE1-NH2 3.47Å; H147-R150 VanDerWaalsContact CE1-NH2 3.33Å; H147-R150 PolarHBondContact NE2-NH2 3.41Å; H147-R150 VanDerWaalsContact NE2-NH2 3.13Å; H147-R150 WeakPolarHBondContact O-CB 3.49Å; H147-R150 PolarHBondContact O-N 3.48Å
148	W	98.1	Very high	97.4	Very high	4 Å²	4	49.9 Å²	49.9	2%	0.015	26%	0.262	C	S	.	.	H	α-helix	trans	-66.6	-31.5	-175.6	-66	121	0	0	0	114	L93 Y99 L101 H138 D140 S141 A143 T144 G145 V153	L93-W148 HydrophobicContact CD1-CB 3.52Å; L93-W148 HydrophobicContact CD1-CG 4.22Å; Y99-W148 PolarHBondContact O-NE1 3.45Å; L101-W148 HydrophobicContact CB-CH2 3.97Å; L101-W148 HydrophobicContact CB-CZ2 4.1Å; L101-W148 HydrophobicContact CB-CZ3 4.24Å; L101-W148 HydrophobicContact CD1-CD2 3.92Å; L101-W148 HydrophobicContact CD1-CE3 4.48Å; L101-W148 HydrophobicContact CD1-CG 4.13Å; L101-W148 HydrophobicContact CD1-CZ2 4.2Å; L101-W148 HydrophobicContact CD2-CD2 4.09Å; L101-W148 HydrophobicContact CD2-CE3 3.87Å; L101-W148 HydrophobicContact CD2-CZ3 4.19Å; L101-W148 HydrophobicContact CG-CD2 4.46Å; H138-W148 HydrophobicContact CB-CH2 4.04Å; H138-W148 HydrophobicContact CB-CZ3 4.43Å; H138-W148 AromaticContact CE1-CZ3 3.89Å; H138-W148 AromaticContact CG-CH2 3.96Å; H138-W148 AromaticContact CG-CZ3 3.95Å; H138-W148 AromaticContact ND1-CH2 3.49Å; H138-W148 WeakPolarHBondContact ND1-CH2 3.49Å; H138-W148 AromaticContact ND1-CZ3 3.42Å; H138-W148 WeakPolarHBondContact ND1-CZ3 3.37Å; D140-W148 HydrophobicContact CB-CH2 3.93Å; D140-W148 HydrophobicContact CB-CZ3 4.2Å; S141-W148 WeakPolarHBondContact OG-CH2 3.42Å; S141-W148 WeakPolarHBondContact OG-CZ2 3.49Å; A143-W148 HydrophobicContact CB-CZ2 4.06Å; A143-W148 PolarHBondContact O-NE1 3.14Å; T144-W148 PolarHBondContact O-N 3.1Å; T144-W148 VanDerWaalsContact O-N 3.12Å; G145-W148 PolarHBondContact O-N 3Å; W148-V153 HydrophobicContact CE3-CG1 4.19Å; W148-V153 HydrophobicContact CE3-CG2 3.82Å; W148-V153 HydrophobicContact CZ3-CG1 3.9Å; W148-V153 HydrophobicContact CZ3-CG2 4.36Å
149	M	97.7	Very high	97.4	Very high	58 Å²	58	52.5 Å²	52.5	29%	0.286	27%	0.273	S	S	.	.	H	α-helix	trans	-84.3	-12.9	177.8	-63.2	-169.9	-65.7	0	0	114	V90 G92 L93 P95 G145 H147	V90-M149 WeakPolarHBondContact O-CG 3.18Å; G92-M149 PolarHBondContact N-SD 3Å; L93-M149 HydrophobicContact CB-CE 4.17Å; L93-M149 HydrophobicContact CB-CG 4.14Å; L93-M149 HydrophobicContact CB-SD 3.92Å; L93-M149 HydrophobicContact CD1-CG 4.09Å; L93-M149 HydrophobicContact CG-CG 4.25Å; L93-M149 HydrophobicContact CG-SD 4.44Å; L93-M149 PolarHBondContact N-SD 2.93Å; L93-M149 WeakPolarHBondContact O-CE 3.36Å; P95-M149 HydrophobicContact CG-CE 4.25Å; G145-M149 WeakPolarHBondContact O-CB 3.47Å; G145-M149 WeakPolarHBondContact O-CG 3.24Å; G145-M149 PolarHBondContact O-N 2.8Å; H147-M149 PolarHBondContact O-N 3.07Å
150	R	97.3	Very high	97.4	Very high	148 Å²	148	49.2 Å²	49.2	56%	0.558	25%	0.251	S	S	*	.	H	α-helix	trans	-69.3	-32	-176.7	-176.9	-177.4	64	-110.9	-13.7	113.3	A146 H147	A146-R150 WeakPolarHBondContact O-CB 3.36Å; A146-R150 PolarHBondContact O-N 2.92Å; H147-R150 PolarHBondContact CD2-NH2 2.97Å; H147-R150 PolarHBondContact CE1-NH2 3.47Å; H147-R150 VanDerWaalsContact CE1-NH2 3.33Å; H147-R150 PolarHBondContact NE2-NH2 3.41Å; H147-R150 VanDerWaalsContact NE2-NH2 3.13Å; H147-R150 WeakPolarHBondContact O-CB 3.49Å; H147-R150 PolarHBondContact O-N 3.48Å
151	Q	95.5	Very high	97.5	Very high	102 Å²	102	46 Å²	46	48%	0.477	23%	0.234	S	C	.	.	S	Bend	trans	-148.1	174.7	-173	67.9	-174.4	8.3	0	0	111.9
152	L	97.3	Very high	97.4	Very high	71 Å²	71	48 Å²	48	37%	0.372	24%	0.243	S	C	.	.			trans	-68.8	129.4	172.9	-69.6	167.9	0	0	0	110.9	H58 K89	H58-L152 HydrophobicContact CB-CD2 3.98Å; H58-L152 VanDerWaalsContact CE1-CD1 3.43Å; H58-L152 WeakPolarHBondContact CE1-CD1 3.46Å; H58-L152 WeakPolarHBondContact ND1-CD1 3.29Å; K89-L152 HydrophobicContact CB-CD2 3.92Å
153	V	98.2	Very high	97.4	Very high	5 Å²	5	46.5 Å²	46.5	3%	0.03	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	130.1	171.4	-171.1	0	0	0	0	108.2	K87 V88 V90 L101 H138 W148 F155	K87-V153 CarbonylContact C-O 3.57Å; K87-V153 VanDerWaalsContact CA-O 3.27Å; K87-V153 WeakPolarHBondContact CA-O 3.26Å; V88-V153 HydrophobicContact CG2-CB 4Å; V88-V153 PolarHBondContact N-O 2.9Å; V88-V153 PolarHBondContact O-N 3.3Å; V90-V153 HydrophobicContact CG2-CG2 4.26Å; L101-V153 HydrophobicContact CD2-CB 4.36Å; L101-V153 HydrophobicContact CD2-CG1 3.88Å; L101-V153 HydrophobicContact CD2-CG2 3.95Å; H138-V153 VanDerWaalsContact CD2-CG1 3.48Å; H138-V153 WeakPolarHBondContact CD2-CG1 3.19Å; W148-V153 HydrophobicContact CE3-CG1 4.19Å; W148-V153 HydrophobicContact CE3-CG2 3.82Å; W148-V153 HydrophobicContact CZ3-CG1 3.9Å; W148-V153 HydrophobicContact CZ3-CG2 4.36Å; V153-F155 HydrophobicContact CG1-CD2 4.44Å; V153-F155 HydrophobicContact CG1-CE2 3.73Å; V153-F155 HydrophobicContact CG1-CZ 4.22Å
154	S	98.1	Very high	97.1	Very high	28 Å²	28	50.1 Å²	50.1	20%	0.196	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	104.1	-165.2	-174.4	0	0	0	0	112.6	H138 Q156	H138-S154 PolarHBondContact NE2-N 3.42Å; H138-S154 PolarHBondContact NE2-O 3.4Å; S154-Q156 PolarHBondContact O-N 3.05Å; S154-Q156 VanDerWaalsContact O-N 3.1Å; S154-Q156 WeakPolarHBondContact OG-CG 3.4Å
155	F	98	Very high	96.9	Very high	1 Å²	1	54.7 Å²	54.7	0%	0.004	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-79.7	16	178.5	-65.3	-97	0	0	0	112.5	F86 L101 M103 Y136 H138 V153 K157 L158 I183	F86-F155 HydrophobicContact CB-CB 4.37Å; F86-F155 AromaticContact CD1-CD2 3.96Å; F86-F155 HydrophobicContact CD1-CD2 3.96Å; F86-F155 HydrophobicContact CD1-CG 4.48Å; F86-F155 WeakPolarHBondContact O-CB 3.32Å; F86-F155 PolarHBondContact O-N 3.29Å; L101-F155 HydrophobicContact CB-CZ 4.49Å; M103-F155 HydrophobicContact CB-CD1 3.68Å; M103-F155 HydrophobicContact CB-CE1 3.66Å; M103-F155 HydrophobicContact CB-CZ 4.48Å; M103-F155 HydrophobicContact SD-CB 4.36Å; M103-F155 HydrophobicContact SD-CD1 4.3Å; M103-F155 HydrophobicContact SD-CG 4.33Å; Y136-F155 AromaticContact CD1-CD1 3.69Å; Y136-F155 HydrophobicContact CD1-CD1 3.69Å; Y136-F155 HydrophobicContact CD1-CE1 4.21Å; Y136-F155 AromaticContact CE1-CD1 3.88Å; Y136-F155 HydrophobicContact CE1-CD1 3.88Å; H138-F155 HydrophobicContact CB-CE1 4.1Å; H138-F155 HydrophobicContact CB-CZ 4.3Å; V153-F155 HydrophobicContact CG1-CD2 4.44Å; V153-F155 HydrophobicContact CG1-CE2 3.73Å; V153-F155 HydrophobicContact CG1-CZ 4.22Å; F155-K157 PolarHBondContact O-N 3.08Å; F155-L158 WeakPolarHBondContact O-CB 3.3Å; F155-L158 PolarHBondContact O-N 3.29Å; F155-I183 HydrophobicContact CE2-CD1 3.58Å; F155-I183 HydrophobicContact CE2-CG1 4.25Å; F155-I183 HydrophobicContact CZ-CD1 3.78Å; F155-I183 HydrophobicContact CZ-CG1 4.04Å
156	Q	96.9	Very high	96.8	Very high	98 Å²	98	54.9 Å²	54.9	46%	0.458	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-57.7	-17.8	-178.2	69.3	179.9	-3.8	0	0	115.5	R81 S154	R81-Q156 WeakPolarHBondContact CD-O 3.18Å; R81-Q156 WeakPolarHBondContact CG-O 3.43Å; S154-Q156 PolarHBondContact O-N 3.05Å; S154-Q156 VanDerWaalsContact O-N 3.1Å; S154-Q156 WeakPolarHBondContact OG-CG 3.4Å
157	K	97.1	Very high	96.7	Very high	123 Å²	123	57.6 Å²	57.6	54%	0.535	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-83.6	-17.4	176.6	-72.5	177.8	-179.2	174.3	0	112.7	Y136 F155	Y136-K157 WeakPolarHBondContact OH-CB 3.26Å; F155-K157 PolarHBondContact O-N 3.08Å
158	L	98	Very high	96.5	Very high	2 Å²	2	62.4 Å²	62.4	1%	0.01	30%	0.303	C	S	.	.			trans	-60.2	138.1	176.4	-170.6	166.9	0	0	0	110.3	R81 M82 M103 Y136 F155 L160 I171	R81-L158 WeakPolarHBondContact CA-O 3.46Å; M82-L158 HydrophobicContact CE-CD1 4.2Å; M82-L158 HydrophobicContact CE-CD2 4.11Å; M103-L158 HydrophobicContact CB-CD1 4.18Å; M103-L158 HydrophobicContact CG-CD1 3.7Å; M103-L158 HydrophobicContact SD-CD1 3.52Å; M103-L158 VanDerWaalsContact SD-CD1 3.52Å; Y136-L158 HydrophobicContact CD1-CB 4.1Å; Y136-L158 HydrophobicContact CD1-CD1 3.94Å; Y136-L158 HydrophobicContact CD1-CG 4.19Å; Y136-L158 HydrophobicContact CD2-CB 4Å; Y136-L158 HydrophobicContact CD2-CD1 4.5Å; Y136-L158 HydrophobicContact CD2-CG 3.96Å; Y136-L158 HydrophobicContact CE1-CB 4.22Å; Y136-L158 HydrophobicContact CE2-CB 4.14Å; Y136-L158 HydrophobicContact CG-CB 3.98Å; Y136-L158 HydrophobicContact CG-CD1 3.78Å; Y136-L158 HydrophobicContact CG-CG 3.73Å; F155-L158 WeakPolarHBondContact O-CB 3.3Å; F155-L158 PolarHBondContact O-N 3.29Å; L158-L160 HydrophobicContact CD2-CD2 3.63Å; L158-L160 HydrophobicContact CD2-CG 4.37Å; L158-I171 HydrophobicContact CD1-CD1 3.98Å; L158-I171 HydrophobicContact CD2-CD1 4.01Å; L158-I171 HydrophobicContact CD2-CG1 4.37Å; L158-I171 HydrophobicContact CG-CD1 4.16Å
159	K	98.1	Very high	96.3	Very high	65 Å²	65	64.4 Å²	64.4	28%	0.283	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	142	178.9	-81	172.5	157.1	-160.5	0	111.5	A78 G79 R80 R81 H170 I171	A78-K159 PolarHBondContact O-NZ 2.95Å; G79-K159 WeakPolarHBondContact O-CD 3.49Å; G79-K159 WeakPolarHBondContact O-CE 3.45Å; G79-K159 PolarHBondContact O-NZ 2.89Å; R80-K159 CarbonylContact O-C 3.56Å; R80-K159 VanDerWaalsContact O-CA 3.31Å; R80-K159 WeakPolarHBondContact O-CA 3.48Å; R81-K159 HydrophobicContact CG-CG 4.21Å; K159-H170 HydrophobicContact CB-CB 4.36Å; K159-H170 VanDerWaalsContact CD-CD2 3.5Å; K159-H170 WeakPolarHBondContact CD-CD2 3.29Å; K159-H170 WeakPolarHBondContact CD-NE2 3.47Å; K159-I171 PolarHBondContact O-N 3.24Å; K159-I171 VanDerWaalsContact O-N 3.07Å
160	L	98.1	Very high	96.3	Very high	1 Å²	1	63 Å²	63	1%	0.005	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	134.3	174.3	-51.2	-179.9	0	0	0	109.9	M73 I75 G79 R80 M82 L158 I171 L173 F211	M73-L160 HydrophobicContact CB-CD1 4.01Å; M73-L160 HydrophobicContact CG-CD1 4.47Å; I75-L160 HydrophobicContact CG2-CB 3.76Å; I75-L160 HydrophobicContact CG2-CD1 4.5Å; G79-L160 CarbonylContact C-O 3.55Å; G79-L160 WeakPolarHBondContact CA-O 3.45Å; R80-L160 PolarHBondContact N-O 3.36Å; R80-L160 PolarHBondContact O-N 3.06Å; M82-L160 HydrophobicContact CG-CD1 3.69Å; M82-L160 HydrophobicContact CG-CG 4.04Å; M82-L160 HydrophobicContact SD-CD1 4.19Å; L158-L160 HydrophobicContact CD2-CD2 3.63Å; L158-L160 HydrophobicContact CD2-CG 4.37Å; L160-I171 CarbonylContact C-O 3.48Å; L160-I171 WeakPolarHBondContact CA-O 3.36Å; L160-I171 HydrophobicContact CD2-CB 4.07Å; L160-I171 HydrophobicContact CD2-CG2 4.29Å; L160-L173 HydrophobicContact CB-CD1 4.21Å; L160-L173 HydrophobicContact CD1-CD1 3.87Å; L160-L173 HydrophobicContact CD2-CD1 3.95Å; L160-L173 HydrophobicContact CG-CD1 4.22Å; L160-F211 HydrophobicContact CD1-CE1 4.44Å; L160-F211 HydrophobicContact CD1-CE2 3.96Å; L160-F211 HydrophobicContact CD1-CZ 3.58Å
161	T	97.8	Very high	96.3	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	151.7	-177.7	-173.4	0	0	0	0	111.7	T76 K77 N163 D166 H170 I171 I172 L173	T76-T161 WeakPolarHBondContact O-CA 3.41Å; T76-T161 WeakPolarHBondContact O-CB 3.38Å; T76-T161 PolarHBondContact O-OG1 3.29Å; K77-T161 PolarHBondContact O-OG1 3.29Å; T161-N163 WeakPolarHBondContact OG1-CB 3.27Å; T161-N163 PolarHBondContact OG1-N 2.93Å; T161-N163 VanDerWaalsContact OG1-N 3.08Å; T161-D166 HydrophobicContact CG2-CB 3.83Å; T161-H170 HydrophobicContact CG2-CB 3.78Å; T161-I171 PolarHBondContact N-O 3.26Å; T161-I172 HydrophobicContact CG2-CB 4.4Å; T161-I172 HydrophobicContact CG2-CG1 3.8Å; T161-I172 WeakPolarHBondContact O-CA 3.41Å; T161-L173 PolarHBondContact O-N 3.22Å
162	N	96	Very high	96.4	Very high	67 Å²	67	52.3 Å²	52.3	36%	0.358	27%	0.274	S	S	.	.			trans	-97.5	1.9	167.2	70.5	-39	0	0	0	112.7	I75 K77 H164	I75-N162 HydrophobicContact CD1-CB 3.7Å; I75-N162 HydrophobicContact CG1-CB 3.99Å; K77-N162 PolarHBondContact N-OD1 3.13Å; N162-H164 PolarHBondContact O-N 2.89Å
163	N	95.5	Very high	96.4	Very high	37 Å²	37	49 Å²	49	20%	0.198	26%	0.257	C	S	.	.			trans	-82.2	103.9	178	-178.3	18	0	0	0	110.3	K77 T161 L165 D166	K77-N163 HydrophobicContact CG-CB 4.16Å; T161-N163 WeakPolarHBondContact OG1-CB 3.27Å; T161-N163 PolarHBondContact OG1-N 2.93Å; T161-N163 VanDerWaalsContact OG1-N 3.08Å; N163-L165 PolarHBondContact ND2-O 2.91Å; N163-L165 PolarHBondContact O-N 3.13Å; N163-L165 VanDerWaalsContact O-N 3.15Å; N163-L165 PolarHBondContact OD1-N 3.33Å; N163-L165 VanDerWaalsContact OD1-N 3.08Å; N163-D166 HydrophobicContact CB-CB 4.2Å; N163-D166 WeakPolarHBondContact ND2-CA 3.27Å; N163-D166 PolarHBondContact ND2-N 2.87Å; N163-D166 VanDerWaalsContact O-CB 3.3Å; N163-D166 WeakPolarHBondContact O-CB 3.4Å; N163-D166 PolarHBondContact O-N 3Å; N163-D166 VanDerWaalsContact O-N 3.11Å
164	H	92.8	Very high	96.2	Very high	87 Å²	87	49.1 Å²	49.1	40%	0.403	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-23.8	174.8	-67.2	179.2	0	0	0	113.2	M131 N162 I172 N174	M131-H164 HydrophobicContact CE-CB 4.29Å; N162-H164 PolarHBondContact O-N 2.89Å; H164-I172 WeakPolarHBondContact O-CD1 3.49Å; H164-N174 PolarHBondContact NE2-OD1 3.31Å
165	L	92.9	Very high	96.1	Very high	150 Å²	150	49.2 Å²	49.2	79%	0.785	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.1	38.5	176.8	-55.5	179	0	0	0	111.8	N163 P167	N163-L165 PolarHBondContact ND2-O 2.91Å; N163-L165 PolarHBondContact O-N 3.13Å; N163-L165 VanDerWaalsContact O-N 3.15Å; N163-L165 PolarHBondContact OD1-N 3.33Å; N163-L165 VanDerWaalsContact OD1-N 3.08Å; L165-P167 WeakPolarHBondContact O-CD 3.46Å
166	D	94.6	Very high	96	Very high	4 Å²	4	50.5 Å²	50.5	2%	0.021	26%	0.264	C	S	.	.			trans	-70.1	118.9	178.2	175.3	90.2	0	0	0	112	R134 T161 N163 F168 G169 H170 I172	R134-D166 PolarHBondContact NH1-O 3.18Å; R134-D166 VanDerWaalsContact NH1-O 3.13Å; R134-D166 IonicContact NH1-OD2 3.95Å; R134-D166 PolarHBondContact NH1-OD2 2.89Å; R134-D166 PolarHBondContact NH2-O 3.36Å; T161-D166 HydrophobicContact CG2-CB 3.83Å; N163-D166 HydrophobicContact CB-CB 4.2Å; N163-D166 WeakPolarHBondContact ND2-CA 3.27Å; N163-D166 PolarHBondContact ND2-N 2.87Å; N163-D166 VanDerWaalsContact O-CB 3.3Å; N163-D166 WeakPolarHBondContact O-CB 3.4Å; N163-D166 PolarHBondContact O-N 3Å; N163-D166 VanDerWaalsContact O-N 3.11Å; D166-F168 VanDerWaalsContact C-N 3.34Å; D166-F168 PolarHBondContact O-N 3.21Å; D166-F168 PolarHBondContact OD2-N 3.2Å; D166-G169 PolarHBondContact OD2-N 3.49Å; D166-G169 VanDerWaalsContact OD2-N 3.11Å; D166-H170 IonicContact OD1-CE1 3.81Å; D166-H170 IonicContact OD1-CG 2.87Å; D166-H170 IonicContact OD1-ND1 3.29Å; D166-H170 PolarHBondContact OD1-ND1 3.28Å; D166-H170 IonicContact OD2-CG 2.71Å; D166-H170 PolarHBondContact OD2-N 3.45Å; D166-H170 IonicContact OD2-ND1 4Å; D166-H170 PolarHBondContact OD2-ND1 2.91Å; D166-I172 HydrophobicContact CB-CG1 4.47Å
167	P	94.9	Very high	95.9	Very high	106 Å²	106	46.1 Å²	46.1	69%	0.688	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-5.8	-176.4	35.4	-36.9	0	0	0	113.7	L165	L165-P167 WeakPolarHBondContact O-CD 3.46Å
168	F	94.4	Very high	95.9	Very high	153 Å²	153	43.6 Å²	43.6	67%	0.671	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.9	0.8	-171.9	-62.3	-72.3	0	0	0	113.6	D166 H170	D166-F168 VanDerWaalsContact C-N 3.34Å; D166-F168 PolarHBondContact O-N 3.21Å; D166-F168 PolarHBondContact OD2-N 3.2Å; F168-H170 VanDerWaalsContact C-N 3.26Å; F168-H170 WeakPolarHBondContact CB-CE1 3.39Å; F168-H170 AromaticContact CD2-CE1 3.67Å; F168-H170 AromaticContact CG-CE1 3.72Å; F168-H170 PolarHBondContact O-N 3.18Å
169	G	93.6	Very high	95.9	Very high	46 Å²	46	44 Å²	44	47%	0.474	23%	0.234	S	C	.	.			trans	71.9	15.6	-175.7	0	0	0	0	0	114.1	D166	D166-G169 PolarHBondContact OD2-N 3.49Å; D166-G169 VanDerWaalsContact OD2-N 3.11Å
170	H	97	Very high	95.9	Very high	28 Å²	28	42 Å²	42	13%	0.13	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-61.8	151.9	174.3	-56.8	135.3	0	0	0	110.7	A78 R134 K159 T161 D166 F168 I172	A78-H170 PolarHBondContact O-CE1 3.03Å; R134-H170 WeakPolarHBondContact CD-O 3.5Å; R134-H170 PolarHBondContact NH1-O 3.19Å; K159-H170 HydrophobicContact CB-CB 4.36Å; K159-H170 VanDerWaalsContact CD-CD2 3.5Å; K159-H170 WeakPolarHBondContact CD-CD2 3.29Å; K159-H170 WeakPolarHBondContact CD-NE2 3.47Å; T161-H170 HydrophobicContact CG2-CB 3.78Å; D166-H170 IonicContact OD1-CE1 3.81Å; D166-H170 IonicContact OD1-CG 2.87Å; D166-H170 IonicContact OD1-ND1 3.29Å; D166-H170 PolarHBondContact OD1-ND1 3.28Å; D166-H170 IonicContact OD2-CG 2.71Å; D166-H170 PolarHBondContact OD2-N 3.45Å; D166-H170 IonicContact OD2-ND1 4Å; D166-H170 PolarHBondContact OD2-ND1 2.91Å; F168-H170 VanDerWaalsContact C-N 3.26Å; F168-H170 WeakPolarHBondContact CB-CE1 3.39Å; F168-H170 AromaticContact CD2-CE1 3.67Å; F168-H170 AromaticContact CG-CE1 3.72Å; F168-H170 PolarHBondContact O-N 3.18Å; H170-I172 PolarHBondContact O-N 2.95Å
171	I	97.1	Very high	95.9	Very high	5 Å²	5	42 Å²	42	3%	0.026	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	120.8	178.3	-60.1	-170.8	0	0	0	109	V105 L158 K159 L160 T161 L173	V105-I171 HydrophobicContact CB-CG2 4.15Å; V105-I171 HydrophobicContact CG2-CD1 3.96Å; V105-I171 HydrophobicContact CG2-CG2 4.37Å; L158-I171 HydrophobicContact CD1-CD1 3.98Å; L158-I171 HydrophobicContact CD2-CD1 4.01Å; L158-I171 HydrophobicContact CD2-CG1 4.37Å; L158-I171 HydrophobicContact CG-CD1 4.16Å; K159-I171 PolarHBondContact O-N 3.24Å; K159-I171 VanDerWaalsContact O-N 3.07Å; L160-I171 CarbonylContact C-O 3.48Å; L160-I171 WeakPolarHBondContact CA-O 3.36Å; L160-I171 HydrophobicContact CD2-CB 4.07Å; L160-I171 HydrophobicContact CD2-CG2 4.29Å; T161-I171 PolarHBondContact N-O 3.26Å; I171-L173 HydrophobicContact CG2-CD2 3.96Å; I171-L173 HydrophobicContact CG2-CG 4.36Å
172	I	97.3	Very high	95.8	Very high	21 Å²	21	45.7 Å²	45.7	11%	0.108	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	127.3	-179.2	-60.9	166.4	0	0	0	108.7	M131 R134 T161 H164 D166 H170	M131-I172 HydrophobicContact CB-CG2 4.19Å; M131-I172 HydrophobicContact CG-CG2 4.07Å; R134-I172 VanDerWaalsContact CZ-CD1 3.44Å; T161-I172 HydrophobicContact CG2-CB 4.4Å; T161-I172 HydrophobicContact CG2-CG1 3.8Å; T161-I172 WeakPolarHBondContact O-CA 3.41Å; H164-I172 WeakPolarHBondContact O-CD1 3.49Å; D166-I172 HydrophobicContact CB-CG1 4.47Å; H170-I172 PolarHBondContact O-N 2.95Å
173	L	97.1	Very high	95.9	Very high	3 Å²	3	42.5 Å²	42.5	2%	0.016	22%	0.223	C	C	.	.			trans	-129.5	148.7	175.3	-55.7	179.8	0	0	0	110.4	I75 V105 L160 T161 I171 Y179 F211 A213	I75-L173 HydrophobicContact CD1-CB 4.5Å; I75-L173 HydrophobicContact CG2-CB 4.47Å; I75-L173 HydrophobicContact CG2-CD1 4.28Å; V105-L173 HydrophobicContact CB-CD2 4.27Å; V105-L173 HydrophobicContact CG1-CD1 4.33Å; V105-L173 HydrophobicContact CG1-CD2 3.79Å; L160-L173 HydrophobicContact CB-CD1 4.21Å; L160-L173 HydrophobicContact CD1-CD1 3.87Å; L160-L173 HydrophobicContact CD2-CD1 3.95Å; L160-L173 HydrophobicContact CG-CD1 4.22Å; T161-L173 PolarHBondContact O-N 3.22Å; I171-L173 HydrophobicContact CG2-CD2 3.96Å; I171-L173 HydrophobicContact CG2-CG 4.36Å; L173-Y179 HydrophobicContact CB-CD2 4.48Å; L173-Y179 HydrophobicContact CB-CE2 3.84Å; L173-Y179 HydrophobicContact CD1-CD2 4.12Å; L173-Y179 HydrophobicContact CD1-CE2 4.31Å; L173-Y179 HydrophobicContact CD1-CG 4.42Å; L173-Y179 HydrophobicContact CD2-CD1 3.73Å; L173-Y179 HydrophobicContact CD2-CD2 4.22Å; L173-Y179 HydrophobicContact CD2-CE1 3.62Å; L173-Y179 HydrophobicContact CD2-CE2 4.09Å; L173-Y179 HydrophobicContact CD2-CG 4.05Å; L173-Y179 HydrophobicContact CG-CE2 4.3Å; L173-F211 HydrophobicContact CD1-CE2 3.8Å; L173-F211 HydrophobicContact CD1-CZ 3.83Å; L173-A213 HydrophobicContact CB-CB 4.09Å; L173-A213 HydrophobicContact CD1-CB 3.94Å
174	N	96	Very high	96	Very high	7 Å²	7	41.6 Å²	41.6	4%	0.037	22%	0.217	C	C	.	.			trans	-84.3	138.9	171	-64.8	-19	0	0	0	108.9	E128 P129 H164 H177 Y179	E128-N174 PolarHBondContact O-ND2 3.13Å; P129-N174 PolarHBondContact O-ND2 2.97Å; P129-N174 VanDerWaalsContact O-ND2 3.14Å; H164-N174 PolarHBondContact NE2-OD1 3.31Å; N174-H177 WeakPolarHBondContact CB-ND1 3.46Å; N174-Y179 PolarHBondContact N-OH 2.72Å
175	S	95.9	Very high	96.2	Very high	29 Å²	29	37.5 Å²	37.5	20%	0.203	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	150.8	178.4	-163.5	0	0	0	0	110.7	H177 A213 T215	S175-H177 PolarHBondContact O-CE1 3.13Å; S175-H177 PolarHBondContact O-N 2.93Å; S175-H177 PolarHBondContact O-ND1 2.87Å; S175-A213 CarbonylContact C-O 3.58Å; S175-T215 PolarHBondContact OG-N 2.71Å
176	M	95.1	Very high	96.3	Very high	28 Å²	28	31.9 Å²	31.9	14%	0.138	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.7	23.1	-179.5	-47.9	-57	-71.8	0	0	115.3	Y113 W120 A213 V214 Q218	Y113-M176 WeakPolarHBondContact CB-O 3.43Å; Y113-M176 PolarHBondContact N-O 3.41Å; Y113-M176 WeakPolarHBondContact O-CB 3.35Å; W120-M176 HydrophobicContact CH2-CE 3.63Å; W120-M176 HydrophobicContact CH2-SD 4.25Å; W120-M176 HydrophobicContact CZ3-CE 3.61Å; M176-A213 PolarHBondContact N-O 2.92Å; M176-V214 HydrophobicContact SD-CG1 3.99Å; M176-Q218 HydrophobicContact CE-CG 4.32Å
177	H	95.3	Very high	96.3	Very high	7 Å²	7	34.4 Å²	34.4	3%	0.032	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	150.8	174.5	-65.3	83	0	0	0	110.7	H111 A127 E128 N174 S175 Y179 I212 A213	H111-H177 PolarHBondContact O-CD2 2.76Å; A127-H177 WeakPolarHBondContact CA-NE2 3.24Å; A127-H177 VanDerWaalsContact CB-CD2 3.49Å; A127-H177 WeakPolarHBondContact CB-CD2 3.42Å; E128-H177 PolarHBondContact N-NE2 3.18Å; E128-H177 IonicContact OE1-CE1 3.61Å; E128-H177 IonicContact OE2-CE1 2.75Å; N174-H177 WeakPolarHBondContact CB-ND1 3.46Å; S175-H177 PolarHBondContact O-CE1 3.13Å; S175-H177 PolarHBondContact O-N 2.93Å; S175-H177 PolarHBondContact O-ND1 2.87Å; H177-Y179 HydrophobicContact CB-CE2 3.67Å; H177-Y179 VanDerWaalsContact O-CD2 3.26Å; H177-Y179 WeakPolarHBondContact O-CD2 3.04Å; H177-Y179 WeakPolarHBondContact O-CE2 3.15Å; H177-I212 WeakPolarHBondContact O-CA 3.47Å; H177-A213 PolarHBondContact O-N 3.48Å
178	K	96.3	Very high	96.2	Very high	69 Å²	69	29.5 Å²	29.5	30%	0.3	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	137.6	-177.6	-169.5	175.6	141	-132.7	0	111.2	A108 D109 Y113 F211 I212	A108-K178 HydrophobicContact CB-CB 4.28Å; A108-K178 HydrophobicContact CB-CD 4.31Å; A108-K178 HydrophobicContact CB-CG 3.88Å; A108-K178 PolarHBondContact N-O 2.96Å; D109-K178 WeakPolarHBondContact OD2-CD 3.46Å; D109-K178 IonicContact OD2-NZ 3.69Å; D109-K178 PolarHBondContact OD2-NZ 3.48Å; Y113-K178 HydrophobicContact CD2-CB 4.16Å; Y113-K178 HydrophobicContact CE2-CB 3.66Å; Y113-K178 HydrophobicContact CE2-CD 4.34Å; K178-F211 WeakPolarHBondContact CA-O 3.01Å; K178-I212 HydrophobicContact CB-CG1 4.03Å; K178-I212 HydrophobicContact CG-CG1 4.06Å
179	Y	97.6	Very high	95.9	Very high	10 Å²	10	23.3 Å²	23.3	4%	0.039	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	150.2	-170.5	-70.1	-76.8	0	0	0	112.5	V105 V106 P107 L173 N174 H177 A210 F211 A213	V105-Y179 HydrophobicContact CG1-CD1 4.01Å; V105-Y179 HydrophobicContact CG1-CG 4.02Å; V106-Y179 CarbonylContact O-C 3.54Å; V106-Y179 WeakPolarHBondContact O-CA 3.3Å; V106-Y179 WeakPolarHBondContact O-CD1 3.28Å; P107-Y179 HydrophobicContact CG-CE1 4.14Å; L173-Y179 HydrophobicContact CB-CD2 4.48Å; L173-Y179 HydrophobicContact CB-CE2 3.84Å; L173-Y179 HydrophobicContact CD1-CD2 4.12Å; L173-Y179 HydrophobicContact CD1-CE2 4.31Å; L173-Y179 HydrophobicContact CD1-CG 4.42Å; L173-Y179 HydrophobicContact CD2-CD1 3.73Å; L173-Y179 HydrophobicContact CD2-CD2 4.22Å; L173-Y179 HydrophobicContact CD2-CE1 3.62Å; L173-Y179 HydrophobicContact CD2-CE2 4.09Å; L173-Y179 HydrophobicContact CD2-CG 4.05Å; L173-Y179 HydrophobicContact CG-CE2 4.3Å; N174-Y179 PolarHBondContact N-OH 2.72Å; H177-Y179 HydrophobicContact CB-CE2 3.67Å; H177-Y179 VanDerWaalsContact O-CD2 3.26Å; H177-Y179 WeakPolarHBondContact O-CD2 3.04Å; H177-Y179 WeakPolarHBondContact O-CE2 3.15Å; Y179-A210 VanDerWaalsContact O-CA 3.26Å; Y179-A210 WeakPolarHBondContact O-CA 3.12Å; Y179-F211 HydrophobicContact CD2-CE2 4.37Å; Y179-F211 PolarHBondContact N-O 3Å; Y179-F211 PolarHBondContact O-N 2.75Å; Y179-A213 HydrophobicContact CD2-CB 3.79Å; Y179-A213 HydrophobicContact CE2-CB 3.75Å
180	Q	97.9	Very high	95.5	Very high	25 Å²	25	29.9 Å²	29.9	12%	0.117	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	113.4	176	176.9	61	70.1	0	0	109.5	V106 A108 V205 F206 T209	V106-Q180 HydrophobicContact CG2-CB 4.32Å; V106-Q180 PolarHBondContact N-O 3.15Å; V106-Q180 VanDerWaalsContact N-O 3.09Å; V106-Q180 PolarHBondContact O-N 3.12Å; A108-Q180 HydrophobicContact CB-CB 4.46Å; Q180-V205 HydrophobicContact CG-CG1 3.46Å; Q180-V205 VanDerWaalsContact CG-CG1 3.46Å; Q180-F206 PolarHBondContact NE2-O 2.86Å; Q180-T209 PolarHBondContact NE2-OG1 2.86Å
181	P	97.9	Very high	94.9	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	141.4	166.6	-22.6	34.5	0	0	0	111.5	F86 M103 T209 F211	F86-P181 HydrophobicContact CD2-CB 4.26Å; F86-P181 HydrophobicContact CE2-CB 4.1Å; M103-P181 HydrophobicContact CE-CB 4.16Å; P181-T209 VanDerWaalsContact CD-O 3.3Å; P181-T209 WeakPolarHBondContact CD-O 3.31Å; P181-F211 HydrophobicContact CG-CD1 4.09Å; P181-F211 HydrophobicContact CG-CE1 3.82Å
182	R	97.6	Very high	94.1	Very high	77 Å²	77	38.1 Å²	38.1	29%	0.291	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	140.4	171.6	-45.7	-171.6	-64	-178.5	3.3	109.4	M103 D104 V106 T203 V205	M103-R182 VanDerWaalsContact CA-O 3.32Å; M103-R182 WeakPolarHBondContact CA-O 3.49Å; D104-R182 PolarHBondContact N-O 2.8Å; D104-R182 VanDerWaalsContact N-O 3.1Å; D104-R182 PolarHBondContact O-N 3.43Å; D104-R182 WeakPolarHBondContact OD1-CB 3.45Å; D104-R182 WeakPolarHBondContact OD1-CG 3.4Å; D104-R182 IonicContact OD1-CZ 3.6Å; D104-R182 IonicContact OD1-NE 2.81Å; D104-R182 PolarHBondContact OD1-NE 3.34Å; D104-R182 IonicContact OD1-NH2 3.57Å; D104-R182 IonicContact OD2-CZ 2.68Å; D104-R182 IonicContact OD2-NE 2.93Å; D104-R182 PolarHBondContact OD2-NE 3.38Å; D104-R182 IonicContact OD2-NH2 2.67Å; D104-R182 PolarHBondContact OD2-NH2 2.97Å; V106-R182 HydrophobicContact CG2-CG 4.16Å; R182-T203 HydrophobicContact CB-CG2 4.08Å; R182-V205 HydrophobicContact CB-CG2 4.42Å; R182-V205 HydrophobicContact CG-CG2 4.07Å
183	I	97.3	Very high	93.4	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	131.1	171.6	-173.4	178.7	0	0	0	109.4	V55 F86 V88 L101 M103 F155 T203 H204 F206	V55-I183 HydrophobicContact CG1-CG2 4.3Å; F86-I183 HydrophobicContact CE1-CB 4.25Å; F86-I183 HydrophobicContact CE1-CG2 4.46Å; F86-I183 HydrophobicContact CZ-CB 4.41Å; F86-I183 HydrophobicContact CZ-CG2 4.38Å; V88-I183 HydrophobicContact CG2-CD1 3.64Å; L101-I183 HydrophobicContact CD2-CD1 4.49Å; M103-I183 HydrophobicContact CE-CB 4.39Å; F155-I183 HydrophobicContact CE2-CD1 3.58Å; F155-I183 HydrophobicContact CE2-CG1 4.25Å; F155-I183 HydrophobicContact CZ-CD1 3.78Å; F155-I183 HydrophobicContact CZ-CG1 4.04Å; I183-T203 WeakPolarHBondContact O-CA 3.47Å; I183-H204 HydrophobicContact CG2-CB 3.89Å; I183-H204 PolarHBondContact N-O 3.33Å; I183-H204 VanDerWaalsContact N-O 3.11Å; I183-H204 PolarHBondContact O-N 2.93Å; I183-F206 HydrophobicContact CG2-CE2 4.3Å
184	H	96.6	Very high	93	Very high	19 Å²	19	41.7 Å²	41.7	9%	0.088	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	134.9	179.2	-50.9	-94.2	0	0	0	109.5	L102 D104 C202 T203	L102-H184 HydrophobicContact CD1-CB 3.74Å; L102-H184 HydrophobicContact CG-CB 4.06Å; L102-H184 PolarHBondContact N-O 3.29Å; L102-H184 PolarHBondContact O-N 2.92Å; D104-H184 IonicContact OD1-NE2 3.55Å; D104-H184 PolarHBondContact OD1-NE2 2.87Å; D104-H184 IonicContact OD2-NE2 2.72Å; H184-C202 WeakPolarHBondContact CA-O 3.49Å; H184-T203 WeakPolarHBondContact CE1-CG2 3.37Å; H184-T203 WeakPolarHBondContact ND1-CG2 3.43Å; H184-T203 PolarHBondContact ND1-OG1 2.68Å
185	I	96.8	Very high	92.2	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	121.3	172.4	-57.4	174.8	0	0	0	106.1	M50 I53 V55 V90 L93 Y99 L101 F201 C202	M50-I185 HydrophobicContact CE-CB 3.97Å; M50-I185 HydrophobicContact CE-CG2 3.68Å; M50-I185 WeakPolarHBondContact CE-O 3.42Å; I53-I185 HydrophobicContact CG2-CD1 3.91Å; V55-I185 HydrophobicContact CG2-CD1 3.71Å; V90-I185 HydrophobicContact CG1-CD1 3.94Å; L93-I185 HydrophobicContact CD2-CG2 4.09Å; Y99-I185 HydrophobicContact CD1-CG2 3.65Å; Y99-I185 HydrophobicContact CE1-CG2 4.39Å; Y99-I185 HydrophobicContact CG-CG2 4.3Å; L101-I185 HydrophobicContact CD1-CB 4.37Å; L101-I185 HydrophobicContact CD1-CG1 4.1Å; L101-I185 HydrophobicContact CD1-CG2 3.9Å; L101-I185 HydrophobicContact CG-CG1 4.06Å; I185-F201 VanDerWaalsContact O-CA 3.25Å; I185-F201 WeakPolarHBondContact O-CA 3.45Å; I185-C202 PolarHBondContact N-O 3.3Å; I185-C202 PolarHBondContact O-N 3.24Å
186	V	95.8	Very high	91.5	Very high	33 Å²	33	45.6 Å²	45.6	20%	0.2	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	122.3	176	-174.4	0	0	0	0	108.6	Y99 I100 L102 F194 F201	Y99-V186 CarbonylContact C-O 3.59Å; Y99-V186 WeakPolarHBondContact CA-O 3.41Å; I100-V186 HydrophobicContact CB-CB 4.38Å; I100-V186 PolarHBondContact N-O 3.41Å; I100-V186 PolarHBondContact O-N 3.07Å; L102-V186 HydrophobicContact CD2-CG2 4.43Å; V186-F194 HydrophobicContact CG1-CD1 4.29Å; V186-F201 HydrophobicContact CG2-CB 4.18Å
187	K	94.3	Very high	90.7	Very high	57 Å²	57	54.1 Å²	54.1	25%	0.248	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	129.6	-179.8	-178.4	-173	171	-168.5	0	110	G49 M50 T97 Y99 T199 A200	G49-K187 PolarHBondContact O-NZ 3.48Å; M50-K187 HydrophobicContact CE-CB 4.29Å; M50-K187 HydrophobicContact CG-CB 4.31Å; M50-K187 HydrophobicContact CG-CD 4.05Å; M50-K187 HydrophobicContact SD-CB 3.88Å; T97-K187 HydrophobicContact CG2-CG 4.08Å; Y99-K187 HydrophobicContact CD1-CB 3.9Å; Y99-K187 HydrophobicContact CD1-CG 4.27Å; Y99-K187 HydrophobicContact CE1-CB 3.66Å; Y99-K187 HydrophobicContact CE1-CD 4.4Å; Y99-K187 HydrophobicContact CE1-CG 3.65Å; K187-T199 WeakPolarHBondContact O-CB 3.37Å; K187-A200 WeakPolarHBondContact CB-O 3.36Å; K187-A200 PolarHBondContact N-O 2.99Å
188	A	92.5	Very high	89.9	Confident	2 Å²	2	58.5 Å²	58.5	2%	0.017	31%	0.309	C	S	.	.			trans	-66.1	155.8	170.5	0	0	0	0	0	111.6	T97 K98 G193 F194	T97-A188 HydrophobicContact CG2-CB 4.3Å; K98-A188 HydrophobicContact CB-CB 4.02Å; K98-A188 WeakPolarHBondContact O-CB 3.39Å; K98-A188 PolarHBondContact O-N 2.95Å; A188-G193 VanDerWaalsContact CA-O 3.23Å; A188-G193 WeakPolarHBondContact CA-O 3.42Å; A188-G193 WeakPolarHBondContact CB-O 3.24Å; A188-F194 HydrophobicContact CB-CD1 4.28Å; A188-F194 HydrophobicContact CB-CE1 3.73Å; A188-F194 HydrophobicContact CB-CE2 4.21Å; A188-F194 HydrophobicContact CB-CZ 3.69Å
189	D	89.4	Confident	89.4	Confident	24 Å²	24	56.9 Å²	56.9	13%	0.128	31%	0.305	C	S	.	.			trans	-72.8	-177.6	172	61.2	38.4	0	0	0	112.9	N191 N192 G193 S196 N198	D189-N191 PolarHBondContact O-N 2.73Å; D189-N191 WeakPolarHBondContact OD1-CA 3.43Å; D189-N191 WeakPolarHBondContact OD1-CB 3.43Å; D189-N191 PolarHBondContact OD1-N 2.72Å; D189-N192 WeakPolarHBondContact O-CA 3.48Å; D189-N192 PolarHBondContact O-N 3.01Å; D189-N192 PolarHBondContact OD1-N 3.01Å; D189-N192 VanDerWaalsContact OD1-N 3.09Å; D189-G193 PolarHBondContact N-O 3Å; D189-G193 PolarHBondContact OD1-N 3.08Å; D189-S196 WeakPolarHBondContact CB-OG 3.11Å; D189-S196 VanDerWaalsContact OD2-CB 3.3Å; D189-S196 WeakPolarHBondContact OD2-CB 3.49Å; D189-S196 PolarHBondContact OD2-OG 3.01Å; D189-N198 HydrophobicContact CB-CB 4.19Å
190	E	84.1	Confident	88.9	Confident	184 Å²	184	56.9 Å²	56.9	86%	0.86	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-28.5	-178.9	-62.4	177.7	176.1	0	0	112.9	N192	E190-N192 PolarHBondContact O-N 3.43Å
191	N	84.4	Confident	88.6	Confident	151 Å²	151	59.4 Å²	59.4	81%	0.807	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	4.6	171.9	-59.2	105.9	0	0	0	112.3	D189 G193	D189-N191 PolarHBondContact O-N 2.73Å; D189-N191 WeakPolarHBondContact OD1-CA 3.43Å; D189-N191 WeakPolarHBondContact OD1-CB 3.43Å; D189-N191 PolarHBondContact OD1-N 2.72Å; N191-G193 PolarHBondContact O-N 2.8Å
192	N	81.8	Confident	88.3	Confident	55 Å²	55	59.5 Å²	59.5	29%	0.294	32%	0.318	S	S	.	.	S	Bend	trans	64.7	24.5	-179.5	-138.5	5.6	0	0	0	113.2	K98 D189 E190	K98-N192 WeakPolarHBondContact CB-OD1 3.47Å; K98-N192 WeakPolarHBondContact CE-ND2 3.26Å; K98-N192 WeakPolarHBondContact CG-OD1 3.4Å; K98-N192 PolarHBondContact N-OD1 3.12Å; D189-N192 WeakPolarHBondContact O-CA 3.48Å; D189-N192 PolarHBondContact O-N 3.01Å; D189-N192 PolarHBondContact OD1-N 3.01Å; D189-N192 VanDerWaalsContact OD1-N 3.09Å; E190-N192 PolarHBondContact O-N 3.43Å
193	G	82.1	Confident	88.2	Confident	27 Å²	27	56.4 Å²	56.4	28%	0.278	31%	0.308	S	S	.	.			trans	-95.9	173.7	176.8	0	0	0	0	0	113.5	A188 D189 N191	A188-G193 VanDerWaalsContact CA-O 3.23Å; A188-G193 WeakPolarHBondContact CA-O 3.42Å; A188-G193 WeakPolarHBondContact CB-O 3.24Å; D189-G193 PolarHBondContact N-O 3Å; D189-G193 PolarHBondContact OD1-N 3.08Å; N191-G193 PolarHBondContact O-N 2.8Å
194	F	88	Confident	88.2	Confident	71 Å²	71	56.9 Å²	56.9	31%	0.311	31%	0.31	S	S	.	.	S	Bend	trans	-131.5	149.2	177.5	-61.7	-83.6	0	0	0	110.3	K98 I100 P142 V186 A188	K98-F194 HydrophobicContact CB-CE2 4.46Å; K98-F194 HydrophobicContact CB-CZ 4.05Å; I100-F194 HydrophobicContact CB-CE1 4.39Å; I100-F194 HydrophobicContact CD1-CD1 3.74Å; I100-F194 HydrophobicContact CD1-CD2 3.97Å; I100-F194 HydrophobicContact CD1-CE1 3.74Å; I100-F194 HydrophobicContact CD1-CE2 3.98Å; I100-F194 HydrophobicContact CD1-CG 3.86Å; I100-F194 HydrophobicContact CD1-CZ 3.86Å; I100-F194 HydrophobicContact CG1-CD1 4.27Å; I100-F194 HydrophobicContact CG1-CE1 3.74Å; I100-F194 HydrophobicContact CG1-CE2 4.12Å; I100-F194 HydrophobicContact CG1-CZ 3.65Å; P142-F194 HydrophobicContact CB-CE2 3.57Å; P142-F194 HydrophobicContact CB-CZ 3.76Å; P142-F194 HydrophobicContact CG-CE2 4.13Å; V186-F194 HydrophobicContact CG1-CD1 4.29Å; A188-F194 HydrophobicContact CB-CD1 4.28Å; A188-F194 HydrophobicContact CB-CE1 3.73Å; A188-F194 HydrophobicContact CB-CE2 4.21Å; A188-F194 HydrophobicContact CB-CZ 3.69Å
195	G	78.7	Confident	88.2	Confident	76 Å²	76	57 Å²	57	78%	0.784	31%	0.313	S	S	*	.	S	Bend	trans	90.2	2.1	-179.6	0	0	0	0	0	115.3
196	S	81.9	Confident	88.2	Confident	43 Å²	43	57.1 Å²	57.1	30%	0.301	31%	0.313	S	S	.	.	S	Bend	trans	-82.7	158.2	168.6	74.2	0	0	0	0	111.3	D189 N198 T199	D189-S196 WeakPolarHBondContact CB-OG 3.11Å; D189-S196 VanDerWaalsContact OD2-CB 3.3Å; D189-S196 WeakPolarHBondContact OD2-CB 3.49Å; D189-S196 PolarHBondContact OD2-OG 3.01Å; S196-N198 PolarHBondContact O-N 2.85Å; S196-T199 PolarHBondContact O-N 2.79Å; S196-T199 PolarHBondContact O-OG1 2.93Å
197	K	79.2	Confident	88.3	Confident	206 Å²	206	56.4 Å²	56.4	90%	0.896	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-10.9	176.4	66.2	173.7	-175.7	175.8	0	114.8
198	N	78.3	Confident	88.4	Confident	99 Å²	99	53.7 Å²	53.7	53%	0.529	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-3.8	179.1	-69.4	12.8	0	0	0	112.7	D189 S196	D189-N198 HydrophobicContact CB-CB 4.19Å; S196-N198 PolarHBondContact O-N 2.85Å
199	T	84.9	Confident	88.7	Confident	36 Å²	36	53.6 Å²	53.6	22%	0.221	30%	0.296	C	S	.	.			trans	-71.7	132.1	170	60.7	0	0	0	0	110.4	K187 S196	K187-T199 WeakPolarHBondContact O-CB 3.37Å; S196-T199 PolarHBondContact O-N 2.79Å; S196-T199 PolarHBondContact O-OG1 2.93Å
200	A	87.8	Confident	89.1	Confident	10 Å²	10	53 Å²	53	8%	0.083	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	154.5	175.4	0	0	0	0	0	110.5	Q47 M50 K187	Q47-A200 HydrophobicContact CB-CB 4.17Å; M50-A200 HydrophobicContact CG-CB 3.77Å; M50-A200 HydrophobicContact SD-CB 3.86Å; M50-A200 VanDerWaalsContact SD-O 3.34Å; K187-A200 WeakPolarHBondContact CB-O 3.36Å; K187-A200 PolarHBondContact N-O 2.99Å
201	F	90.3	Very high	89.8	Confident	78 Å²	78	44.4 Å²	44.4	34%	0.342	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	151	169.5	71.5	-90.2	0	0	0	113	Y45 Q47 M50 I185 V186	Y45-F201 HydrophobicContact CD1-CD2 4.47Å; Y45-F201 AromaticContact CD1-CE2 3.83Å; Y45-F201 HydrophobicContact CD1-CE2 3.83Å; Y45-F201 HydrophobicContact CD1-CZ 4.44Å; Y45-F201 AromaticContact CE1-CE2 3.69Å; Y45-F201 HydrophobicContact CE1-CE2 3.69Å; Y45-F201 AromaticContact CE1-CZ 3.85Å; Y45-F201 HydrophobicContact CE1-CZ 3.85Å; Q47-F201 WeakPolarHBondContact CB-O 3.47Å; Q47-F201 HydrophobicContact CG-CD1 4.49Å; Q47-F201 HydrophobicContact CG-CE1 4.47Å; Q47-F201 WeakPolarHBondContact CG-O 3.3Å; Q47-F201 PolarHBondContact N-O 3.49Å; Q47-F201 VanDerWaalsContact NE2-CE1 3.29Å; M50-F201 WeakPolarHBondContact SD-CA 3.24Å; I185-F201 VanDerWaalsContact O-CA 3.25Å; I185-F201 WeakPolarHBondContact O-CA 3.45Å; V186-F201 HydrophobicContact CG2-CB 4.18Å
202	C	92.8	Very high	90.4	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.007	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	153.6	162.4	75.2	0	0	0	0	110.4	Y45 I46 M50 H184 I185 H204	Y45-C202 CarbonylContact O-C 3.58Å; Y45-C202 WeakPolarHBondContact O-CA 3.35Å; Y45-C202 WeakPolarHBondContact O-CB 3.45Å; I46-C202 HydrophobicContact CB-CB 4.43Å; I46-C202 HydrophobicContact CG1-CB 4.34Å; I46-C202 HydrophobicContact CG2-CB 4.29Å; M50-C202 HydrophobicContact CB-CB 4.45Å; M50-C202 HydrophobicContact CE-CB 4.05Å; M50-C202 VanDerWaalsContact CE-SG 3.59Å; M50-C202 HydrophobicContact SD-CB 4.32Å; M50-C202 PolarHBondContact SD-N 3.29Å; M50-C202 VanDerWaalsContact SD-N 3.45Å; H184-C202 WeakPolarHBondContact CA-O 3.49Å; I185-C202 PolarHBondContact N-O 3.3Å; I185-C202 PolarHBondContact O-N 3.24Å; C202-H204 PolarHBondContact SG-NE2 3.42Å
203	T	95.8	Very high	91.1	Very high	12 Å²	12	35.2 Å²	35.2	7%	0.074	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	122.8	179.2	-56.2	0	0	0	0	108.7	T44 Y45 R182 I183 H184 V205	T44-T203 CarbonylContact C-O 3.5Å; T44-T203 WeakPolarHBondContact CA-O 3.3Å; Y45-T203 PolarHBondContact N-O 3.1Å; Y45-T203 PolarHBondContact O-N 2.75Å; R182-T203 HydrophobicContact CB-CG2 4.08Å; I183-T203 WeakPolarHBondContact O-CA 3.47Å; H184-T203 WeakPolarHBondContact CE1-CG2 3.37Å; H184-T203 WeakPolarHBondContact ND1-CG2 3.43Å; H184-T203 PolarHBondContact ND1-OG1 2.68Å; T203-V205 HydrophobicContact CG2-CG2 4.38Å
204	H	95.9	Very high	91.9	Very high	10 Å²	10	33.9 Å²	33.9	5%	0.046	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	137.2	175.3	-60.6	-95.1	0	0	0	110.2	T44 V55 I183 C202	T44-H204 WeakPolarHBondContact CG2-CE1 3.42Å; T44-H204 WeakPolarHBondContact CG2-ND1 3.45Å; T44-H204 PolarHBondContact OG1-ND1 3.11Å; T44-H204 VanDerWaalsContact OG1-ND1 3.16Å; V55-H204 HydrophobicContact CB-CB 4.39Å; V55-H204 WeakPolarHBondContact CG2-CD2 3.36Å; V55-H204 WeakPolarHBondContact CG2-NE2 3.46Å; I183-H204 HydrophobicContact CG2-CB 3.89Å; I183-H204 PolarHBondContact N-O 3.33Å; I183-H204 VanDerWaalsContact N-O 3.11Å; I183-H204 PolarHBondContact O-N 2.93Å; C202-H204 PolarHBondContact SG-NE2 3.42Å
205	V	97.2	Very high	92.3	Very high	23 Å²	23	34.2 Å²	34.2	14%	0.139	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	130.5	-178.7	-171.5	0	0	0	0	109.4	T43 Q180 R182 T203	T43-V205 WeakPolarHBondContact O-CB 3.39Å; T43-V205 PolarHBondContact O-N 2.99Å; Q180-V205 HydrophobicContact CG-CG1 3.46Å; Q180-V205 VanDerWaalsContact CG-CG1 3.46Å; R182-V205 HydrophobicContact CB-CG2 4.42Å; R182-V205 HydrophobicContact CG-CG2 4.07Å; T203-V205 HydrophobicContact CG2-CG2 4.38Å
206	F	97.7	Very high	93.2	Very high	2 Å²	2	33.7 Å²	33.7	1%	0.009	18%	0.184	C	C	.	.			trans	-112.8	99.7	177.2	-61.9	-73.9	0	0	0	108.5	Q42 V55 L57 F86 V88 Q180 I183 E208 T209	Q42-F206 HydrophobicContact CG-CD1 3.94Å; Q42-F206 HydrophobicContact CG-CE1 4.31Å; V55-F206 HydrophobicContact CB-CZ 4.31Å; V55-F206 HydrophobicContact CG1-CE2 4.16Å; V55-F206 HydrophobicContact CG1-CZ 3.95Å; V55-F206 WeakPolarHBondContact O-CZ 3.5Å; L57-F206 HydrophobicContact CB-CD1 3.92Å; L57-F206 HydrophobicContact CB-CD2 4.43Å; L57-F206 HydrophobicContact CB-CE1 3.96Å; L57-F206 HydrophobicContact CB-CE2 4.45Å; L57-F206 HydrophobicContact CB-CG 4.17Å; L57-F206 HydrophobicContact CB-CZ 4.23Å; L57-F206 HydrophobicContact CD1-CD2 4.47Å; L57-F206 HydrophobicContact CD2-CB 4.23Å; L57-F206 HydrophobicContact CD2-CG 4.32Å; F86-F206 HydrophobicContact CE2-CD2 4.14Å; F86-F206 AromaticContact CZ-CD2 3.76Å; F86-F206 HydrophobicContact CZ-CD2 3.76Å; F86-F206 HydrophobicContact CZ-CE2 4.07Å; V88-F206 HydrophobicContact CG1-CE2 4.15Å; Q180-F206 PolarHBondContact NE2-O 2.86Å; I183-F206 HydrophobicContact CG2-CE2 4.3Å; F206-E208 VanDerWaalsContact CA-OE2 3.26Å; F206-E208 WeakPolarHBondContact CA-OE2 3.34Å; F206-E208 HydrophobicContact CB-CG 4.42Å; F206-E208 WeakPolarHBondContact CB-OE2 3.26Å; F206-E208 PolarHBondContact O-N 3.15Å; F206-T209 HydrophobicContact CB-CG2 3.75Å; F206-T209 WeakPolarHBondContact O-CB 3.34Å; F206-T209 PolarHBondContact O-N 3.08Å; F206-T209 PolarHBondContact O-OG1 3.06Å
207	P	97.2	Very high	93.9	Very high	17 Å²	17	34.7 Å²	34.7	11%	0.11	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-56.4	-30.1	-178.7	-28.8	38.8	0	0	0	114	S40 H67 T209 A210	S40-P207 WeakPolarHBondContact O-CG 3.34Å; H67-P207 PolarHBondContact CE1-O 2.93Å; H67-P207 PolarHBondContact ND1-O 3.28Å; P207-T209 PolarHBondContact O-N 3.49Å; P207-A210 VanDerWaalsContact O-CB 3.31Å; P207-A210 WeakPolarHBondContact O-CB 3.39Å; P207-A210 PolarHBondContact O-N 3.38Å; P207-A210 VanDerWaalsContact O-N 3.13Å
208	E	97.1	Very high	94.6	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.005	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-63	-17.8	173.4	62.3	-89.9	-116	0	0	113.6	P39 L57 R60 W63 I64 F206	P39-E208 HydrophobicContact CG-CB 4.45Å; L57-E208 HydrophobicContact CD2-CG 3.65Å; R60-E208 IonicContact CZ-OE1 3.16Å; R60-E208 IonicContact NE-OE1 2.72Å; R60-E208 PolarHBondContact NE-OE1 2.98Å; R60-E208 IonicContact NH2-OE1 2.74Å; R60-E208 PolarHBondContact NH2-OE1 3.45Å; W63-E208 HydrophobicContact CB-CG 4.39Å; I64-E208 HydrophobicContact CG1-CB 4.36Å; F206-E208 VanDerWaalsContact CA-OE2 3.26Å; F206-E208 WeakPolarHBondContact CA-OE2 3.34Å; F206-E208 HydrophobicContact CB-CG 4.42Å; F206-E208 WeakPolarHBondContact CB-OE2 3.26Å; F206-E208 PolarHBondContact O-N 3.15Å
209	T	98.2	Very high	95.3	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-91.8	-1.8	176.5	68.1	0	0	0	0	114.2	L57 W63 F86 Q180 P181 F206 P207	L57-T209 HydrophobicContact CD1-CG2 3.87Å; L57-T209 HydrophobicContact CD2-CG2 3.49Å; L57-T209 VanDerWaalsContact CD2-CG2 3.49Å; L57-T209 HydrophobicContact CG-CG2 4.35Å; W63-T209 HydrophobicContact CD2-CG2 3.8Å; W63-T209 HydrophobicContact CE3-CG2 3.86Å; W63-T209 HydrophobicContact CG-CG2 4.24Å; W63-T209 HydrophobicContact CH2-CG2 4.44Å; W63-T209 HydrophobicContact CZ2-CG2 4.41Å; W63-T209 HydrophobicContact CZ3-CG2 4.17Å; F86-T209 HydrophobicContact CD2-CG2 4.1Å; F86-T209 HydrophobicContact CE2-CG2 3.88Å; Q180-T209 PolarHBondContact NE2-OG1 2.86Å; P181-T209 VanDerWaalsContact CD-O 3.3Å; P181-T209 WeakPolarHBondContact CD-O 3.31Å; F206-T209 HydrophobicContact CB-CG2 3.75Å; F206-T209 WeakPolarHBondContact O-CB 3.34Å; F206-T209 PolarHBondContact O-N 3.08Å; F206-T209 PolarHBondContact O-OG1 3.06Å; P207-T209 PolarHBondContact O-N 3.49Å
210	A	98.1	Very high	95.7	Very high	11 Å²	11	24.2 Å²	24.2	9%	0.091	13%	0.13	C	C	.	.			trans	-61.2	143	173.5	0	0	0	0	0	111.4	T71 Y179 P207	T71-A210 WeakPolarHBondContact CB-O 3.38Å; T71-A210 PolarHBondContact OG1-O 3.08Å; Y179-A210 VanDerWaalsContact O-CA 3.26Å; Y179-A210 WeakPolarHBondContact O-CA 3.12Å; P207-A210 VanDerWaalsContact O-CB 3.31Å; P207-A210 WeakPolarHBondContact O-CB 3.39Å; P207-A210 PolarHBondContact O-N 3.38Å; P207-A210 VanDerWaalsContact O-N 3.13Å
211	F	98.1	Very high	96	Very high	3 Å²	3	29.1 Å²	29.1	1%	0.013	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	163.2	-176.5	67.9	-101.6	0	0	0	112.8	T71 M73 M82 V105 L160 L173 K178 Y179 P181 A213	T71-F211 HydrophobicContact CG2-CB 3.66Å; T71-F211 CarbonylContact O-C 3.51Å; T71-F211 WeakPolarHBondContact O-CA 3.2Å; T71-F211 WeakPolarHBondContact O-CB 3.13Å; M73-F211 HydrophobicContact CB-CD2 3.56Å; M73-F211 HydrophobicContact CB-CE2 3.7Å; M73-F211 HydrophobicContact CB-CG 4.11Å; M73-F211 HydrophobicContact CB-CZ 4.33Å; M73-F211 HydrophobicContact CE-CD1 4.43Å; M73-F211 HydrophobicContact CG-CB 3.9Å; M73-F211 HydrophobicContact CG-CD1 3.78Å; M73-F211 HydrophobicContact CG-CD2 3.44Å; M73-F211 VanDerWaalsContact CG-CD2 3.44Å; M73-F211 HydrophobicContact CG-CE1 4.09Å; M73-F211 HydrophobicContact CG-CE2 3.82Å; M73-F211 HydrophobicContact CG-CG 3.44Å; M73-F211 VanDerWaalsContact CG-CG 3.44Å; M73-F211 HydrophobicContact CG-CZ 4.13Å; M82-F211 HydrophobicContact SD-CE1 4.11Å; V105-F211 HydrophobicContact CG1-CE1 4.34Å; V105-F211 HydrophobicContact CG1-CZ 4.01Å; L160-F211 HydrophobicContact CD1-CE1 4.44Å; L160-F211 HydrophobicContact CD1-CE2 3.96Å; L160-F211 HydrophobicContact CD1-CZ 3.58Å; L173-F211 HydrophobicContact CD1-CE2 3.8Å; L173-F211 HydrophobicContact CD1-CZ 3.83Å; K178-F211 WeakPolarHBondContact CA-O 3.01Å; Y179-F211 HydrophobicContact CD2-CE2 4.37Å; Y179-F211 PolarHBondContact N-O 3Å; Y179-F211 PolarHBondContact O-N 2.75Å; P181-F211 HydrophobicContact CG-CD1 4.09Å; P181-F211 HydrophobicContact CG-CE1 3.82Å; F211-A213 HydrophobicContact CE2-CB 4.14Å
212	I	97	Very high	96.3	Very high	13 Å²	13	25.4 Å²	25.4	7%	0.067	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	128.5	167.5	-60.6	175.2	0	0	0	109	T71 E72 M73 Y113 W120 H177 K178 V214	T71-I212 PolarHBondContact O-N 3.44Å; E72-I212 WeakPolarHBondContact CA-O 3.18Å; M73-I212 PolarHBondContact N-O 2.98Å; Y113-I212 HydrophobicContact CD2-CD1 4.35Å; Y113-I212 HydrophobicContact CG-CD1 4.23Å; W120-I212 HydrophobicContact CB-CD1 4.43Å; W120-I212 HydrophobicContact CD2-CD1 3.59Å; W120-I212 HydrophobicContact CE3-CD1 3.39Å; W120-I212 HydrophobicContact CE3-CG2 4.48Å; W120-I212 HydrophobicContact CG-CD1 4.07Å; W120-I212 HydrophobicContact CH2-CB 4.32Å; W120-I212 HydrophobicContact CH2-CD1 4.35Å; W120-I212 HydrophobicContact CH2-CG2 3.7Å; W120-I212 HydrophobicContact CZ2-CG2 4.36Å; W120-I212 HydrophobicContact CZ3-CB 4.48Å; W120-I212 HydrophobicContact CZ3-CD1 3.8Å; W120-I212 HydrophobicContact CZ3-CG2 3.78Å; H177-I212 WeakPolarHBondContact O-CA 3.47Å; K178-I212 HydrophobicContact CB-CG1 4.03Å; K178-I212 HydrophobicContact CG-CG1 4.06Å; I212-V214 HydrophobicContact CG2-CG1 4.04Å
213	A	97.6	Very high	96.4	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	129.8	177.8	0	0	0	0	0	109.5	I75 L173 S175 M176 H177 Y179 F211	I75-A213 HydrophobicContact CD1-CB 4.21Å; I75-A213 HydrophobicContact CG2-CB 4.02Å; L173-A213 HydrophobicContact CB-CB 4.09Å; L173-A213 HydrophobicContact CD1-CB 3.94Å; S175-A213 CarbonylContact C-O 3.58Å; M176-A213 PolarHBondContact N-O 2.92Å; H177-A213 PolarHBondContact O-N 3.48Å; Y179-A213 HydrophobicContact CD2-CB 3.79Å; Y179-A213 HydrophobicContact CE2-CB 3.75Å; F211-A213 HydrophobicContact CE2-CB 4.14Å
214	V	97.7	Very high	96.4	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	150.1	-174.7	-58.7	0	0	0	0	111.8	E72 M73 I74 I75 W120 M176 I212 S216 Q218	E72-V214 HydrophobicContact CB-CG2 4.09Å; M73-V214 PolarHBondContact O-N 3.49Å; I74-V214 CarbonylContact C-O 3.57Å; I74-V214 VanDerWaalsContact CA-O 3.26Å; I74-V214 WeakPolarHBondContact CA-O 3.39Å; I74-V214 HydrophobicContact CD1-CG2 3.9Å; I75-V214 PolarHBondContact N-O 3.11Å; W120-V214 HydrophobicContact CH2-CG1 3.75Å; W120-V214 HydrophobicContact CZ2-CG1 4.07Å; M176-V214 HydrophobicContact SD-CG1 3.99Å; I212-V214 HydrophobicContact CG2-CG1 4.04Å; V214-S216 WeakPolarHBondContact CB-O 3.36Å; V214-S216 WeakPolarHBondContact CG2-O 3.44Å; V214-Q218 HydrophobicContact CG1-CG 4.24Å
215	T	97.4	Very high	96.4	Very high	78 Å²	78	30.6 Å²	30.6	48%	0.479	16%	0.161	S	C	.	.	S	Bend	trans	-79.6	-26.4	174.8	41.5	0	0	0	0	113.1	I75 S175	I75-T215 HydrophobicContact CG1-CG2 4.41Å; S175-T215 PolarHBondContact OG-N 2.71Å
216	S	96.4	Very high	96.3	Very high	65 Å²	65	29.8 Å²	29.8	46%	0.455	16%	0.155	S	C	.	.	S	Bend	trans	-143.7	153.8	170.3	62.8	0	0	0	0	108.9	V214 Q218	V214-S216 WeakPolarHBondContact CB-O 3.36Å; V214-S216 WeakPolarHBondContact CG2-O 3.44Å; S216-Q218 PolarHBondContact O-NE2 2.93Å; S216-Q218 PolarHBondContact OG-NE2 2.88Å
217	Y	96.7	Very high	96.2	Very high	64 Å²	64	30.6 Å²	30.6	25%	0.251	16%	0.159	S	C	.	.			trans	-60.6	144.8	174.4	-64.2	-55.5	0	0	0	111.1	E72 I74 I222 T223 K226	E72-Y217 HydrophobicContact CB-CD1 4Å; E72-Y217 HydrophobicContact CB-CE1 4.35Å; E72-Y217 WeakPolarHBondContact OE2-CA 3.09Å; I74-Y217 HydrophobicContact CD1-CD1 3.52Å; I74-Y217 HydrophobicContact CD1-CD2 4.03Å; I74-Y217 HydrophobicContact CD1-CE1 3.49Å; I74-Y217 VanDerWaalsContact CD1-CE1 3.49Å; I74-Y217 HydrophobicContact CD1-CE2 4.02Å; I74-Y217 HydrophobicContact CD1-CG 3.78Å; I74-Y217 HydrophobicContact CG1-CD1 4.18Å; I74-Y217 HydrophobicContact CG1-CE1 3.61Å; I74-Y217 HydrophobicContact CG1-CE2 3.99Å; I74-Y217 VanDerWaalsContact CG1-CZ 3.49Å; Y217-I222 HydrophobicContact CD1-CG2 4.12Å; Y217-I222 HydrophobicContact CE1-CG2 4.21Å; Y217-T223 VanDerWaalsContact CB-OG1 3.3Å; Y217-T223 WeakPolarHBondContact CB-OG1 3.42Å; Y217-T223 HydrophobicContact CD2-CG2 4.23Å; Y217-K226 HydrophobicContact CE1-CD 4.37Å; Y217-K226 HydrophobicContact CE1-CG 4.16Å; Y217-K226 HydrophobicContact CE2-CG 4.2Å; Y217-K226 WeakPolarHBondContact OH-CD 3.41Å; Y217-K226 WeakPolarHBondContact OH-CE 3.44Å; Y217-K226 WeakPolarHBondContact OH-CG 2.97Å
218	Q	95	Very high	96.1	Very high	51 Å²	51	34.9 Å²	34.9	24%	0.238	18%	0.178	C	C	.	.			trans	-107.1	-49.7	179.2	-50.9	-65.1	-70.3	0	0	110.2	E72 F115 W120 M176 V214 S216	E72-Q218 PolarHBondContact OE2-N 2.87Å; F115-Q218 HydrophobicContact CB-CB 3.61Å; F115-Q218 HydrophobicContact CB-CG 4.11Å; F115-Q218 HydrophobicContact CD1-CB 3.74Å; F115-Q218 HydrophobicContact CD2-CB 4.4Å; F115-Q218 HydrophobicContact CE1-CB 4.49Å; F115-Q218 WeakPolarHBondContact CE1-O 3.42Å; F115-Q218 HydrophobicContact CG-CB 3.68Å; W120-Q218 HydrophobicContact CH2-CB 4.23Å; W120-Q218 HydrophobicContact CH2-CG 3.66Å; W120-Q218 HydrophobicContact CZ2-CB 3.74Å; W120-Q218 HydrophobicContact CZ2-CG 3.61Å; M176-Q218 HydrophobicContact CE-CG 4.32Å; V214-Q218 HydrophobicContact CG1-CG 4.24Å; S216-Q218 PolarHBondContact O-NE2 2.93Å; S216-Q218 PolarHBondContact OG-NE2 2.88Å
219	N	93.4	Very high	96	Very high	11 Å²	11	37.7 Å²	37.7	6%	0.059	19%	0.193	C	C	.	.			trans	-86.1	115	177.5	-171.7	-10.2	0	0	0	111.2	V69 E72 F115 K221 I222 T223	V69-N219 WeakPolarHBondContact CG1-ND2 3.19Å; V69-N219 PolarHBondContact O-ND2 2.87Å; E72-N219 WeakPolarHBondContact OE1-CB 3.36Å; E72-N219 PolarHBondContact OE1-N 2.97Å; F115-N219 HydrophobicContact CE1-CB 4.3Å; F115-N219 HydrophobicContact CE2-CB 3.8Å; F115-N219 HydrophobicContact CZ-CB 3.6Å; N219-K221 PolarHBondContact O-N 2.83Å; N219-K221 VanDerWaalsContact O-N 3.15Å; N219-K221 WeakPolarHBondContact OD1-CB 3.4Å; N219-K221 PolarHBondContact OD1-N 3.08Å; N219-K221 VanDerWaalsContact OD1-N 3.08Å; N219-I222 HydrophobicContact CB-CB 4.44Å; N219-I222 HydrophobicContact CB-CG1 3.97Å; N219-I222 WeakPolarHBondContact O-CB 3.41Å; N219-I222 PolarHBondContact O-N 2.79Å; N219-T223 PolarHBondContact O-N 3.15Å
220	H	93	Very high	95.8	Very high	58 Å²	58	38.4 Å²	38.4	27%	0.269	20%	0.197	S	C	.	.	H	α-helix	trans	-56.7	-30.6	178	61.3	-94.7	0	0	0	113.2	I222 T223 Q224	H220-I222 VanDerWaalsContact C-N 3.3Å; H220-I222 PolarHBondContact O-N 3.12Å; H220-T223 WeakPolarHBondContact O-CB 3.46Å; H220-T223 PolarHBondContact O-N 3.44Å; H220-T223 VanDerWaalsContact O-N 3.12Å; H220-Q224 WeakPolarHBondContact O-CG 3.3Å; H220-Q224 PolarHBondContact O-N 3.06Å
221	K	94.6	Very high	95.5	Very high	114 Å²	114	42.2 Å²	42.2	50%	0.496	22%	0.221	S	C	.	.	H	α-helix	trans	-65.7	-33.9	176.4	-60	-172.9	178.3	-174.5	0	112.3	V69 N219 L225	V69-K221 HydrophobicContact CG1-CB 3.65Å; N219-K221 PolarHBondContact O-N 2.83Å; N219-K221 VanDerWaalsContact O-N 3.15Å; N219-K221 WeakPolarHBondContact OD1-CB 3.4Å; N219-K221 PolarHBondContact OD1-N 3.08Å; N219-K221 VanDerWaalsContact OD1-N 3.08Å; K221-L225 WeakPolarHBondContact O-CG 3.48Å; K221-L225 PolarHBondContact O-N 3.29Å
222	I	95.5	Very high	95.2	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-65.7	-48.1	170.9	-62.1	-67.9	0	0	0	108.9	F66 V69 G70 E72 Y217 N219 H220 Q224 L225 K226	F66-I222 HydrophobicContact CD1-CD1 3.96Å; F66-I222 HydrophobicContact CD1-CG2 4.35Å; F66-I222 HydrophobicContact CE1-CG2 4.25Å; V69-I222 HydrophobicContact CB-CD1 3.73Å; V69-I222 HydrophobicContact CG1-CD1 3.54Å; V69-I222 HydrophobicContact CG1-CG1 3.84Å; G70-I222 VanDerWaalsContact O-CD1 3.24Å; G70-I222 WeakPolarHBondContact O-CD1 3.42Å; E72-I222 HydrophobicContact CB-CG2 4.05Å; E72-I222 HydrophobicContact CG-CG1 4.23Å; E72-I222 HydrophobicContact CG-CG2 4.39Å; Y217-I222 HydrophobicContact CD1-CG2 4.12Å; Y217-I222 HydrophobicContact CE1-CG2 4.21Å; N219-I222 HydrophobicContact CB-CB 4.44Å; N219-I222 HydrophobicContact CB-CG1 3.97Å; N219-I222 WeakPolarHBondContact O-CB 3.41Å; N219-I222 PolarHBondContact O-N 2.79Å; H220-I222 VanDerWaalsContact C-N 3.3Å; H220-I222 PolarHBondContact O-N 3.12Å; I222-Q224 VanDerWaalsContact C-N 3.32Å; I222-Q224 PolarHBondContact O-N 2.97Å; I222-L225 PolarHBondContact O-N 3.23Å; I222-K226 HydrophobicContact CG2-CD 4.42Å; I222-K226 HydrophobicContact CG2-CG 4.08Å; I222-K226 WeakPolarHBondContact O-CG 3.47Å; I222-K226 PolarHBondContact O-N 3.2Å
223	T	95.3	Very high	94.9	Very high	41 Å²	41	51 Å²	51	25%	0.252	26%	0.261	S	S	.	.	H	α-helix	trans	-53.2	-47	177.3	-53.4	0	0	0	0	112.3	Y217 N219 H220 K226 I227	Y217-T223 VanDerWaalsContact CB-OG1 3.3Å; Y217-T223 WeakPolarHBondContact CB-OG1 3.42Å; Y217-T223 HydrophobicContact CD2-CG2 4.23Å; N219-T223 PolarHBondContact O-N 3.15Å; H220-T223 WeakPolarHBondContact O-CB 3.46Å; H220-T223 PolarHBondContact O-N 3.44Å; H220-T223 VanDerWaalsContact O-N 3.12Å; T223-K226 WeakPolarHBondContact O-CB 3.36Å; T223-K226 PolarHBondContact O-N 2.95Å; T223-I227 HydrophobicContact CG2-CD1 3.97Å; T223-I227 WeakPolarHBondContact O-CG1 3.12Å; T223-I227 PolarHBondContact O-N 2.94Å
224	Q	94.9	Very high	94.4	Very high	63 Å²	63	58.1 Å²	58.1	29%	0.294	29%	0.292	S	S	.	.	H	α-helix	trans	-58.4	-53.6	175.3	-72.3	169.2	-41.7	0	0	111.7	H220 I222 K226 I227 E228 L244	H220-Q224 WeakPolarHBondContact O-CG 3.3Å; H220-Q224 PolarHBondContact O-N 3.06Å; I222-Q224 VanDerWaalsContact C-N 3.32Å; I222-Q224 PolarHBondContact O-N 2.97Å; Q224-K226 PolarHBondContact O-N 2.89Å; Q224-I227 WeakPolarHBondContact O-CA 3.2Å; Q224-I227 WeakPolarHBondContact O-CB 3.39Å; Q224-I227 PolarHBondContact O-N 3.18Å; Q224-E228 WeakPolarHBondContact O-CG 3.5Å; Q224-E228 PolarHBondContact O-N 2.87Å; Q224-L244 HydrophobicContact CG-CD1 3.7Å
225	L	95.8	Very high	94	Very high	28 Å²	28	61.7 Å²	61.7	15%	0.147	33%	0.329	C	S	.	.	H	α-helix	trans	-56.5	-36	176.1	-74.6	172.7	0	0	0	112.6	F66 V69 K221 I222 N229	F66-L225 HydrophobicContact CD1-CB 4.21Å; F66-L225 HydrophobicContact CD1-CD1 4.23Å; F66-L225 HydrophobicContact CE1-CB 3.44Å; F66-L225 VanDerWaalsContact CE1-CB 3.44Å; F66-L225 HydrophobicContact CE1-CD1 4.28Å; F66-L225 HydrophobicContact CZ-CB 3.65Å; V69-L225 HydrophobicContact CB-CD1 4.41Å; V69-L225 HydrophobicContact CG2-CD1 3.99Å; K221-L225 WeakPolarHBondContact O-CG 3.48Å; K221-L225 PolarHBondContact O-N 3.29Å; I222-L225 PolarHBondContact O-N 3.23Å; L225-N229 VanDerWaalsContact O-CB 3.3Å; L225-N229 WeakPolarHBondContact O-CB 3.49Å; L225-N229 PolarHBondContact O-N 2.87Å; L225-N229 VanDerWaalsContact O-N 3.12Å; L225-N229 PolarHBondContact O-ND2 3.12Å
226	K	96.4	Very high	93.5	Very high	6 Å²	6	64.3 Å²	64.3	3%	0.026	33%	0.334	C	S	.	.	H	α-helix	trans	-67.6	-42.5	174.1	-57.1	-75.8	-168.7	-148.2	0	110.9	F66 E72 F83 Y217 I222 T223 Q224 N230	F66-K226 HydrophobicContact CE1-CD 3.62Å; F66-K226 HydrophobicContact CE1-CG 3.96Å; F66-K226 HydrophobicContact CZ-CD 3.77Å; F66-K226 HydrophobicContact CZ-CG 4.25Å; E72-K226 VanDerWaalsContact O-CE 3.24Å; E72-K226 WeakPolarHBondContact O-CE 3.45Å; E72-K226 PolarHBondContact O-NZ 2.88Å; F83-K226 HydrophobicContact CD1-CD 3.77Å; F83-K226 PolarHBondContact O-NZ 3.32Å; Y217-K226 HydrophobicContact CE1-CD 4.37Å; Y217-K226 HydrophobicContact CE1-CG 4.16Å; Y217-K226 HydrophobicContact CE2-CG 4.2Å; Y217-K226 WeakPolarHBondContact OH-CD 3.41Å; Y217-K226 WeakPolarHBondContact OH-CE 3.44Å; Y217-K226 WeakPolarHBondContact OH-CG 2.97Å; I222-K226 HydrophobicContact CG2-CD 4.42Å; I222-K226 HydrophobicContact CG2-CG 4.08Å; I222-K226 WeakPolarHBondContact O-CG 3.47Å; I222-K226 PolarHBondContact O-N 3.2Å; T223-K226 WeakPolarHBondContact O-CB 3.36Å; T223-K226 PolarHBondContact O-N 2.95Å; Q224-K226 PolarHBondContact O-N 2.89Å; K226-N230 WeakPolarHBondContact O-CB 3.34Å; K226-N230 PolarHBondContact O-N 3.03Å
227	I	94.8	Very high	93.2	Very high	19 Å²	19	66.4 Å²	66.4	10%	0.097	33%	0.332	C	S	.	.	H	α-helix	trans	-63.3	-49.6	178.6	-72.3	166.3	0	0	0	111.1	T223 Q224 A233 F236 R237	T223-I227 HydrophobicContact CG2-CD1 3.97Å; T223-I227 WeakPolarHBondContact O-CG1 3.12Å; T223-I227 PolarHBondContact O-N 2.94Å; Q224-I227 WeakPolarHBondContact O-CA 3.2Å; Q224-I227 WeakPolarHBondContact O-CB 3.39Å; Q224-I227 PolarHBondContact O-N 3.18Å; I227-A233 HydrophobicContact CG1-CB 4.5Å; I227-F236 HydrophobicContact CD1-CB 4.04Å; I227-F236 HydrophobicContact CG1-CB 4.06Å; I227-F236 HydrophobicContact CG2-CB 3.88Å; I227-R237 HydrophobicContact CG2-CB 4.43Å; I227-R237 HydrophobicContact CG2-CG 3.67Å; I227-R237 PolarHBondContact O-NE 2.95Å; I227-R237 PolarHBondContact O-NH2 3.28Å
228	E	94.8	Very high	91.9	Very high	106 Å²	106	67.2 Å²	67.2	50%	0.495	36%	0.359	S	S	.	.	H	α-helix	trans	-62.1	-41	-180	-71	166	-165.1	0	0	113.6	Q224 R237	Q224-E228 WeakPolarHBondContact O-CG 3.5Å; Q224-E228 PolarHBondContact O-N 2.87Å; E228-R237 PolarHBondContact O-NE 2.89Å; E228-R237 PolarHBondContact O-NH1 3.05Å; E228-R237 PolarHBondContact O-NH2 3.44Å
229	N	94.9	Very high	90.2	Very high	60 Å²	60	68.3 Å²	68.3	32%	0.321	37%	0.373	S	S	.	.	H	α-helix	trans	-101.8	-25.7	-169.5	-64.7	-89.7	0	0	0	113.1	L62 F83 L225 P231	L62-N229 HydrophobicContact CD1-CB 3.94Å; L62-N229 WeakPolarHBondContact CD1-OD1 3.3Å; L62-N229 HydrophobicContact CD2-CB 4.44Å; F83-N229 HydrophobicContact CE1-CB 4.01Å; F83-N229 VanDerWaalsContact CZ-C 3.45Å; F83-N229 HydrophobicContact CZ-CB 3.94Å; F83-N229 WeakPolarHBondContact CZ-O 3.33Å; L225-N229 VanDerWaalsContact O-CB 3.3Å; L225-N229 WeakPolarHBondContact O-CB 3.49Å; L225-N229 PolarHBondContact O-N 2.87Å; L225-N229 VanDerWaalsContact O-N 3.12Å; L225-N229 PolarHBondContact O-ND2 3.12Å; N229-P231 WeakPolarHBondContact O-CD 3.37Å
230	N	93.9	Very high	88.6	Confident	16 Å²	16	69.6 Å²	69.6	9%	0.086	38%	0.38	C	S	.	.			trans	-83.3	122	-179.6	-169.8	-16.7	0	0	0	111.3	F83 K226 F232 A233 R237	F83-N230 HydrophobicContact CD1-CB 4.06Å; F83-N230 HydrophobicContact CD2-CB 3.9Å; F83-N230 HydrophobicContact CE1-CB 3.9Å; F83-N230 HydrophobicContact CE2-CB 3.74Å; F83-N230 HydrophobicContact CG-CB 4.07Å; F83-N230 VanDerWaalsContact CZ-CA 3.48Å; F83-N230 HydrophobicContact CZ-CB 3.75Å; K226-N230 WeakPolarHBondContact O-CB 3.34Å; K226-N230 PolarHBondContact O-N 3.03Å; N230-F232 PolarHBondContact O-N 2.89Å; N230-F232 WeakPolarHBondContact OD1-CB 3.4Å; N230-F232 WeakPolarHBondContact OD1-CD2 3.48Å; N230-F232 PolarHBondContact OD1-N 2.86Å; N230-A233 HydrophobicContact CB-CB 4.07Å; N230-A233 PolarHBondContact O-N 3.49Å; N230-R237 PolarHBondContact O-NH2 3.06Å
231	P	92.4	Very high	86.9	Confident	91 Å²	91	73.3 Å²	73.3	59%	0.591	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-58.3	-35.4	175.7	-25.3	35.5	0	0	0	113	N229 A233 K234	N229-P231 WeakPolarHBondContact O-CD 3.37Å; P231-A233 PolarHBondContact O-N 2.8Å; P231-K234 WeakPolarHBondContact O-CB 3.5Å; P231-K234 PolarHBondContact O-N 3.39Å
232	F	90.8	Very high	85.1	Confident	185 Å²	185	75.9 Å²	75.9	81%	0.811	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-73.8	-3.4	179	-58.7	-73.7	0	0	0	113.8	N230	N230-F232 PolarHBondContact O-N 2.89Å; N230-F232 WeakPolarHBondContact OD1-CB 3.4Å; N230-F232 WeakPolarHBondContact OD1-CD2 3.48Å; N230-F232 PolarHBondContact OD1-N 2.86Å
233	A	91.2	Very high	83.5	Confident	14 Å²	14	79.4 Å²	79.4	12%	0.116	43%	0.434	C	S	.	.	G	3₁₀ helix	trans	-111.2	7.8	174.4	0	0	0	0	0	113	I227 N230 P231 G235 F236	I227-A233 HydrophobicContact CG1-CB 4.5Å; N230-A233 HydrophobicContact CB-CB 4.07Å; N230-A233 PolarHBondContact O-N 3.49Å; P231-A233 PolarHBondContact O-N 2.8Å; A233-G235 PolarHBondContact O-N 2.94Å; A233-G235 VanDerWaalsContact O-N 3.08Å; A233-F236 PolarHBondContact O-N 2.93Å; A233-F236 VanDerWaalsContact O-N 3.07Å
234	K	87.9	Confident	81.8	Confident	151 Å²	151	79 Å²	79	66%	0.657	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-53.2	-34.3	-176.3	-173.6	-177.5	176.4	-173.4	0	113.7	P231 F236 R237	P231-K234 WeakPolarHBondContact O-CB 3.5Å; P231-K234 PolarHBondContact O-N 3.39Å; K234-F236 PolarHBondContact O-N 3.05Å; K234-R237 WeakPolarHBondContact O-CB 3.4Å; K234-R237 WeakPolarHBondContact O-CG 3.49Å; K234-R237 PolarHBondContact O-N 3.21Å; K234-R237 VanDerWaalsContact O-N 3.14Å
235	G	88.7	Confident	80.1	Confident	75 Å²	75	81 Å²	81	77%	0.773	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-66.3	-10.5	-179.6	0	0	0	0	0	116	A233	A233-G235 PolarHBondContact O-N 2.94Å; A233-G235 VanDerWaalsContact O-N 3.08Å
236	F	87.5	Confident	78.5	Confident	133 Å²	133	86.8 Å²	86.8	58%	0.583	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-98.1	-7.5	174.7	-60.9	-79.9	0	0	0	113	I227 A233 K234 G238	I227-F236 HydrophobicContact CD1-CB 4.04Å; I227-F236 HydrophobicContact CG1-CB 4.06Å; I227-F236 HydrophobicContact CG2-CB 3.88Å; A233-F236 PolarHBondContact O-N 2.93Å; A233-F236 VanDerWaalsContact O-N 3.07Å; K234-F236 PolarHBondContact O-N 3.05Å; F236-G238 PolarHBondContact O-N 3Å
237	R	89.1	Confident	76.8	Confident	109 Å²	109	91.1 Å²	91.1	41%	0.411	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	120.1	-177.9	-62.6	177.1	-166.7	-170	5.3	110	I227 E228 N230 K234	I227-R237 HydrophobicContact CG2-CB 4.43Å; I227-R237 HydrophobicContact CG2-CG 3.67Å; I227-R237 PolarHBondContact O-NE 2.95Å; I227-R237 PolarHBondContact O-NH2 3.28Å; E228-R237 PolarHBondContact O-NE 2.89Å; E228-R237 PolarHBondContact O-NH1 3.05Å; E228-R237 PolarHBondContact O-NH2 3.44Å; N230-R237 PolarHBondContact O-NH2 3.06Å; K234-R237 WeakPolarHBondContact O-CB 3.4Å; K234-R237 WeakPolarHBondContact O-CG 3.49Å; K234-R237 PolarHBondContact O-N 3.21Å; K234-R237 VanDerWaalsContact O-N 3.14Å
238	G	70	Confident	75.3	Confident	80 Å²	80	93 Å²	93	83%	0.825	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	96	2.8	175.4	0	0	0	0	0	115.5	F236	F236-G238 PolarHBondContact O-N 3Å
239	S	59.7	Low	73.4	Confident	75 Å²	75	96.9 Å²	96.9	52%	0.524	51%	0.505	S	S	.	.			trans	-81.5	-2.8	170.4	-59.8	0	0	0	0	113.7
240	D	59.7	Low	71.5	Confident	37 Å²	37	99.3 Å²	99.3	20%	0.198	52%	0.518	C	S	.	.	H	α-helix	trans	-97.2	-18	-141.9	-79	-11.4	0	0	0	115.8	M242 L244	D240-M242 VanDerWaalsContact C-N 3.3Å; D240-M242 PolarHBondContact O-N 3.23Å; D240-L244 HydrophobicContact CB-CD1 3.61Å; D240-L244 HydrophobicContact CB-CG 3.71Å; D240-L244 VanDerWaalsContact CG-CD1 3.49Å; D240-L244 VanDerWaalsContact O-CB 3.27Å; D240-L244 WeakPolarHBondContact O-CB 3.43Å; D240-L244 PolarHBondContact O-N 3.3Å; D240-L244 VanDerWaalsContact O-N 3.13Å
241	D	57.3	Low	69.7	Low	137 Å²	137	104.6 Å²	104.6	73%	0.733	54%	0.542	S	S	*	.	H	α-helix	trans	-66.9	-30.6	-179.9	-112.8	-16.2	0	0	0	112.6	H245	D241-H245 PolarHBondContact O-ND1 3.15Å; D241-H245 IonicContact OD1-CE1 3.79Å
242	M	56.3	Low	67.6	Low	167 Å²	167	105.1 Å²	105.1	82%	0.823	55%	0.547	S	S	*	.	H	α-helix	trans	-93.4	-49.2	177.2	-67.9	-177.4	69.2	0	0	112.6	D240 R246	D240-M242 VanDerWaalsContact C-N 3.3Å; D240-M242 PolarHBondContact O-N 3.23Å; M242-R246 PolarHBondContact O-N 2.87Å
243	E	61.8	Low	65.5	Low	75 Å²	75	100.7 Å²	100.7	35%	0.35	54%	0.536	S	S	.	.	H	α-helix	trans	-77.7	-37.8	-172.1	-162.7	67.4	-139.3	0	0	112.6	R246 M247	E243-R246 WeakPolarHBondContact O-CA 3.38Å; E243-R246 VanDerWaalsContact O-CB 3.25Å; E243-R246 WeakPolarHBondContact O-CB 3.3Å; E243-R246 PolarHBondContact O-N 3.24Å; E243-R246 VanDerWaalsContact O-N 3.13Å; E243-R246 IonicContact OE1-CZ 2.92Å; E243-R246 VanDerWaalsContact OE1-CZ 3.29Å; E243-R246 IonicContact OE1-NE 3.97Å; E243-R246 PolarHBondContact OE1-NE 3.04Å; E243-R246 IonicContact OE1-NH2 3Å; E243-R246 PolarHBondContact OE1-NH2 3.11Å; E243-R246 IonicContact OE2-NE 3.27Å; E243-M247 HydrophobicContact CG-CE 4Å; E243-M247 WeakPolarHBondContact O-CG 3.27Å; E243-M247 PolarHBondContact O-N 3.3Å
244	L	59.4	Low	63.3	Low	31 Å²	31	110 Å²	110	16%	0.162	57%	0.574	C	S	.	*	H	α-helix	trans	-71	-33.5	177.7	-59.5	-169.7	0	0	0	112.4	Q224 D240 R246 M247 S248	Q224-L244 HydrophobicContact CG-CD1 3.7Å; D240-L244 HydrophobicContact CB-CD1 3.61Å; D240-L244 HydrophobicContact CB-CG 3.71Å; D240-L244 VanDerWaalsContact CG-CD1 3.49Å; D240-L244 VanDerWaalsContact O-CB 3.27Å; D240-L244 WeakPolarHBondContact O-CB 3.43Å; D240-L244 PolarHBondContact O-N 3.3Å; D240-L244 VanDerWaalsContact O-N 3.13Å; L244-R246 PolarHBondContact O-N 2.8Å; L244-M247 HydrophobicContact CD2-SD 3.85Å; L244-M247 PolarHBondContact O-N 3.18Å; L244-S248 VanDerWaalsContact O-CB 3.3Å; L244-S248 WeakPolarHBondContact O-CB 3.44Å; L244-S248 PolarHBondContact O-N 3.33Å
245	H	60.5	Low	60.9	Low	107 Å²	107	110.9 Å²	110.9	50%	0.495	58%	0.58	S	S	.	*	H	α-helix	trans	-61	-35.7	170	-84.9	104.3	0	0	0	111.6	D241 R249	D241-H245 PolarHBondContact O-ND1 3.15Å; D241-H245 IonicContact OD1-CE1 3.79Å; H245-R249 WeakPolarHBondContact O-CG 3.49Å; H245-R249 PolarHBondContact O-N 3.19Å; H245-R249 VanDerWaalsContact O-N 3.14Å
246	R	61.8	Low	58.3	Low	148 Å²	148	117.5 Å²	117.5	56%	0.558	58%	0.583	S	S	*	*	H	α-helix	trans	-65.6	-47.1	173.6	-150.2	174.8	77.2	92.8	-0.7	111.6	M242 E243 L244 L250	M242-R246 PolarHBondContact O-N 2.87Å; E243-R246 WeakPolarHBondContact O-CA 3.38Å; E243-R246 VanDerWaalsContact O-CB 3.25Å; E243-R246 WeakPolarHBondContact O-CB 3.3Å; E243-R246 PolarHBondContact O-N 3.24Å; E243-R246 VanDerWaalsContact O-N 3.13Å; E243-R246 IonicContact OE1-CZ 2.92Å; E243-R246 VanDerWaalsContact OE1-CZ 3.29Å; E243-R246 IonicContact OE1-NE 3.97Å; E243-R246 PolarHBondContact OE1-NE 3.04Å; E243-R246 IonicContact OE1-NH2 3Å; E243-R246 PolarHBondContact OE1-NH2 3.11Å; E243-R246 IonicContact OE2-NE 3.27Å; L244-R246 PolarHBondContact O-N 2.8Å; R246-L250 WeakPolarHBondContact O-CD1 3.49Å; R246-L250 VanDerWaalsContact O-CG 3.3Å; R246-L250 WeakPolarHBondContact O-CG 3.3Å; R246-L250 PolarHBondContact O-N 3.16Å; R246-L250 VanDerWaalsContact O-N 3.16Å
247	M	61.5	Low	56	Low	98 Å²	98	116.9 Å²	116.9	48%	0.483	59%	0.593	S	S	.	*	H	α-helix	trans	-62.6	-42.5	177	-67.3	179.7	178.2	0	0	112.8	E243 L244 L250 Q251	E243-M247 HydrophobicContact CG-CE 4Å; E243-M247 WeakPolarHBondContact O-CG 3.27Å; E243-M247 PolarHBondContact O-N 3.3Å; L244-M247 HydrophobicContact CD2-SD 3.85Å; L244-M247 PolarHBondContact O-N 3.18Å; M247-L250 PolarHBondContact O-N 3.14Å; M247-Q251 PolarHBondContact O-N 3.27Å
248	S	61.6	Low	53.9	Low	57 Å²	57	117.9 Å²	117.9	40%	0.399	61%	0.611	S	S	.	*	H	α-helix	trans	-64	-44.8	179.4	-176.5	0	0	0	0	112	L244 L250 Q251 S252	L244-S248 VanDerWaalsContact O-CB 3.3Å; L244-S248 WeakPolarHBondContact O-CB 3.44Å; L244-S248 PolarHBondContact O-N 3.33Å; S248-L250 PolarHBondContact O-N 2.83Å; S248-Q251 PolarHBondContact O-N 2.96Å; S248-S252 PolarHBondContact O-N 3.39Å
249	R	56.6	Low	52.6	Low	188 Å²	188	119.8 Å²	119.8	71%	0.709	61%	0.606	S	S	*	*	H	α-helix	trans	-59.9	-45.5	174.2	-73.2	-178.9	-174.1	-135.9	3.3	111.9	H245 Q251 S252 T253	H245-R249 WeakPolarHBondContact O-CG 3.49Å; H245-R249 PolarHBondContact O-N 3.19Å; H245-R249 VanDerWaalsContact O-N 3.14Å; R249-Q251 VanDerWaalsContact C-N 3.27Å; R249-Q251 PolarHBondContact O-N 3.46Å; R249-S252 PolarHBondContact O-N 3.36Å; R249-S252 VanDerWaalsContact O-N 3.11Å; R249-T253 PolarHBondContact O-N 3.13Å; R249-T253 PolarHBondContact O-OG1 3.07Å
250	L	54.8	Low	51.8	Low	111 Å²	111	121.5 Å²	121.5	58%	0.581	62%	0.615	S	S	*	*	H	α-helix	trans	-63.6	-26.8	-179.3	-73.7	167.2	0	0	0	114.1	R246 M247 S248	R246-L250 WeakPolarHBondContact O-CD1 3.49Å; R246-L250 VanDerWaalsContact O-CG 3.3Å; R246-L250 WeakPolarHBondContact O-CG 3.3Å; R246-L250 PolarHBondContact O-N 3.16Å; R246-L250 VanDerWaalsContact O-N 3.16Å; M247-L250 PolarHBondContact O-N 3.14Å; S248-L250 PolarHBondContact O-N 2.83Å
251	Q	55.2	Low	51.2	Low	128 Å²	128	131.9 Å²	131.9	60%	0.598	65%	0.652	S	S	*	*	H	α-helix	trans	-83.6	-26.9	173.8	-69	-176.4	1.4	0	0	113	M247 S248 R249	M247-Q251 PolarHBondContact O-N 3.27Å; S248-Q251 PolarHBondContact O-N 2.96Å; R249-Q251 VanDerWaalsContact C-N 3.27Å; R249-Q251 PolarHBondContact O-N 3.46Å
252	S	48.3	Very low	50.5	Low	101 Å²	101	129.6 Å²	129.6	71%	0.706	65%	0.646	S	S	*	*	H	α-helix	trans	-76.4	-39.8	178	-167	0	0	0	0	112.3	S248 R249 K254	S248-S252 PolarHBondContact O-N 3.39Å; R249-S252 PolarHBondContact O-N 3.36Å; R249-S252 VanDerWaalsContact O-N 3.11Å; S252-K254 VanDerWaalsContact C-N 3.28Å; S252-K254 PolarHBondContact O-N 3.08Å
253	T	46.9	Very low	49.8	Very low	93 Å²	93	127.8 Å²	127.8	57%	0.571	65%	0.645	S	S	*	*			trans	-78.2	69.9	-177.9	57.3	0	0	0	0	112.7	R249 E255	R249-T253 PolarHBondContact O-N 3.13Å; R249-T253 PolarHBondContact O-OG1 3.07Å; T253-E255 PolarHBondContact O-N 2.74Å; T253-E255 VanDerWaalsContact O-N 3.15Å
254	K	46	Very low	48.7	Very low	208 Å²	208	130.9 Å²	130.9	90%	0.904	67%	0.669	S	S	*	*			trans	-83.1	44.3	163.6	-158	-151.9	173.8	-168.4	0	111.7	S252	S252-K254 VanDerWaalsContact C-N 3.28Å; S252-K254 PolarHBondContact O-N 3.08Å
255	E	35.5	Very low	47.8	Very low	171 Å²	171	138.9 Å²	138.9	80%	0.799	70%	0.697	S	S	*	*	S	Bend	trans	-127.6	128.5	177.7	-171.4	153.9	-136.2	0	0	108.2	T253	T253-E255 PolarHBondContact O-N 2.74Å; T253-E255 VanDerWaalsContact O-N 3.15Å
256	Y	34.4	Very low	46.6	Very low	213 Å²	213	142.6 Å²	142.6	84%	0.835	71%	0.714	S	S	*	*			trans	-69	137.5	-176.5	-80.4	-99.6	0	0	0	109.8	V258	Y256-V258 PolarHBondContact O-N 3.36Å
257	P	40.2	Very low	45.6	Very low	121 Å²	121	145.3 Å²	145.3	79%	0.786	73%	0.725	S	S	*	*			trans	-65.3	102.5	174.3	26.8	-33.4	0	0	0	109.7	V259	P257-V259 PolarHBondContact O-N 3.28Å
258	V	44.6	Very low	44.3	Very low	130 Å²	130	147.3 Å²	147.3	79%	0.788	74%	0.742	S	S	*	*			trans	-66.3	105.2	174.3	177.9	0	0	0	0	108.2	Y256 P260	Y256-V258 PolarHBondContact O-N 3.36Å; V258-P260 VanDerWaalsContact O-CD 3.27Å; V258-P260 WeakPolarHBondContact O-CD 3.25Å
259	V	43	Very low	43	Very low	119 Å²	119	148.1 Å²	148.1	72%	0.721	76%	0.76	S	S	*	*			trans	-62.7	119.1	177.2	179.9	0	0	0	0	109.1	P257 R261	P257-V259 PolarHBondContact O-N 3.28Å; V259-R261 PolarHBondContact O-N 3.14Å
260	P	41.6	Very low	41.8	Very low	111 Å²	111	144.4 Å²	144.4	72%	0.721	76%	0.762	S	S	*	*			trans	-62.1	120	178.5	-23.9	35.5	0	0	0	111.3	V258 S262	V258-P260 VanDerWaalsContact O-CD 3.27Å; V258-P260 WeakPolarHBondContact O-CD 3.25Å; P260-S262 PolarHBondContact O-N 3.18Å
261	R	47	Very low	41	Very low	255 Å²	255	144.1 Å²	144.1	96%	0.962	77%	0.77	S	S	*	*			trans	-89.8	89.2	176	-94.9	-175.2	165.4	150.1	-4.2	111.3	V259	V259-R261 PolarHBondContact O-N 3.14Å
262	S	44.6	Very low	40	Very low	89 Å²	89	147.6 Å²	147.6	62%	0.622	79%	0.785	S	S	*	*			trans	-140.4	108.8	159.3	46.2	0	0	0	0	107.7	P260	P260-S262 PolarHBondContact O-N 3.18Å
263	T	40.3	Very low	39.4	Very low	130 Å²	130	147.5 Å²	147.5	80%	0.798	79%	0.785	S	S	*	*				52.3	123.4	88.9	63.6	0	0	0	0	113.1
264	V	38	Very low	39.4	Very low	139 Å²	139	149 Å²	149	84%	0.842	80%	0.797	S	S	*	*			cis	-149.1	167.3	12.1	97.8	0	0	0	0	113.2
265	R	41.4	Very low	38.8	Very low	199 Å²	199	148.5 Å²	148.5	75%	0.751	80%	0.795	S	S	*	*			trans	-74.6	119.8	-177.6	-174.8	-162.8	-142.4	176	9	111.6
266	Q	35.8	Very low	38.8	Very low	186 Å²	186	146.3 Å²	146.3	87%	0.869	80%	0.798	S	S	*	*			trans	-110	130.8	152.1	-97.8	-165.7	-34.1	0	0	110.6
267	R	39.8	Very low	38.6	Very low	205 Å²	205	140 Å²	140	77%	0.774	80%	0.797	S	S	*	*			trans	-101.8	122.3	163.2	-80.8	176.4	166.6	170.4	-7.5	107.4
268	V	34.5	Very low	38.3	Very low	139 Å²	139	142.1 Å²	142.1	84%	0.842	80%	0.802	S	S	*	*			trans	-135.1	140.2	139.3	-176.2	0	0	0	0	105.9
269	G	35.3	Very low	37.9	Very low	75 Å²	75	142.2 Å²	142.2	77%	0.773	80%	0.803	S	S	*	*			trans	-150.6	123	175.1	0	0	0	0	0	109.8
270	S	31.3	Very low	37.4	Very low	109 Å²	109	144.4 Å²	144.4	76%	0.762	81%	0.805	S	S	*	*			trans	-157.1	115.9	166.1	54	0	0	0	0	108.1
271	S	37.4	Very low	36.9	Very low	106 Å²	106	142.3 Å²	142.3	74%	0.741	80%	0.804	S	S	*	*			trans	-59.6	148.2	161.6	-46.7	0	0	0	0	109.4
272	H	33.6	Very low	36.2	Very low	200 Å²	200	139.3 Å²	139.3	93%	0.926	80%	0.803	S	S	*	*			trans	-178.3	149	134.2	-91.8	-60	0	0	0	110.3
273	S	36.2	Very low	35.5	Very low	100 Å²	100	139.4 Å²	139.4	70%	0.699	81%	0.809	S	S	*	*			trans	-141	139.2	171.3	172.1	0	0	0	0	106.4
274	P	46.9	Very low	35.1	Very low	125 Å²	125	139.5 Å²	139.5	81%	0.812	81%	0.81	S	S	*	*				-148.2	178.5	110.2	37.3	-19.8	0	0	0	115.6
275	F	33.8	Very low	35.8	Very low	197 Å²	197	137.8 Å²	137.8	86%	0.864	80%	0.802	S	S	*	*			trans	-64.7	153.3	177.3	-83.9	-114.6	0	0	0	115.4
276	S	34.3	Very low	35.3	Very low	124 Å²	124	133.1 Å²	133.1	87%	0.867	80%	0.8	S	S	*	*				161.9	150.6	110.4	-70.2	0	0	0	0	113.7
277	G	31.2	Very low	35.1	Very low	80 Å²	80	130 Å²	130	83%	0.825	79%	0.793	S	S	*	*			trans	139	97.8	157.8	0	0	0	0	0	117.3
278	D	33.8	Very low	34.9	Very low	166 Å²	166	127.2 Å²	127.2	89%	0.888	79%	0.793	S	S	*	*			trans	-82.8	166.1	164.6	-79.2	-66.8	0	0	0	112.8
279	V	35.5	Very low	34.7	Very low	132 Å²	132	125 Å²	125	80%	0.8	78%	0.784	S	S	*	*			trans	-167.3	152.6	130.9	144.5	0	0	0	0	110.6
280	Q	34.3	Very low	34.6	Very low	166 Å²	166	125.8 Å²	125.8	78%	0.776	78%	0.777	S	S	*	*			trans	-46.7	163.4	-176.8	-76.6	84.4	-21.5	0	0	117.8
281	G	30.1	Very low	34.7	Very low	67 Å²	67	128.1 Å²	128.1	69%	0.691	78%	0.776	S	S	*	*			cis	140.9	173.9	-4.8	0	0	0	0	0	115.4
282	M	31.8	Very low	34.4	Very low	192 Å²	192	132.5 Å²	132.5	95%	0.946	78%	0.778	S	S	*	*			trans	68	151.3	175.5	-55.5	-178.6	69.5	0	0	116.2
283	A	30.3	Very low	34.4	Very low	90 Å²	90	127.6 Å²	127.6	74%	0.744	77%	0.766	S	S	*	*			cis	-139.8	173.9	4.8	0	0	0	0	0	113.1
284	T	33	Very low	34.2	Very low	132 Å²	132	131.2 Å²	131.2	81%	0.81	77%	0.772	S	S	*	*			trans	-104.9	-168.7	174.9	60.8	0	0	0	0	109.7
285	P	50.7	Low	33.2	Very low	104 Å²	104	129.8 Å²	129.8	68%	0.675	76%	0.764	S	S	*	*			cis	-139.7	-168.2	-2.7	42	-22.5	0	0	0	116.1
286	S	32.7	Very low	33	Very low	101 Å²	101	127.6 Å²	127.6	71%	0.706	76%	0.756	S	S	*	*			trans	77.2	144	144.7	75.4	0	0	0	0	119.7
287	T	31.8	Very low	32.9	Very low	121 Å²	121	128.3 Å²	128.3	74%	0.742	75%	0.751	S	S	*	*			cis	-160.8	159.8	-10.2	9.9	0	0	0	0	113.2
288	L	35.5	Very low	32.8	Very low	145 Å²	145	127.6 Å²	127.6	76%	0.759	74%	0.743	S	S	*	*			trans	52.9	104.4	151.6	-93.9	74.5	0	0	0	122.6
289	S	30.2	Very low	32.6	Very low	93 Å²	93	126.5 Å²	126.5	65%	0.65	74%	0.742	S	S	*	*				69.8	151.7	111.8	84.9	0	0	0	0	123.6
290	S	33.1	Very low	32.4	Very low	92 Å²	92	126.1 Å²	126.1	64%	0.643	74%	0.74	S	S	*	*			trans	80.4	144	151.4	-56.5	0	0	0	0	118.3
291	Q	33.1	Very low	32.1	Very low	158 Å²	158	123.1 Å²	123.1	74%	0.738	74%	0.737	S	S	*	*			cis	-160.4	159.3	-14.3	-113	179.7	47	0	0	110.6
292	Y	30.5	Very low	32.2	Very low	198 Å²	198	125.5 Å²	125.5	78%	0.776	74%	0.739	S	S	*	*			trans	39	126.1	150.9	-87.7	-89.5	0	0	0	123.2
293	S	33.9	Very low	32.2	Very low	97 Å²	97	121.4 Å²	121.4	68%	0.678	73%	0.729	S	S	*	*			trans	68.2	156.7	133.1	76.3	0	0	0	0	119.3
294	Q	31.1	Very low	32.4	Very low	175 Å²	175	125.8 Å²	125.8	82%	0.818	73%	0.734	S	S	*	*			cis	-157.8	-168	-11.2	-125.2	174.6	-7.7	0	0	110.7
295	C	26.2	Very low	32.3	Very low	95 Å²	95	126.3 Å²	126.3	64%	0.642	73%	0.732	S	S	*	*			trans	-36.4	166	162.3	-41.9	0	0	0	0	116
296	E	29.7	Very low	31.5	Very low	152 Å²	152	129.4 Å²	129.4	71%	0.71	74%	0.742	S	S	*	*			cis	-165.4	171.7	1.5	-130.4	171.1	111.7	0	0	111.6
297	N	31.9	Very low	31.6	Very low	139 Å²	139	132.2 Å²	132.2	74%	0.743	75%	0.748	S	S	*	*			trans	32.4	131.4	150.6	-56.6	-26.1	0	0	0	123.3
298	G	30.2	Very low	32.8	Very low	64 Å²	64	131.4 Å²	131.4	66%	0.66	75%	0.745	S	S	*	*				135.8	120.4	112	0	0	0	0	0	119.8
299	V	29.6	Very low	32.5	Very low	144 Å²	144	132.9 Å²	132.9	87%	0.873	75%	0.748	S	S	*	*			trans	56.5	155.8	153.5	-81.2	0	0	0	0	119
300	T	30.2	Very low	32.5	Very low	124 Å²	124	133.4 Å²	133.4	76%	0.761	75%	0.751	S	S	*	*			cis	-154.8	156.2	12.8	-14.3	0	0	0	0	111.3
301	S	29.1	Very low	32.2	Very low	102 Å²	102	132.6 Å²	132.6	71%	0.713	76%	0.757	S	S	*	*			trans	46.7	136.8	144.3	-139.3	0	0	0	0	120.7
302	T	30.7	Very low	32.1	Very low	118 Å²	118	130.8 Å²	130.8	72%	0.724	76%	0.762	S	S	*	*				-171.9	152.5	63.2	35.2	0	0	0	0	113.3
303	S	33.5	Very low	32.1	Very low	106 Å²	106	131.9 Å²	131.9	74%	0.741	77%	0.767	S	S	*	*			trans	60.9	157.5	148.2	-56.3	0	0	0	0	119.9
304	Q	33.6	Very low	32.6	Very low	181 Å²	181	133.2 Å²	133.2	85%	0.846	77%	0.773	S	S	*	*			cis	-151.8	162.8	1.5	-140.2	164.5	3.4	0	0	111.6
305	D	31.5	Very low	32.8	Very low	143 Å²	143	132.4 Å²	132.4	77%	0.765	77%	0.774	S	S	*	*			trans	-74.3	157.8	-179.1	-53.9	-100	0	0	0	115.8
306	L	33.7	Very low	33.9	Very low	170 Å²	170	133.2 Å²	133.2	89%	0.89	78%	0.777	S	S	*	*				171	160.5	109.8	-87.2	173.9	0	0	0	114.7
307	L	34.6	Very low	34	Very low	159 Å²	159	134 Å²	134	83%	0.832	78%	0.781	S	S	*	*			trans	-146.9	177.7	-177.6	-86.1	176.5	0	0	0	108.1
308	P	56.3	Low	34.1	Very low	104 Å²	104	135 Å²	135	68%	0.675	78%	0.781	S	S	*	*			cis	-134.6	-148.2	-24.9	34.2	-11.6	0	0	0	112.4
309	Q	30.3	Very low	34.1	Very low	177 Å²	177	140.6 Å²	140.6	83%	0.827	79%	0.789	S	S	*	*			trans	96.1	152.4	163.1	-59.1	-170.7	14.4	0	0	118.8
310	S	30.1	Very low	34.2	Very low	103 Å²	103	137.2 Å²	137.2	72%	0.72	78%	0.784	S	S	*	*			cis	-174.4	147.7	-30	59.3	0	0	0	0	113.2
311	G	27.5	Very low	34.3	Very low	75 Å²	75	140.2 Å²	140.2	77%	0.773	79%	0.789	S	S	*	*			trans	79.4	166.3	163.7	0	0	0	0	0	117.2
312	S	29.3	Very low	34.3	Very low	120 Å²	120	141.3 Å²	141.3	84%	0.839	79%	0.787	S	S	*	*			cis	-167.5	164.9	-18.9	36	0	0	0	0	111.6
313	Y	31.9	Very low	34.3	Very low	222 Å²	222	144.5 Å²	144.5	87%	0.871	79%	0.787	S	S	*	*			trans	-54.6	156	-176.2	-74.2	-81.2	0	0	0	116.9
314	P	44	Very low	34	Very low	125 Å²	125	145.7 Å²	145.7	81%	0.812	80%	0.795	S	S	*	*				-146.8	171	87.4	38.7	-20.8	0	0	0	117.9
315	L	35.8	Very low	33.9	Very low	158 Å²	158	144 Å²	144	83%	0.827	79%	0.789	S	S	*	*			trans	-107.9	163.6	166.2	-86.6	167.4	0	0	0	110.5
316	P	49.3	Very low	33.9	Very low	111 Å²	111	146.4 Å²	146.4	72%	0.721	79%	0.793	S	S	*	*				-150.4	156.3	119.4	37	-20.7	0	0	0	117.4
317	H	31.1	Very low	33.7	Very low	168 Å²	168	149 Å²	149	78%	0.778	79%	0.791	S	S	*	*			trans	27.5	137.8	148.8	-70.6	-82.4	0	0	0	122.8
318	E	33.4	Very low	33.5	Very low	160 Å²	160	149.5 Å²	149.5	75%	0.748	79%	0.787	S	S	*	*			cis	99	157.9	41.1	-96.7	-82.6	70.2	0	0	115.3
319	H	31.5	Very low	32.2	Very low	182 Å²	182	149.3 Å²	149.3	84%	0.843	79%	0.794	S	S	*	*			trans	85.9	143.1	-168.9	-51.1	83.5	0	0	0	114.6
320	G	30.1	Very low	32.4	Very low	74 Å²	74	146.7 Å²	146.7	76%	0.763	79%	0.786	S	S	*	*			cis	-169.7	169.7	-0.5	0	0	0	0	0	113.5
321	Q	32.5	Very low	32.4	Very low	186 Å²	186	148.9 Å²	148.9	87%	0.869	79%	0.789	S	S	*	*			trans	-65.3	155.3	-169.3	-60.8	158	-28.9	0	0	115.6
322	D	30.5	Very low	32.7	Very low	126 Å²	126	152.2 Å²	152.2	67%	0.674	79%	0.789	S	S	*	*				-178.1	161.5	105.5	-106.8	-8.6	0	0	0	119.4
323	Y	29.8	Very low	32.6	Very low	184 Å²	184	151.1 Å²	151.1	72%	0.722	78%	0.781	S	S	*	*			trans	-9.8	140.4	177.6	-59.2	-78.3	0	0	0	125.2
324	C	26.8	Very low	32.5	Very low	132 Å²	132	148.3 Å²	148.3	89%	0.892	78%	0.775	S	S	*	*				-158.1	144.8	112.9	-105.8	0	0	0	0	114.1
325	I	32.2	Very low	31.8	Very low	144 Å²	144	148.2 Å²	148.2	74%	0.738	78%	0.778	S	S	*	*			trans	-133.8	131.2	179.7	-65.9	176.7	0	0	0	112.1
326	K	30.8	Very low	31.5	Very low	195 Å²	195	144.4 Å²	144.4	85%	0.848	78%	0.776	S	S	*	*			trans	-156.3	113.4	152.8	-116	171.1	175.7	176.6	0	107.1
327	R	30.7	Very low	30.6	Very low	225 Å²	225	146.5 Å²	146.5	85%	0.849	78%	0.777	S	S	*	*				47.9	142.4	81.6	-57.5	-164.4	-142	172.7	4.4	114.1
328	K	29.6	Very low	30.7	Very low	169 Å²	169	145.8 Å²	145.8	74%	0.735	77%	0.773	S	S	*	*			cis	-175.7	136.3	-25.6	160.8	168.7	172.2	144	0	104.9	D330	K328-D330 WeakPolarHBondContact CE-OD2 3.27Å; K328-D330 IonicContact NZ-OD2 3.83Å; K328-D330 PolarHBondContact NZ-OD2 3.45Å
329	A	28.4	Very low	30.5	Very low	100 Å²	100	141.3 Å²	141.3	83%	0.826	77%	0.77	S	S	*	*			trans	-158.1	100.7	159.2	0	0	0	0	0	109.9
330	D	34.6	Very low	30.4	Very low	122 Å²	122	142 Å²	142	65%	0.652	77%	0.767	S	S	*	*			trans	-84.4	148.4	148.7	-54	-81.2	0	0	0	106.2	K328	K328-D330 WeakPolarHBondContact CE-OD2 3.27Å; K328-D330 IonicContact NZ-OD2 3.83Å; K328-D330 PolarHBondContact NZ-OD2 3.45Å
331	D	30.9	Very low	30.5	Very low	148 Å²	148	147.3 Å²	147.3	79%	0.791	77%	0.769	S	S	*	*			trans	-151	132.1	152.2	-141.7	-51.9	0	0	0	109.8
332	D	34.1	Very low	30.5	Very low	146 Å²	146	147.8 Å²	147.8	78%	0.781	77%	0.768	S	S	*	*			trans	-150.2	109.4	-178.9	-177	-17.7	0	0	0	107.6
333	C	26.9	Very low	31.3	Very low	97 Å²	97	147.1 Å²	147.1	66%	0.655	77%	0.77	S	S	*	*			trans	-153.4	98	174.1	50.5	0	0	0	0	113.9
334	H	29.8	Very low	31.1	Very low	162 Å²	162	148.3 Å²	148.3	75%	0.75	78%	0.775	S	S	*	*			trans	40.2	121	131.1	-57.6	-25.1	0	0	0	122.7
335	S	29.3	Very low	31.3	Very low	124 Å²	124	148.3 Å²	148.3	87%	0.867	77%	0.766	S	S	*	*				67.4	120.5	119.6	-55.8	0	0	0	0	122.5
336	G	29.3	Very low	31.4	Very low	78 Å²	78	150.1 Å²	150.1	80%	0.804	77%	0.771	S	S	*	*			trans	146.5	143.2	149.1	0	0	0	0	0	112.9
337	E	30.3	Very low	31.3	Very low	155 Å²	155	146.4 Å²	146.4	72%	0.724	77%	0.769	S	S	*	*			cis	-172.6	166	-23.6	-139.3	-74	85.1	0	0	104.2
338	H	32.6	Very low	31.2	Very low	153 Å²	153	141.1 Å²	141.1	71%	0.708	77%	0.767	S	S	*	*			trans	73.2	139.8	179	-41.7	-25.6	0	0	0	114.7
339	G	29.1	Very low	31.2	Very low	66 Å²	66	138.3 Å²	138.3	68%	0.68	77%	0.769	S	S	*	*			cis	114.6	129.6	14.3	0	0	0	0	0	109.1
340	Y	30.3	Very low	31.2	Very low	196 Å²	196	138.5 Å²	138.5	77%	0.769	76%	0.764	S	S	*	*			cis	-151.3	141.6	34.5	-98.2	-112.6	0	0	0	114.3
341	K	31.2	Very low	31	Very low	185 Å²	185	141.2 Å²	141.2	80%	0.804	77%	0.773	S	S	*	*			trans	51	129.1	141.4	-61.7	-173.8	-175.3	177.5	0	123.5
342	K	34.3	Very low	31.1	Very low	196 Å²	196	142.7 Å²	142.7	85%	0.852	78%	0.775	S	S	*	*			trans	-67.5	-168.4	150.9	-48.2	177.4	173.1	179.1	0	111
343	P	46	Very low	30.9	Very low	112 Å²	112	141.9 Å²	141.9	73%	0.727	77%	0.77	S	S	*	*			cis	-137.4	-169.8	-5.9	43.6	-25.6	0	0	0	114.3
344	Y	26.2	Very low	31.4	Very low	210 Å²	210	144.5 Å²	144.5	82%	0.824	77%	0.773	S	S	*	*				-167	-166.7	109.8	-162.3	-118.2	0	0	0	111.2
345	L	31.2	Very low	31.4	Very low	132 Å²	132	146.6 Å²	146.6	69%	0.691	78%	0.775	S	S	*	*			trans	-103.1	163.9	-150.6	-132.7	76.7	0	0	0	115.9
346	E	34.9	Very low	31.5	Very low	181 Å²	181	151.2 Å²	151.2	85%	0.846	78%	0.775	S	S	*	*			trans	-67.9	147.5	158.9	171.6	178.3	-141.4	0	0	112.1
347	S	27.6	Very low	31.7	Very low	117 Å²	117	158.5 Å²	158.5	82%	0.818	78%	0.779	S	S	*	*			trans	-153.4	142.2	169	57.9	0	0	0	0	111.6
348	S	29.7	Very low	32.3	Very low	114 Å²	114	156.5 Å²	156.5	80%	0.797	78%	0.779	S	S	*	*			trans	-121	-169.2	-175.6	-170.9	0	0	0	0	111.4
349	S	28	Very low	32.2	Very low	111 Å²	111	155.1 Å²	155.1	78%	0.776	78%	0.781	S	S	*	*			trans	65.5	148.5	-170.9	71.6	0	0	0	0	113.1
350	S	29.8	Very low	32.2	Very low	103 Å²	103	155.2 Å²	155.2	72%	0.72	78%	0.782	S	S	*	*			cis	-177.1	-177.5	-4.7	41	0	0	0	0	103.7
351	E	30.3	Very low	32.2	Very low	179 Å²	179	156.6 Å²	156.6	84%	0.836	79%	0.787	S	S	*	*			cis	-146.2	-164.2	22.7	-62.5	175.8	121.1	0	0	110.3
352	E	31.8	Very low	32	Very low	179 Å²	179	156 Å²	156	84%	0.836	79%	0.787	S	S	*	*			trans	-67.7	178.5	172.8	-75.1	139.3	105.1	0	0	113.2
353	D	31.3	Very low	31.9	Very low	129 Å²	129	154.9 Å²	154.9	69%	0.69	79%	0.785	S	S	*	*			cis	-158.3	-174.1	27.4	-156.7	-1.1	0	0	0	114.6
354	H	35.5	Very low	31.1	Very low	152 Å²	152	154.4 Å²	154.4	70%	0.704	78%	0.784	S	S	*	*			trans	-68.1	153.9	-170.4	-54.5	-25	0	0	0	117.1
355	Y	30.6	Very low	31.4	Very low	206 Å²	206	152.1 Å²	152.1	81%	0.808	79%	0.785	S	S	*	*				-179.4	160.7	100.7	-112.6	-86.6	0	0	0	116.3
356	Y	31.4	Very low	31.2	Very low	221 Å²	221	151.4 Å²	151.4	87%	0.867	79%	0.792	S	S	*	*			trans	80	151	164.5	-101.7	-89	0	0	0	121.9
357	R	34	Very low	31.1	Very low	232 Å²	232	151 Å²	151	88%	0.875	79%	0.794	S	S	*	*			trans	-124.2	167.3	-164.5	-118.8	-156	174.7	-168.3	1.3	112.1
358	P	42.1	Very low	31.3	Very low	113 Å²	113	150.3 Å²	150.3	73%	0.734	80%	0.796	S	S	*	*			trans	-94.9	170.8	-167.6	38.6	-37.5	0	0	0	115.7
359	V	29.9	Very low	31.2	Very low	124 Å²	124	151 Å²	151	75%	0.752	80%	0.801	S	S	*	*			trans	-136.4	140.4	169.3	-177.6	0	0	0	0	107.9	Y361	V359-Y361 HydrophobicContact CG1-CD2 3.88Å; V359-Y361 HydrophobicContact CG1-CE2 3.94Å
360	G	30.5	Very low	31.1	Very low	67 Å²	67	149.6 Å²	149.6	69%	0.691	80%	0.804	S	S	*	*			cis	120.1	69.6	-7.3	0	0	0	0	0	115.1
361	Y	29.2	Very low	31.2	Very low	226 Å²	226	149.2 Å²	149.2	89%	0.886	81%	0.806	S	S	*	*			trans	-141.6	159.4	171.2	-93.5	-77.1	0	0	0	113.8	V359	V359-Y361 HydrophobicContact CG1-CD2 3.88Å; V359-Y361 HydrophobicContact CG1-CE2 3.94Å
362	H	28.1	Very low	31.3	Very low	172 Å²	172	152.2 Å²	152.2	80%	0.796	81%	0.812	S	S	*	*			trans	-152.7	174.8	-172.3	177.5	-103.5	0	0	0	109.5
363	Q	31.7	Very low	31.1	Very low	172 Å²	172	153.9 Å²	153.9	80%	0.804	81%	0.81	S	S	*	*			trans	75.9	149.4	-173.5	-69.5	-177.6	-4.2	0	0	115.2
364	S	29.7	Very low	31	Very low	102 Å²	102	153 Å²	153	71%	0.713	81%	0.814	S	S	*	*			cis	-151.2	155.1	0.4	48	0	0	0	0	114.2
365	L	32.7	Very low	30.8	Very low	162 Å²	162	153.1 Å²	153.1	85%	0.848	82%	0.815	S	S	*	*			trans	7	129.9	148.3	-68.7	161.3	0	0	0	120.6
366	S	26	Very low	30.9	Very low	118 Å²	118	147.8 Å²	147.8	83%	0.825	81%	0.808	S	S	*	*			trans	-155.4	154.5	135.9	66.6	0	0	0	0	111.3
367	L	33.7	Very low	30.9	Very low	171 Å²	171	143.2 Å²	143.2	90%	0.895	81%	0.808	S	S	*	*			trans	-104.5	137.7	167.4	-80.9	83.1	0	0	0	109.3
368	A	31	Very low	30.9	Very low	103 Å²	103	140.7 Å²	140.7	85%	0.851	81%	0.806	S	S	*	*			trans	-152.9	145.5	159	0	0	0	0	0	111.5
369	S	27.5	Very low	30.5	Very low	130 Å²	130	147.2 Å²	147.2	91%	0.909	82%	0.816	S	S	*	*			trans	-68.7	148.9	-177.3	-48.6	0	0	0	0	113.7
370	G	27.2	Very low	30.7	Very low	81 Å²	81	149.9 Å²	149.9	84%	0.835	82%	0.821	S	S	*	*			trans	178.9	101.8	168.2	0	0	0	0	0	113.2
371	A	31.9	Very low	30.8	Very low	94 Å²	94	151.2 Å²	151.2	78%	0.777	83%	0.825	S	S	*	*			trans	-98.6	130.9	175.5	0	0	0	0	0	110.9
372	Y	30.8	Very low	31.3	Very low	242 Å²	242	146.5 Å²	146.5	95%	0.949	82%	0.824	S	S	*	*			trans	-142.8	147.2	159.9	-101.8	-77.5	0	0	0	111.2
373	R	28	Very low	32.1	Very low	215 Å²	215	146.1 Å²	146.1	81%	0.811	82%	0.824	S	S	*	*			trans	-141.4	123.7	-170.7	-175.7	-169.5	-164.6	-115.5	11.6	109.8
374	S	29.5	Very low	32.4	Very low	109 Å²	109	149.1 Å²	149.1	76%	0.762	83%	0.83	S	S	*	*			trans	-155.3	131.3	161.8	-61.7	0	0	0	0	105.9
375	E	31.3	Very low	32.7	Very low	155 Å²	155	148.4 Å²	148.4	72%	0.724	83%	0.83	S	S	*	*				62.5	140.3	52.7	-73.8	-141.5	64.9	0	0	115.1
376	S	32.6	Very low	32.9	Very low	94 Å²	94	146.6 Å²	146.6	66%	0.657	83%	0.831	S	S	*	*			cis	-167.1	154.3	-24	48.6	0	0	0	0	108.9
377	S	32.2	Very low	33.3	Very low	125 Å²	125	146.1 Å²	146.1	87%	0.874	83%	0.828	S	S	*	*			trans	-159.9	61.4	171.9	68.8	0	0	0	0	114
378	Q	33.5	Very low	33.3	Very low	180 Å²	180	143 Å²	143	84%	0.841	82%	0.821	S	S	*	*			trans	-100.1	121.7	168.1	-175.8	170.8	-9	0	0	109
379	R	34.3	Very low	33.7	Very low	250 Å²	250	147.9 Å²	147.9	94%	0.943	83%	0.826	S	S	*	*			trans	-94.4	134.2	176.6	-71.4	-175.3	175.6	-124.6	-0.2	110.5
380	Q	33.5	Very low	33.8	Very low	179 Å²	179	145.3 Å²	145.3	84%	0.836	82%	0.82	S	S	*	*			trans	-131.1	159.3	177.1	-162	165.8	5.2	0	0	110
381	A	31.7	Very low	34.1	Very low	96 Å²	96	145.7 Å²	145.7	79%	0.793	82%	0.815	S	S	*	*			trans	-76	154.8	-173	0	0	0	0	0	113.3
382	C	41.5	Very low	34.1	Very low	127 Å²	127	149.7 Å²	149.7	86%	0.858	82%	0.818	S	S	*	*			trans	-86.9	144.3	178.3	-57.5	0	0	0	0	112.2
383	M	44.2	Very low	34.8	Very low	163 Å²	163	142.8 Å²	142.8	80%	0.803	80%	0.803	S	S	*	*			trans	-118.1	147	170.7	-82.9	-81	-72	0	0	109.4
384	Y	38.8	Very low	35.1	Very low	236 Å²	236	139 Å²	139	93%	0.925	80%	0.803	S	S	*	*			trans	-147.4	141.7	158.6	-93.8	-74.9	0	0	0	109.1
385	A	35.7	Very low	36	Very low	87 Å²	87	138.6 Å²	138.6	72%	0.719	80%	0.798	S	S	*	*			trans	-157.6	140.4	-178.5	0	0	0	0	0	112.3
386	S	36.2	Very low	36	Very low	123 Å²	123	136.4 Å²	136.4	86%	0.86	80%	0.8	S	S	*	*			trans	-175.7	155.2	162.5	51.6	0	0	0	0	109
387	S	34.2	Very low	35.9	Very low	109 Å²	109	138.5 Å²	138.5	76%	0.762	80%	0.803	S	S	*	*			cis	-113	-145.3	-9	55.1	0	0	0	0	109.7
388	S	34.5	Very low	35.9	Very low	106 Å²	106	140.1 Å²	140.1	74%	0.741	80%	0.797	S	S	*	*			cis	-142.5	-151.9	12.9	-59.8	0	0	0	0	110.2
389	Q	38	Very low	35.7	Very low	204 Å²	204	139.3 Å²	139.3	95%	0.953	80%	0.798	S	S	*	*			trans	-145.8	161.6	-179	-67.2	-175	-3.6	0	0	114.3
390	G	30.3	Very low	35.9	Very low	77 Å²	77	134.5 Å²	134.5	79%	0.794	79%	0.789	S	S	*	*			trans	124.1	145.2	153.6	0	0	0	0	0	115.1
391	A	34	Very low	35.8	Very low	88 Å²	88	129.7 Å²	129.7	73%	0.727	78%	0.776	S	S	*	*			cis	-166	168.8	-18.9	0	0	0	0	0	109.7
392	E	31.9	Very low	35.8	Very low	178 Å²	178	131.3 Å²	131.3	83%	0.832	78%	0.78	S	S	*	*			trans	70.6	153.9	166.9	-56.7	-49.7	94.3	0	0	121.8
393	P	45.7	Very low	35.5	Very low	98 Å²	98	131.6 Å²	131.6	64%	0.636	77%	0.773	S	S	*	*			trans	-147.6	176.4	-147.6	43.2	-21.2	0	0	0	119.9
394	V	34.1	Very low	35	Very low	134 Å²	134	128.9 Å²	128.9	81%	0.812	77%	0.766	S	S	*	*			trans	73.3	151.3	159.4	-168.9	0	0	0	0	117.9
395	P	47.6	Very low	34.8	Very low	101 Å²	101	130 Å²	130	66%	0.656	77%	0.768	S	S	*	*			cis	-129.9	169.9	-28	35.5	-18.7	0	0	0	116.8
396	S	30.9	Very low	34.6	Very low	110 Å²	110	130.3 Å²	130.3	77%	0.769	77%	0.77	S	S	*	*			trans	69	160.3	150.5	73	0	0	0	0	117.8
397	L	31.6	Very low	34.5	Very low	138 Å²	138	130.2 Å²	130.2	72%	0.723	77%	0.77	S	S	*	*			cis	-151.5	161.2	16.8	-178.3	57.9	0	0	0	111.6
398	E	32	Very low	34.6	Very low	159 Å²	159	131.3 Å²	131.3	74%	0.743	77%	0.772	S	S	*	*			trans	67.3	111	161.9	-90.1	154.9	-143.3	0	0	121
399	D	30.2	Very low	34.6	Very low	163 Å²	163	131 Å²	131	87%	0.872	77%	0.77	S	S	*	*			trans	-140	102.3	170.3	-170.6	3.2	0	0	0	107.9
400	I	37.4	Very low	34.7	Very low	148 Å²	148	127.5 Å²	127.5	76%	0.759	76%	0.764	S	S	*	*			trans	-139.2	115.1	-174.5	-68.2	-173.5	0	0	0	113
401	S	30.6	Very low	34.9	Very low	79 Å²	79	134.8 Å²	134.8	55%	0.552	77%	0.769	S	S	*	*			trans	59.1	116.9	147.2	179	0	0	0	0	120.4	N403	S401-N403 PolarHBondContact OG-ND2 2.9Å
402	C	31.8	Very low	34.9	Very low	130 Å²	130	134 Å²	134	88%	0.878	77%	0.77	S	S	*	*				-147.3	114.6	107.5	-119.7	0	0	0	0	114.7
403	N	36.8	Very low	34.9	Very low	132 Å²	132	131.3 Å²	131.3	71%	0.706	77%	0.771	S	S	*	*			trans	-35.7	171.7	169.2	-62.8	-59.8	0	0	0	118.5	S401	S401-N403 PolarHBondContact OG-ND2 2.9Å
404	T	33.8	Very low	34.1	Very low	107 Å²	107	132.5 Å²	132.5	66%	0.656	78%	0.78	S	S	*	*			cis	172.8	145.6	-24.1	-77.8	0	0	0	0	105.2
405	W	33.5	Very low	34.1	Very low	260 Å²	260	131.6 Å²	131.6	99%	0.985	78%	0.78	S	S	*	*			trans	-171.6	154.2	140.6	-97.4	10.7	0	0	0	114.2
406	A	31.7	Very low	33.4	Very low	92 Å²	92	133.3 Å²	133.3	76%	0.76	79%	0.788	S	S	*	*			trans	-58	149.7	-157.6	0	0	0	0	0	118.1
407	S	33.9	Very low	33.5	Very low	121 Å²	121	134.3 Å²	134.3	85%	0.846	79%	0.79	S	S	*	*			trans	-77.9	152.5	156.9	52.5	0	0	0	0	111.3
408	V	36.6	Very low	33.7	Very low	132 Å²	132	133.7 Å²	133.7	80%	0.8	79%	0.792	S	S	*	*			trans	-133.1	133.3	172.4	-174.2	0	0	0	0	108.7
409	S	35.1	Very low	33.8	Very low	101 Å²	101	134.8 Å²	134.8	71%	0.706	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-70.1	147	-177.8	-56	0	0	0	0	112.8
410	P	39.6	Very low	34	Very low	129 Å²	129	135.7 Å²	135.7	84%	0.838	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-70.3	136.4	174.5	29.6	-34.3	0	0	0	111.3
411	Y	34.4	Very low	34.9	Very low	230 Å²	230	133.6 Å²	133.6	90%	0.902	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-72.8	146.2	172.3	-89.9	-98.8	0	0	0	111.6
412	G	34.6	Very low	35	Very low	71 Å²	71	138 Å²	138	73%	0.732	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-72.7	148.1	-173.5	0	0	0	0	0	114.7	C414	G412-C414 PolarHBondContact O-N 2.8Å
413	S	30.2	Very low	35	Very low	122 Å²	122	138.6 Å²	138.6	85%	0.853	80%	0.798	S	S	*	*			trans	-75.5	114.5	172.8	53.4	0	0	0	0	111.5
414	C	29.8	Very low	34.9	Very low	124 Å²	124	142.1 Å²	142.1	84%	0.838	80%	0.801	S	S	*	*			trans	-76.7	124.4	165.8	-72.3	0	0	0	0	110.4	G412	G412-C414 PolarHBondContact O-N 2.8Å
415	S	34.2	Very low	34.9	Very low	114 Å²	114	144 Å²	144	80%	0.797	81%	0.807	S	S	*	*			trans	-81.6	142.5	162.7	45.2	0	0	0	0	110.1
416	V	32.4	Very low	35.6	Very low	138 Å²	138	136.6 Å²	136.6	84%	0.836	79%	0.792	S	S	*	*			trans	-126	129.1	171.1	178.9	0	0	0	0	108.4
417	T	33.5	Very low	35.4	Very low	130 Å²	130	142.4 Å²	142.4	80%	0.798	80%	0.796	S	S	*	*			trans	-77.3	150.2	-170.6	-48.8	0	0	0	0	112.5
418	T	35.2	Very low	35.3	Very low	126 Å²	126	143.7 Å²	143.7	77%	0.773	79%	0.789	S	S	*	*			trans	-66.6	135.2	176.9	50.7	0	0	0	0	113.6
419	M	33.6	Very low	35	Very low	181 Å²	181	144.4 Å²	144.4	89%	0.892	78%	0.783	S	S	*	*			trans	-134.7	159.8	157.1	-87.9	-87.2	69.6	0	0	110.8
420	Q	35.4	Very low	34.9	Very low	183 Å²	183	149.1 Å²	149.1	86%	0.855	79%	0.791	S	S	*	*			trans	-115.7	169.6	-167.7	-92.4	-111.4	-28.7	0	0	112.3
421	P	55.5	Low	34.5	Very low	104 Å²	104	147.5 Å²	147.5	68%	0.675	78%	0.783	S	S	*	*			trans	-107.8	146.3	-147.8	38.5	-34.9	0	0	0	117.5
422	M	32.8	Very low	34.5	Very low	171 Å²	171	140.4 Å²	140.4	84%	0.842	77%	0.772	S	S	*	*			trans	176.1	158.3	159.3	-104.6	165.8	169.6	0	0	108
423	E	32.2	Very low	34.5	Very low	142 Å²	142	145.6 Å²	145.6	66%	0.664	78%	0.777	S	S	*	*			cis	-145.4	-108.8	-15.3	-151.9	166.6	-165.8	0	0	112.2
424	R	34.7	Very low	34.9	Very low	207 Å²	207	149.5 Å²	149.5	78%	0.781	78%	0.779	S	S	*	*			trans	-143.7	162.8	-155.7	-76	174.5	171.7	139.1	-7.4	115
425	L	34.5	Very low	35.1	Very low	146 Å²	146	150.6 Å²	150.6	76%	0.764	78%	0.781	S	S	*	*			cis	-143.4	-70.5	-0.4	-130.8	168.9	0	0	0	117.3
426	P	47.2	Very low	35.2	Very low	105 Å²	105	151 Å²	151	68%	0.682	79%	0.785	S	S	*	*			trans	-133.8	-178.9	-145.4	41.7	-23.4	0	0	0	118.9
427	Y	27.5	Very low	35.1	Very low	213 Å²	213	148.4 Å²	148.4	84%	0.835	79%	0.785	S	S	*	*			trans	78	145.3	173.4	-85.5	-150.8	0	0	0	116
428	Q	31.8	Very low	35.1	Very low	149 Å²	149	147.4 Å²	147.4	70%	0.696	78%	0.784	S	S	*	*			cis	-144.4	-176.5	7.3	-115.3	-93.9	-16	0	0	112.5
429	H	29.6	Very low	35.4	Very low	147 Å²	147	149.8 Å²	149.8	68%	0.681	79%	0.791	S	S	*	*			trans	-119.7	151.3	-166.4	-170.8	-83.9	0	0	0	112.3
430	F	33.1	Very low	35.4	Very low	199 Å²	199	147 Å²	147	87%	0.873	78%	0.784	S	S	*	*			trans	-143.9	145.9	172.3	-105.3	-79.2	0	0	0	114.6
431	S	32.1	Very low	35.2	Very low	95 Å²	95	143.5 Å²	143.5	66%	0.664	78%	0.779	S	S	*	*			trans	-165	154.6	172.9	-63.4	0	0	0	0	107.1
432	A	34.3	Very low	34.2	Very low	82 Å²	82	150.6 Å²	150.6	68%	0.678	79%	0.793	S	S	*	*			cis	-119.3	-148.4	-4.7	0	0	0	0	0	109.9
433	H	35.8	Very low	34.4	Very low	180 Å²	180	151.3 Å²	151.3	83%	0.833	80%	0.799	S	S	*	*				-159.3	160.4	51.2	-76.8	-90.9	0	0	0	112.6
434	F	38.3	Very low	34.3	Very low	204 Å²	204	148.4 Å²	148.4	90%	0.895	81%	0.807	S	S	*	*			trans	-93.9	137.4	166.5	-102.6	-101.1	0	0	0	111
435	T	32.9	Very low	34.1	Very low	146 Å²	146	142.2 Å²	142.2	90%	0.896	81%	0.808	S	S	*	*			trans	-142.9	144.4	146.1	51.4	0	0	0	0	109.8
436	S	36.7	Very low	34.1	Very low	124 Å²	124	142.2 Å²	142.2	87%	0.867	81%	0.814	S	S	*	*			trans	-114.8	145.4	172.3	49.3	0	0	0	0	109.6
437	G	30.5	Very low	33.3	Very low	82 Å²	82	140.8 Å²	140.8	85%	0.845	82%	0.818	S	S	*	*			trans	-155.1	132.3	-178.5	0	0	0	0	0	111.7
438	S	33.6	Very low	33.4	Very low	109 Å²	109	133.8 Å²	133.8	76%	0.762	81%	0.81	S	S	*	*			trans	-102.9	146.8	175	-177.7	0	0	0	0	109.9
439	L	40.7	Very low	33.5	Very low	177 Å²	177	136.4 Å²	136.4	93%	0.927	82%	0.822	S	S	*	*			trans	-132.7	142.9	172.5	-73.2	177.1	0	0	0	110.5
440	V	33.5	Very low	33.6	Very low	123 Å²	123	134.2 Å²	134.2	75%	0.745	83%	0.829	S	S	*	*			trans	-128.4	133	-172.7	171.5	0	0	0	0	110.1
441	S	32.3	Very low	33.6	Very low	109 Å²	109	130 Å²	130	76%	0.762	83%	0.825	S	S	*	*			trans	33.3	131.4	156.3	-53.3	0	0	0	0	121.5
442	R	33.7	Very low	34.6	Very low	253 Å²	253	130.6 Å²	130.6	96%	0.955	83%	0.826	S	S	*	*			trans	-133.6	148.8	136.9	-80.7	-158.9	170.3	-138.2	-3.4	112
443	L	37	Very low	34.6	Very low	185 Å²	185	134.6 Å²	134.6	97%	0.969	83%	0.831	S	S	*	*			trans	-90	157.7	176.5	-78.7	144.4	0	0	0	111.4
444	G	30.1	Very low	34.3	Very low	81 Å²	81	133.4 Å²	133.4	84%	0.835	83%	0.83	S	S	*	*			trans	-173.3	134.3	163.5	0	0	0	0	0	110
445	G	31.6	Very low	33.9	Very low	78 Å²	78	126.8 Å²	126.8	80%	0.804	82%	0.819	S	S	*	*			trans	-172.8	146.2	-178.6	0	0	0	0	0	114.8
446	V	33.8	Very low	33.8	Very low	146 Å²	146	128.9 Å²	128.9	89%	0.885	82%	0.819	S	S	*	*			trans	-149.6	130.7	169	-170.6	0	0	0	0	102.6
447	G	30.2	Very low	33.6	Very low	74 Å²	74	126 Å²	126	76%	0.763	81%	0.809	S	S	*	*				82.7	125.6	58.5	0	0	0	0	0	109.5
448	G	30.3	Very low	33.9	Very low	66 Å²	66	129.8 Å²	129.8	68%	0.68	80%	0.804	S	S	*	*			cis	160.1	128.7	-7.2	0	0	0	0	0	109.9
449	H	34.3	Very low	34	Very low	205 Å²	205	133.3 Å²	133.3	95%	0.949	81%	0.809	S	S	*	*			trans	-144.1	171	178.6	-86.5	-67.5	0	0	0	112.6
450	A	30	Very low	33.7	Very low	100 Å²	100	129 Å²	129	83%	0.826	80%	0.798	S	S	*	*			trans	-104.3	166.3	-147	0	0	0	0	0	117.1
451	S	33.6	Very low	33.8	Very low	111 Å²	111	127.4 Å²	127.4	78%	0.776	80%	0.798	S	S	*	*			trans	-72.1	170.5	165.5	-137.8	0	0	0	0	111.2
452	P	54	Low	33.7	Very low	107 Å²	107	129.2 Å²	129.2	70%	0.695	80%	0.796	S	S	*	*				-151.4	165.3	61.1	41.9	-22.1	0	0	0	119
453	Q	33	Very low	33.7	Very low	167 Å²	167	126.9 Å²	126.9	78%	0.78	79%	0.789	S	S	*	*			trans	64.3	161.2	151.6	-74.2	-179	-1.4	0	0	118.3
454	L	30.4	Very low	33.5	Very low	154 Å²	154	125.4 Å²	125.4	81%	0.806	78%	0.777	S	S	*	*			cis	-150.8	158	-7.3	-128.6	165.5	0	0	0	108.6
455	G	29.6	Very low	33.5	Very low	66 Å²	66	126.6 Å²	126.6	68%	0.68	77%	0.773	S	S	*	*			trans	170.1	133.2	169.7	0	0	0	0	0	115.1
456	E	30.6	Very low	33.6	Very low	190 Å²	190	127.8 Å²	127.8	89%	0.888	77%	0.769	S	S	*	*			trans	-79.4	164.8	175.4	-63.9	137.9	114.5	0	0	112.1
457	G	32.3	Very low	33.7	Very low	64 Å²	64	129.9 Å²	129.9	66%	0.66	77%	0.771	S	S	*	*			cis	163.3	172.9	-6.3	0	0	0	0	0	113.2
458	H	36.7	Very low	33.8	Very low	160 Å²	160	130.8 Å²	130.8	74%	0.741	77%	0.771	S	S	*	*			trans	50	105.6	158.4	-57.6	-80.4	0	0	0	121.1
459	H	36	Very low	33.8	Very low	184 Å²	184	136 Å²	136	85%	0.852	78%	0.778	S	S	*	*				169.1	116.8	115.4	-89.8	-72.2	0	0	0	107.9
460	A	33.9	Very low	33.8	Very low	86 Å²	86	134.2 Å²	134.2	71%	0.711	77%	0.77	S	S	*	*			cis	69.1	130.2	30.6	0	0	0	0	0	114
461	A	36	Very low	33.8	Very low	90 Å²	90	135.1 Å²	135.1	74%	0.744	77%	0.765	S	S	*	*			cis	-164.1	-177.7	-12.5	0	0	0	0	0	108.2
462	M	31.4	Very low	33.9	Very low	146 Å²	146	138.5 Å²	138.5	72%	0.719	77%	0.771	S	S	*	*			cis	-157.5	-146	3.4	-150.9	-167.4	-66.4	0	0	109.8
463	Y	33.6	Very low	32.7	Very low	204 Å²	204	137.2 Å²	137.2	80%	0.8	78%	0.777	S	S	*	*			trans	71.8	110.8	168.7	-64.4	-74.6	0	0	0	118.7
464	Q	31.6	Very low	32.8	Very low	154 Å²	154	139.1 Å²	139.1	72%	0.72	78%	0.777	S	S	*	*			cis	109	103.9	5.4	-164.7	-171.6	13.8	0	0	116.2
465	S	31.5	Very low	32.9	Very low	107 Å²	107	141 Å²	141	75%	0.748	78%	0.782	S	S	*	*			trans	-177.8	130.1	145.4	-76.1	0	0	0	0	106.5
466	S	33.5	Very low	33	Very low	103 Å²	103	141.7 Å²	141.7	72%	0.72	78%	0.775	S	S	*	*				68.7	134.5	54.5	79.7	0	0	0	0	113.2
467	M	35.5	Very low	33	Very low	189 Å²	189	138.2 Å²	138.2	93%	0.931	77%	0.772	S	S	*	*			cis	-162.8	-171.6	-12.7	-128	-174	-176.3	0	0	110.9
468	A	31.4	Very low	34.3	Very low	93 Å²	93	141.7 Å²	141.7	77%	0.769	78%	0.783	S	S	*	*			trans	89.4	80.7	157.5	0	0	0	0	0	122.7
469	H	32	Very low	34.2	Very low	177 Å²	177	137.7 Å²	137.7	82%	0.819	79%	0.785	S	S	*	*				43.6	154.9	112.5	-125.5	-85.4	0	0	0	125.3
470	Q	32.5	Very low	34.1	Very low	166 Å²	166	134.3 Å²	134.3	78%	0.776	79%	0.789	S	S	*	*			trans	83.1	138.6	158.8	-73.3	-158.5	86.7	0	0	119.8
471	T	31.4	Very low	33.9	Very low	120 Å²	120	133.3 Å²	133.3	74%	0.736	79%	0.787	S	S	*	*			cis	-158.6	172.4	-22.5	-9.2	0	0	0	0	111.7
472	M	34.3	Very low	33.9	Very low	181 Å²	181	136.8 Å²	136.8	89%	0.892	79%	0.792	S	S	*	*			trans	-77.7	158.9	177.5	-88.7	-172.2	166	0	0	115.6
473	G	28.8	Very low	33.9	Very low	80 Å²	80	138.7 Å²	138.7	83%	0.825	80%	0.798	S	S	*	*			trans	-130.7	144.5	152.7	0	0	0	0	0	111.3
474	R	36.7	Very low	33.8	Very low	207 Å²	207	134.2 Å²	134.2	78%	0.781	80%	0.797	S	S	*	*			trans	-157.6	137.9	-171.3	-178.3	-174.3	-170.4	-113	6.3	112
475	Q	31	Very low	34.7	Very low	194 Å²	194	132.8 Å²	132.8	91%	0.907	80%	0.801	S	S	*	*			trans	-154.6	175.9	161.7	-116.7	172	8.9	0	0	112.8
476	C	31.8	Very low	34.9	Very low	81 Å²	81	134.1 Å²	134.1	55%	0.547	81%	0.805	S	S	.	*			trans	-148.5	144.5	-146.2	-53.4	0	0	0	0	116.3
477	S	32	Very low	34.9	Very low	117 Å²	117	134.2 Å²	134.2	82%	0.818	81%	0.812	S	S	*	*			trans	58.7	179	141.7	-49.8	0	0	0	0	119.7
478	P	58.9	Low	34.7	Very low	137 Å²	137	128.7 Å²	128.7	89%	0.89	80%	0.804	S	S	*	*			cis	-121.5	-153.9	-20.3	36.5	-17.1	0	0	0	112.2
479	G	34.4	Very low	35	Very low	76 Å²	76	131.4 Å²	131.4	78%	0.784	81%	0.805	S	S	*	*			trans	-164.4	171.3	175.6	0	0	0	0	0	117.3
480	A	33.1	Very low	35	Very low	112 Å²	112	131.8 Å²	131.8	93%	0.926	81%	0.807	S	S	*	*			trans	-169.6	169	175.3	0	0	0	0	0	110.4
481	G	30.9	Very low	34.9	Very low	66 Å²	66	127.3 Å²	127.3	68%	0.68	81%	0.805	S	S	*	*			cis	160.9	131.8	-12.7	0	0	0	0	0	115.5
482	I	35.8	Very low	35	Very low	163 Å²	163	128.4 Å²	128.4	84%	0.836	81%	0.806	S	S	*	*			trans	63.7	121.7	161.6	-29.3	179.2	0	0	0	120.4
483	Q	30.8	Very low	35	Very low	185 Å²	185	129.1 Å²	129.1	86%	0.864	81%	0.807	S	S	*	*				164.4	158	120.3	-86.7	-174.1	47.4	0	0	114.6
484	S	32.8	Very low	35.3	Very low	110 Å²	110	134.6 Å²	134.6	77%	0.769	81%	0.805	S	S	*	*			trans	-124.5	172	178.1	-41.3	0	0	0	0	109.5
485	P	50.6	Low	35.1	Very low	125 Å²	125	132.8 Å²	132.8	81%	0.812	81%	0.809	S	S	*	*				-157.9	-174.6	76.5	42.6	-20.2	0	0	0	118.7
486	T	34.2	Very low	35.1	Very low	134 Å²	134	134.1 Å²	134.1	82%	0.822	81%	0.808	S	S	*	*			trans	-51.3	149.2	-177.3	52.4	0	0	0	0	122.9
487	A	34	Very low	35.1	Very low	106 Å²	106	133.2 Å²	133.2	88%	0.876	81%	0.806	S	S	*	*				173.9	141.6	123.5	0	0	0	0	0	108.3
488	G	31.8	Very low	35.1	Very low	73 Å²	73	137 Å²	137	75%	0.753	81%	0.81	S	S	*	*			cis	116.4	139.1	45.2	0	0	0	0	0	107.5
489	L	36.8	Very low	33.8	Very low	150 Å²	150	133.4 Å²	133.4	79%	0.785	80%	0.798	S	S	*	*			cis	-157.7	151.5	9.5	-88.3	161.5	0	0	0	111.3
490	Q	32.9	Very low	33.9	Very low	185 Å²	185	137.1 Å²	137.1	86%	0.864	80%	0.798	S	S	*	*			trans	60.6	153.9	147.8	-69.2	169.2	-16.4	0	0	120.8
491	G	30.1	Very low	34.1	Very low	71 Å²	71	137.7 Å²	137.7	73%	0.732	79%	0.793	S	S	*	*			cis	-156.9	173.3	4.1	0	0	0	0	0	114.8
492	N	33.5	Very low	34.5	Very low	143 Å²	143	146 Å²	146	77%	0.765	80%	0.804	S	S	*	*			trans	-86.5	159.8	176.6	-68.8	-19.4	0	0	0	111.5
493	E	33.2	Very low	34.3	Very low	196 Å²	196	144.7 Å²	144.7	92%	0.916	80%	0.803	S	S	*	*				-158.7	171.5	114.2	-114.5	177.1	171	0	0	113.1
494	Y	35.2	Very low	34.5	Very low	196 Å²	196	144.4 Å²	144.4	77%	0.769	81%	0.807	S	S	*	*			trans	-105.7	157	-167.5	-72.9	-110.7	0	0	0	112.1
495	L	33.1	Very low	34.4	Very low	169 Å²	169	144.9 Å²	144.9	89%	0.885	81%	0.81	S	S	*	*				179.1	165.3	109.6	-94.6	167.7	0	0	0	116.1
496	Y	31.8	Very low	34.3	Very low	222 Å²	222	143.7 Å²	143.7	87%	0.871	80%	0.802	S	S	*	*			trans	-71	171.3	174.8	-102.4	-109.4	0	0	0	112.4
497	A	30.7	Very low	34.2	Very low	61 Å²	61	145.5 Å²	145.5	50%	0.504	80%	0.801	S	S	.	*			cis	-161.7	173.2	8.8	0	0	0	0	0	112.7
498	H	32.4	Very low	34.1	Very low	196 Å²	196	148.9 Å²	148.9	91%	0.907	80%	0.799	S	S	*	*			trans	63.6	154.9	155.9	-53	-54.3	0	0	0	118.7
499	G	31.5	Very low	34.1	Very low	62 Å²	62	155.9 Å²	155.9	64%	0.639	80%	0.804	S	S	*	*			cis	163.3	159.5	-8.9	0	0	0	0	0	113.3
500	I	36.6	Very low	33.9	Very low	154 Å²	154	156.9 Å²	156.9	79%	0.79	80%	0.804	S	S	*	*			trans	83.4	111.7	176.3	-53.8	173.6	0	0	0	117
501	P	37.7	Very low	33.9	Very low	124 Å²	124	153 Å²	153	81%	0.805	80%	0.797	S	S	*	*			trans	-87.7	155.9	154.3	36.1	-31.6	0	0	0	111.3
502	R	38.5	Very low	34	Very low	242 Å²	242	156 Å²	156	91%	0.913	80%	0.802	S	S	*	*			trans	-118.2	123.2	166.9	-79	-169.6	175	-169.1	-0.5	111.4
503	T	33	Very low	34	Very low	134 Å²	134	157.1 Å²	157.1	82%	0.822	80%	0.802	S	S	*	*			trans	-95.8	133.9	167	42.9	0	0	0	0	110
504	L	33.5	Very low	33.8	Very low	180 Å²	180	153.3 Å²	153.3	94%	0.942	80%	0.796	S	S	*	*			trans	-140.5	147.5	157.2	-78.9	-179.3	0	0	0	108.3
505	S	31.4	Very low	33.7	Very low	120 Å²	120	149.8 Å²	149.8	84%	0.839	80%	0.795	S	S	*	*			trans	-133.1	172.9	-174.4	-128.7	0	0	0	0	109.6
506	P	48.7	Very low	33.5	Very low	100 Å²	100	146.9 Å²	146.9	65%	0.649	79%	0.789	S	S	*	*			trans	-85.9	158.5	-144	34.5	-39.7	0	0	0	114.9
507	H	31.4	Very low	33.6	Very low	172 Å²	172	143.7 Å²	143.7	80%	0.796	79%	0.786	S	S	*	*				175.2	125.4	121.8	-91.5	-62.3	0	0	0	110.7
508	Q	31.7	Very low	33.7	Very low	177 Å²	177	148.3 Å²	148.3	83%	0.827	80%	0.799	S	S	*	*				-171.7	141.8	127.8	-104.9	164.4	0.4	0	0	111.2
509	Y	32.5	Very low	34.1	Very low	220 Å²	220	143.9 Å²	143.9	86%	0.863	79%	0.787	S	S	*	*			trans	-82.5	137.5	169.9	-91	-113.9	0	0	0	109.1
510	H	32.7	Very low	34.2	Very low	171 Å²	171	149.8 Å²	149.8	79%	0.792	80%	0.798	S	S	*	*			trans	-115.3	119.6	157.7	-85.4	-75.8	0	0	0	109.5	V512	H510-V512 PolarHBondContact O-N 3.13Å
511	S	32.5	Very low	34	Very low	103 Å²	103	153.3 Å²	153.3	72%	0.72	80%	0.802	S	S	*	*			trans	-70.2	114.1	172	-59.7	0	0	0	0	109.6	H513	S511-H513 PolarHBondContact O-N 3.29Å
512	V	33.3	Very low	33.9	Very low	135 Å²	135	152.9 Å²	152.9	82%	0.818	80%	0.802	S	S	*	*			trans	-76.9	104.5	171	-176.3	0	0	0	0	108.2	H510 S514	H510-V512 PolarHBondContact O-N 3.13Å; V512-S514 PolarHBondContact O-N 3.19Å
513	H	32.8	Very low	34.2	Very low	166 Å²	166	149.7 Å²	149.7	77%	0.769	80%	0.797	S	S	*	*			trans	-68.1	115.9	165.2	-83.1	-101.1	0	0	0	109	S511 V515	S511-H513 PolarHBondContact O-N 3.29Å; H513-V515 PolarHBondContact O-N 3.04Å; H513-V515 VanDerWaalsContact O-N 3.08Å
514	S	29.7	Very low	34.5	Very low	115 Å²	115	151 Å²	151	80%	0.804	80%	0.799	S	S	*	*			trans	-67.2	104.8	165.6	-65.8	0	0	0	0	109.2	V512 S516	V512-S514 PolarHBondContact O-N 3.19Å; S514-S516 PolarHBondContact O-N 2.87Å
515	V	32.9	Very low	34.7	Very low	122 Å²	122	151.9 Å²	151.9	74%	0.739	82%	0.82	S	S	*	*			trans	-74	114.6	168.4	177.5	0	0	0	0	108.1	H513 I517	H513-V515 PolarHBondContact O-N 3.04Å; H513-V515 VanDerWaalsContact O-N 3.08Å; V515-I517 PolarHBondContact O-N 3.35Å; V515-I517 VanDerWaalsContact O-N 3.17Å
516	S	28.2	Very low	34.9	Very low	109 Å²	109	153.5 Å²	153.5	76%	0.762	82%	0.819	S	S	*	*			trans	-68.4	108.2	172.1	-64.8	0	0	0	0	110.1	S514	S514-S516 PolarHBondContact O-N 2.87Å
517	I	34.4	Very low	34.2	Very low	155 Å²	155	156.3 Å²	156.3	80%	0.795	83%	0.828	S	S	*	*			trans	-87.9	107.5	165.3	-60.1	177.5	0	0	0	107.3	V515	V515-I517 PolarHBondContact O-N 3.35Å; V515-I517 VanDerWaalsContact O-N 3.17Å
518	M	33.1	Very low	34.3	Very low	158 Å²	158	155.4 Å²	155.4	78%	0.778	83%	0.83	S	S	*	*			trans	-78.9	134.6	167.4	-66.6	-98.4	66	0	0	108.9	E520	M518-E520 PolarHBondContact O-N 3.49Å
519	P	40.4	Very low	34.5	Very low	102 Å²	102	154.1 Å²	154.1	66%	0.662	83%	0.83	S	S	*	*			trans	-78.5	109.4	165.1	30.8	-29.4	0	0	0	109
520	E	33.8	Very low	34.6	Very low	187 Å²	187	150 Å²	150	87%	0.874	83%	0.828	S	S	*	*			trans	-68.8	131.4	176.6	-167.9	170.2	177.2	0	0	110.6	M518	M518-E520 PolarHBondContact O-N 3.49Å
521	W	32.3	Very low	34.8	Very low	228 Å²	228	148.6 Å²	148.6	86%	0.864	83%	0.83	S	S	*	*			trans	-95.2	110.1	175.4	-87.3	40.1	0	0	0	109.6
522	S	34.7	Very low	34.9	Very low	115 Å²	115	151.9 Å²	151.9	80%	0.804	84%	0.838	S	S	*	*			trans	-91.5	101.9	170.7	58.5	0	0	0	0	110.6
523	E	44.7	Very low	35	Very low	174 Å²	174	153.2 Å²	153.2	81%	0.813	84%	0.84	S	S	*	*			trans	-86.2	151.2	164.4	-75.2	-169.7	97.3	0	0	111.2
524	N	40.2	Very low	35.2	Very low	161 Å²	161	152.1 Å²	152.1	86%	0.861	85%	0.846	S	S	*	*			trans	-74.8	130	178.2	-67.5	-28.7	0	0	0	111.6
525	S	38.4	Very low	35.7	Very low	199 Å²	199	155.5 Å²	155.5	100%	1.392	85%	0.849	S	S	*	*				-177.9	0	124.1	-75.4	0	0	0	0	111.2

Retrieved 525 of 525 residues in 115.8 ms (Link to these results)

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