A0A087Y149_POEFO Loading...

Lysine-specific demethylase 8

Histone demethylase required for G2/M phase cell cycle progression. Specifically demethylates dimethylated 'Lys-36' (H3K36me2) of histone H3, an epigenetic repressive mark, thereby acting as a transcription activator. May play a role in the regulation of the circadian clock.

AlphaFold DB , UniProt , Accession A0A087Y149, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 464 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.9	Very low	31.7	Very low	234 Å²	234	145.7 Å²	145.7	100%	1.153	82%	0.82	S	S	*	*				0	77.8	0	-72.9	171.9	175.4	0	0	106.2
2	T	32.5	Very low	31.3	Very low	133 Å²	133	151.6 Å²	151.6	82%	0.816	82%	0.82	S	S	*	*				66.2	103.7	92.4	51.4	0	0	0	0	113.2
3	Q	32.5	Very low	30.6	Very low	180 Å²	180	146.3 Å²	146.3	84%	0.841	81%	0.81	S	S	*	*			trans	-61.2	158.6	141.3	-70.7	-167.1	-36.8	0	0	109.8
4	P	43.3	Very low	30.2	Very low	111 Å²	111	146.5 Å²	146.5	72%	0.721	82%	0.816	S	S	*	*				-133.3	155	83.1	16.1	7.7	0	0	0	111.7
5	S	29.1	Very low	29.8	Very low	88 Å²	88	152.1 Å²	152.1	62%	0.615	82%	0.82	S	S	*	*				68.9	131.1	59.3	89.2	0	0	0	0	116.2
6	D	28.2	Very low	29.4	Very low	144 Å²	144	151.2 Å²	151.2	77%	0.77	83%	0.827	S	S	*	*			trans	96	95.1	154.5	-49.5	-38.4	0	0	0	121.7
7	D	31.1	Very low	29.3	Very low	156 Å²	156	149.4 Å²	149.4	83%	0.834	83%	0.828	S	S	*	*				62.2	163.9	113.4	-117.4	13.9	0	0	0	122.6
8	P	36.8	Very low	29.1	Very low	112 Å²	112	145.5 Å²	145.5	73%	0.727	83%	0.827	S	S	*	*			trans	-117.5	158.8	-130.1	20.2	6.8	0	0	0	113.4
9	G	24.7	Very low	29	Very low	83 Å²	83	146.6 Å²	146.6	86%	0.856	83%	0.825	S	S	*	*			trans	-102.3	111.6	179	0	0	0	0	0	113.4
10	E	27.2	Very low	29.1	Very low	162 Å²	162	148.1 Å²	148.1	76%	0.757	82%	0.824	S	S	*	*			trans	-41.9	142.1	162.9	-88.5	178.3	127.2	0	0	115.7
11	Q	26.9	Very low	28.9	Very low	200 Å²	200	144.5 Å²	144.5	94%	0.935	82%	0.82	S	S	*	*			trans	-137	108.5	138.6	-76.8	-167.1	-2.4	0	0	112.1
12	R	26.1	Very low	28.5	Very low	216 Å²	216	142.7 Å²	142.7	82%	0.815	81%	0.809	S	S	*	*			trans	-57	164.7	153.4	-79.1	174.1	171.4	-178.1	-3.4	110.9
13	A	23	Very low	28.2	Very low	83 Å²	83	141.2 Å²	141.2	69%	0.686	81%	0.811	S	S	*	*			cis	-179.7	146.7	-14.8	0	0	0	0	0	105.2
14	V	24.3	Very low	27.9	Very low	149 Å²	149	136.6 Å²	136.6	90%	0.903	81%	0.811	S	S	*	*			trans	-142.8	118.6	150.1	179.6	0	0	0	0	108.6
15	R	25	Very low	27.1	Very low	230 Å²	230	135.7 Å²	135.7	87%	0.868	81%	0.813	S	S	*	*			trans	-85.9	149.8	165.1	-76.3	179.3	175.4	-170.2	-2.5	109.4
16	C	23.6	Very low	27	Very low	138 Å²	138	136.4 Å²	136.4	93%	0.932	82%	0.818	S	S	*	*			trans	-146.9	129.3	137.2	-107.9	0	0	0	0	109.8
17	S	26.5	Very low	26.9	Very low	121 Å²	121	138.8 Å²	138.8	85%	0.846	82%	0.824	S	S	*	*			trans	-103.1	156.7	-177.5	44.6	0	0	0	0	111.1
18	G	25.5	Very low	26.8	Very low	79 Å²	79	137.9 Å²	137.9	81%	0.814	83%	0.825	S	S	*	*			trans	-177.9	97.4	163	0	0	0	0	0	112.6
19	E	28.2	Very low	26.3	Very low	167 Å²	167	137.6 Å²	137.6	78%	0.78	83%	0.825	S	S	*	*			trans	-93.6	156.9	170	-71.8	176.8	117.8	0	0	112.3
20	H	30.3	Very low	26.4	Very low	176 Å²	176	140.1 Å²	140.1	82%	0.815	82%	0.824	S	S	*	*				126.3	136.5	129.9	-75.1	-46.4	0	0	0	119.3
21	G	26	Very low	26.5	Very low	72 Å²	72	138.6 Å²	138.6	74%	0.742	83%	0.826	S	S	*	*			trans	125.5	82.5	149.4	0	0	0	0	0	114.7
22	E	27.7	Very low	26.7	Very low	196 Å²	196	134.5 Å²	134.5	92%	0.916	82%	0.817	S	S	*	*				69.5	117.4	88.8	-89.3	-167.5	165.8	0	0	119.1
23	A	27	Very low	26.7	Very low	103 Å²	103	128.3 Å²	128.3	85%	0.851	81%	0.812	S	S	*	*			trans	56.6	131.7	133.6	0	0	0	0	0	123.7
24	G	25.4	Very low	27	Very low	82 Å²	82	132.8 Å²	132.8	85%	0.845	82%	0.818	S	S	*	*			trans	-179.7	124	161.1	0	0	0	0	0	113.1
25	A	27.7	Very low	27.1	Very low	92 Å²	92	133.4 Å²	133.4	76%	0.76	81%	0.812	S	S	*	*			trans	-89.6	160.4	-160.7	0	0	0	0	0	117
26	S	25.6	Very low	27.1	Very low	103 Å²	103	132.6 Å²	132.6	72%	0.72	81%	0.809	S	S	*	*			trans	34.5	129.6	144.7	72.4	0	0	0	0	120.9
27	Q	27	Very low	27.1	Very low	194 Å²	194	135.1 Å²	135.1	91%	0.907	80%	0.799	S	S	*	*				-165.7	130.1	126	-107.2	168.5	36	0	0	112.7
28	T	28.1	Very low	27.2	Very low	138 Å²	138	138.5 Å²	138.5	85%	0.847	80%	0.801	S	S	*	*			trans	-78.4	139.8	166.7	46.1	0	0	0	0	110.9
29	S	26.5	Very low	27.3	Very low	105 Å²	105	141.1 Å²	141.1	73%	0.734	80%	0.795	S	S	*	*			trans	-157.9	107.9	155	64.8	0	0	0	0	108.6
30	T	27.2	Very low	27.3	Very low	136 Å²	136	141.5 Å²	141.5	83%	0.834	80%	0.797	S	S	*	*				55.6	118.5	97.9	45.5	0	0	0	0	116.3
31	T	29.4	Very low	27.2	Very low	131 Å²	131	139.7 Å²	139.7	80%	0.804	79%	0.793	S	S	*	*			trans	-44.6	163.1	167.7	-11.4	0	0	0	0	114.6
32	P	30.1	Very low	27.4	Very low	114 Å²	114	144.3 Å²	144.3	74%	0.74	80%	0.799	S	S	*	*				-142.8	148.8	95.1	32.3	-14.4	0	0	0	115.8
33	A	27.1	Very low	27.5	Very low	86 Å²	86	142.5 Å²	142.5	71%	0.711	80%	0.795	S	S	*	*			trans	-63.4	144.8	162.4	0	0	0	0	0	111.4
34	H	28.9	Very low	27.9	Very low	176 Å²	176	142.8 Å²	142.8	82%	0.815	79%	0.788	S	S	*	*			trans	-137.1	126	155.1	-98.1	-80.5	0	0	0	109.9
35	Q	26.1	Very low	28.1	Very low	163 Å²	163	147.2 Å²	147.2	76%	0.762	79%	0.787	S	S	*	*			trans	-66.2	-174.8	176.6	-83.3	171.2	-52.9	0	0	113.7
36	W	24.6	Very low	28.5	Very low	213 Å²	213	154.5 Å²	154.5	81%	0.807	80%	0.795	S	S	*	*			trans	96	122.8	160.2	-47.5	96.6	0	0	0	113.1
37	W	25.3	Very low	28.7	Very low	191 Å²	191	160.5 Å²	160.5	72%	0.723	80%	0.801	S	S	*	*			cis	-165.2	157.8	13.4	32.9	-100.1	0	0	0	109.1	I39	W37-I39 HydrophobicContact CD2-CG1 4.49Å; W37-I39 HydrophobicContact CE3-CB 4.01Å; W37-I39 HydrophobicContact CE3-CD1 3.65Å; W37-I39 HydrophobicContact CE3-CG1 3.44Å; W37-I39 VanDerWaalsContact CE3-CG1 3.44Å; W37-I39 HydrophobicContact CH2-CD1 3.84Å; W37-I39 HydrophobicContact CH2-CG1 4.43Å; W37-I39 HydrophobicContact CZ3-CB 3.72Å; W37-I39 HydrophobicContact CZ3-CD1 3.27Å; W37-I39 HydrophobicContact CZ3-CG1 3.41Å; W37-I39 VanDerWaalsContact CZ3-CG1 3.41Å
38	E	27.6	Very low	28.7	Very low	192 Å²	192	156.8 Å²	156.8	90%	0.897	79%	0.792	S	S	*	*			trans	-69.2	133.6	163.3	-71.7	168.2	147.6	0	0	110.3
39	I	28.2	Very low	28.8	Very low	134 Å²	134	159.8 Å²	159.8	69%	0.687	79%	0.794	S	S	*	*			trans	-139	114.4	149.6	-71.1	179	0	0	0	107.1	W37	W37-I39 HydrophobicContact CD2-CG1 4.49Å; W37-I39 HydrophobicContact CE3-CB 4.01Å; W37-I39 HydrophobicContact CE3-CD1 3.65Å; W37-I39 HydrophobicContact CE3-CG1 3.44Å; W37-I39 VanDerWaalsContact CE3-CG1 3.44Å; W37-I39 HydrophobicContact CH2-CD1 3.84Å; W37-I39 HydrophobicContact CH2-CG1 4.43Å; W37-I39 HydrophobicContact CZ3-CB 3.72Å; W37-I39 HydrophobicContact CZ3-CD1 3.27Å; W37-I39 HydrophobicContact CZ3-CG1 3.41Å; W37-I39 VanDerWaalsContact CZ3-CG1 3.41Å
40	E	27.6	Very low	29.1	Very low	174 Å²	174	160.3 Å²	160.3	81%	0.813	79%	0.792	S	S	*	*			trans	-82.4	152.8	158.6	-81.9	-177.4	148.5	0	0	110.8
41	D	28.1	Very low	29.4	Very low	139 Å²	139	158.3 Å²	158.3	74%	0.743	78%	0.784	S	S	*	*			trans	77.1	111.9	160.3	-64.9	-22	0	0	0	120.8
42	I	29.6	Very low	29.7	Very low	169 Å²	169	157 Å²	157	87%	0.867	78%	0.78	S	S	*	*				178	129.5	98	-78.7	158.4	0	0	0	110
43	L	31.3	Very low	30.7	Very low	158 Å²	158	158.4 Å²	158.4	83%	0.827	78%	0.778	S	S	*	*			trans	-45.2	164.5	178.1	-72.3	164.9	0	0	0	116.8
44	P	34.9	Very low	32.4	Very low	108 Å²	108	156.3 Å²	156.3	70%	0.701	76%	0.762	S	S	*	*			cis	-153.6	-176.4	42.8	43.7	-20.7	0	0	0	119
45	E	28.8	Very low	35	Very low	175 Å²	175	151.3 Å²	151.3	82%	0.818	75%	0.746	S	S	*	*			trans	90.2	109	159.1	-66.6	-179.3	-178.2	0	0	119	R47	E45-R47 PolarHBondContact O-N 3.18Å
46	R	36.8	Very low	38.1	Very low	246 Å²	246	144 Å²	144	93%	0.928	71%	0.712	S	S	*	*			trans	-26.2	93.6	156.4	-70.5	175	172.8	-166.9	-3.1	112.6	T48	R46-T48 PolarHBondContact O-N 2.9Å
47	R	28.7	Very low	41.3	Very low	228 Å²	228	136.1 Å²	136.1	86%	0.86	68%	0.682	S	S	*	*			trans	-73.8	100.6	149	-81	-177.4	176.7	174.7	-0.2	106.8	E45 F49	E45-R47 PolarHBondContact O-N 3.18Å; R47-F49 VanDerWaalsContact C-N 3.35Å; R47-F49 PolarHBondContact O-N 2.94Å
48	T	28.6	Very low	44.5	Very low	116 Å²	116	129.5 Å²	129.5	71%	0.712	67%	0.665	S	S	*	*			trans	-49.2	105.5	155.6	46.9	0	0	0	0	107.4	R46 V50	R46-T48 PolarHBondContact O-N 2.9Å; T48-V50 PolarHBondContact O-N 2.81Å
49	F	28.9	Very low	47.7	Very low	201 Å²	201	123.9 Å²	123.9	88%	0.882	64%	0.638	S	S	*	*			trans	-66.2	78.5	160.2	-97.7	-94.2	0	0	0	106.7	R47 S51	R47-F49 VanDerWaalsContact C-N 3.35Å; R47-F49 PolarHBondContact O-N 2.94Å; F49-S51 PolarHBondContact O-N 3.17Å
50	V	32.9	Very low	50.9	Low	116 Å²	116	117.5 Å²	117.5	70%	0.703	61%	0.605	S	S	*	*			trans	-77.6	91.7	154.9	-177.9	0	0	0	0	103.9	T48 S52	T48-V50 PolarHBondContact O-N 2.81Å; V50-S52 PolarHBondContact O-N 2.92Å
51	S	33.3	Very low	54.1	Low	94 Å²	94	111.6 Å²	111.6	66%	0.657	58%	0.583	S	S	*	*			trans	-55.8	102.1	155.9	176.7	0	0	0	0	105.6	F49 M53	F49-S51 PolarHBondContact O-N 3.17Å; S51-M53 PolarHBondContact O-N 2.81Å
52	S	36.6	Very low	57.3	Low	105 Å²	105	108.9 Å²	108.9	73%	0.734	58%	0.58	S	S	*	*			trans	-66.5	84.5	171.7	167.1	0	0	0	0	106.6	V50 A54	V50-S52 PolarHBondContact O-N 2.92Å; S52-A54 PolarHBondContact O-N 3.01Å
53	M	51.2	Low	60.4	Low	142 Å²	142	103.5 Å²	103.5	70%	0.7	55%	0.552	S	S	*	*			trans	-59	107.9	166	-71.5	-160.9	-71.4	0	0	106	S51 S55	S51-M53 PolarHBondContact O-N 2.81Å; M53-S55 PolarHBondContact O-N 3.36Å
54	A	62	Low	63.5	Low	43 Å²	43	96.8 Å²	96.8	36%	0.355	52%	0.517	S	S	.	.			trans	-50.7	128.1	170.6	0	0	0	0	0	107.4	S52 K59	S52-A54 PolarHBondContact O-N 3.01Å; A54-K59 WeakPolarHBondContact O-CE 3.48Å
55	S	85	Confident	66.4	Low	70 Å²	70	92.6 Å²	92.6	49%	0.49	49%	0.49	S	S	.	.			trans	-54.4	152.1	178.1	63.5	0	0	0	0	110	M53 W57 S58 K59	M53-S55 PolarHBondContact O-N 3.36Å; S55-W57 PolarHBondContact O-N 3.13Å; S55-S58 WeakPolarHBondContact O-CA 3.39Å; S55-S58 VanDerWaalsContact O-CB 3.31Å; S55-S58 WeakPolarHBondContact O-CB 3.48Å; S55-S58 PolarHBondContact O-N 3.2Å; S55-S58 PolarHBondContact OG-N 3.4Å; S55-K59 PolarHBondContact O-N 2.92Å
56	L	90.5	Very high	69.4	Low	10 Å²	10	89 Å²	89	5%	0.052	48%	0.481	C	S	.	.	H	α-helix	trans	-50.6	-43	176	179.7	61.4	0	0	0	111.2	S58 K59 I60 C147 P151 I156 I184 L185 E188	L56-S58 VanDerWaalsContact C-N 3.34Å; L56-S58 PolarHBondContact O-N 3.12Å; L56-K59 WeakPolarHBondContact O-CB 3.37Å; L56-K59 PolarHBondContact O-N 3.29Å; L56-K59 VanDerWaalsContact O-N 3.13Å; L56-I60 WeakPolarHBondContact O-CG1 3.46Å; L56-I60 PolarHBondContact O-N 3.33Å; L56-I60 VanDerWaalsContact O-N 3.1Å; L56-C147 HydrophobicContact CD2-CB 4.14Å; L56-C147 HydrophobicContact CG-CB 4.26Å; L56-P151 HydrophobicContact CD2-CG 3.71Å; L56-I156 HydrophobicContact CD2-CD1 4.24Å; L56-I156 HydrophobicContact CD2-CG1 4.12Å; L56-I184 HydrophobicContact CD1-CG2 3.8Å; L56-L185 HydrophobicContact CD1-CD2 3.92Å; L56-L185 HydrophobicContact CD2-CD2 3.81Å; L56-L185 HydrophobicContact CG-CD2 4.28Å; L56-E188 HydrophobicContact CD1-CB 4.36Å; L56-E188 HydrophobicContact CD1-CG 4.3Å
57	W	92.4	Very high	72.1	Confident	47 Å²	47	79.6 Å²	79.6	18%	0.178	45%	0.45	C	S	.	.	H	α-helix	trans	-55.1	-45.1	173.4	-178.4	-118.6	0	0	0	113	S55 K59 I60 S61 L64 L94 A144 C147 R148	S55-W57 PolarHBondContact O-N 3.13Å; W57-K59 PolarHBondContact O-N 3.35Å; W57-I60 HydrophobicContact CE3-CB 4.39Å; W57-I60 HydrophobicContact CE3-CG2 4.35Å; W57-I60 HydrophobicContact CZ3-CG2 4.11Å; W57-I60 PolarHBondContact O-N 2.85Å; W57-I60 VanDerWaalsContact O-N 3.13Å; W57-S61 WeakPolarHBondContact O-CB 3.48Å; W57-S61 PolarHBondContact O-N 3.16Å; W57-S61 PolarHBondContact O-OG 3.33Å; W57-L64 HydrophobicContact CH2-CD1 4.36Å; W57-L94 HydrophobicContact CH2-CD1 3.77Å; W57-A144 HydrophobicContact CZ3-CB 4.02Å; W57-A144 VanDerWaalsContact CZ3-O 3.26Å; W57-A144 WeakPolarHBondContact CZ3-O 3.24Å; W57-C147 WeakPolarHBondContact CB-O 3.32Å; W57-C147 PolarHBondContact N-O 3.37Å; W57-R148 HydrophobicContact CD2-CB 4.2Å; W57-R148 HydrophobicContact CD2-CG 3.88Å; W57-R148 HydrophobicContact CE3-CB 3.98Å; W57-R148 HydrophobicContact CE3-CG 4.1Å; W57-R148 HydrophobicContact CG-CG 4.35Å; W57-R148 HydrophobicContact CH2-CG 4.45Å; W57-R148 HydrophobicContact CZ2-CG 4.23Å; W57-R148 HydrophobicContact CZ3-CB 4.31Å; W57-R148 HydrophobicContact CZ3-CG 4.38Å
58	S	92.5	Very high	75.2	Confident	52 Å²	52	71 Å²	71	36%	0.364	42%	0.42	S	S	.	.	H	α-helix	trans	-60.5	-33.6	179	-178.9	0	0	0	0	112.7	S55 L56 S61 A62	S55-S58 WeakPolarHBondContact O-CA 3.39Å; S55-S58 VanDerWaalsContact O-CB 3.31Å; S55-S58 WeakPolarHBondContact O-CB 3.48Å; S55-S58 PolarHBondContact O-N 3.2Å; S55-S58 PolarHBondContact OG-N 3.4Å; L56-S58 VanDerWaalsContact C-N 3.34Å; L56-S58 PolarHBondContact O-N 3.12Å; S58-S61 WeakPolarHBondContact CA-OG 3.39Å; S58-S61 PolarHBondContact O-OG 3.24Å; S58-A62 WeakPolarHBondContact O-CB 3.46Å; S58-A62 PolarHBondContact O-N 3.27Å
59	K	94.9	Very high	78.2	Confident	74 Å²	74	73.1 Å²	73.1	32%	0.322	42%	0.421	S	S	.	.	H	α-helix	trans	-71.2	-42.3	176	-58.1	173.9	-168.1	169.1	0	110.8	A54 S55 L56 W57 I184 E188	A54-K59 WeakPolarHBondContact O-CE 3.48Å; S55-K59 PolarHBondContact O-N 2.92Å; L56-K59 WeakPolarHBondContact O-CB 3.37Å; L56-K59 PolarHBondContact O-N 3.29Å; L56-K59 VanDerWaalsContact O-N 3.13Å; W57-K59 PolarHBondContact O-N 3.35Å; K59-I184 HydrophobicContact CB-CD1 4.44Å; K59-I184 HydrophobicContact CB-CG2 3.8Å; K59-I184 HydrophobicContact CD-CG2 4.05Å; K59-E188 IonicContact NZ-OE2 3.74Å; K59-E188 PolarHBondContact NZ-OE2 2.85Å
60	I	94.7	Very high	81.3	Confident	1 Å²	1	69.2 Å²	69.2	1%	0.005	41%	0.406	C	S	.	.	H	α-helix	trans	-68.7	-44	178.4	-62.4	-66.3	0	0	0	111.4	L56 W57 A62 I63 C147 I181 I184	L56-I60 WeakPolarHBondContact O-CG1 3.46Å; L56-I60 PolarHBondContact O-N 3.33Å; L56-I60 VanDerWaalsContact O-N 3.1Å; W57-I60 HydrophobicContact CE3-CB 4.39Å; W57-I60 HydrophobicContact CE3-CG2 4.35Å; W57-I60 HydrophobicContact CZ3-CG2 4.11Å; W57-I60 PolarHBondContact O-N 2.85Å; W57-I60 VanDerWaalsContact O-N 3.13Å; I60-A62 VanDerWaalsContact C-N 3.25Å; I60-A62 PolarHBondContact O-N 3.4Å; I60-I63 WeakPolarHBondContact O-CG1 3.31Å; I60-I63 PolarHBondContact O-N 3.03Å; I60-C147 HydrophobicContact CG1-CB 4.16Å; I60-I181 HydrophobicContact CD1-CB 4.21Å; I60-I181 HydrophobicContact CD1-CG1 3.96Å; I60-I181 HydrophobicContact CD1-CG2 3.81Å; I60-I184 HydrophobicContact CD1-CB 4.24Å; I60-I184 HydrophobicContact CD1-CD1 4.09Å; I60-I184 HydrophobicContact CD1-CG2 4.03Å
61	S	93.7	Very high	84.3	Confident	49 Å²	49	63.8 Å²	63.8	34%	0.343	37%	0.373	S	S	.	.	H	α-helix	trans	-65.4	-29.7	-179.5	64.7	0	0	0	0	112.8	W57 S58 I63 L64	W57-S61 WeakPolarHBondContact O-CB 3.48Å; W57-S61 PolarHBondContact O-N 3.16Å; W57-S61 PolarHBondContact O-OG 3.33Å; S58-S61 WeakPolarHBondContact CA-OG 3.39Å; S58-S61 PolarHBondContact O-OG 3.24Å; S61-I63 VanDerWaalsContact C-N 3.26Å; S61-I63 PolarHBondContact O-N 3.22Å; S61-L64 PolarHBondContact O-N 2.73Å
62	A	95.1	Very high	87.2	Confident	82 Å²	82	61.7 Å²	61.7	68%	0.678	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-21.5	179.8	0	0	0	0	0	114.1	S58 I60	S58-A62 WeakPolarHBondContact O-CB 3.46Å; S58-A62 PolarHBondContact O-N 3.27Å; I60-A62 VanDerWaalsContact C-N 3.25Å; I60-A62 PolarHBondContact O-N 3.4Å
63	I	95.6	Very high	89.9	Confident	57 Å²	57	57.7 Å²	57.7	29%	0.292	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	-6.5	178.7	63.1	163	0	0	0	113.1	I60 S61 I177 V180 I181 I184	I60-I63 WeakPolarHBondContact O-CG1 3.31Å; I60-I63 PolarHBondContact O-N 3.03Å; S61-I63 VanDerWaalsContact C-N 3.26Å; S61-I63 PolarHBondContact O-N 3.22Å; I63-I177 HydrophobicContact CD1-CG1 4.04Å; I63-V180 HydrophobicContact CD1-CB 4.02Å; I63-V180 HydrophobicContact CD1-CG1 3.74Å; I63-V180 HydrophobicContact CG2-CG1 4.19Å; I63-I181 HydrophobicContact CD1-CG1 3.64Å; I63-I184 HydrophobicContact CD1-CD1 3.87Å; I63-I184 HydrophobicContact CG1-CD1 4.44Å; I63-I184 HydrophobicContact CG2-CD1 4.41Å
64	L	95.7	Very high	91.8	Very high	16 Å²	16	58.5 Å²	58.5	8%	0.084	33%	0.329	C	S	.	.	S	Bend	trans	-78.3	156.8	173.8	-68.9	172.4	0	0	0	110	W57 S61 F71 L94 L140 I177	W57-L64 HydrophobicContact CH2-CD1 4.36Å; S61-L64 PolarHBondContact O-N 2.73Å; L64-F71 HydrophobicContact CD2-CE2 4.37Å; L64-L94 HydrophobicContact CD1-CD1 4.04Å; L64-L94 HydrophobicContact CD1-CD2 3.91Å; L64-L94 HydrophobicContact CD1-CG 4.15Å; L64-L94 HydrophobicContact CD2-CD2 4.3Å; L64-L140 HydrophobicContact CD2-CD1 4.16Å; L64-I177 HydrophobicContact CD2-CD1 3.82Å
65	P	95.6	Very high	93.4	Very high	21 Å²	21	58.2 Å²	58.2	14%	0.136	32%	0.32	C	S	.	.			trans	-49.7	143.4	167.8	-26.5	34.6	0	0	0	111	N67 Q70 F71 Y95 M174	P65-N67 PolarHBondContact O-N 2.99Å; P65-Q70 HydrophobicContact CB-CB 4.23Å; P65-F71 HydrophobicContact CB-CB 4.05Å; P65-F71 HydrophobicContact CB-CD2 4.38Å; P65-F71 HydrophobicContact CG-CB 4.03Å; P65-F71 HydrophobicContact CG-CD2 3.74Å; P65-F71 HydrophobicContact CG-CG 4.14Å; P65-Y95 VanDerWaalsContact O-CE1 3.27Å; P65-Y95 WeakPolarHBondContact O-CE1 3.27Å; P65-Y95 PolarHBondContact O-OH 2.67Å; P65-M174 HydrophobicContact CG-SD 3.65Å
66	P	92.6	Very high	93.9	Very high	98 Å²	98	57 Å²	57	64%	0.636	31%	0.311	S	S	*	.	S	Bend	trans	-70.4	-17.6	-168.4	27.5	-36.2	0	0	0	114	Q70	P66-Q70 VanDerWaalsContact CD-OE1 3.3Å
67	N	93.9	Very high	94	Very high	50 Å²	50	64 Å²	64	27%	0.267	35%	0.349	S	S	.	.	S	Bend	trans	-153.3	170	178.3	51.5	57	0	0	0	111	P65 E69 Q70 F71	P65-N67 PolarHBondContact O-N 2.99Å; N67-E69 VanDerWaalsContact C-N 3.29Å; N67-E69 PolarHBondContact O-N 3.18Å; N67-E69 PolarHBondContact OD1-N 2.87Å; N67-E69 PolarHBondContact OD1-OE2 3.38Å; N67-Q70 PolarHBondContact ND2-NE2 3.38Å; N67-Q70 PolarHBondContact O-N 3.07Å; N67-Q70 WeakPolarHBondContact OD1-CB 3.49Å; N67-Q70 VanDerWaalsContact OD1-CG 3.24Å; N67-Q70 WeakPolarHBondContact OD1-CG 3.27Å; N67-Q70 PolarHBondContact OD1-N 2.92Å; N67-F71 PolarHBondContact O-N 3.25Å
68	E	94	Very high	94	Very high	48 Å²	48	67.3 Å²	67.3	22%	0.224	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-38.3	-178.8	-177.6	176.6	168.2	0	0	112.3	Q70 F71 R91 Q92 Y95	E68-Q70 VanDerWaalsContact C-N 3.32Å; E68-Q70 PolarHBondContact O-N 3.26Å; E68-F71 PolarHBondContact O-N 3.19Å; E68-R91 HydrophobicContact CG-CG 3.99Å; E68-R91 VanDerWaalsContact CG-NE 3.32Å; E68-R91 PolarHBondContact O-NH1 2.7Å; E68-R91 IonicContact OE1-CZ 3.26Å; E68-R91 IonicContact OE1-NE 2.79Å; E68-R91 PolarHBondContact OE1-NE 3.16Å; E68-R91 IonicContact OE1-NH2 3.18Å; E68-R91 PolarHBondContact OE1-NH2 3.26Å; E68-Q92 VanDerWaalsContact OE1-CG 3.25Å; E68-Q92 WeakPolarHBondContact OE1-CG 3.44Å; E68-Q92 WeakPolarHBondContact OE2-CG 3.34Å; E68-Y95 HydrophobicContact CB-CD2 4.03Å; E68-Y95 HydrophobicContact CB-CG 4.48Å
69	E	91.7	Very high	94.2	Very high	160 Å²	160	65 Å²	65	75%	0.748	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-34.6	-176.7	-64.4	78.8	-171.1	0	0	112.5	N67	N67-E69 VanDerWaalsContact C-N 3.29Å; N67-E69 PolarHBondContact O-N 3.18Å; N67-E69 PolarHBondContact OD1-N 2.87Å; N67-E69 PolarHBondContact OD1-OE2 3.38Å
70	Q	93.4	Very high	94.1	Very high	119 Å²	119	62.9 Å²	62.9	56%	0.556	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-9.3	178.7	-70	178.1	37.3	0	0	113.4	P65 P66 N67 E68 P72	P65-Q70 HydrophobicContact CB-CB 4.23Å; P66-Q70 VanDerWaalsContact CD-OE1 3.3Å; N67-Q70 PolarHBondContact ND2-NE2 3.38Å; N67-Q70 PolarHBondContact O-N 3.07Å; N67-Q70 WeakPolarHBondContact OD1-CB 3.49Å; N67-Q70 VanDerWaalsContact OD1-CG 3.24Å; N67-Q70 WeakPolarHBondContact OD1-CG 3.27Å; N67-Q70 PolarHBondContact OD1-N 2.92Å; E68-Q70 VanDerWaalsContact C-N 3.32Å; E68-Q70 PolarHBondContact O-N 3.26Å; Q70-P72 VanDerWaalsContact O-CD 3.3Å; Q70-P72 WeakPolarHBondContact O-CD 3.39Å
71	F	95.8	Very high	94.2	Very high	2 Å²	2	70.1 Å²	70.1	1%	0.009	38%	0.383	C	S	.	.	S	Bend	trans	-81	112.9	176.9	-170.4	-66	0	0	0	111.1	L64 P65 N67 E68 L73 R91 L94 Y95 Y137 L140 F141 M174	L64-F71 HydrophobicContact CD2-CE2 4.37Å; P65-F71 HydrophobicContact CB-CB 4.05Å; P65-F71 HydrophobicContact CB-CD2 4.38Å; P65-F71 HydrophobicContact CG-CB 4.03Å; P65-F71 HydrophobicContact CG-CD2 3.74Å; P65-F71 HydrophobicContact CG-CG 4.14Å; N67-F71 PolarHBondContact O-N 3.25Å; E68-F71 PolarHBondContact O-N 3.19Å; F71-L73 HydrophobicContact CD1-CD2 4.45Å; F71-L73 HydrophobicContact CD1-CG 4.06Å; F71-L73 HydrophobicContact CE1-CD2 4.02Å; F71-L73 HydrophobicContact CE1-CG 4.11Å; F71-L73 PolarHBondContact O-N 2.9Å; F71-R91 HydrophobicContact CB-CG 4.17Å; F71-R91 HydrophobicContact CD1-CG 3.93Å; F71-R91 HydrophobicContact CG-CG 3.99Å; F71-R91 PolarHBondContact O-NH1 2.77Å; F71-L94 HydrophobicContact CD2-CD2 4.27Å; F71-L94 HydrophobicContact CE2-CD2 3.78Å; F71-Y95 HydrophobicContact CB-CE2 4.12Å; F71-Y95 AromaticContact CD2-CE2 4Å; F71-Y95 HydrophobicContact CD2-CE2 4Å; F71-Y95 WeakPolarHBondContact CD2-OH 3.32Å; F71-Y95 HydrophobicContact CG-CE2 4.34Å; F71-Y137 HydrophobicContact CD1-CE1 4.45Å; F71-Y137 AromaticContact CE1-CD1 3.68Å; F71-Y137 HydrophobicContact CE1-CD1 3.68Å; F71-Y137 AromaticContact CE1-CE1 3.48Å; F71-Y137 HydrophobicContact CE1-CE1 3.48Å; F71-Y137 VanDerWaalsContact CE1-CE1 3.48Å; F71-Y137 AromaticContact CZ-CD1 3.85Å; F71-Y137 HydrophobicContact CZ-CD1 3.85Å; F71-Y137 AromaticContact CZ-CE1 3.87Å; F71-Y137 HydrophobicContact CZ-CE1 3.87Å; F71-L140 HydrophobicContact CE2-CD2 4.09Å; F71-L140 HydrophobicContact CZ-CD2 3.79Å; F71-F141 HydrophobicContact CE1-CE1 4.16Å; F71-F141 AromaticContact CE1-CZ 3.8Å; F71-F141 HydrophobicContact CE1-CZ 3.8Å; F71-F141 HydrophobicContact CE2-CE1 4.26Å; F71-F141 AromaticContact CZ-CE1 3.66Å; F71-F141 HydrophobicContact CZ-CE1 3.66Å; F71-F141 AromaticContact CZ-CZ 3.73Å; F71-F141 HydrophobicContact CZ-CZ 3.73Å; F71-M174 HydrophobicContact CD2-SD 4.45Å; F71-M174 HydrophobicContact CE2-CE 3.96Å; F71-M174 HydrophobicContact CE2-SD 4.29Å; F71-M174 HydrophobicContact CZ-CE 3.86Å; F71-M174 HydrophobicContact CZ-SD 4.48Å
72	P	94.2	Very high	94.3	Very high	50 Å²	50	71.5 Å²	71.5	33%	0.325	39%	0.392	S	S	.	.			trans	-75.7	129.2	-170.2	29.5	-33.3	0	0	0	111.7	Q70 Y137 M174	Q70-P72 VanDerWaalsContact O-CD 3.3Å; Q70-P72 WeakPolarHBondContact O-CD 3.39Å; P72-Y137 WeakPolarHBondContact O-CE1 3.3Å; P72-Y137 PolarHBondContact O-OH 3.43Å; P72-M174 HydrophobicContact CG-CG 3.88Å; P72-M174 HydrophobicContact CG-SD 4.11Å
73	L	93.3	Very high	94.4	Very high	21 Å²	21	68 Å²	68	11%	0.11	36%	0.362	C	S	.	.			trans	-142.3	61.9	172	-72.5	179.6	0	0	0	110	F71 F75 L87 K88 R91 Y137	F71-L73 HydrophobicContact CD1-CD2 4.45Å; F71-L73 HydrophobicContact CD1-CG 4.06Å; F71-L73 HydrophobicContact CE1-CD2 4.02Å; F71-L73 HydrophobicContact CE1-CG 4.11Å; F71-L73 PolarHBondContact O-N 2.9Å; L73-F75 HydrophobicContact CB-CE2 4.34Å; L73-F75 HydrophobicContact CD2-CE2 4.03Å; L73-L87 HydrophobicContact CD1-CB 4.01Å; L73-L87 HydrophobicContact CD2-CB 4.16Å; L73-K88 HydrophobicContact CD1-CG 4.41Å; L73-R91 HydrophobicContact CD1-CB 3.96Å; L73-R91 HydrophobicContact CD1-CG 4.44Å; L73-Y137 HydrophobicContact CD2-CD1 3.93Å; L73-Y137 HydrophobicContact CD2-CD2 4.07Å; L73-Y137 HydrophobicContact CD2-CE1 3.96Å; L73-Y137 HydrophobicContact CD2-CE2 4.12Å; L73-Y137 HydrophobicContact CD2-CG 4Å
74	Q	91.9	Very high	94.5	Very high	158 Å²	158	66.2 Å²	66.2	74%	0.738	35%	0.354	S	S	*	.			trans	-100.4	120.7	177.4	-65	179.7	1.6	0	0	110	R133	Q74-R133 PolarHBondContact O-NH1 2.88Å; Q74-R133 PolarHBondContact O-NH2 3.36Å
75	F	95.2	Very high	94.5	Very high	37 Å²	37	70.4 Å²	70.4	16%	0.162	37%	0.373	C	S	.	.			trans	-138.1	150	179.9	-63.7	-84.5	0	0	0	109.5	L73 V79 V84 L87 E130 R133 V134 Y137	L73-F75 HydrophobicContact CB-CE2 4.34Å; L73-F75 HydrophobicContact CD2-CE2 4.03Å; F75-V79 HydrophobicContact CB-CB 4.15Å; F75-V79 HydrophobicContact CB-CG2 4.2Å; F75-V79 HydrophobicContact CD1-CB 4.44Å; F75-V79 HydrophobicContact CD1-CG2 3.77Å; F75-V79 HydrophobicContact CG-CB 4.47Å; F75-V79 HydrophobicContact CG-CG2 4.27Å; F75-V84 HydrophobicContact CB-CG2 4.27Å; F75-L87 HydrophobicContact CD2-CD1 4.24Å; F75-L87 HydrophobicContact CE2-CD1 3.57Å; F75-L87 HydrophobicContact CZ-CD1 3.84Å; F75-E130 HydrophobicContact CD1-CB 4.2Å; F75-R133 HydrophobicContact CE1-CB 3.96Å; F75-R133 HydrophobicContact CZ-CB 4.49Å; F75-V134 HydrophobicContact CD1-CG2 4.09Å; F75-V134 HydrophobicContact CE1-CG2 3.55Å; F75-V134 HydrophobicContact CZ-CG2 3.97Å; F75-Y137 HydrophobicContact CE2-CE2 4.44Å; F75-Y137 AromaticContact CZ-CD2 3.78Å; F75-Y137 HydrophobicContact CZ-CD2 3.78Å; F75-Y137 AromaticContact CZ-CE2 3.83Å; F75-Y137 HydrophobicContact CZ-CE2 3.83Å
76	S	94.4	Very high	94.6	Very high	44 Å²	44	71.3 Å²	71.3	31%	0.308	38%	0.376	S	S	.	.			trans	-81.9	-179.5	172.7	105.1	0	0	0	0	111.1	K78 V79 E130	S76-K78 PolarHBondContact O-N 2.98Å; S76-K78 VanDerWaalsContact O-N 3.09Å; S76-K78 WeakPolarHBondContact OG-CB 3.4Å; S76-K78 VanDerWaalsContact OG-CG 3.32Å; S76-K78 WeakPolarHBondContact OG-CG 3.4Å; S76-K78 PolarHBondContact OG-N 3.47Å; S76-K78 VanDerWaalsContact OG-N 3.09Å; S76-V79 PolarHBondContact O-N 2.89Å; S76-E130 PolarHBondContact N-OE1 2.92Å; S76-E130 VanDerWaalsContact N-OE1 3.09Å; S76-E130 PolarHBondContact N-OE2 3.34Å
77	D	93.3	Very high	94.8	Very high	157 Å²	157	66.7 Å²	66.7	84%	0.84	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-9.8	168.7	61.6	-23.2	0	0	0	115.2	V79	D77-V79 VanDerWaalsContact C-N 3.29Å; D77-V79 PolarHBondContact O-N 3.14Å
78	K	93	Very high	95	Very high	118 Å²	118	68 Å²	68	51%	0.513	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-29.1	173.8	-71.1	177.2	173.8	-170.2	0	113.2	S76 D128 W131	S76-K78 PolarHBondContact O-N 2.98Å; S76-K78 VanDerWaalsContact O-N 3.09Å; S76-K78 WeakPolarHBondContact OG-CB 3.4Å; S76-K78 VanDerWaalsContact OG-CG 3.32Å; S76-K78 WeakPolarHBondContact OG-CG 3.4Å; S76-K78 PolarHBondContact OG-N 3.47Å; S76-K78 VanDerWaalsContact OG-N 3.09Å; K78-D128 VanDerWaalsContact CD-OD2 3.26Å; K78-D128 WeakPolarHBondContact CD-OD2 3.43Å; K78-D128 WeakPolarHBondContact CE-OD2 3.45Å; K78-D128 IonicContact NZ-OD2 2.71Å; K78-D128 PolarHBondContact NZ-OD2 3.3Å; K78-W131 PolarHBondContact O-NE1 2.87Å
79	V	95.5	Very high	95.1	Very high	3 Å²	3	71.8 Å²	71.8	2%	0.018	36%	0.362	C	S	.	.	S	Bend	trans	-96.2	127.6	174.4	-178.6	0	0	0	0	108.9	F75 S76 D77 L81 V83 V84 E130 W131 V134	F75-V79 HydrophobicContact CB-CB 4.15Å; F75-V79 HydrophobicContact CB-CG2 4.2Å; F75-V79 HydrophobicContact CD1-CB 4.44Å; F75-V79 HydrophobicContact CD1-CG2 3.77Å; F75-V79 HydrophobicContact CG-CB 4.47Å; F75-V79 HydrophobicContact CG-CG2 4.27Å; S76-V79 PolarHBondContact O-N 2.89Å; D77-V79 VanDerWaalsContact C-N 3.29Å; D77-V79 PolarHBondContact O-N 3.14Å; V79-L81 PolarHBondContact O-N 3.38Å; V79-V83 HydrophobicContact CG1-CB 4.12Å; V79-V83 HydrophobicContact CG1-CG1 4.12Å; V79-V84 HydrophobicContact CB-CG2 4.26Å; V79-V84 HydrophobicContact CG1-CG2 3.87Å; V79-E130 HydrophobicContact CG2-CB 3.78Å; V79-W131 HydrophobicContact CB-CZ2 4.41Å; V79-W131 HydrophobicContact CG1-CH2 3.9Å; V79-W131 HydrophobicContact CG1-CZ2 4.26Å; V79-W131 HydrophobicContact CG1-CZ3 4.17Å; V79-W131 HydrophobicContact CG2-CD2 4.48Å; V79-V134 HydrophobicContact CG1-CG2 3.79Å; V79-V134 HydrophobicContact CG2-CG2 3.92Å
80	A	94.1	Very high	95.3	Very high	30 Å²	30	64.4 Å²	64.4	25%	0.248	33%	0.328	C	S	.	.			trans	-57.1	134.3	-178.6	0	0	0	0	0	111.6	S82 V83 V84	A80-S82 PolarHBondContact O-N 3Å; A80-S82 VanDerWaalsContact O-N 3.11Å; A80-V83 HydrophobicContact CB-CG2 4.2Å; A80-V83 WeakPolarHBondContact O-CA 3.5Å; A80-V83 WeakPolarHBondContact O-CB 3.17Å; A80-V83 PolarHBondContact O-N 3.2Å; A80-V84 PolarHBondContact O-N 3.2Å; A80-V84 VanDerWaalsContact O-N 3.13Å
81	L	95.7	Very high	95.4	Very high	153 Å²	153	60.8 Å²	60.8	80%	0.801	31%	0.309	S	S	*	.	H	α-helix	trans	-54	-35.3	-178.7	-73.3	173.7	0	0	0	113.2	V79 V83 V84 E85	V79-L81 PolarHBondContact O-N 3.38Å; L81-V83 VanDerWaalsContact C-N 3.31Å; L81-V83 PolarHBondContact O-N 3.39Å; L81-V84 PolarHBondContact O-N 2.69Å; L81-E85 PolarHBondContact O-N 3.04Å
82	S	96.2	Very high	95.4	Very high	78 Å²	78	65.4 Å²	65.4	55%	0.545	33%	0.331	S	S	.	.	H	α-helix	trans	-62	-37.1	175.5	52	0	0	0	0	112.8	A80 E85 M86	A80-S82 PolarHBondContact O-N 3Å; A80-S82 VanDerWaalsContact O-N 3.11Å; S82-E85 PolarHBondContact O-N 3.44Å; S82-M86 WeakPolarHBondContact O-CG 3.5Å; S82-M86 PolarHBondContact O-N 3.47Å; S82-M86 VanDerWaalsContact O-N 3.08Å
83	V	96.9	Very high	95.4	Very high	8 Å²	8	63.8 Å²	63.8	5%	0.048	32%	0.319	C	S	.	.	H	α-helix	trans	-73.3	-40.1	177.3	179.3	0	0	0	0	110.6	V79 A80 L81 E85 M86 L87 Y114 W131 V134	V79-V83 HydrophobicContact CG1-CB 4.12Å; V79-V83 HydrophobicContact CG1-CG1 4.12Å; A80-V83 HydrophobicContact CB-CG2 4.2Å; A80-V83 WeakPolarHBondContact O-CA 3.5Å; A80-V83 WeakPolarHBondContact O-CB 3.17Å; A80-V83 PolarHBondContact O-N 3.2Å; L81-V83 VanDerWaalsContact C-N 3.31Å; L81-V83 PolarHBondContact O-N 3.39Å; V83-E85 VanDerWaalsContact C-N 3.26Å; V83-E85 PolarHBondContact O-N 2.81Å; V83-M86 WeakPolarHBondContact O-CB 3.46Å; V83-M86 PolarHBondContact O-N 3.47Å; V83-M86 VanDerWaalsContact O-N 3.16Å; V83-L87 WeakPolarHBondContact O-CG 3.47Å; V83-L87 PolarHBondContact O-N 3.18Å; V83-Y114 HydrophobicContact CG2-CD1 3.54Å; V83-Y114 HydrophobicContact CG2-CD2 4.5Å; V83-Y114 HydrophobicContact CG2-CE1 3.63Å; V83-Y114 HydrophobicContact CG2-CG 4Å; V83-W131 HydrophobicContact CB-CH2 4.46Å; V83-W131 HydrophobicContact CG1-CZ3 4.17Å; V83-W131 HydrophobicContact CG2-CH2 4.1Å; V83-W131 HydrophobicContact CG2-CZ3 4.35Å; V83-V134 HydrophobicContact CG1-CG1 3.78Å
84	V	97.3	Very high	95.4	Very high	19 Å²	19	63.3 Å²	63.3	12%	0.115	32%	0.316	C	S	.	.	H	α-helix	trans	-59.4	-40.5	173.6	179	0	0	0	0	110.8	F75 V79 A80 L81 L87 K88	F75-V84 HydrophobicContact CB-CG2 4.27Å; V79-V84 HydrophobicContact CB-CG2 4.26Å; V79-V84 HydrophobicContact CG1-CG2 3.87Å; A80-V84 PolarHBondContact O-N 3.2Å; A80-V84 VanDerWaalsContact O-N 3.13Å; L81-V84 PolarHBondContact O-N 2.69Å; V84-L87 WeakPolarHBondContact O-CB 3.41Å; V84-L87 PolarHBondContact O-N 3.25Å; V84-K88 WeakPolarHBondContact O-CG 3.35Å; V84-K88 PolarHBondContact O-N 3.31Å
85	E	97	Very high	95.4	Very high	105 Å²	105	58.9 Å²	58.9	49%	0.491	29%	0.293	S	S	.	.	H	α-helix	trans	-67.2	-37	176.4	-163.2	57.5	-153.2	0	0	112.4	L81 S82 V83 K88 R89	L81-E85 PolarHBondContact O-N 3.04Å; S82-E85 PolarHBondContact O-N 3.44Å; V83-E85 VanDerWaalsContact C-N 3.26Å; V83-E85 PolarHBondContact O-N 2.81Å; E85-K88 PolarHBondContact O-N 3.42Å; E85-K88 IonicContact OE2-NZ 2.94Å; E85-K88 PolarHBondContact OE2-NZ 2.94Å; E85-R89 PolarHBondContact O-N 3.17Å
86	M	97.1	Very high	95	Very high	40 Å²	40	58.3 Å²	58.3	20%	0.197	30%	0.298	C	S	.	.	H	α-helix	trans	-63.9	-39.5	172.3	-72.7	-60.9	-64.9	0	0	112.5	S82 V83 R89 A90 T107 I110 I111	S82-M86 WeakPolarHBondContact O-CG 3.5Å; S82-M86 PolarHBondContact O-N 3.47Å; S82-M86 VanDerWaalsContact O-N 3.08Å; V83-M86 WeakPolarHBondContact O-CB 3.46Å; V83-M86 PolarHBondContact O-N 3.47Å; V83-M86 VanDerWaalsContact O-N 3.16Å; M86-R89 PolarHBondContact O-N 3.12Å; M86-A90 PolarHBondContact O-N 3.1Å; M86-T107 HydrophobicContact CE-CG2 3.7Å; M86-I110 HydrophobicContact CE-CB 4.16Å; M86-I110 HydrophobicContact CE-CD1 4Å; M86-I110 HydrophobicContact CE-CG2 4Å; M86-I111 HydrophobicContact CB-CD1 4.41Å; M86-I111 HydrophobicContact CB-CG1 4.01Å
87	L	97.7	Very high	94	Very high	1 Å²	1	63.8 Å²	63.8	1%	0.005	32%	0.324	C	S	.	.	H	α-helix	trans	-62.9	-43.1	174.4	-72.6	167.1	0	0	0	111.7	L73 F75 V83 V84 R89 A90 R91 I111 V134 F141	L73-L87 HydrophobicContact CD1-CB 4.01Å; L73-L87 HydrophobicContact CD2-CB 4.16Å; F75-L87 HydrophobicContact CD2-CD1 4.24Å; F75-L87 HydrophobicContact CE2-CD1 3.57Å; F75-L87 HydrophobicContact CZ-CD1 3.84Å; V83-L87 WeakPolarHBondContact O-CG 3.47Å; V83-L87 PolarHBondContact O-N 3.18Å; V84-L87 WeakPolarHBondContact O-CB 3.41Å; V84-L87 PolarHBondContact O-N 3.25Å; L87-R89 VanDerWaalsContact C-N 3.35Å; L87-A90 PolarHBondContact O-N 3.42Å; L87-R91 WeakPolarHBondContact O-CB 3.47Å; L87-R91 PolarHBondContact O-N 3.13Å; L87-I111 HydrophobicContact CD2-CD1 3.92Å; L87-I111 HydrophobicContact CD2-CG1 4.42Å; L87-I111 HydrophobicContact CD2-CG2 3.84Å; L87-I111 HydrophobicContact CG-CD1 4.37Å; L87-V134 HydrophobicContact CD1-CG1 4.29Å; L87-V134 HydrophobicContact CD1-CG2 4.17Å; L87-F141 HydrophobicContact CD2-CD2 4.43Å; L87-F141 HydrophobicContact CD2-CE2 3.88Å
88	K	97	Very high	92.6	Very high	77 Å²	77	61.3 Å²	61.3	34%	0.335	33%	0.325	S	S	.	.	H	α-helix	trans	-62.1	-42.4	174.8	-70.3	173.8	-172.8	167.2	0	111.6	L73 V84 E85 R91 Q92	L73-K88 HydrophobicContact CD1-CG 4.41Å; V84-K88 WeakPolarHBondContact O-CG 3.35Å; V84-K88 PolarHBondContact O-N 3.31Å; E85-K88 PolarHBondContact O-N 3.42Å; E85-K88 IonicContact OE2-NZ 2.94Å; E85-K88 PolarHBondContact OE2-NZ 2.94Å; K88-R91 WeakPolarHBondContact O-CB 3.29Å; K88-R91 PolarHBondContact O-N 3.28Å; K88-Q92 WeakPolarHBondContact O-CG 3.48Å; K88-Q92 PolarHBondContact O-N 3.35Å
89	R	95.9	Very high	91.8	Very high	128 Å²	128	57.7 Å²	57.7	48%	0.483	31%	0.313	S	S	.	.	H	α-helix	trans	-61.2	-45.3	174.9	-177.6	178.3	177.3	174.9	1.2	111.8	E85 M86 L87 R91 Q92 Q93 T107	E85-R89 PolarHBondContact O-N 3.17Å; M86-R89 PolarHBondContact O-N 3.12Å; L87-R89 VanDerWaalsContact C-N 3.35Å; R89-R91 VanDerWaalsContact C-N 3.31Å; R89-R91 PolarHBondContact O-N 3.23Å; R89-Q92 PolarHBondContact O-N 2.96Å; R89-Q93 VanDerWaalsContact O-CG 3.27Å; R89-Q93 WeakPolarHBondContact O-CG 3.42Å; R89-Q93 PolarHBondContact O-N 3.44Å; R89-T107 HydrophobicContact CG-CG2 4.36Å
90	A	96.6	Very high	91.2	Very high	5 Å²	5	61 Å²	61	4%	0.041	34%	0.337	C	S	.	.	H	α-helix	trans	-61.4	-40.8	176.7	0	0	0	0	0	111.6	M86 L87 Q93 L94 T107 I111 F141	M86-A90 PolarHBondContact O-N 3.1Å; L87-A90 PolarHBondContact O-N 3.42Å; A90-Q93 PolarHBondContact O-N 3.13Å; A90-L94 PolarHBondContact O-N 2.9Å; A90-T107 HydrophobicContact CB-CG2 3.98Å; A90-I111 HydrophobicContact CB-CD1 3.84Å; A90-F141 HydrophobicContact CB-CB 4.35Å; A90-F141 HydrophobicContact CB-CD1 4.16Å; A90-F141 HydrophobicContact CB-CD2 3.51Å; A90-F141 HydrophobicContact CB-CE1 4.34Å; A90-F141 HydrophobicContact CB-CE2 3.71Å; A90-F141 HydrophobicContact CB-CG 3.77Å; A90-F141 HydrophobicContact CB-CZ 4.14Å
91	R	96.4	Very high	90.7	Very high	42 Å²	42	61.7 Å²	61.7	16%	0.158	34%	0.342	C	S	.	.	H	α-helix	trans	-61.4	-46.5	173.2	-175.6	-172.8	61.9	171.2	12	112.2	E68 F71 L73 L87 K88 R89 Q93 L94 Y95 F141	E68-R91 HydrophobicContact CG-CG 3.99Å; E68-R91 VanDerWaalsContact CG-NE 3.32Å; E68-R91 PolarHBondContact O-NH1 2.7Å; E68-R91 IonicContact OE1-CZ 3.26Å; E68-R91 IonicContact OE1-NE 2.79Å; E68-R91 PolarHBondContact OE1-NE 3.16Å; E68-R91 IonicContact OE1-NH2 3.18Å; E68-R91 PolarHBondContact OE1-NH2 3.26Å; F71-R91 HydrophobicContact CB-CG 4.17Å; F71-R91 HydrophobicContact CD1-CG 3.93Å; F71-R91 HydrophobicContact CG-CG 3.99Å; F71-R91 PolarHBondContact O-NH1 2.77Å; L73-R91 HydrophobicContact CD1-CB 3.96Å; L73-R91 HydrophobicContact CD1-CG 4.44Å; L87-R91 WeakPolarHBondContact O-CB 3.47Å; L87-R91 PolarHBondContact O-N 3.13Å; K88-R91 WeakPolarHBondContact O-CB 3.29Å; K88-R91 PolarHBondContact O-N 3.28Å; R89-R91 VanDerWaalsContact C-N 3.31Å; R89-R91 PolarHBondContact O-N 3.23Å; R91-Q93 VanDerWaalsContact C-N 3.31Å; R91-Q93 PolarHBondContact O-N 3.03Å; R91-L94 VanDerWaalsContact O-CB 3.28Å; R91-L94 WeakPolarHBondContact O-CB 3.47Å; R91-L94 PolarHBondContact O-N 2.81Å; R91-L94 VanDerWaalsContact O-N 3.12Å; R91-Y95 HydrophobicContact CG-CD2 4.27Å; R91-Y95 HydrophobicContact CG-CE2 4.14Å; R91-Y95 VanDerWaalsContact O-CD2 3.31Å; R91-Y95 WeakPolarHBondContact O-CD2 3.42Å; R91-Y95 PolarHBondContact O-N 2.91Å; R91-F141 HydrophobicContact CB-CE1 4.23Å; R91-F141 HydrophobicContact CB-CZ 4.01Å
92	Q	95.1	Very high	90.3	Very high	100 Å²	100	58.8 Å²	58.8	47%	0.467	34%	0.335	S	S	.	.	H	α-helix	trans	-59.3	-43.2	175.6	-74.5	170.5	-5.4	0	0	111.7	E68 K88 R89 L94 Y95 G96	E68-Q92 VanDerWaalsContact OE1-CG 3.25Å; E68-Q92 WeakPolarHBondContact OE1-CG 3.44Å; E68-Q92 WeakPolarHBondContact OE2-CG 3.34Å; K88-Q92 WeakPolarHBondContact O-CG 3.48Å; K88-Q92 PolarHBondContact O-N 3.35Å; R89-Q92 PolarHBondContact O-N 2.96Å; Q92-L94 VanDerWaalsContact C-N 3.28Å; Q92-L94 PolarHBondContact O-N 3.11Å; Q92-Y95 PolarHBondContact O-N 2.96Å; Q92-G96 PolarHBondContact O-N 3.38Å
93	Q	93.9	Very high	90	Very high	15 Å²	15	56.9 Å²	56.9	7%	0.07	32%	0.322	C	S	.	.	H	α-helix	trans	-66.4	-29.8	176.9	-66.5	172.1	-22.6	0	0	112.7	R89 A90 R91 T99 Q104 T107 R148	R89-Q93 VanDerWaalsContact O-CG 3.27Å; R89-Q93 WeakPolarHBondContact O-CG 3.42Å; R89-Q93 PolarHBondContact O-N 3.44Å; A90-Q93 PolarHBondContact O-N 3.13Å; R91-Q93 VanDerWaalsContact C-N 3.31Å; R91-Q93 PolarHBondContact O-N 3.03Å; Q93-T99 HydrophobicContact CB-CG2 4.37Å; Q93-T99 HydrophobicContact CG-CG2 4Å; Q93-Q104 HydrophobicContact CB-CG 3.88Å; Q93-Q104 PolarHBondContact O-NE2 3.28Å; Q93-T107 PolarHBondContact NE2-OG1 3.34Å; Q93-T107 PolarHBondContact OE1-OG1 3.47Å; Q93-T107 VanDerWaalsContact OE1-OG1 3.13Å; Q93-R148 PolarHBondContact O-NH1 3.47Å
94	L	93.1	Very high	89.8	Confident	11 Å²	11	57 Å²	57	6%	0.058	32%	0.321	C	S	.	.	H	α-helix	trans	-63.6	-40.6	175.5	-174.4	67.6	0	0	0	111.4	W57 L64 F71 A90 R91 Q92 F141 A144 R148	W57-L94 HydrophobicContact CH2-CD1 3.77Å; L64-L94 HydrophobicContact CD1-CD1 4.04Å; L64-L94 HydrophobicContact CD1-CD2 3.91Å; L64-L94 HydrophobicContact CD1-CG 4.15Å; L64-L94 HydrophobicContact CD2-CD2 4.3Å; F71-L94 HydrophobicContact CD2-CD2 4.27Å; F71-L94 HydrophobicContact CE2-CD2 3.78Å; A90-L94 PolarHBondContact O-N 2.9Å; R91-L94 VanDerWaalsContact O-CB 3.28Å; R91-L94 WeakPolarHBondContact O-CB 3.47Å; R91-L94 PolarHBondContact O-N 2.81Å; R91-L94 VanDerWaalsContact O-N 3.12Å; Q92-L94 VanDerWaalsContact C-N 3.28Å; Q92-L94 PolarHBondContact O-N 3.11Å; L94-F141 HydrophobicContact CB-CD1 4.5Å; L94-F141 HydrophobicContact CB-CE1 4.47Å; L94-F141 HydrophobicContact CD2-CD1 4.14Å; L94-F141 HydrophobicContact CD2-CE1 3.93Å; L94-A144 HydrophobicContact CD1-CB 3.7Å; L94-R148 PolarHBondContact O-NH1 3.29Å; L94-R148 PolarHBondContact O-NH2 3.34Å
95	Y	92.3	Very high	89.7	Confident	65 Å²	65	58.6 Å²	58.6	26%	0.255	33%	0.329	S	S	.	.	H	α-helix	trans	-92.9	-10	-179.7	-67.7	-78.9	0	0	0	114.5	P65 E68 F71 R91 Q92	P65-Y95 VanDerWaalsContact O-CE1 3.27Å; P65-Y95 WeakPolarHBondContact O-CE1 3.27Å; P65-Y95 PolarHBondContact O-OH 2.67Å; E68-Y95 HydrophobicContact CB-CD2 4.03Å; E68-Y95 HydrophobicContact CB-CG 4.48Å; F71-Y95 HydrophobicContact CB-CE2 4.12Å; F71-Y95 AromaticContact CD2-CE2 4Å; F71-Y95 HydrophobicContact CD2-CE2 4Å; F71-Y95 WeakPolarHBondContact CD2-OH 3.32Å; F71-Y95 HydrophobicContact CG-CE2 4.34Å; R91-Y95 HydrophobicContact CG-CD2 4.27Å; R91-Y95 HydrophobicContact CG-CE2 4.14Å; R91-Y95 VanDerWaalsContact O-CD2 3.31Å; R91-Y95 WeakPolarHBondContact O-CD2 3.42Å; R91-Y95 PolarHBondContact O-N 2.91Å; Q92-Y95 PolarHBondContact O-N 2.96Å
96	G	86.8	Confident	89.6	Confident	26 Å²	26	58.8 Å²	58.8	27%	0.268	33%	0.333	S	S	.	.			trans	-92.7	141.6	179.8	0	0	0	0	0	114.2	Q92 R148	Q92-G96 PolarHBondContact O-N 3.38Å; G96-R148 PolarHBondContact O-NH2 3.44Å
97	D	73.1	Confident	89.6	Confident	158 Å²	158	57.1 Å²	57.1	85%	0.845	33%	0.325	S	S	*	.	S	Bend	trans	-86.4	-12.9	-179.1	-67.5	-32.3	0	0	0	114.6	R148	D97-R148 IonicContact OD1-NH2 2.82Å
98	A	64.8	Low	89.5	Confident	105 Å²	105	57.1 Å²	57.1	87%	0.868	33%	0.325	S	S	*	.	S	Bend	trans	-91.8	-1.2	-169.4	0	0	0	0	0	115.1
99	T	74.5	Confident	89.5	Confident	42 Å²	42	56 Å²	56	26%	0.258	32%	0.321	S	S	.	.	S	Bend	trans	-100.8	131.7	-173.5	-51.3	0	0	0	0	111.1	Q93 Q104	Q93-T99 HydrophobicContact CB-CG2 4.37Å; Q93-T99 HydrophobicContact CG-CG2 4Å; T99-Q104 HydrophobicContact CG2-CG 3.97Å
100	S	83.3	Confident	89.6	Confident	73 Å²	73	53.8 Å²	53.8	51%	0.51	32%	0.317	S	S	.	.			trans	-66	145.6	173.9	65.4	0	0	0	0	111.7	S102 S103 Q104	S100-S102 PolarHBondContact O-N 3.12Å; S100-S103 WeakPolarHBondContact O-CB 3.16Å; S100-S103 PolarHBondContact O-N 3.1Å; S100-S103 WeakPolarHBondContact OG-CB 3.49Å; S100-Q104 PolarHBondContact O-N 3.48Å
101	A	83.4	Confident	89.7	Confident	44 Å²	44	53.6 Å²	53.6	36%	0.364	32%	0.316	S	S	.	.	H	α-helix	trans	-54.3	-39	177.4	0	0	0	0	0	112.2	S103 Q104 I105	A101-S103 VanDerWaalsContact C-N 3.3Å; A101-S103 PolarHBondContact O-N 3.45Å; A101-Q104 WeakPolarHBondContact O-CB 3.45Å; A101-Q104 PolarHBondContact O-N 3.39Å; A101-I105 VanDerWaalsContact O-CG1 3.32Å; A101-I105 WeakPolarHBondContact O-CG1 3.26Å; A101-I105 PolarHBondContact O-N 3.1Å
102	S	87.4	Confident	89.8	Confident	93 Å²	93	52.2 Å²	52.2	65%	0.65	31%	0.311	S	S	*	.	H	α-helix	trans	-60.5	-37.2	176.7	-45.5	0	0	0	0	113	S100 L106	S100-S102 PolarHBondContact O-N 3.12Å; S102-L106 WeakPolarHBondContact O-CB 3.33Å; S102-L106 PolarHBondContact O-N 2.89Å
103	S	91.1	Very high	89.8	Confident	38 Å²	38	51.8 Å²	51.8	27%	0.266	31%	0.313	S	S	.	.	H	α-helix	trans	-71.9	-37.5	177.5	-178.5	0	0	0	0	112	S100 A101 T107	S100-S103 WeakPolarHBondContact O-CB 3.16Å; S100-S103 PolarHBondContact O-N 3.1Å; S100-S103 WeakPolarHBondContact OG-CB 3.49Å; A101-S103 VanDerWaalsContact C-N 3.3Å; A101-S103 PolarHBondContact O-N 3.45Å; S103-T107 WeakPolarHBondContact O-CB 3.43Å; S103-T107 PolarHBondContact O-N 3.07Å; S103-T107 PolarHBondContact O-OG1 3.5Å
104	Q	92.6	Very high	89.9	Confident	10 Å²	10	54.6 Å²	54.6	5%	0.047	32%	0.323	C	S	.	.	H	α-helix	trans	-63.5	-48.1	172.9	-72.9	170.1	0	0	0	111.4	Q93 T99 S100 A101 L106 T107 A108 A145 R148	Q93-Q104 HydrophobicContact CB-CG 3.88Å; Q93-Q104 PolarHBondContact O-NE2 3.28Å; T99-Q104 HydrophobicContact CG2-CG 3.97Å; S100-Q104 PolarHBondContact O-N 3.48Å; A101-Q104 WeakPolarHBondContact O-CB 3.45Å; A101-Q104 PolarHBondContact O-N 3.39Å; Q104-L106 VanDerWaalsContact C-N 3.35Å; Q104-L106 PolarHBondContact O-N 2.89Å; Q104-T107 PolarHBondContact O-N 3.43Å; Q104-A108 PolarHBondContact O-N 3.46Å; Q104-A145 HydrophobicContact CB-CB 3.56Å; Q104-R148 VanDerWaalsContact OE1-CD 3.31Å
105	I	93.9	Very high	90.1	Very high	53 Å²	53	54.1 Å²	54.1	27%	0.272	32%	0.32	S	S	.	.	H	α-helix	trans	-60.4	-44.4	178.1	-68.6	168	0	0	0	110.7	A101 T107 A108 Q109 A145 I146	A101-I105 VanDerWaalsContact O-CG1 3.32Å; A101-I105 WeakPolarHBondContact O-CG1 3.26Å; A101-I105 PolarHBondContact O-N 3.1Å; I105-T107 PolarHBondContact O-N 3.47Å; I105-A108 PolarHBondContact O-N 3.39Å; I105-Q109 WeakPolarHBondContact O-CB 3.39Å; I105-Q109 PolarHBondContact O-N 3.19Å; I105-A145 HydrophobicContact CG1-CB 3.73Å; I105-I146 HydrophobicContact CD1-CG1 4.06Å; I105-I146 HydrophobicContact CG1-CG1 4.36Å
106	L	95.4	Very high	90.2	Very high	109 Å²	109	56.3 Å²	56.3	57%	0.571	33%	0.328	S	S	*	.	H	α-helix	trans	-61.4	-44.8	177.8	179.3	63.5	0	0	0	111.9	S102 Q104 A108 Q109 I110	S102-L106 WeakPolarHBondContact O-CB 3.33Å; S102-L106 PolarHBondContact O-N 2.89Å; Q104-L106 VanDerWaalsContact C-N 3.35Å; Q104-L106 PolarHBondContact O-N 2.89Å; L106-A108 VanDerWaalsContact C-N 3.33Å; L106-A108 PolarHBondContact O-N 3.17Å; L106-Q109 PolarHBondContact O-N 3.3Å; L106-I110 HydrophobicContact CG-CD1 4.33Å; L106-I110 WeakPolarHBondContact O-CG1 3.4Å; L106-I110 PolarHBondContact O-N 3.37Å
107	T	96.5	Very high	90.5	Very high	5 Å²	5	61.1 Å²	61.1	3%	0.031	34%	0.344	C	S	.	.	H	α-helix	trans	-61.3	-44.5	178.6	-55.4	0	0	0	0	110.6	M86 R89 A90 Q93 S103 Q104 I105 I110 I111	M86-T107 HydrophobicContact CE-CG2 3.7Å; R89-T107 HydrophobicContact CG-CG2 4.36Å; A90-T107 HydrophobicContact CB-CG2 3.98Å; Q93-T107 PolarHBondContact NE2-OG1 3.34Å; Q93-T107 PolarHBondContact OE1-OG1 3.47Å; Q93-T107 VanDerWaalsContact OE1-OG1 3.13Å; S103-T107 WeakPolarHBondContact O-CB 3.43Å; S103-T107 PolarHBondContact O-N 3.07Å; S103-T107 PolarHBondContact O-OG1 3.5Å; Q104-T107 PolarHBondContact O-N 3.43Å; I105-T107 PolarHBondContact O-N 3.47Å; T107-I110 PolarHBondContact O-N 2.81Å; T107-I111 PolarHBondContact O-N 2.89Å
108	A	97.3	Very high	91.5	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-65.8	-37.3	175.8	0	0	0	0	0	112.6	Q104 I105 L106 I110 I111 L112 F141 K142	Q104-A108 PolarHBondContact O-N 3.46Å; I105-A108 PolarHBondContact O-N 3.39Å; L106-A108 VanDerWaalsContact C-N 3.33Å; L106-A108 PolarHBondContact O-N 3.17Å; A108-I110 PolarHBondContact O-N 2.94Å; A108-I111 WeakPolarHBondContact O-CB 3.27Å; A108-I111 PolarHBondContact O-N 3.32Å; A108-L112 WeakPolarHBondContact O-CG 3.39Å; A108-L112 PolarHBondContact O-N 3.45Å; A108-F141 HydrophobicContact CB-CB 3.83Å; A108-K142 HydrophobicContact CB-CB 3.7Å
109	Q	97.3	Very high	92.9	Very high	55 Å²	55	53.7 Å²	53.7	26%	0.257	28%	0.282	S	S	.	.	H	α-helix	trans	-63.7	-41.1	177.7	-170.1	61.2	50.7	0	0	111.8	I105 L106 I111 L112 D113	I105-Q109 WeakPolarHBondContact O-CB 3.39Å; I105-Q109 PolarHBondContact O-N 3.19Å; L106-Q109 PolarHBondContact O-N 3.3Å; Q109-I111 VanDerWaalsContact C-N 3.29Å; Q109-I111 PolarHBondContact O-N 2.89Å; Q109-L112 WeakPolarHBondContact O-CB 3.37Å; Q109-L112 PolarHBondContact O-N 3.22Å; Q109-L112 VanDerWaalsContact O-N 3.14Å; Q109-D113 PolarHBondContact NE2-OD1 2.94Å; Q109-D113 VanDerWaalsContact O-CG 3.24Å; Q109-D113 PolarHBondContact O-N 3.18Å
110	I	97.6	Very high	93.6	Very high	80 Å²	80	55.8 Å²	55.8	41%	0.41	29%	0.291	S	S	.	.	H	α-helix	trans	-59.6	-41.6	175.5	-66.9	163.1	0	0	0	111.1	M86 L106 T107 A108 Y114	M86-I110 HydrophobicContact CE-CB 4.16Å; M86-I110 HydrophobicContact CE-CD1 4Å; M86-I110 HydrophobicContact CE-CG2 4Å; L106-I110 HydrophobicContact CG-CD1 4.33Å; L106-I110 WeakPolarHBondContact O-CG1 3.4Å; L106-I110 PolarHBondContact O-N 3.37Å; T107-I110 PolarHBondContact O-N 2.81Å; A108-I110 PolarHBondContact O-N 2.94Å; I110-Y114 WeakPolarHBondContact O-CB 3.32Å; I110-Y114 PolarHBondContact O-N 3.37Å; I110-Y114 VanDerWaalsContact O-N 3.16Å
111	I	98.1	Very high	93.8	Very high	2 Å²	2	56.5 Å²	56.5	1%	0.01	29%	0.293	C	S	.	.	H	α-helix	trans	-63.2	-44.7	176.6	-66	159.6	0	0	0	110.3	M86 L87 A90 T107 A108 Q109 S115 V134 F141	M86-I111 HydrophobicContact CB-CD1 4.41Å; M86-I111 HydrophobicContact CB-CG1 4.01Å; L87-I111 HydrophobicContact CD2-CD1 3.92Å; L87-I111 HydrophobicContact CD2-CG1 4.42Å; L87-I111 HydrophobicContact CD2-CG2 3.84Å; L87-I111 HydrophobicContact CG-CD1 4.37Å; A90-I111 HydrophobicContact CB-CD1 3.84Å; T107-I111 PolarHBondContact O-N 2.89Å; A108-I111 WeakPolarHBondContact O-CB 3.27Å; A108-I111 PolarHBondContact O-N 3.32Å; Q109-I111 VanDerWaalsContact C-N 3.29Å; Q109-I111 PolarHBondContact O-N 2.89Å; I111-S115 WeakPolarHBondContact O-CB 3.48Å; I111-S115 PolarHBondContact O-N 3.07Å; I111-S115 PolarHBondContact O-OG 3.19Å; I111-V134 HydrophobicContact CG2-CG1 3.81Å; I111-F141 HydrophobicContact CD1-CD2 4.34Å
112	L	97.9	Very high	93.9	Very high	12 Å²	12	57.7 Å²	57.7	6%	0.063	31%	0.309	C	S	.	.	H	α-helix	trans	-63.7	-46.4	179.2	-74.1	173.1	0	0	0	112.4	A108 Q109 Y114 S115 W116 Y135 K142	A108-L112 WeakPolarHBondContact O-CG 3.39Å; A108-L112 PolarHBondContact O-N 3.45Å; Q109-L112 WeakPolarHBondContact O-CB 3.37Å; Q109-L112 PolarHBondContact O-N 3.22Å; Q109-L112 VanDerWaalsContact O-N 3.14Å; L112-Y114 PolarHBondContact O-N 3.33Å; L112-S115 PolarHBondContact O-N 3.21Å; L112-S115 PolarHBondContact O-OG 3.41Å; L112-W116 WeakPolarHBondContact O-CB 3.43Å; L112-W116 PolarHBondContact O-N 2.69Å; L112-Y135 HydrophobicContact CD2-CD2 4.02Å; L112-Y135 HydrophobicContact CD2-CE2 3.85Å; L112-Y135 HydrophobicContact CD2-CG 4.42Å; L112-K142 HydrophobicContact CD1-CB 4.18Å; L112-K142 HydrophobicContact CD1-CD 3.57Å
113	D	96.4	Very high	93.7	Very high	92 Å²	92	57.1 Å²	57.1	49%	0.492	30%	0.302	S	S	.	.	H	α-helix	trans	-62.8	-45.2	-178.8	-65.9	-20.4	0	0	0	111	Q109 W116 E117	Q109-D113 PolarHBondContact NE2-OD1 2.94Å; Q109-D113 VanDerWaalsContact O-CG 3.24Å; Q109-D113 PolarHBondContact O-N 3.18Å; D113-W116 PolarHBondContact O-N 3.37Å; D113-E117 PolarHBondContact O-N 3Å; D113-E117 VanDerWaalsContact O-N 3.16Å
114	Y	96.3	Very high	93.4	Very high	74 Å²	74	61 Å²	61	29%	0.29	31%	0.31	S	S	.	.	H	α-helix	trans	-66.7	-45.4	179.3	-164.9	-80.8	0	0	0	111.9	V83 I110 L112 E117 R118 W131	V83-Y114 HydrophobicContact CG2-CD1 3.54Å; V83-Y114 HydrophobicContact CG2-CD2 4.5Å; V83-Y114 HydrophobicContact CG2-CE1 3.63Å; V83-Y114 HydrophobicContact CG2-CG 4Å; I110-Y114 WeakPolarHBondContact O-CB 3.32Å; I110-Y114 PolarHBondContact O-N 3.37Å; I110-Y114 VanDerWaalsContact O-N 3.16Å; L112-Y114 PolarHBondContact O-N 3.33Å; Y114-E117 PolarHBondContact O-N 3Å; Y114-R118 HydrophobicContact CD1-CG 4.16Å; Y114-R118 HydrophobicContact CE1-CG 4Å; Y114-R118 WeakPolarHBondContact O-CG 3.42Å; Y114-R118 PolarHBondContact O-N 3.02Å; Y114-R118 PolarHBondContact OH-NH2 2.84Å; Y114-W131 AromaticContact CD1-CH2 3.78Å; Y114-W131 HydrophobicContact CD1-CH2 3.78Å; Y114-W131 AromaticContact CD1-CZ3 3.67Å; Y114-W131 HydrophobicContact CD1-CZ3 3.67Å; Y114-W131 AromaticContact CE1-CH2 3.4Å; Y114-W131 HydrophobicContact CE1-CH2 3.4Å; Y114-W131 HydrophobicContact CE1-CZ2 4.26Å; Y114-W131 AromaticContact CE1-CZ3 3.8Å; Y114-W131 HydrophobicContact CE1-CZ3 3.8Å
115	S	96.5	Very high	93	Very high	0 Å²	0	69.6 Å²	69.6	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-68.5	-36.4	178.9	52	0	0	0	0	111.8	I111 L112 E117 R118 L119 Y135	I111-S115 WeakPolarHBondContact O-CB 3.48Å; I111-S115 PolarHBondContact O-N 3.07Å; I111-S115 PolarHBondContact O-OG 3.19Å; L112-S115 PolarHBondContact O-N 3.21Å; L112-S115 PolarHBondContact O-OG 3.41Å; S115-E117 PolarHBondContact O-N 2.69Å; S115-R118 WeakPolarHBondContact O-CB 3.37Å; S115-R118 PolarHBondContact O-N 3.5Å; S115-R118 VanDerWaalsContact O-N 3.1Å; S115-L119 VanDerWaalsContact O-CG 3.31Å; S115-L119 WeakPolarHBondContact O-CG 3.39Å; S115-L119 PolarHBondContact O-N 2.97Å; S115-Y135 WeakPolarHBondContact OG-CD2 3.32Å
116	W	94.3	Very high	92.7	Very high	112 Å²	112	73 Å²	73	42%	0.424	36%	0.357	S	S	.	.	H	α-helix	trans	-55.1	-48.7	172.8	176.5	-87.1	0	0	0	112.2	L112 D113 R118 L119 N120 Y135 M165 M169	L112-W116 WeakPolarHBondContact O-CB 3.43Å; L112-W116 PolarHBondContact O-N 2.69Å; D113-W116 PolarHBondContact O-N 3.37Å; W116-R118 PolarHBondContact O-N 3.36Å; W116-L119 PolarHBondContact O-N 3.35Å; W116-N120 PolarHBondContact NE1-ND2 3.29Å; W116-N120 PolarHBondContact O-N 3.12Å; W116-N120 PolarHBondContact O-ND2 3.33Å; W116-Y135 HydrophobicContact CB-CE2 4.22Å; W116-Y135 AromaticContact CE3-CE2 3.98Å; W116-Y135 HydrophobicContact CE3-CE2 3.98Å; W116-M165 HydrophobicContact CH2-CE 4.41Å; W116-M165 HydrophobicContact CZ3-CE 3.76Å; W116-M169 HydrophobicContact CE3-CE 3.82Å; W116-M169 HydrophobicContact CE3-SD 3.85Å; W116-M169 HydrophobicContact CH2-CE 3.99Å; W116-M169 HydrophobicContact CH2-SD 3.88Å; W116-M169 HydrophobicContact CZ3-CE 3.53Å; W116-M169 HydrophobicContact CZ3-SD 3.19Å; W116-M169 WeakPolarHBondContact CZ3-SD 3.2Å
117	E	93.3	Very high	92.4	Very high	126 Å²	126	68.8 Å²	68.8	59%	0.589	34%	0.336	S	S	*	.	H	α-helix	trans	-57.7	-41.3	177.1	-171.9	-178.8	177.1	0	0	111	D113 Y114 S115 N120 T121	D113-E117 PolarHBondContact O-N 3Å; D113-E117 VanDerWaalsContact O-N 3.16Å; Y114-E117 PolarHBondContact O-N 3Å; S115-E117 PolarHBondContact O-N 2.69Å; E117-N120 CarbonylContact O-C 3.55Å; E117-N120 PolarHBondContact O-N 3.11Å; E117-T121 PolarHBondContact O-N 2.94Å; E117-T121 VanDerWaalsContact O-N 3.16Å; E117-T121 PolarHBondContact O-OG1 3.24Å
118	R	93.9	Very high	92.2	Very high	106 Å²	106	70.7 Å²	70.7	40%	0.4	35%	0.346	S	S	.	.	H	α-helix	trans	-66.7	-40.7	177	-63.7	-62.2	-177.1	178.5	1.6	113.2	Y114 S115 W116 N120 T121 W131	Y114-R118 HydrophobicContact CD1-CG 4.16Å; Y114-R118 HydrophobicContact CE1-CG 4Å; Y114-R118 WeakPolarHBondContact O-CG 3.42Å; Y114-R118 PolarHBondContact O-N 3.02Å; Y114-R118 PolarHBondContact OH-NH2 2.84Å; S115-R118 WeakPolarHBondContact O-CB 3.37Å; S115-R118 PolarHBondContact O-N 3.5Å; S115-R118 VanDerWaalsContact O-N 3.1Å; W116-R118 PolarHBondContact O-N 3.36Å; R118-N120 VanDerWaalsContact C-N 3.26Å; R118-N120 PolarHBondContact O-N 3.06Å; R118-T121 PolarHBondContact O-N 3.01Å; R118-W131 HydrophobicContact CB-CB 4.48Å; R118-W131 HydrophobicContact CB-CD2 3.78Å; R118-W131 HydrophobicContact CB-CE3 3.9Å; R118-W131 HydrophobicContact CB-CG 4.03Å; R118-W131 HydrophobicContact CG-CD2 3.82Å; R118-W131 HydrophobicContact CG-CE3 3.77Å; R118-W131 HydrophobicContact CG-CH2 4.05Å; R118-W131 HydrophobicContact CG-CZ2 4.04Å; R118-W131 HydrophobicContact CG-CZ3 3.89Å
119	L	93.1	Very high	92	Very high	2 Å²	2	77.8 Å²	77.8	1%	0.01	38%	0.377	C	S	.	.	H	α-helix	trans	-66.6	-29.7	177.2	-63.8	-172.7	0	0	0	112.3	S115 W116 W124 V127 W131 R132 Y135 M169	S115-L119 VanDerWaalsContact O-CG 3.31Å; S115-L119 WeakPolarHBondContact O-CG 3.39Å; S115-L119 PolarHBondContact O-N 2.97Å; W116-L119 PolarHBondContact O-N 3.35Å; L119-W124 HydrophobicContact CB-CZ3 4.3Å; L119-V127 HydrophobicContact CD2-CG1 3.36Å; L119-V127 WeakPolarHBondContact O-CG2 3.4Å; L119-W131 HydrophobicContact CD2-CB 4.11Å; L119-R132 HydrophobicContact CD2-CB 4.46Å; L119-R132 HydrophobicContact CD2-CG 3.68Å; L119-Y135 HydrophobicContact CD1-CD1 4.2Å; L119-Y135 HydrophobicContact CD1-CD2 3.81Å; L119-Y135 HydrophobicContact CD1-CE2 4.47Å; L119-Y135 HydrophobicContact CD1-CG 3.67Å; L119-M169 HydrophobicContact CB-CE 4.49Å; L119-M169 HydrophobicContact CD1-CB 4.07Å; L119-M169 HydrophobicContact CD1-CE 4.24Å
120	N	89.9	Confident	92	Very high	85 Å²	85	76.9 Å²	76.9	46%	0.455	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	12.4	-177.9	-68	-83.6	0	0	0	113.4	W116 E117 R118	W116-N120 PolarHBondContact NE1-ND2 3.29Å; W116-N120 PolarHBondContact O-N 3.12Å; W116-N120 PolarHBondContact O-ND2 3.33Å; E117-N120 CarbonylContact O-C 3.55Å; E117-N120 PolarHBondContact O-N 3.11Å; R118-N120 VanDerWaalsContact C-N 3.26Å; R118-N120 PolarHBondContact O-N 3.06Å
121	T	87.5	Confident	91.9	Very high	89 Å²	89	74.3 Å²	74.3	55%	0.546	36%	0.358	S	S	.	.	S	Bend	trans	-93.4	106	173.6	-60.9	0	0	0	0	110.2	E117 R118	E117-T121 PolarHBondContact O-N 2.94Å; E117-T121 VanDerWaalsContact O-N 3.16Å; E117-T121 PolarHBondContact O-OG1 3.24Å; R118-T121 PolarHBondContact O-N 3.01Å
122	G	84.6	Confident	91.8	Very high	69 Å²	69	77.9 Å²	77.9	71%	0.711	37%	0.371	S	S	*	.	S	Bend	trans	84.5	-157.1	176.8	0	0	0	0	0	113.8
123	T	84	Confident	91.8	Very high	80 Å²	80	80 Å²	80	49%	0.491	38%	0.378	S	S	.	.			trans	-81.1	134.6	-177.1	-43.4	0	0	0	0	111.6	R125 H126	T123-R125 HydrophobicContact CG2-CG 3.86Å; T123-R125 PolarHBondContact O-N 3.37Å; T123-R125 VanDerWaalsContact O-N 3.08Å; T123-H126 PolarHBondContact O-N 2.93Å
124	W	85	Confident	91.9	Very high	119 Å²	119	75.6 Å²	75.6	45%	0.451	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-49.1	-38.8	179.8	-175.1	-108.5	0	0	0	114.3	L119 H126 V127 M169	L119-W124 HydrophobicContact CB-CZ3 4.3Å; W124-H126 PolarHBondContact O-N 3.11Å; W124-V127 HydrophobicContact CD2-CG2 4.48Å; W124-V127 HydrophobicContact CE3-CG2 3.98Å; W124-V127 VanDerWaalsContact O-CB 3.27Å; W124-V127 WeakPolarHBondContact O-CB 3.43Å; W124-V127 WeakPolarHBondContact O-CG2 3.3Å; W124-V127 PolarHBondContact O-N 3.35Å; W124-M169 HydrophobicContact CH2-CB 4.42Å; W124-M169 WeakPolarHBondContact CH2-O 3.4Å
125	R	84.3	Confident	92	Very high	191 Å²	191	72.8 Å²	72.8	72%	0.721	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-59.7	-20.4	178.8	77.6	-175.9	-172.2	-171.4	-2	114.7	T123	T123-R125 HydrophobicContact CG2-CG 3.86Å; T123-R125 PolarHBondContact O-N 3.37Å; T123-R125 VanDerWaalsContact O-N 3.08Å
126	H	87.1	Confident	92.1	Very high	125 Å²	125	72.9 Å²	72.9	58%	0.579	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-100.5	-0.1	179	-53	134	0	0	0	112.7	T123 W124 D128	T123-H126 PolarHBondContact O-N 2.93Å; W124-H126 PolarHBondContact O-N 3.11Å; H126-D128 PolarHBondContact O-N 3.35Å
127	V	89.9	Confident	92.3	Very high	21 Å²	21	67.7 Å²	67.7	13%	0.127	33%	0.325	C	S	.	.			trans	-68.9	120.2	179.7	174.7	0	0	0	0	109.1	L119 W124 R132	L119-V127 HydrophobicContact CD2-CG1 3.36Å; L119-V127 WeakPolarHBondContact O-CG2 3.4Å; W124-V127 HydrophobicContact CD2-CG2 4.48Å; W124-V127 HydrophobicContact CE3-CG2 3.98Å; W124-V127 VanDerWaalsContact O-CB 3.27Å; W124-V127 WeakPolarHBondContact O-CB 3.43Å; W124-V127 WeakPolarHBondContact O-CG2 3.3Å; W124-V127 PolarHBondContact O-N 3.35Å; V127-R132 HydrophobicContact CG1-CG 3.91Å
128	D	92.3	Very high	92.5	Very high	44 Å²	44	61.7 Å²	61.7	24%	0.235	30%	0.297	C	S	.	.			trans	-68.1	136.8	-176.5	-163.7	-77.8	0	0	0	111.8	K78 H126 E130 W131 R132	K78-D128 VanDerWaalsContact CD-OD2 3.26Å; K78-D128 WeakPolarHBondContact CD-OD2 3.43Å; K78-D128 WeakPolarHBondContact CE-OD2 3.45Å; K78-D128 IonicContact NZ-OD2 2.71Å; K78-D128 PolarHBondContact NZ-OD2 3.3Å; H126-D128 PolarHBondContact O-N 3.35Å; D128-E130 PolarHBondContact O-N 3.28Å; D128-E130 WeakPolarHBondContact OD1-CB 3.07Å; D128-E130 PolarHBondContact OD1-N 3.39Å; D128-W131 PolarHBondContact O-N 3.35Å; D128-W131 VanDerWaalsContact O-N 3.08Å; D128-R132 PolarHBondContact O-N 2.84Å
129	K	93.6	Very high	92.7	Very high	150 Å²	150	56.7 Å²	56.7	65%	0.652	28%	0.278	S	S	*	.	H	α-helix	trans	-58.6	-30	179.6	-172.3	174.9	-179.2	175.8	0	112.3	R132 R133 A171	K129-R132 WeakPolarHBondContact O-CB 3.31Å; K129-R132 PolarHBondContact O-N 3.32Å; K129-R133 WeakPolarHBondContact O-CG 3.34Å; K129-R133 PolarHBondContact O-N 3.32Å; K129-A171 HydrophobicContact CG-CB 4.28Å
130	E	95.6	Very high	93	Very high	36 Å²	36	56.6 Å²	56.6	17%	0.168	28%	0.277	C	S	.	.	H	α-helix	trans	-66.4	-40.9	176.4	-65.9	-157.3	158.1	0	0	112.2	F75 S76 V79 D128 R132 R133 V134	F75-E130 HydrophobicContact CD1-CB 4.2Å; S76-E130 PolarHBondContact N-OE1 2.92Å; S76-E130 VanDerWaalsContact N-OE1 3.09Å; S76-E130 PolarHBondContact N-OE2 3.34Å; V79-E130 HydrophobicContact CG2-CB 3.78Å; D128-E130 PolarHBondContact O-N 3.28Å; D128-E130 WeakPolarHBondContact OD1-CB 3.07Å; D128-E130 PolarHBondContact OD1-N 3.39Å; E130-R132 VanDerWaalsContact C-N 3.29Å; E130-R132 PolarHBondContact O-N 3.11Å; E130-R133 WeakPolarHBondContact O-CB 3.23Å; E130-R133 PolarHBondContact O-N 3.3Å; E130-R133 VanDerWaalsContact O-N 3.11Å; E130-V134 WeakPolarHBondContact O-CG2 3.42Å; E130-V134 PolarHBondContact O-N 2.89Å
131	W	96.6	Very high	93.4	Very high	25 Å²	25	53 Å²	53	10%	0.095	26%	0.257	C	S	.	.	H	α-helix	trans	-64.9	-35.2	174.5	-77.9	110.7	0	0	0	112.2	K78 V79 V83 Y114 R118 L119 D128 V134 Y135	K78-W131 PolarHBondContact O-NE1 2.87Å; V79-W131 HydrophobicContact CB-CZ2 4.41Å; V79-W131 HydrophobicContact CG1-CH2 3.9Å; V79-W131 HydrophobicContact CG1-CZ2 4.26Å; V79-W131 HydrophobicContact CG1-CZ3 4.17Å; V79-W131 HydrophobicContact CG2-CD2 4.48Å; V83-W131 HydrophobicContact CB-CH2 4.46Å; V83-W131 HydrophobicContact CG1-CZ3 4.17Å; V83-W131 HydrophobicContact CG2-CH2 4.1Å; V83-W131 HydrophobicContact CG2-CZ3 4.35Å; Y114-W131 AromaticContact CD1-CH2 3.78Å; Y114-W131 HydrophobicContact CD1-CH2 3.78Å; Y114-W131 AromaticContact CD1-CZ3 3.67Å; Y114-W131 HydrophobicContact CD1-CZ3 3.67Å; Y114-W131 AromaticContact CE1-CH2 3.4Å; Y114-W131 HydrophobicContact CE1-CH2 3.4Å; Y114-W131 HydrophobicContact CE1-CZ2 4.26Å; Y114-W131 AromaticContact CE1-CZ3 3.8Å; Y114-W131 HydrophobicContact CE1-CZ3 3.8Å; R118-W131 HydrophobicContact CB-CB 4.48Å; R118-W131 HydrophobicContact CB-CD2 3.78Å; R118-W131 HydrophobicContact CB-CE3 3.9Å; R118-W131 HydrophobicContact CB-CG 4.03Å; R118-W131 HydrophobicContact CG-CD2 3.82Å; R118-W131 HydrophobicContact CG-CE3 3.77Å; R118-W131 HydrophobicContact CG-CH2 4.05Å; R118-W131 HydrophobicContact CG-CZ2 4.04Å; R118-W131 HydrophobicContact CG-CZ3 3.89Å; L119-W131 HydrophobicContact CD2-CB 4.11Å; D128-W131 PolarHBondContact O-N 3.35Å; D128-W131 VanDerWaalsContact O-N 3.08Å; W131-V134 HydrophobicContact CE3-CB 4.26Å; W131-V134 HydrophobicContact CE3-CG1 4.39Å; W131-V134 HydrophobicContact CE3-CG2 4.22Å; W131-V134 HydrophobicContact CZ3-CG1 4.35Å; W131-V134 HydrophobicContact CZ3-CG2 4.47Å; W131-V134 WeakPolarHBondContact O-CB 3.27Å; W131-V134 PolarHBondContact O-N 2.93Å; W131-Y135 PolarHBondContact O-N 3.35Å
132	R	96.8	Very high	93.8	Very high	77 Å²	77	50.2 Å²	50.2	29%	0.291	24%	0.238	S	C	.	.	H	α-helix	trans	-63.8	-38.9	171.3	-67	-179.8	63.3	-179.5	-0.6	112.1	L119 V127 D128 K129 E130 Y135 S136 M169 G170 A171	L119-R132 HydrophobicContact CD2-CB 4.46Å; L119-R132 HydrophobicContact CD2-CG 3.68Å; V127-R132 HydrophobicContact CG1-CG 3.91Å; D128-R132 PolarHBondContact O-N 2.84Å; K129-R132 WeakPolarHBondContact O-CB 3.31Å; K129-R132 PolarHBondContact O-N 3.32Å; E130-R132 VanDerWaalsContact C-N 3.29Å; E130-R132 PolarHBondContact O-N 3.11Å; R132-Y135 PolarHBondContact O-N 2.98Å; R132-S136 PolarHBondContact O-N 3.32Å; R132-S136 VanDerWaalsContact O-N 3.1Å; R132-S136 PolarHBondContact O-OG 3.3Å; R132-M169 PolarHBondContact NE-O 2.74Å; R132-G170 PolarHBondContact NE-O 2.79Å; R132-G170 PolarHBondContact NH2-O 3.26Å; R132-G170 VanDerWaalsContact O-CA 3.26Å; R132-G170 WeakPolarHBondContact O-CA 3.5Å; R132-A171 HydrophobicContact CB-CB 3.74Å; R132-A171 PolarHBondContact O-N 2.94Å
133	R	97.3	Very high	94.4	Very high	57 Å²	57	46.9 Å²	46.9	22%	0.215	20%	0.204	C	C	.	.	H	α-helix	trans	-65.1	-42.3	172.7	-70.8	174.3	66.7	-144.5	-3.5	111.8	Q74 F75 K129 E130 Y135 S136 Y137 A171 I173	Q74-R133 PolarHBondContact O-NH1 2.88Å; Q74-R133 PolarHBondContact O-NH2 3.36Å; F75-R133 HydrophobicContact CE1-CB 3.96Å; F75-R133 HydrophobicContact CZ-CB 4.49Å; K129-R133 WeakPolarHBondContact O-CG 3.34Å; K129-R133 PolarHBondContact O-N 3.32Å; E130-R133 WeakPolarHBondContact O-CB 3.23Å; E130-R133 PolarHBondContact O-N 3.3Å; E130-R133 VanDerWaalsContact O-N 3.11Å; R133-Y135 VanDerWaalsContact C-N 3.29Å; R133-Y135 PolarHBondContact O-N 3.31Å; R133-S136 WeakPolarHBondContact O-CB 3.19Å; R133-S136 PolarHBondContact O-N 3.46Å; R133-Y137 WeakPolarHBondContact O-CD2 3.33Å; R133-Y137 PolarHBondContact O-N 3.18Å; R133-A171 HydrophobicContact CG-CB 3.87Å; R133-I173 HydrophobicContact CB-CG2 4.37Å; R133-I173 HydrophobicContact CG-CG2 4.3Å
134	V	98.1	Very high	95	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-56	-46.8	175.2	174.9	0	0	0	0	110.4	F75 V79 V83 L87 I111 E130 W131 S136 Y137 G138	F75-V134 HydrophobicContact CD1-CG2 4.09Å; F75-V134 HydrophobicContact CE1-CG2 3.55Å; F75-V134 HydrophobicContact CZ-CG2 3.97Å; V79-V134 HydrophobicContact CG1-CG2 3.79Å; V79-V134 HydrophobicContact CG2-CG2 3.92Å; V83-V134 HydrophobicContact CG1-CG1 3.78Å; L87-V134 HydrophobicContact CD1-CG1 4.29Å; L87-V134 HydrophobicContact CD1-CG2 4.17Å; I111-V134 HydrophobicContact CG2-CG1 3.81Å; E130-V134 WeakPolarHBondContact O-CG2 3.42Å; E130-V134 PolarHBondContact O-N 2.89Å; W131-V134 HydrophobicContact CE3-CB 4.26Å; W131-V134 HydrophobicContact CE3-CG1 4.39Å; W131-V134 HydrophobicContact CE3-CG2 4.22Å; W131-V134 HydrophobicContact CZ3-CG1 4.35Å; W131-V134 HydrophobicContact CZ3-CG2 4.47Å; W131-V134 WeakPolarHBondContact O-CB 3.27Å; W131-V134 PolarHBondContact O-N 2.93Å; V134-S136 PolarHBondContact O-N 2.86Å; V134-Y137 PolarHBondContact O-N 3.5Å; V134-G138 PolarHBondContact O-N 3.46Å
135	Y	98.3	Very high	95.5	Very high	15 Å²	15	37.6 Å²	37.6	6%	0.059	16%	0.16	C	C	.	.	H	α-helix	trans	-59.5	-46.4	177.6	-167.2	-95.5	0	0	0	111.6	L112 S115 W116 L119 W131 R132 R133 Y137 G138 C139 M165 M169	L112-Y135 HydrophobicContact CD2-CD2 4.02Å; L112-Y135 HydrophobicContact CD2-CE2 3.85Å; L112-Y135 HydrophobicContact CD2-CG 4.42Å; S115-Y135 WeakPolarHBondContact OG-CD2 3.32Å; W116-Y135 HydrophobicContact CB-CE2 4.22Å; W116-Y135 AromaticContact CE3-CE2 3.98Å; W116-Y135 HydrophobicContact CE3-CE2 3.98Å; L119-Y135 HydrophobicContact CD1-CD1 4.2Å; L119-Y135 HydrophobicContact CD1-CD2 3.81Å; L119-Y135 HydrophobicContact CD1-CE2 4.47Å; L119-Y135 HydrophobicContact CD1-CG 3.67Å; W131-Y135 PolarHBondContact O-N 3.35Å; R132-Y135 PolarHBondContact O-N 2.98Å; R133-Y135 VanDerWaalsContact C-N 3.29Å; R133-Y135 PolarHBondContact O-N 3.31Å; Y135-Y137 PolarHBondContact O-N 2.9Å; Y135-G138 PolarHBondContact O-N 2.89Å; Y135-G138 VanDerWaalsContact O-N 3.13Å; Y135-C139 PolarHBondContact O-N 3.02Å; Y135-C139 PolarHBondContact O-SG 3.4Å; Y135-M165 HydrophobicContact CE1-CB 4.25Å; Y135-M165 WeakPolarHBondContact CE1-O 3.45Å; Y135-M169 HydrophobicContact CD1-CB 4.07Å; Y135-M169 HydrophobicContact CE1-CB 3.86Å
136	S	98.3	Very high	95.9	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.007	13%	0.13	C	C	.	.	H	α-helix	trans	-58.6	-41.7	175.5	-57.5	0	0	0	0	113.6	R132 R133 V134 C139 L140 G170 A171	R132-S136 PolarHBondContact O-N 3.32Å; R132-S136 VanDerWaalsContact O-N 3.1Å; R132-S136 PolarHBondContact O-OG 3.3Å; R133-S136 WeakPolarHBondContact O-CB 3.19Å; R133-S136 PolarHBondContact O-N 3.46Å; V134-S136 PolarHBondContact O-N 2.86Å; S136-C139 PolarHBondContact O-N 3.08Å; S136-L140 WeakPolarHBondContact O-CB 3.31Å; S136-L140 PolarHBondContact O-N 2.93Å; S136-G170 WeakPolarHBondContact OG-CA 3.44Å; S136-A171 WeakPolarHBondContact CB-O 3.46Å; S136-A171 PolarHBondContact OG-N 2.95Å; S136-A171 PolarHBondContact OG-O 3.24Å
137	Y	98.4	Very high	96.2	Very high	4 Å²	4	23.4 Å²	23.4	2%	0.016	10%	0.103	C	C	.	.	H	α-helix	trans	-66.4	-39.8	175	-77.4	-70.1	0	0	0	111.7	F71 P72 L73 F75 R133 V134 Y135 C139 L140 F141 I173 M174	F71-Y137 HydrophobicContact CD1-CE1 4.45Å; F71-Y137 AromaticContact CE1-CD1 3.68Å; F71-Y137 HydrophobicContact CE1-CD1 3.68Å; F71-Y137 AromaticContact CE1-CE1 3.48Å; F71-Y137 HydrophobicContact CE1-CE1 3.48Å; F71-Y137 VanDerWaalsContact CE1-CE1 3.48Å; F71-Y137 AromaticContact CZ-CD1 3.85Å; F71-Y137 HydrophobicContact CZ-CD1 3.85Å; F71-Y137 AromaticContact CZ-CE1 3.87Å; F71-Y137 HydrophobicContact CZ-CE1 3.87Å; P72-Y137 WeakPolarHBondContact O-CE1 3.3Å; P72-Y137 PolarHBondContact O-OH 3.43Å; L73-Y137 HydrophobicContact CD2-CD1 3.93Å; L73-Y137 HydrophobicContact CD2-CD2 4.07Å; L73-Y137 HydrophobicContact CD2-CE1 3.96Å; L73-Y137 HydrophobicContact CD2-CE2 4.12Å; L73-Y137 HydrophobicContact CD2-CG 4Å; F75-Y137 HydrophobicContact CE2-CE2 4.44Å; F75-Y137 AromaticContact CZ-CD2 3.78Å; F75-Y137 HydrophobicContact CZ-CD2 3.78Å; F75-Y137 AromaticContact CZ-CE2 3.83Å; F75-Y137 HydrophobicContact CZ-CE2 3.83Å; R133-Y137 WeakPolarHBondContact O-CD2 3.33Å; R133-Y137 PolarHBondContact O-N 3.18Å; V134-Y137 PolarHBondContact O-N 3.5Å; Y135-Y137 PolarHBondContact O-N 2.9Å; Y137-C139 VanDerWaalsContact C-N 3.31Å; Y137-C139 PolarHBondContact O-N 2.91Å; Y137-L140 HydrophobicContact CD1-CD2 4.35Å; Y137-L140 WeakPolarHBondContact O-CB 3.34Å; Y137-L140 PolarHBondContact O-N 3.41Å; Y137-F141 WeakPolarHBondContact O-CD2 3.41Å; Y137-F141 WeakPolarHBondContact O-CG 3.26Å; Y137-F141 PolarHBondContact O-N 3.12Å; Y137-I173 HydrophobicContact CD1-CD1 3.71Å; Y137-I173 HydrophobicContact CD2-CD1 4.46Å; Y137-I173 HydrophobicContact CD2-CG2 4.22Å; Y137-I173 HydrophobicContact CE1-CB 4.47Å; Y137-I173 HydrophobicContact CE1-CD1 3.9Å; Y137-I173 HydrophobicContact CE2-CB 4.48Å; Y137-I173 HydrophobicContact CE2-CG2 3.74Å; Y137-I173 HydrophobicContact CG-CD1 4.01Å; Y137-M174 HydrophobicContact CE1-CE 3.94Å
138	G	98.3	Very high	96.1	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-56.8	-45.2	172.8	0	0	0	0	0	112.1	V134 Y135 F141 K142	V134-G138 PolarHBondContact O-N 3.46Å; Y135-G138 PolarHBondContact O-N 2.89Å; Y135-G138 VanDerWaalsContact O-N 3.13Å; G138-F141 PolarHBondContact O-N 3.34Å; G138-K142 WeakPolarHBondContact O-CB 3.27Å; G138-K142 PolarHBondContact O-N 3.41Å
139	C	98.5	Very high	95.6	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.007	12%	0.116	C	C	.	.	H	α-helix	trans	-61.8	-46.3	175.6	-71.7	0	0	0	0	111.7	Y135 S136 Y137 K142 A143 T162 G166 L178	Y135-C139 PolarHBondContact O-N 3.02Å; Y135-C139 PolarHBondContact O-SG 3.4Å; S136-C139 PolarHBondContact O-N 3.08Å; Y137-C139 VanDerWaalsContact C-N 3.31Å; Y137-C139 PolarHBondContact O-N 2.91Å; C139-K142 PolarHBondContact O-N 2.96Å; C139-A143 WeakPolarHBondContact O-CB 3.44Å; C139-A143 PolarHBondContact O-N 2.87Å; C139-T162 HydrophobicContact CB-CG2 4.02Å; C139-T162 WeakPolarHBondContact CB-O 3.36Å; C139-T162 WeakPolarHBondContact O-CG2 3.44Å; C139-T162 PolarHBondContact SG-O 3.46Å; C139-G166 VanDerWaalsContact SG-CA 3.56Å; C139-L178 HydrophobicContact CB-CD1 4.28Å; C139-L178 HydrophobicContact CB-CD2 4.36Å
140	L	98.4	Very high	95.3	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-57.7	-50.9	177.3	172.6	61.4	0	0	0	111.5	L64 F71 S136 Y137 K142 A143 A144 I173 M174 I177 L178 I181	L64-L140 HydrophobicContact CD2-CD1 4.16Å; F71-L140 HydrophobicContact CE2-CD2 4.09Å; F71-L140 HydrophobicContact CZ-CD2 3.79Å; S136-L140 WeakPolarHBondContact O-CB 3.31Å; S136-L140 PolarHBondContact O-N 2.93Å; Y137-L140 HydrophobicContact CD1-CD2 4.35Å; Y137-L140 WeakPolarHBondContact O-CB 3.34Å; Y137-L140 PolarHBondContact O-N 3.41Å; L140-K142 PolarHBondContact O-N 3.37Å; L140-A143 PolarHBondContact O-N 3.01Å; L140-A144 VanDerWaalsContact O-CB 3.23Å; L140-A144 WeakPolarHBondContact O-CB 3.49Å; L140-A144 PolarHBondContact O-N 3.45Å; L140-I173 HydrophobicContact CB-CD1 4.31Å; L140-I173 HydrophobicContact CD2-CD1 4.03Å; L140-M174 HydrophobicContact CD2-CE 3.23Å; L140-I177 HydrophobicContact CD1-CD1 4.42Å; L140-I177 HydrophobicContact CD1-CG2 4.27Å; L140-I177 HydrophobicContact CD2-CG2 4.18Å; L140-L178 HydrophobicContact CB-CD2 3.88Å; L140-L178 HydrophobicContact CD1-CD2 4.42Å; L140-I181 HydrophobicContact CD1-CD1 3.23Å
141	F	97.9	Very high	95.1	Very high	8 Å²	8	23 Å²	23	4%	0.035	13%	0.127	C	C	.	.	H	α-helix	trans	-63.4	-41.6	-178.8	-68	-49.7	0	0	0	112	F71 L87 A90 R91 L94 A108 I111 Y137 G138 A145	F71-F141 HydrophobicContact CE1-CE1 4.16Å; F71-F141 AromaticContact CE1-CZ 3.8Å; F71-F141 HydrophobicContact CE1-CZ 3.8Å; F71-F141 HydrophobicContact CE2-CE1 4.26Å; F71-F141 AromaticContact CZ-CE1 3.66Å; F71-F141 HydrophobicContact CZ-CE1 3.66Å; F71-F141 AromaticContact CZ-CZ 3.73Å; F71-F141 HydrophobicContact CZ-CZ 3.73Å; L87-F141 HydrophobicContact CD2-CD2 4.43Å; L87-F141 HydrophobicContact CD2-CE2 3.88Å; A90-F141 HydrophobicContact CB-CB 4.35Å; A90-F141 HydrophobicContact CB-CD1 4.16Å; A90-F141 HydrophobicContact CB-CD2 3.51Å; A90-F141 HydrophobicContact CB-CE1 4.34Å; A90-F141 HydrophobicContact CB-CE2 3.71Å; A90-F141 HydrophobicContact CB-CG 3.77Å; A90-F141 HydrophobicContact CB-CZ 4.14Å; R91-F141 HydrophobicContact CB-CE1 4.23Å; R91-F141 HydrophobicContact CB-CZ 4.01Å; L94-F141 HydrophobicContact CB-CD1 4.5Å; L94-F141 HydrophobicContact CB-CE1 4.47Å; L94-F141 HydrophobicContact CD2-CD1 4.14Å; L94-F141 HydrophobicContact CD2-CE1 3.93Å; A108-F141 HydrophobicContact CB-CB 3.83Å; I111-F141 HydrophobicContact CD1-CD2 4.34Å; Y137-F141 WeakPolarHBondContact O-CD2 3.41Å; Y137-F141 WeakPolarHBondContact O-CG 3.26Å; Y137-F141 PolarHBondContact O-N 3.12Å; G138-F141 PolarHBondContact O-N 3.34Å; F141-A145 VanDerWaalsContact O-CB 3.27Å; F141-A145 WeakPolarHBondContact O-CB 3.4Å; F141-A145 PolarHBondContact O-N 2.77Å
142	K	97.6	Very high	94.9	Very high	31 Å²	31	24.4 Å²	24.4	14%	0.135	14%	0.14	C	C	.	.	H	α-helix	trans	-65.8	-47.1	178	-179.3	172.3	178.4	179.4	0	111.5	A108 L112 G138 C139 L140 A144 A145 I146 T162	A108-K142 HydrophobicContact CB-CB 3.7Å; L112-K142 HydrophobicContact CD1-CB 4.18Å; L112-K142 HydrophobicContact CD1-CD 3.57Å; G138-K142 WeakPolarHBondContact O-CB 3.27Å; G138-K142 PolarHBondContact O-N 3.41Å; C139-K142 PolarHBondContact O-N 2.96Å; L140-K142 PolarHBondContact O-N 3.37Å; K142-A144 PolarHBondContact O-N 2.89Å; K142-A145 PolarHBondContact O-N 2.84Å; K142-I146 HydrophobicContact CG-CD1 4.15Å; K142-I146 WeakPolarHBondContact O-CG1 3.48Å; K142-I146 PolarHBondContact O-N 3.26Å; K142-I146 VanDerWaalsContact O-N 3.07Å; K142-T162 HydrophobicContact CB-CG2 3.95Å; K142-T162 HydrophobicContact CD-CG2 3.96Å; K142-T162 HydrophobicContact CG-CG2 4.04Å
143	A	97.2	Very high	94.7	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-61.5	-45	177.7	0	0	0	0	0	111.7	C139 L140 A145 I146 C147 A159 C163	C139-A143 WeakPolarHBondContact O-CB 3.44Å; C139-A143 PolarHBondContact O-N 2.87Å; L140-A143 PolarHBondContact O-N 3.01Å; A143-A145 PolarHBondContact O-N 2.9Å; A143-I146 PolarHBondContact O-N 3.39Å; A143-C147 PolarHBondContact O-N 3.17Å; A143-C147 VanDerWaalsContact O-N 3.1Å; A143-C147 PolarHBondContact O-SG 2.68Å; A143-A159 HydrophobicContact CB-CB 4.33Å; A143-C163 VanDerWaalsContact CB-SG 3.53Å
144	A	95.7	Very high	94.5	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.008	17%	0.169	C	C	.	.	H	α-helix	trans	-61.2	-42.8	176.4	0	0	0	0	0	112.3	W57 L94 L140 K142 I146 C147 R148	W57-A144 HydrophobicContact CZ3-CB 4.02Å; W57-A144 VanDerWaalsContact CZ3-O 3.26Å; W57-A144 WeakPolarHBondContact CZ3-O 3.24Å; L94-A144 HydrophobicContact CD1-CB 3.7Å; L140-A144 VanDerWaalsContact O-CB 3.23Å; L140-A144 WeakPolarHBondContact O-CB 3.49Å; L140-A144 PolarHBondContact O-N 3.45Å; K142-A144 PolarHBondContact O-N 2.89Å; A144-I146 PolarHBondContact O-N 2.88Å; A144-C147 PolarHBondContact O-N 2.83Å; A144-R148 PolarHBondContact O-N 2.96Å
145	A	94.6	Very high	94.4	Very high	2 Å²	2	33.8 Å²	33.8	2%	0.017	19%	0.19	C	C	.	.	H	α-helix	trans	-63.2	-41.1	178.6	0	0	0	0	0	112.7	Q104 I105 F141 K142 A143 C147 R148	Q104-A145 HydrophobicContact CB-CB 3.56Å; I105-A145 HydrophobicContact CG1-CB 3.73Å; F141-A145 VanDerWaalsContact O-CB 3.27Å; F141-A145 WeakPolarHBondContact O-CB 3.4Å; F141-A145 PolarHBondContact O-N 2.77Å; K142-A145 PolarHBondContact O-N 2.84Å; A143-A145 PolarHBondContact O-N 2.9Å; A145-C147 VanDerWaalsContact C-N 3.3Å; A145-C147 PolarHBondContact O-N 2.85Å; A145-R148 PolarHBondContact O-N 2.98Å
146	I	94.2	Very high	94.3	Very high	18 Å²	18	33.3 Å²	33.3	9%	0.092	19%	0.188	C	C	.	.	H	α-helix	trans	-60.2	-43.1	173.6	-67.5	164.8	0	0	0	110.4	I105 K142 A143 A144 R148 P151 E155 Q158 A159	I105-I146 HydrophobicContact CD1-CG1 4.06Å; I105-I146 HydrophobicContact CG1-CG1 4.36Å; K142-I146 HydrophobicContact CG-CD1 4.15Å; K142-I146 WeakPolarHBondContact O-CG1 3.48Å; K142-I146 PolarHBondContact O-N 3.26Å; K142-I146 VanDerWaalsContact O-N 3.07Å; A143-I146 PolarHBondContact O-N 3.39Å; A144-I146 PolarHBondContact O-N 2.88Å; I146-R148 VanDerWaalsContact C-N 3.27Å; I146-R148 PolarHBondContact O-N 3.14Å; I146-P151 HydrophobicContact CG2-CB 4.34Å; I146-E155 HydrophobicContact CG2-CB 3.85Å; I146-E155 WeakPolarHBondContact CG2-O 3.15Å; I146-Q158 HydrophobicContact CD1-CG 4.37Å; I146-A159 HydrophobicContact CB-CB 4.32Å; I146-A159 HydrophobicContact CD1-CB 4.19Å; I146-A159 HydrophobicContact CG2-CB 4.12Å
147	C	93.1	Very high	94.2	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-4.7	-175.7	-60.7	0	0	0	0	114.8	L56 W57 I60 A143 A144 A145 L185	L56-C147 HydrophobicContact CD2-CB 4.14Å; L56-C147 HydrophobicContact CG-CB 4.26Å; W57-C147 WeakPolarHBondContact CB-O 3.32Å; W57-C147 PolarHBondContact N-O 3.37Å; I60-C147 HydrophobicContact CG1-CB 4.16Å; A143-C147 PolarHBondContact O-N 3.17Å; A143-C147 VanDerWaalsContact O-N 3.1Å; A143-C147 PolarHBondContact O-SG 2.68Å; A144-C147 PolarHBondContact O-N 2.83Å; A145-C147 VanDerWaalsContact C-N 3.3Å; A145-C147 PolarHBondContact O-N 2.85Å; C147-L185 WeakPolarHBondContact SG-CD2 3.33Å
148	R	87.9	Confident	94	Very high	48 Å²	48	39.5 Å²	39.5	18%	0.181	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-28	-173.4	-160.8	-179.4	-170.4	107.8	4.1	113.4	W57 Q93 L94 G96 D97 Q104 A144 A145 I146	W57-R148 HydrophobicContact CD2-CB 4.2Å; W57-R148 HydrophobicContact CD2-CG 3.88Å; W57-R148 HydrophobicContact CE3-CB 3.98Å; W57-R148 HydrophobicContact CE3-CG 4.1Å; W57-R148 HydrophobicContact CG-CG 4.35Å; W57-R148 HydrophobicContact CH2-CG 4.45Å; W57-R148 HydrophobicContact CZ2-CG 4.23Å; W57-R148 HydrophobicContact CZ3-CB 4.31Å; W57-R148 HydrophobicContact CZ3-CG 4.38Å; Q93-R148 PolarHBondContact O-NH1 3.47Å; L94-R148 PolarHBondContact O-NH1 3.29Å; L94-R148 PolarHBondContact O-NH2 3.34Å; G96-R148 PolarHBondContact O-NH2 3.44Å; D97-R148 IonicContact OD1-NH2 2.82Å; Q104-R148 VanDerWaalsContact OE1-CD 3.31Å; A144-R148 PolarHBondContact O-N 2.96Å; A145-R148 PolarHBondContact O-N 2.98Å; I146-R148 VanDerWaalsContact C-N 3.27Å; I146-R148 PolarHBondContact O-N 3.14Å
149	G	81.9	Confident	94	Very high	45 Å²	45	39.5 Å²	39.5	46%	0.464	22%	0.219	S	C	.	.	S	Bend	trans	-95	-144.4	178.1	0	0	0	0	0	113	P151	G149-P151 VanDerWaalsContact O-CD 3.27Å; G149-P151 WeakPolarHBondContact O-CD 3.33Å
150	S	86.1	Confident	94	Very high	126 Å²	126	39.4 Å²	39.4	88%	0.881	22%	0.219	S	C	*	.			trans	-109	82.4	167.6	-59.2	0	0	0	0	107.9
151	P	91.1	Very high	93.9	Very high	24 Å²	24	44.9 Å²	44.9	16%	0.156	24%	0.239	C	C	.	.			trans	-68.9	148.6	-173.8	28.4	-34.5	0	0	0	111.6	L56 I146 G149 E155 I156	L56-P151 HydrophobicContact CD2-CG 3.71Å; I146-P151 HydrophobicContact CG2-CB 4.34Å; G149-P151 VanDerWaalsContact O-CD 3.27Å; G149-P151 WeakPolarHBondContact O-CD 3.33Å; P151-E155 WeakPolarHBondContact CA-OE2 3.23Å; P151-E155 HydrophobicContact CB-CB 3.75Å; P151-I156 HydrophobicContact CB-CG1 4.11Å; P151-I156 HydrophobicContact CG-CD1 4.28Å; P151-I156 HydrophobicContact CG-CG1 3.82Å
152	S	93.1	Very high	93.9	Very high	55 Å²	55	44.9 Å²	44.9	39%	0.385	24%	0.24	S	C	.	.			trans	-68.4	167.5	166.6	75.7	0	0	0	0	111.3	E154 E155 I156	S152-E154 VanDerWaalsContact C-N 3.29Å; S152-E154 PolarHBondContact O-N 3.13Å; S152-E154 PolarHBondContact OG-N 3.48Å; S152-E155 PolarHBondContact N-OE2 3.27Å; S152-E155 WeakPolarHBondContact O-CB 3.28Å; S152-E155 PolarHBondContact O-N 3.29Å; S152-E155 WeakPolarHBondContact OG-CG 3.16Å; S152-E155 PolarHBondContact OG-N 2.8Å; S152-I156 WeakPolarHBondContact O-CG1 3.15Å; S152-I156 PolarHBondContact O-N 2.88Å
153	E	92.9	Very high	93.9	Very high	83 Å²	83	43.4 Å²	43.4	39%	0.388	23%	0.233	S	C	.	.	H	α-helix	trans	-57.2	-43.2	173.5	-168.2	-171.1	159.3	0	0	112.1	E155 I156 L157 I189 L192	E153-E155 VanDerWaalsContact C-N 3.3Å; E153-E155 PolarHBondContact O-N 3.04Å; E153-I156 PolarHBondContact O-N 3.22Å; E153-I156 VanDerWaalsContact O-N 3.14Å; E153-L157 WeakPolarHBondContact O-CG 3.43Å; E153-L157 PolarHBondContact O-N 2.82Å; E153-I189 HydrophobicContact CG-CD1 3.52Å; E153-L192 HydrophobicContact CB-CD1 4.47Å; E153-L192 HydrophobicContact CG-CD1 4.44Å
154	E	93.9	Very high	94	Very high	156 Å²	156	43.4 Å²	43.4	73%	0.729	23%	0.233	S	C	*	.	H	α-helix	trans	-61	-39.6	177.4	-173	177.5	-173.6	0	0	111.8	S152 L157 Q158	S152-E154 VanDerWaalsContact C-N 3.29Å; S152-E154 PolarHBondContact O-N 3.13Å; S152-E154 PolarHBondContact OG-N 3.48Å; E154-L157 PolarHBondContact O-N 3.02Å; E154-Q158 WeakPolarHBondContact O-CB 3.4Å; E154-Q158 PolarHBondContact O-N 3.07Å
155	E	94.9	Very high	94	Very high	92 Å²	92	44.3 Å²	44.3	43%	0.43	24%	0.237	S	C	.	.	H	α-helix	trans	-66.1	-40.1	175.2	-73.9	177.9	134.3	0	0	111.7	I146 P151 S152 E153 Q158 A159	I146-E155 HydrophobicContact CG2-CB 3.85Å; I146-E155 WeakPolarHBondContact CG2-O 3.15Å; P151-E155 WeakPolarHBondContact CA-OE2 3.23Å; P151-E155 HydrophobicContact CB-CB 3.75Å; S152-E155 PolarHBondContact N-OE2 3.27Å; S152-E155 WeakPolarHBondContact O-CB 3.28Å; S152-E155 PolarHBondContact O-N 3.29Å; S152-E155 WeakPolarHBondContact OG-CG 3.16Å; S152-E155 PolarHBondContact OG-N 2.8Å; E153-E155 VanDerWaalsContact C-N 3.3Å; E153-E155 PolarHBondContact O-N 3.04Å; E155-Q158 PolarHBondContact O-N 3.05Å; E155-A159 PolarHBondContact O-N 3.13Å
156	I	95.8	Very high	94.1	Very high	5 Å²	5	44.2 Å²	44.2	3%	0.026	24%	0.237	C	C	.	.	H	α-helix	trans	-63.6	-44.3	174.6	-64.6	168.8	0	0	0	110.6	L56 P151 S152 E153 Q158 A159 I160 L185 E188 I189 L192	L56-I156 HydrophobicContact CD2-CD1 4.24Å; L56-I156 HydrophobicContact CD2-CG1 4.12Å; P151-I156 HydrophobicContact CB-CG1 4.11Å; P151-I156 HydrophobicContact CG-CD1 4.28Å; P151-I156 HydrophobicContact CG-CG1 3.82Å; S152-I156 WeakPolarHBondContact O-CG1 3.15Å; S152-I156 PolarHBondContact O-N 2.88Å; E153-I156 PolarHBondContact O-N 3.22Å; E153-I156 VanDerWaalsContact O-N 3.14Å; I156-Q158 VanDerWaalsContact C-N 3.3Å; I156-Q158 PolarHBondContact O-N 2.72Å; I156-A159 WeakPolarHBondContact O-CB 3.49Å; I156-A159 PolarHBondContact O-N 3.13Å; I156-A159 VanDerWaalsContact O-N 3.12Å; I156-I160 HydrophobicContact CG2-CD1 4.29Å; I156-I160 WeakPolarHBondContact O-CG1 3.49Å; I156-I160 PolarHBondContact O-N 2.97Å; I156-L185 HydrophobicContact CG2-CB 3.97Å; I156-L185 HydrophobicContact CG2-CD2 3.99Å; I156-L185 HydrophobicContact CG2-CG 4.5Å; I156-E188 HydrophobicContact CD1-CG 4.06Å; I156-I189 HydrophobicContact CB-CD1 3.88Å; I156-I189 HydrophobicContact CB-CG1 4.48Å; I156-I189 HydrophobicContact CG2-CD1 3.59Å; I156-I189 HydrophobicContact CG2-CG1 3.64Å; I156-L192 HydrophobicContact CD1-CD1 4.22Å
157	L	96.1	Very high	94.2	Very high	65 Å²	65	45.7 Å²	45.7	34%	0.34	25%	0.245	S	C	.	.	H	α-helix	trans	-61.2	-39.7	175.1	-69	173.8	0	0	0	111.5	E153 E154 A159 I160 R161 I189 C273	E153-L157 WeakPolarHBondContact O-CG 3.43Å; E153-L157 PolarHBondContact O-N 2.82Å; E154-L157 PolarHBondContact O-N 3.02Å; L157-A159 VanDerWaalsContact C-N 3.33Å; L157-A159 PolarHBondContact O-N 2.88Å; L157-I160 PolarHBondContact O-N 2.93Å; L157-R161 WeakPolarHBondContact O-CB 3.21Å; L157-R161 PolarHBondContact O-N 3Å; L157-I189 HydrophobicContact CD2-CD1 4.11Å; L157-I189 HydrophobicContact CD2-CG1 4.33Å; L157-I189 HydrophobicContact CG-CD1 4.12Å; L157-C273 HydrophobicContact CD2-CB 3.69Å
158	Q	96.1	Very high	94.2	Very high	69 Å²	69	47.8 Å²	47.8	32%	0.322	26%	0.256	S	S	.	.	H	α-helix	trans	-66.1	-34.4	174.3	-178.1	54	54.9	0	0	112.3	I146 E154 E155 I156 T162	I146-Q158 HydrophobicContact CD1-CG 4.37Å; E154-Q158 WeakPolarHBondContact O-CB 3.4Å; E154-Q158 PolarHBondContact O-N 3.07Å; E155-Q158 PolarHBondContact O-N 3.05Å; I156-Q158 VanDerWaalsContact C-N 3.3Å; I156-Q158 PolarHBondContact O-N 2.72Å; Q158-T162 PolarHBondContact NE2-OG1 3.44Å; Q158-T162 WeakPolarHBondContact O-CB 3.27Å; Q158-T162 PolarHBondContact O-N 2.75Å; Q158-T162 PolarHBondContact O-OG1 3.11Å
159	A	97.3	Very high	94.5	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-67.6	-43.5	172.6	0	0	0	0	0	111.7	A143 I146 E155 I156 L157 T162 C163 L185	A143-A159 HydrophobicContact CB-CB 4.33Å; I146-A159 HydrophobicContact CB-CB 4.32Å; I146-A159 HydrophobicContact CD1-CB 4.19Å; I146-A159 HydrophobicContact CG2-CB 4.12Å; E155-A159 PolarHBondContact O-N 3.13Å; I156-A159 WeakPolarHBondContact O-CB 3.49Å; I156-A159 PolarHBondContact O-N 3.13Å; I156-A159 VanDerWaalsContact O-N 3.12Å; L157-A159 VanDerWaalsContact C-N 3.33Å; L157-A159 PolarHBondContact O-N 2.88Å; A159-T162 WeakPolarHBondContact O-CB 3.38Å; A159-T162 PolarHBondContact O-N 3.21Å; A159-C163 PolarHBondContact O-N 2.99Å; A159-C163 PolarHBondContact O-SG 3.42Å; A159-L185 HydrophobicContact CB-CD1 3.77Å
160	I	97.6	Very high	95.1	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-57.6	-51	173.6	-69.2	170.5	0	0	0	110.2	I156 L157 T162 C163 D164 V182 L185 Q186 I189 C273	I156-I160 HydrophobicContact CG2-CD1 4.29Å; I156-I160 WeakPolarHBondContact O-CG1 3.49Å; I156-I160 PolarHBondContact O-N 2.97Å; L157-I160 PolarHBondContact O-N 2.93Å; I160-T162 VanDerWaalsContact C-N 3.26Å; I160-T162 PolarHBondContact O-N 3Å; I160-C163 WeakPolarHBondContact O-CB 3.43Å; I160-C163 PolarHBondContact O-N 3.31Å; I160-C163 VanDerWaalsContact O-N 3.08Å; I160-D164 PolarHBondContact O-N 3.21Å; I160-V182 HydrophobicContact CG2-CG1 4.26Å; I160-L185 HydrophobicContact CD1-CB 3.86Å; I160-L185 HydrophobicContact CG1-CB 3.52Å; I160-L185 HydrophobicContact CG1-CD1 3.84Å; I160-L185 HydrophobicContact CG1-CG 4.33Å; I160-Q186 HydrophobicContact CD1-CG 4.21Å; I160-I189 HydrophobicContact CD1-CG1 4.12Å; I160-C273 HydrophobicContact CD1-CB 4.43Å
161	R	97.6	Very high	95.5	Very high	115 Å²	115	39.1 Å²	39.1	43%	0.434	20%	0.195	S	C	.	.	H	α-helix	trans	-56.1	-42.9	176.6	-176.5	173.5	-174.6	-117.9	-3.2	111.5	L157 C163 D164 M165	L157-R161 WeakPolarHBondContact O-CB 3.21Å; L157-R161 PolarHBondContact O-N 3Å; R161-C163 PolarHBondContact O-N 3.36Å; R161-D164 PolarHBondContact O-N 3.38Å; R161-M165 VanDerWaalsContact O-CG 3.27Å; R161-M165 WeakPolarHBondContact O-CG 3.48Å; R161-M165 PolarHBondContact O-N 3.41Å
162	T	97.9	Very high	95.6	Very high	7 Å²	7	41.4 Å²	41.4	4%	0.043	22%	0.216	C	C	.	.	H	α-helix	trans	-61.3	-43.2	177.5	-58.7	0	0	0	0	111.6	C139 K142 Q158 A159 I160 G166	C139-T162 HydrophobicContact CB-CG2 4.02Å; C139-T162 WeakPolarHBondContact CB-O 3.36Å; C139-T162 WeakPolarHBondContact O-CG2 3.44Å; C139-T162 PolarHBondContact SG-O 3.46Å; K142-T162 HydrophobicContact CB-CG2 3.95Å; K142-T162 HydrophobicContact CD-CG2 3.96Å; K142-T162 HydrophobicContact CG-CG2 4.04Å; Q158-T162 PolarHBondContact NE2-OG1 3.44Å; Q158-T162 WeakPolarHBondContact O-CB 3.27Å; Q158-T162 PolarHBondContact O-N 2.75Å; Q158-T162 PolarHBondContact O-OG1 3.11Å; A159-T162 WeakPolarHBondContact O-CB 3.38Å; A159-T162 PolarHBondContact O-N 3.21Å; I160-T162 VanDerWaalsContact C-N 3.26Å; I160-T162 PolarHBondContact O-N 3Å; T162-G166 PolarHBondContact O-N 3.5Å
163	C	98	Very high	95.7	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-66.1	-44.1	175.1	-68.3	0	0	0	0	112.4	A143 A159 I160 R161 M165 G166 L167 L178 I181 V182	A143-C163 VanDerWaalsContact CB-SG 3.53Å; A159-C163 PolarHBondContact O-N 2.99Å; A159-C163 PolarHBondContact O-SG 3.42Å; I160-C163 WeakPolarHBondContact O-CB 3.43Å; I160-C163 PolarHBondContact O-N 3.31Å; I160-C163 VanDerWaalsContact O-N 3.08Å; R161-C163 PolarHBondContact O-N 3.36Å; C163-M165 VanDerWaalsContact C-N 3.32Å; C163-M165 PolarHBondContact O-N 3.37Å; C163-G166 CarbonylContact O-C 3.55Å; C163-G166 WeakPolarHBondContact O-CA 3.37Å; C163-G166 PolarHBondContact O-N 2.59Å; C163-L167 WeakPolarHBondContact O-CG 3.32Å; C163-L167 PolarHBondContact O-N 3.18Å; C163-L178 HydrophobicContact CB-CB 4.41Å; C163-L178 HydrophobicContact CB-CD2 4.45Å; C163-I181 VanDerWaalsContact SG-CG2 3.58Å; C163-V182 HydrophobicContact CB-CG2 3.27Å
164	D	97.5	Very high	95.8	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-61.3	-39.9	177.5	-79.7	-31.9	0	0	0	111.8	I160 R161 G166 L167 L168 R274 T275 Q329	I160-D164 PolarHBondContact O-N 3.21Å; R161-D164 PolarHBondContact O-N 3.38Å; D164-G166 VanDerWaalsContact C-N 3.26Å; D164-G166 PolarHBondContact O-N 2.99Å; D164-L167 PolarHBondContact O-N 3.37Å; D164-L167 VanDerWaalsContact O-N 3.11Å; D164-L168 WeakPolarHBondContact O-CB 3.46Å; D164-L168 VanDerWaalsContact O-CG 3.27Å; D164-L168 WeakPolarHBondContact O-CG 3.42Å; D164-L168 PolarHBondContact O-N 2.81Å; D164-R274 IonicContact OD1-CZ 2.97Å; D164-R274 VanDerWaalsContact OD1-CZ 3.31Å; D164-R274 IonicContact OD1-NE 3.31Å; D164-R274 PolarHBondContact OD1-NE 2.97Å; D164-R274 IonicContact OD1-NH2 3.98Å; D164-R274 PolarHBondContact OD1-NH2 3.06Å; D164-R274 VanDerWaalsContact OD2-CA 3.27Å; D164-R274 WeakPolarHBondContact OD2-CA 3.5Å; D164-R274 IonicContact OD2-NE 2.88Å; D164-R274 PolarHBondContact OD2-NE 2.92Å; D164-T275 PolarHBondContact OD2-N 2.85Å; D164-Q329 VanDerWaalsContact CG-NE2 3.27Å; D164-Q329 PolarHBondContact OD1-NE2 3.4Å
165	M	96.8	Very high	95.5	Very high	20 Å²	20	39.2 Å²	39.2	10%	0.099	20%	0.2	C	C	.	.	H	α-helix	trans	-57.7	-41	171.3	-69.8	-55.3	-59.6	0	0	111.7	W116 Y135 R161 C163 L167 L168 M169 L293	W116-M165 HydrophobicContact CH2-CE 4.41Å; W116-M165 HydrophobicContact CZ3-CE 3.76Å; Y135-M165 HydrophobicContact CE1-CB 4.25Å; Y135-M165 WeakPolarHBondContact CE1-O 3.45Å; R161-M165 VanDerWaalsContact O-CG 3.27Å; R161-M165 WeakPolarHBondContact O-CG 3.48Å; R161-M165 PolarHBondContact O-N 3.41Å; C163-M165 VanDerWaalsContact C-N 3.32Å; C163-M165 PolarHBondContact O-N 3.37Å; M165-L167 VanDerWaalsContact C-N 3.35Å; M165-L168 PolarHBondContact O-N 2.77Å; M165-M169 HydrophobicContact CE-CG 4.26Å; M165-M169 HydrophobicContact CE-SD 3.44Å; M165-M169 WeakPolarHBondContact CE-SD 3.43Å; M165-M169 WeakPolarHBondContact O-CB 3.5Å; M165-M169 PolarHBondContact O-N 3.25Å; M165-L293 HydrophobicContact CE-CD1 3.69Å; M165-L293 HydrophobicContact SD-CD1 3.59Å; M165-L293 VanDerWaalsContact SD-CD1 3.59Å
166	G	96.8	Very high	95.4	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.01	20%	0.201	C	C	.	.	H	α-helix	trans	-66.8	-33.6	175.8	0	0	0	0	0	113.3	C139 T162 C163 D164 G170	C139-G166 VanDerWaalsContact SG-CA 3.56Å; T162-G166 PolarHBondContact O-N 3.5Å; C163-G166 CarbonylContact O-C 3.55Å; C163-G166 WeakPolarHBondContact O-CA 3.37Å; C163-G166 PolarHBondContact O-N 2.59Å; D164-G166 VanDerWaalsContact C-N 3.26Å; D164-G166 PolarHBondContact O-N 2.99Å; G166-G170 WeakPolarHBondContact O-CA 3.49Å; G166-G170 PolarHBondContact O-N 3.46Å
167	L	95.3	Very high	95.4	Very high	49 Å²	49	38.9 Å²	38.9	26%	0.257	20%	0.201	S	C	.	.	H	α-helix	trans	-71.3	-39.2	174.2	-67.1	168.6	0	0	0	111.8	C163 D164 M165 L178 Q179	C163-L167 WeakPolarHBondContact O-CG 3.32Å; C163-L167 PolarHBondContact O-N 3.18Å; D164-L167 PolarHBondContact O-N 3.37Å; D164-L167 VanDerWaalsContact O-N 3.11Å; M165-L167 VanDerWaalsContact C-N 3.35Å; L167-L178 HydrophobicContact CD2-CB 4.04Å; L167-L178 HydrophobicContact CG-CB 4.21Å; L167-Q179 VanDerWaalsContact CD1-OE1 3.24Å; L167-Q179 HydrophobicContact CD2-CB 4.41Å
168	L	93.4	Very high	95.5	Very high	44 Å²	44	36 Å²	36	23%	0.23	19%	0.186	C	C	.	.	H	α-helix	trans	-74.8	-45.6	-179	-70	168.3	0	0	0	112.6	D164 M165 T275 L293	D164-L168 WeakPolarHBondContact O-CB 3.46Å; D164-L168 VanDerWaalsContact O-CG 3.27Å; D164-L168 WeakPolarHBondContact O-CG 3.42Å; D164-L168 PolarHBondContact O-N 2.81Å; M165-L168 PolarHBondContact O-N 2.77Å; L168-T275 HydrophobicContact CD1-CG2 4.44Å; L168-L293 HydrophobicContact CD1-CD2 3.87Å
169	M	93.6	Very high	95.4	Very high	22 Å²	22	33.4 Å²	33.4	11%	0.108	17%	0.174	C	C	.	.	H	α-helix	trans	-106.2	-23.6	-171	-59.5	-170.8	68.2	0	0	113.6	W116 L119 W124 R132 Y135 M165	W116-M169 HydrophobicContact CE3-CE 3.82Å; W116-M169 HydrophobicContact CE3-SD 3.85Å; W116-M169 HydrophobicContact CH2-CE 3.99Å; W116-M169 HydrophobicContact CH2-SD 3.88Å; W116-M169 HydrophobicContact CZ3-CE 3.53Å; W116-M169 HydrophobicContact CZ3-SD 3.19Å; W116-M169 WeakPolarHBondContact CZ3-SD 3.2Å; L119-M169 HydrophobicContact CB-CE 4.49Å; L119-M169 HydrophobicContact CD1-CB 4.07Å; L119-M169 HydrophobicContact CD1-CE 4.24Å; W124-M169 HydrophobicContact CH2-CB 4.42Å; W124-M169 WeakPolarHBondContact CH2-O 3.4Å; R132-M169 PolarHBondContact NE-O 2.74Å; Y135-M169 HydrophobicContact CD1-CB 4.07Å; Y135-M169 HydrophobicContact CE1-CB 3.86Å; M165-M169 HydrophobicContact CE-CG 4.26Å; M165-M169 HydrophobicContact CE-SD 3.44Å; M165-M169 WeakPolarHBondContact CE-SD 3.43Å; M165-M169 WeakPolarHBondContact O-CB 3.5Å; M165-M169 PolarHBondContact O-N 3.25Å
170	G	94.9	Very high	95.3	Very high	3 Å²	3	35.9 Å²	35.9	3%	0.031	19%	0.189	C	C	.	.	S	Bend	trans	-83.7	-166.7	-176.3	0	0	0	0	0	113.5	R132 S136 G166	R132-G170 PolarHBondContact NE-O 2.79Å; R132-G170 PolarHBondContact NH2-O 3.26Å; R132-G170 VanDerWaalsContact O-CA 3.26Å; R132-G170 WeakPolarHBondContact O-CA 3.5Å; S136-G170 WeakPolarHBondContact OG-CA 3.44Å; G166-G170 WeakPolarHBondContact O-CA 3.49Å; G166-G170 PolarHBondContact O-N 3.46Å
171	A	94.2	Very high	95.2	Very high	12 Å²	12	35.9 Å²	35.9	10%	0.099	19%	0.189	C	C	.	.			trans	-121.7	152.3	169.4	0	0	0	0	0	109.6	K129 R132 R133 S136 I173	K129-A171 HydrophobicContact CG-CB 4.28Å; R132-A171 HydrophobicContact CB-CB 3.74Å; R132-A171 PolarHBondContact O-N 2.94Å; R133-A171 HydrophobicContact CG-CB 3.87Å; S136-A171 WeakPolarHBondContact CB-O 3.46Å; S136-A171 PolarHBondContact OG-N 2.95Å; S136-A171 PolarHBondContact OG-O 3.24Å; A171-I173 PolarHBondContact O-N 3.45Å
172	A	93.7	Very high	95.2	Very high	72 Å²	72	30.4 Å²	30.4	60%	0.595	17%	0.168	S	C	*	.			trans	-52.4	132	176	0	0	0	0	0	111.6	N176	A172-N176 WeakPolarHBondContact CB-OD1 3.45Å
173	I	95.9	Very high	95	Very high	7 Å²	7	35 Å²	35	4%	0.036	18%	0.184	C	C	.	.			trans	-131.1	142.6	173.2	57.1	168.5	0	0	0	108.8	R133 Y137 L140 A171 E175 N176 I177	R133-I173 HydrophobicContact CB-CG2 4.37Å; R133-I173 HydrophobicContact CG-CG2 4.3Å; Y137-I173 HydrophobicContact CD1-CD1 3.71Å; Y137-I173 HydrophobicContact CD2-CD1 4.46Å; Y137-I173 HydrophobicContact CD2-CG2 4.22Å; Y137-I173 HydrophobicContact CE1-CB 4.47Å; Y137-I173 HydrophobicContact CE1-CD1 3.9Å; Y137-I173 HydrophobicContact CE2-CB 4.48Å; Y137-I173 HydrophobicContact CE2-CG2 3.74Å; Y137-I173 HydrophobicContact CG-CD1 4.01Å; L140-I173 HydrophobicContact CB-CD1 4.31Å; L140-I173 HydrophobicContact CD2-CD1 4.03Å; A171-I173 PolarHBondContact O-N 3.45Å; I173-E175 VanDerWaalsContact C-N 3.34Å; I173-E175 PolarHBondContact O-N 2.8Å; I173-N176 PolarHBondContact O-N 2.81Å; I173-N176 VanDerWaalsContact O-N 3.09Å; I173-I177 HydrophobicContact CD1-CG2 4.25Å; I173-I177 HydrophobicContact CG1-CG2 4.01Å; I173-I177 PolarHBondContact O-N 2.93Å
174	M	94	Very high	94.8	Very high	51 Å²	51	36 Å²	36	25%	0.251	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	44.8	56.8	175	-61.9	177.4	-70.2	0	0	112.3	P65 F71 P72 Y137 L140 N176 I177	P65-M174 HydrophobicContact CG-SD 3.65Å; F71-M174 HydrophobicContact CD2-SD 4.45Å; F71-M174 HydrophobicContact CE2-CE 3.96Å; F71-M174 HydrophobicContact CE2-SD 4.29Å; F71-M174 HydrophobicContact CZ-CE 3.86Å; F71-M174 HydrophobicContact CZ-SD 4.48Å; P72-M174 HydrophobicContact CG-CG 3.88Å; P72-M174 HydrophobicContact CG-SD 4.11Å; Y137-M174 HydrophobicContact CE1-CE 3.94Å; L140-M174 HydrophobicContact CD2-CE 3.23Å; M174-N176 PolarHBondContact O-N 2.84Å; M174-I177 HydrophobicContact CB-CB 4.16Å; M174-I177 HydrophobicContact CB-CG2 4.24Å; M174-I177 HydrophobicContact CE-CD1 4.01Å; M174-I177 HydrophobicContact CE-CG2 3.9Å; M174-I177 PolarHBondContact O-N 3.33Å
175	E	89.3	Confident	94.7	Very high	189 Å²	189	36 Å²	36	88%	0.883	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.5	47.2	179	-60.1	176.6	-167.8	0	0	113.4	I173 I177	I173-E175 VanDerWaalsContact C-N 3.34Å; I173-E175 PolarHBondContact O-N 2.8Å; E175-I177 PolarHBondContact O-N 2.92Å
176	N	91.4	Very high	94.5	Very high	84 Å²	84	35.3 Å²	35.3	45%	0.449	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.3	41.8	-179.9	-64.7	-42.8	0	0	0	113.9	A172 I173 M174 L178 Q179 V180	A172-N176 WeakPolarHBondContact CB-OD1 3.45Å; I173-N176 PolarHBondContact O-N 2.81Å; I173-N176 VanDerWaalsContact O-N 3.09Å; M174-N176 PolarHBondContact O-N 2.84Å; N176-L178 PolarHBondContact O-N 2.91Å; N176-Q179 HydrophobicContact CB-CB 4.21Å; N176-Q179 WeakPolarHBondContact O-CA 3.37Å; N176-Q179 WeakPolarHBondContact O-CB 3.39Å; N176-Q179 PolarHBondContact O-N 3.43Å; N176-V180 PolarHBondContact O-N 3.14Å
177	I	96.3	Very high	94.2	Very high	7 Å²	7	43.4 Å²	43.4	4%	0.036	22%	0.217	C	C	.	.	H	α-helix	trans	-51.3	-33.5	-179.7	-163.5	172.6	0	0	0	114.2	I63 L64 L140 I173 M174 E175 Q179 V180 I181	I63-I177 HydrophobicContact CD1-CG1 4.04Å; L64-I177 HydrophobicContact CD2-CD1 3.82Å; L140-I177 HydrophobicContact CD1-CD1 4.42Å; L140-I177 HydrophobicContact CD1-CG2 4.27Å; L140-I177 HydrophobicContact CD2-CG2 4.18Å; I173-I177 HydrophobicContact CD1-CG2 4.25Å; I173-I177 HydrophobicContact CG1-CG2 4.01Å; I173-I177 PolarHBondContact O-N 2.93Å; M174-I177 HydrophobicContact CB-CB 4.16Å; M174-I177 HydrophobicContact CB-CG2 4.24Å; M174-I177 HydrophobicContact CE-CD1 4.01Å; M174-I177 HydrophobicContact CE-CG2 3.9Å; M174-I177 PolarHBondContact O-N 3.33Å; E175-I177 PolarHBondContact O-N 2.92Å; I177-Q179 VanDerWaalsContact C-N 3.27Å; I177-Q179 PolarHBondContact O-N 3Å; I177-V180 WeakPolarHBondContact O-CB 3.48Å; I177-V180 PolarHBondContact O-N 2.95Å; I177-V180 VanDerWaalsContact O-N 3.11Å; I177-I181 HydrophobicContact CG1-CD1 4.46Å; I177-I181 WeakPolarHBondContact O-CG1 3.43Å; I177-I181 PolarHBondContact O-N 2.89Å
178	L	97.1	Very high	94	Very high	5 Å²	5	43 Å²	43	3%	0.026	21%	0.214	C	C	.	.	H	α-helix	trans	-60.7	-37.7	176.7	-66.1	-179.4	0	0	0	111.8	C139 L140 C163 L167 N176 V180 I181 V182	C139-L178 HydrophobicContact CB-CD1 4.28Å; C139-L178 HydrophobicContact CB-CD2 4.36Å; L140-L178 HydrophobicContact CB-CD2 3.88Å; L140-L178 HydrophobicContact CD1-CD2 4.42Å; C163-L178 HydrophobicContact CB-CB 4.41Å; C163-L178 HydrophobicContact CB-CD2 4.45Å; L167-L178 HydrophobicContact CD2-CB 4.04Å; L167-L178 HydrophobicContact CG-CB 4.21Å; N176-L178 PolarHBondContact O-N 2.91Å; L178-V180 VanDerWaalsContact C-N 3.32Å; L178-V180 PolarHBondContact O-N 3.25Å; L178-I181 PolarHBondContact O-N 3.45Å; L178-V182 WeakPolarHBondContact O-CG2 3.4Å; L178-V182 PolarHBondContact O-N 3.44Å
179	Q	94.7	Very high	93.7	Very high	14 Å²	14	41.9 Å²	41.9	7%	0.065	21%	0.208	C	C	.	.	H	α-helix	trans	-64.2	-40.2	175.5	-171.2	62.2	34	0	0	111.2	L167 N176 I177 V182 R183 Q329 P331	L167-Q179 VanDerWaalsContact CD1-OE1 3.24Å; L167-Q179 HydrophobicContact CD2-CB 4.41Å; N176-Q179 HydrophobicContact CB-CB 4.21Å; N176-Q179 WeakPolarHBondContact O-CA 3.37Å; N176-Q179 WeakPolarHBondContact O-CB 3.39Å; N176-Q179 PolarHBondContact O-N 3.43Å; I177-Q179 VanDerWaalsContact C-N 3.27Å; I177-Q179 PolarHBondContact O-N 3Å; Q179-V182 PolarHBondContact O-N 3.47Å; Q179-R183 WeakPolarHBondContact O-CG 3.49Å; Q179-R183 PolarHBondContact O-N 2.93Å; Q179-R183 VanDerWaalsContact O-N 3.11Å; Q179-Q329 PolarHBondContact NE2-O 3.24Å; Q179-Q329 PolarHBondContact OE1-O 3.31Å; Q179-P331 HydrophobicContact CG-CG 4.49Å
180	V	95.2	Very high	93.4	Very high	51 Å²	51	44.7 Å²	44.7	31%	0.309	22%	0.217	S	C	.	.	H	α-helix	trans	-66.2	-42.9	177.4	-172	0	0	0	0	110.7	I63 N176 I177 L178 R183 I184	I63-V180 HydrophobicContact CD1-CB 4.02Å; I63-V180 HydrophobicContact CD1-CG1 3.74Å; I63-V180 HydrophobicContact CG2-CG1 4.19Å; N176-V180 PolarHBondContact O-N 3.14Å; I177-V180 WeakPolarHBondContact O-CB 3.48Å; I177-V180 PolarHBondContact O-N 2.95Å; I177-V180 VanDerWaalsContact O-N 3.11Å; L178-V180 VanDerWaalsContact C-N 3.32Å; L178-V180 PolarHBondContact O-N 3.25Å; V180-R183 PolarHBondContact O-N 3.45Å; V180-I184 HydrophobicContact CG1-CD1 4.46Å; V180-I184 WeakPolarHBondContact O-CG1 3.41Å; V180-I184 PolarHBondContact O-N 3.33Å; V180-I184 VanDerWaalsContact O-N 3.11Å
181	I	96.5	Very high	92.8	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-59.2	-47.9	175.2	-70.3	174.1	0	0	0	110.7	I60 I63 L140 C163 I177 L178 R183 I184 L185	I60-I181 HydrophobicContact CD1-CB 4.21Å; I60-I181 HydrophobicContact CD1-CG1 3.96Å; I60-I181 HydrophobicContact CD1-CG2 3.81Å; I63-I181 HydrophobicContact CD1-CG1 3.64Å; L140-I181 HydrophobicContact CD1-CD1 3.23Å; C163-I181 VanDerWaalsContact SG-CG2 3.58Å; I177-I181 HydrophobicContact CG1-CD1 4.46Å; I177-I181 WeakPolarHBondContact O-CG1 3.43Å; I177-I181 PolarHBondContact O-N 2.89Å; L178-I181 PolarHBondContact O-N 3.45Å; I181-R183 VanDerWaalsContact C-N 3.31Å; I181-R183 PolarHBondContact O-N 3.29Å; I181-I184 WeakPolarHBondContact O-CB 3.34Å; I181-I184 PolarHBondContact O-N 2.89Å; I181-L185 HydrophobicContact CG2-CD1 3.63Å; I181-L185 HydrophobicContact CG2-CG 4.13Å; I181-L185 WeakPolarHBondContact O-CG 3.49Å; I181-L185 PolarHBondContact O-N 2.84Å
182	V	96.3	Very high	92.1	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-58.4	-43.8	178.5	173.2	0	0	0	0	111.2	I160 C163 L178 Q179 I184 L185 Q186 R274	I160-V182 HydrophobicContact CG2-CG1 4.26Å; C163-V182 HydrophobicContact CB-CG2 3.27Å; L178-V182 WeakPolarHBondContact O-CG2 3.4Å; L178-V182 PolarHBondContact O-N 3.44Å; Q179-V182 PolarHBondContact O-N 3.47Å; V182-I184 VanDerWaalsContact C-N 3.29Å; V182-I184 PolarHBondContact O-N 3.27Å; V182-L185 PolarHBondContact O-N 3.14Å; V182-Q186 HydrophobicContact CG1-CG 3.96Å; V182-Q186 WeakPolarHBondContact O-CB 3.47Å; V182-Q186 VanDerWaalsContact O-CG 3.3Å; V182-Q186 WeakPolarHBondContact O-CG 3.38Å; V182-Q186 PolarHBondContact O-N 3.49Å; V182-R274 VanDerWaalsContact CG1-CZ 3.45Å
183	R	93.3	Very high	91.2	Very high	103 Å²	103	47.9 Å²	47.9	39%	0.389	23%	0.228	S	C	.	.	H	α-helix	trans	-59.5	-38.6	175.9	-70.6	178.5	-173.5	164.5	3.1	112.5	Q179 V180 I181 R187	Q179-R183 WeakPolarHBondContact O-CG 3.49Å; Q179-R183 PolarHBondContact O-N 2.93Å; Q179-R183 VanDerWaalsContact O-N 3.11Å; V180-R183 PolarHBondContact O-N 3.45Å; I181-R183 VanDerWaalsContact C-N 3.31Å; I181-R183 PolarHBondContact O-N 3.29Å; R183-R187 VanDerWaalsContact O-CG 3.29Å; R183-R187 WeakPolarHBondContact O-CG 3.22Å; R183-R187 PolarHBondContact O-N 3Å
184	I	95	Very high	89.9	Confident	22 Å²	22	55.1 Å²	55.1	11%	0.113	26%	0.259	C	S	.	.	H	α-helix	trans	-64.6	-48.6	175.5	-66.8	167.2	0	0	0	110	L56 K59 I60 I63 V180 I181 V182 R187 E188	L56-I184 HydrophobicContact CD1-CG2 3.8Å; K59-I184 HydrophobicContact CB-CD1 4.44Å; K59-I184 HydrophobicContact CB-CG2 3.8Å; K59-I184 HydrophobicContact CD-CG2 4.05Å; I60-I184 HydrophobicContact CD1-CB 4.24Å; I60-I184 HydrophobicContact CD1-CD1 4.09Å; I60-I184 HydrophobicContact CD1-CG2 4.03Å; I63-I184 HydrophobicContact CD1-CD1 3.87Å; I63-I184 HydrophobicContact CG1-CD1 4.44Å; I63-I184 HydrophobicContact CG2-CD1 4.41Å; V180-I184 HydrophobicContact CG1-CD1 4.46Å; V180-I184 WeakPolarHBondContact O-CG1 3.41Å; V180-I184 PolarHBondContact O-N 3.33Å; V180-I184 VanDerWaalsContact O-N 3.11Å; I181-I184 WeakPolarHBondContact O-CB 3.34Å; I181-I184 PolarHBondContact O-N 2.89Å; V182-I184 VanDerWaalsContact C-N 3.29Å; V182-I184 PolarHBondContact O-N 3.27Å; I184-R187 PolarHBondContact O-N 3.25Å; I184-E188 PolarHBondContact O-N 2.91Å
185	L	95.1	Very high	88.3	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-65.8	-40.9	-178.1	-63.5	172.3	0	0	0	112.6	L56 C147 I156 A159 I160 I181 V182 R187 E188 I189	L56-L185 HydrophobicContact CD1-CD2 3.92Å; L56-L185 HydrophobicContact CD2-CD2 3.81Å; L56-L185 HydrophobicContact CG-CD2 4.28Å; C147-L185 WeakPolarHBondContact SG-CD2 3.33Å; I156-L185 HydrophobicContact CG2-CB 3.97Å; I156-L185 HydrophobicContact CG2-CD2 3.99Å; I156-L185 HydrophobicContact CG2-CG 4.5Å; A159-L185 HydrophobicContact CB-CD1 3.77Å; I160-L185 HydrophobicContact CD1-CB 3.86Å; I160-L185 HydrophobicContact CG1-CB 3.52Å; I160-L185 HydrophobicContact CG1-CD1 3.84Å; I160-L185 HydrophobicContact CG1-CG 4.33Å; I181-L185 HydrophobicContact CG2-CD1 3.63Å; I181-L185 HydrophobicContact CG2-CG 4.13Å; I181-L185 WeakPolarHBondContact O-CG 3.49Å; I181-L185 PolarHBondContact O-N 2.84Å; V182-L185 PolarHBondContact O-N 3.14Å; L185-R187 VanDerWaalsContact C-N 3.31Å; L185-R187 PolarHBondContact O-N 3.5Å; L185-E188 WeakPolarHBondContact O-CB 3.39Å; L185-E188 PolarHBondContact O-N 3.32Å; L185-E188 VanDerWaalsContact O-N 3.12Å; L185-I189 PolarHBondContact O-N 2.73Å
186	Q	91.8	Very high	86.8	Confident	5 Å²	5	56.3 Å²	56.3	2%	0.023	26%	0.264	C	S	.	.	H	α-helix	trans	-61.5	-39.4	175.7	-75	-175.2	-68.1	0	0	112.1	I160 V182 E188 I189 R190 V270	I160-Q186 HydrophobicContact CD1-CG 4.21Å; V182-Q186 HydrophobicContact CG1-CG 3.96Å; V182-Q186 WeakPolarHBondContact O-CB 3.47Å; V182-Q186 VanDerWaalsContact O-CG 3.3Å; V182-Q186 WeakPolarHBondContact O-CG 3.38Å; V182-Q186 PolarHBondContact O-N 3.49Å; Q186-E188 VanDerWaalsContact C-N 3.28Å; Q186-E188 PolarHBondContact O-N 2.94Å; Q186-I189 PolarHBondContact O-N 2.93Å; Q186-R190 WeakPolarHBondContact O-CB 3.45Å; Q186-R190 WeakPolarHBondContact O-CG 3.02Å; Q186-R190 PolarHBondContact O-N 3.14Å; Q186-V270 PolarHBondContact NE2-O 2.77Å; Q186-V270 VanDerWaalsContact NE2-O 3.12Å
187	R	90.8	Very high	84.8	Confident	172 Å²	172	57.7 Å²	57.7	65%	0.649	27%	0.272	S	S	*	.	H	α-helix	trans	-64.3	-36.2	174.9	-73.7	172.7	-179.5	-178.1	0.1	111.7	R183 I184 L185 T191	R183-R187 VanDerWaalsContact O-CG 3.29Å; R183-R187 WeakPolarHBondContact O-CG 3.22Å; R183-R187 PolarHBondContact O-N 3Å; I184-R187 PolarHBondContact O-N 3.25Å; L185-R187 VanDerWaalsContact C-N 3.31Å; L185-R187 PolarHBondContact O-N 3.5Å; R187-T191 PolarHBondContact O-N 3.39Å; R187-T191 PolarHBondContact O-OG1 2.9Å
188	E	90.8	Very high	82.5	Confident	41 Å²	41	61.1 Å²	61.1	19%	0.192	30%	0.301	C	S	.	.	H	α-helix	trans	-64.3	-50.7	174.9	-154.7	70.7	-169.4	0	0	110.8	L56 K59 I156 I184 L185 Q186 R190 T191 L192	L56-E188 HydrophobicContact CD1-CB 4.36Å; L56-E188 HydrophobicContact CD1-CG 4.3Å; K59-E188 IonicContact NZ-OE2 3.74Å; K59-E188 PolarHBondContact NZ-OE2 2.85Å; I156-E188 HydrophobicContact CD1-CG 4.06Å; I184-E188 PolarHBondContact O-N 2.91Å; L185-E188 WeakPolarHBondContact O-CB 3.39Å; L185-E188 PolarHBondContact O-N 3.32Å; L185-E188 VanDerWaalsContact O-N 3.12Å; Q186-E188 VanDerWaalsContact C-N 3.28Å; Q186-E188 PolarHBondContact O-N 2.94Å; E188-R190 PolarHBondContact O-N 3.36Å; E188-T191 WeakPolarHBondContact O-CA 3.37Å; E188-T191 WeakPolarHBondContact O-CB 3.48Å; E188-T191 PolarHBondContact O-N 3.46Å; E188-L192 WeakPolarHBondContact O-CG 3.38Å; E188-L192 PolarHBondContact O-N 2.87Å
189	I	89.1	Confident	79.8	Confident	20 Å²	20	69 Å²	69	10%	0.103	34%	0.338	C	S	.	.	H	α-helix	trans	-56.6	-46.6	175.6	-65.9	-65.8	0	0	0	111.7	E153 I156 L157 I160 L185 Q186 T191 L192 A193	E153-I189 HydrophobicContact CG-CD1 3.52Å; I156-I189 HydrophobicContact CB-CD1 3.88Å; I156-I189 HydrophobicContact CB-CG1 4.48Å; I156-I189 HydrophobicContact CG2-CD1 3.59Å; I156-I189 HydrophobicContact CG2-CG1 3.64Å; L157-I189 HydrophobicContact CD2-CD1 4.11Å; L157-I189 HydrophobicContact CD2-CG1 4.33Å; L157-I189 HydrophobicContact CG-CD1 4.12Å; I160-I189 HydrophobicContact CD1-CG1 4.12Å; L185-I189 PolarHBondContact O-N 2.73Å; Q186-I189 PolarHBondContact O-N 2.93Å; I189-T191 PolarHBondContact O-N 3.17Å; I189-L192 PolarHBondContact O-N 3.23Å; I189-A193 WeakPolarHBondContact O-CB 3.47Å; I189-A193 PolarHBondContact O-N 3.11Å
190	R	85.3	Confident	77.2	Confident	81 Å²	81	75.5 Å²	75.5	31%	0.306	37%	0.368	S	S	.	.	H	α-helix	trans	-63.8	-25.8	177.8	-72.2	-177.5	-169.9	154	17.7	112.6	Q186 E188 K194 S269 V270 E332	Q186-R190 WeakPolarHBondContact O-CB 3.45Å; Q186-R190 WeakPolarHBondContact O-CG 3.02Å; Q186-R190 PolarHBondContact O-N 3.14Å; E188-R190 PolarHBondContact O-N 3.36Å; R190-K194 WeakPolarHBondContact O-CB 3.45Å; R190-K194 VanDerWaalsContact O-CG 3.24Å; R190-K194 WeakPolarHBondContact O-CG 3.44Å; R190-K194 PolarHBondContact O-N 3.48Å; R190-S269 PolarHBondContact NE-O 3.16Å; R190-S269 PolarHBondContact NH2-O 3.42Å; R190-V270 PolarHBondContact NH2-O 2.78Å; R190-E332 IonicContact CZ-OE1 2.7Å; R190-E332 IonicContact NH1-OE1 3.9Å; R190-E332 IonicContact NH2-OE1 3.83Å; R190-E332 PolarHBondContact NH2-OE1 3.33Å
191	T	83.9	Confident	74.1	Confident	64 Å²	64	81.3 Å²	81.3	39%	0.393	40%	0.397	S	S	.	.	H	α-helix	trans	-75.3	-44.5	175.8	-55.1	0	0	0	0	110.1	R187 E188 I189 K194 E195	R187-T191 PolarHBondContact O-N 3.39Å; R187-T191 PolarHBondContact O-OG1 2.9Å; E188-T191 WeakPolarHBondContact O-CA 3.37Å; E188-T191 WeakPolarHBondContact O-CB 3.48Å; E188-T191 PolarHBondContact O-N 3.46Å; I189-T191 PolarHBondContact O-N 3.17Å; T191-K194 PolarHBondContact O-N 2.76Å; T191-E195 PolarHBondContact O-N 2.94Å
192	L	78.9	Confident	71.3	Confident	56 Å²	56	88.2 Å²	88.2	29%	0.293	43%	0.433	S	S	.	.	H	α-helix	trans	-60.4	-47.5	175.2	-63.4	172	0	0	0	111.7	E153 I156 E188 I189 K194 E195 E196	E153-L192 HydrophobicContact CB-CD1 4.47Å; E153-L192 HydrophobicContact CG-CD1 4.44Å; I156-L192 HydrophobicContact CD1-CD1 4.22Å; E188-L192 WeakPolarHBondContact O-CG 3.38Å; E188-L192 PolarHBondContact O-N 2.87Å; I189-L192 PolarHBondContact O-N 3.23Å; L192-K194 VanDerWaalsContact C-N 3.33Å; L192-K194 PolarHBondContact O-N 3.24Å; L192-E195 WeakPolarHBondContact O-CB 3.39Å; L192-E195 PolarHBondContact O-N 3.37Å; L192-E195 VanDerWaalsContact O-N 3.12Å; L192-E196 PolarHBondContact O-N 3.18Å
193	A	75.6	Confident	68.2	Low	34 Å²	34	96.9 Å²	96.9	28%	0.281	47%	0.473	S	S	.	.	H	α-helix	trans	-62.3	-36.9	178.6	0	0	0	0	0	112.9	I189 E195 E196 D197	I189-A193 WeakPolarHBondContact O-CB 3.47Å; I189-A193 PolarHBondContact O-N 3.11Å; A193-E195 VanDerWaalsContact C-N 3.28Å; A193-E195 PolarHBondContact O-N 3.21Å; A193-E196 PolarHBondContact O-N 3.5Å; A193-E196 VanDerWaalsContact O-N 3.16Å; A193-D197 WeakPolarHBondContact O-CB 3.25Å; A193-D197 PolarHBondContact O-N 3.3Å
194	K	68.6	Low	65.3	Low	158 Å²	158	95.8 Å²	95.8	69%	0.687	49%	0.486	S	S	*	.	H	α-helix	trans	-68.5	-25.5	176.6	-79.6	177	-179.9	-176.6	0	113.6	R190 T191 L192 E196	R190-K194 WeakPolarHBondContact O-CB 3.45Å; R190-K194 VanDerWaalsContact O-CG 3.24Å; R190-K194 WeakPolarHBondContact O-CG 3.44Å; R190-K194 PolarHBondContact O-N 3.48Å; T191-K194 PolarHBondContact O-N 2.76Å; L192-K194 VanDerWaalsContact C-N 3.33Å; L192-K194 PolarHBondContact O-N 3.24Å; K194-E196 VanDerWaalsContact C-N 3.34Å
195	E	60.2	Low	62.2	Low	130 Å²	130	104 Å²	104	61%	0.607	52%	0.521	S	S	*	.	H	α-helix	trans	-73.5	-29.5	173.1	-69.4	177.9	177.6	0	0	111.2	T191 L192 A193	T191-E195 PolarHBondContact O-N 2.94Å; L192-E195 WeakPolarHBondContact O-CB 3.39Å; L192-E195 PolarHBondContact O-N 3.37Å; L192-E195 VanDerWaalsContact O-N 3.12Å; A193-E195 VanDerWaalsContact C-N 3.28Å; A193-E195 PolarHBondContact O-N 3.21Å
196	E	56.2	Low	59.2	Low	135 Å²	135	114 Å²	114	63%	0.631	56%	0.564	S	S	*	*	H	α-helix	trans	-83.1	-39.9	175.9	-65.1	-173.6	156.2	0	0	113.1	L192 A193 K194 A198 H199	L192-E196 PolarHBondContact O-N 3.18Å; A193-E196 PolarHBondContact O-N 3.5Å; A193-E196 VanDerWaalsContact O-N 3.16Å; K194-E196 VanDerWaalsContact C-N 3.34Å; E196-A198 PolarHBondContact O-N 3.02Å; E196-A198 VanDerWaalsContact O-N 3.13Å; E196-H199 PolarHBondContact O-N 2.98Å
197	D	50.9	Low	56.6	Low	113 Å²	113	123.4 Å²	123.4	60%	0.604	60%	0.6	S	S	*	*	G	3₁₀ helix	trans	-70.3	-5.1	-178.4	-78.7	-26.1	0	0	0	114.2	A193 H199	A193-D197 WeakPolarHBondContact O-CB 3.25Å; A193-D197 PolarHBondContact O-N 3.3Å; D197-H199 PolarHBondContact O-N 2.73Å
198	A	46.7	Very low	53.8	Low	79 Å²	79	125.3 Å²	125.3	65%	0.653	61%	0.613	S	S	*	*	G	3₁₀ helix	trans	-62.5	-6.3	169.5	0	0	0	0	0	113.1	E196	E196-A198 PolarHBondContact O-N 3.02Å; E196-A198 VanDerWaalsContact O-N 3.13Å
199	H	41.2	Very low	51.7	Low	171 Å²	171	129.3 Å²	129.3	79%	0.792	63%	0.634	S	S	*	*	G	3₁₀ helix	trans	-117.6	-7.3	-175.4	-80.9	-54.7	0	0	0	117.7	E196 D197	E196-H199 PolarHBondContact O-N 2.98Å; D197-H199 PolarHBondContact O-N 2.73Å
200	E	39.8	Very low	49.5	Very low	150 Å²	150	132.5 Å²	132.5	70%	0.701	66%	0.663	S	S	*	*			trans	-139.7	115.4	178.2	-72.5	-169	161.3	0	0	113
201	N	30.1	Very low	47.5	Very low	174 Å²	174	133.4 Å²	133.4	93%	0.93	68%	0.682	S	S	*	*			trans	-104.2	100.5	177.7	-148.8	0.5	0	0	0	107.6
202	I	37.3	Very low	45.8	Very low	144 Å²	144	131.5 Å²	131.5	74%	0.738	67%	0.671	S	S	*	*			trans	-102.7	117.4	-180	-61.7	177.7	0	0	0	109.6	A204	I202-A204 PolarHBondContact O-N 3.28Å
203	E	31.3	Very low	44.2	Very low	182 Å²	182	137.9 Å²	137.9	85%	0.85	70%	0.699	S	S	*	*			trans	-66.5	120.5	175.1	-74.3	-178.2	150.3	0	0	111.9	K205	E203-K205 PolarHBondContact O-N 2.87Å
204	A	33.8	Very low	43.4	Very low	80 Å²	80	138.1 Å²	138.1	66%	0.661	70%	0.697	S	S	*	*			trans	-70.1	107.4	172.3	0	0	0	0	0	111.1	I202 K206	I202-A204 PolarHBondContact O-N 3.28Å; A204-K206 PolarHBondContact O-N 3.2Å
205	K	29.9	Very low	43.2	Very low	195 Å²	195	133.6 Å²	133.6	85%	0.848	70%	0.695	S	S	*	*			trans	-71.6	110.7	171.5	-78.9	179.3	179.4	171	0	110.1	E203 R207	E203-K205 PolarHBondContact O-N 2.87Å; K205-R207 PolarHBondContact O-N 3.03Å
206	K	31	Very low	43.9	Very low	209 Å²	209	135.9 Å²	135.9	91%	0.909	71%	0.71	S	S	*	*			trans	-58.6	102.7	166.6	-72.8	-178	177.1	-179.9	0	110	A204	A204-K206 PolarHBondContact O-N 3.2Å
207	R	37.6	Very low	45.4	Very low	204 Å²	204	131.2 Å²	131.2	77%	0.77	69%	0.689	S	S	*	*			trans	-71.3	125.1	167.6	-84.9	-178.9	168.5	-178	-3.2	108.7	K205 I209	K205-R207 PolarHBondContact O-N 3.03Å; R207-I209 PolarHBondContact O-N 3.25Å
208	K	32.8	Very low	47.2	Very low	211 Å²	211	131.6 Å²	131.6	92%	0.917	69%	0.685	S	S	*	*			trans	-70.1	113.1	167.6	-89.8	-177	173.8	-179.9	0	108.3	A210	K208-A210 PolarHBondContact O-N 3.48Å
209	I	44.8	Very low	49.1	Very low	125 Å²	125	134.3 Å²	134.3	64%	0.641	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-72.3	117.2	173.2	-60.4	170.4	0	0	0	107.3	R207 E454	R207-I209 PolarHBondContact O-N 3.25Å; I209-E454 HydrophobicContact CG2-CG 4.04Å; I209-E454 WeakPolarHBondContact CG2-OE2 3.45Å
210	A	42.8	Very low	51.6	Low	87 Å²	87	132.9 Å²	132.9	72%	0.719	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-70.9	131.4	169.9	0	0	0	0	0	108.7	K208 P212	K208-A210 PolarHBondContact O-N 3.48Å; A210-P212 WeakPolarHBondContact O-CD 3.48Å
211	S	43.4	Very low	54.2	Low	100 Å²	100	127.6 Å²	127.6	70%	0.699	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-54.1	122.7	176.1	146.6	0	0	0	0	109.7	H213	S211-H213 PolarHBondContact O-N 3.34Å
212	P	48.4	Very low	57.3	Low	24 Å²	24	121.6 Å²	121.6	16%	0.156	63%	0.631	C	S	.	*	P	Polyproline II helix	trans	-61.1	131.2	171.5	-18	29.4	0	0	0	108.8	A210 V214 L453 E454	A210-P212 WeakPolarHBondContact O-CD 3.48Å; P212-V214 VanDerWaalsContact C-N 3.33Å; P212-V214 PolarHBondContact O-N 3.19Å; P212-L453 HydrophobicContact CB-CB 3.79Å; P212-L453 HydrophobicContact CG-CB 3.68Å; P212-L453 WeakPolarHBondContact CG-O 3.44Å; P212-E454 WeakPolarHBondContact CD-OE1 3.1Å; P212-E454 HydrophobicContact CG-CG 3.59Å; P212-E454 WeakPolarHBondContact CG-OE1 3.4Å
213	H	46	Very low	60.2	Low	191 Å²	191	114.9 Å²	114.9	88%	0.884	60%	0.597	S	S	*	*			trans	-69.7	93.3	165.6	-91.3	10.3	0	0	0	108.6	S211	S211-H213 PolarHBondContact O-N 3.34Å
214	V	58.8	Low	63.4	Low	39 Å²	39	108.7 Å²	108.7	24%	0.236	57%	0.572	C	S	.	*			trans	-83	136.3	153.2	-172.1	0	0	0	0	106	P212 I217 Y385 V433 L453	P212-V214 VanDerWaalsContact C-N 3.33Å; P212-V214 PolarHBondContact O-N 3.19Å; V214-I217 HydrophobicContact CG1-CG1 4.47Å; V214-Y385 HydrophobicContact CG1-CD2 4.08Å; V214-V433 HydrophobicContact CB-CG2 4.01Å; V214-V433 HydrophobicContact CG1-CG2 3.79Å; V214-V433 HydrophobicContact CG2-CG2 3.75Å; V214-L453 HydrophobicContact CG2-CD1 3.28Å; V214-L453 HydrophobicContact CG2-CD2 3.85Å; V214-L453 HydrophobicContact CG2-CG 4.19Å
215	G	63.5	Low	66.5	Low	62 Å²	62	108.9 Å²	108.9	64%	0.639	56%	0.556	S	S	*	*			trans	-53	152.9	170.3	0	0	0	0	0	110.4	I217	G215-I217 PolarHBondContact O-N 3.26Å
216	L	76.6	Confident	69.8	Low	179 Å²	179	101.3 Å²	101.3	94%	0.937	52%	0.524	S	S	*	.			trans	-57.1	109	174.5	-105.9	127.4	0	0	0	109	K218	L216-K218 PolarHBondContact O-N 3.09Å
217	I	86.8	Confident	73	Confident	36 Å²	36	99 Å²	99	19%	0.185	51%	0.514	C	S	.	.			trans	-66.8	126.4	169.9	-64.5	178.4	0	0	0	106.6	V214 G215 E431 V433	V214-I217 HydrophobicContact CG1-CG1 4.47Å; G215-I217 PolarHBondContact O-N 3.26Å; I217-E431 HydrophobicContact CB-CG 4.49Å; I217-E431 HydrophobicContact CD1-CG 4.23Å; I217-E431 HydrophobicContact CG1-CG 4.14Å; I217-E431 HydrophobicContact CG2-CG 3.71Å; I217-V433 HydrophobicContact CD1-CG2 3.95Å
218	K	88.3	Confident	75.9	Confident	121 Å²	121	92.4 Å²	92.4	53%	0.526	50%	0.499	S	S	.	.			trans	-73.6	138.1	177.3	-60.1	-176.8	-177.4	177.5	0	109.5	L216 E220 L221 S222	L216-K218 PolarHBondContact O-N 3.09Å; K218-E220 HydrophobicContact CB-CG 4.36Å; K218-E220 VanDerWaalsContact CD-OE1 3.31Å; K218-E220 WeakPolarHBondContact CD-OE1 3.35Å; K218-E220 PolarHBondContact O-N 2.91Å; K218-L221 HydrophobicContact CB-CD1 4.39Å; K218-L221 HydrophobicContact CB-CG 4.48Å; K218-L221 HydrophobicContact CD-CD1 4.4Å; K218-L221 PolarHBondContact O-N 3.23Å; K218-S222 PolarHBondContact O-N 2.85Å; K218-S222 VanDerWaalsContact O-N 3.15Å
219	D	87.7	Confident	79	Confident	137 Å²	137	83.2 Å²	83.2	73%	0.733	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-55.6	-38.3	-177.3	-69.3	-16.6	0	0	0	111.8	L221 S222	D219-L221 PolarHBondContact O-N 3.43Å; D219-S222 WeakPolarHBondContact O-CB 3.47Å; D219-S222 PolarHBondContact O-N 2.91Å; D219-S222 VanDerWaalsContact O-N 3.13Å; D219-S222 PolarHBondContact O-OG 2.91Å
220	E	92.7	Very high	81.5	Confident	141 Å²	141	80.6 Å²	80.6	66%	0.659	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-67	-19	178.5	66.1	-93	-161.3	0	0	115	K218	K218-E220 HydrophobicContact CB-CG 4.36Å; K218-E220 VanDerWaalsContact CD-OE1 3.31Å; K218-E220 WeakPolarHBondContact CD-OE1 3.35Å; K218-E220 PolarHBondContact O-N 2.91Å
221	L	93.8	Very high	84.2	Confident	39 Å²	39	79.8 Å²	79.8	20%	0.204	44%	0.436	C	S	.	.	G	3₁₀ helix	trans	-103.1	-3.5	176.6	-59.9	174.5	0	0	0	111.7	K218 D219 Y429 L430 E431	K218-L221 HydrophobicContact CB-CD1 4.39Å; K218-L221 HydrophobicContact CB-CG 4.48Å; K218-L221 HydrophobicContact CD-CD1 4.4Å; K218-L221 PolarHBondContact O-N 3.23Å; D219-L221 PolarHBondContact O-N 3.43Å; L221-Y429 HydrophobicContact CB-CE2 4.43Å; L221-Y429 HydrophobicContact CD1-CE2 3.81Å; L221-Y429 HydrophobicContact CD2-CE2 4.45Å; L221-Y429 HydrophobicContact CG-CE2 4.45Å; L221-L430 CarbonylContact O-C 3.39Å; L221-L430 WeakPolarHBondContact O-CA 3.27Å; L221-E431 HydrophobicContact CB-CG 4.44Å; L221-E431 PolarHBondContact O-N 2.92Å
222	S	96.9	Very high	86.8	Confident	47 Å²	47	82.6 Å²	82.6	33%	0.329	44%	0.438	S	S	.	.	B	Isolated β-bridge	trans	-73.9	137.7	-175.2	70.4	0	0	0	0	111.7	K218 D219 E431	K218-S222 PolarHBondContact O-N 2.85Å; K218-S222 VanDerWaalsContact O-N 3.15Å; D219-S222 WeakPolarHBondContact O-CB 3.47Å; D219-S222 PolarHBondContact O-N 2.91Å; D219-S222 VanDerWaalsContact O-N 3.13Å; D219-S222 PolarHBondContact O-OG 2.91Å; S222-E431 WeakPolarHBondContact CA-O 3.41Å
223	V	98.4	Very high	89.2	Confident	4 Å²	4	83.5 Å²	83.5	2%	0.024	45%	0.445	C	S	.	.	P	Polyproline II helix	trans	-64	129.5	167	-179	0	0	0	0	108.6	P244 I246 L388 L430 E431 C432 L440	V223-P244 HydrophobicContact CG1-CB 4.32Å; V223-I246 HydrophobicContact CB-CD1 4.34Å; V223-I246 HydrophobicContact CB-CG1 4.47Å; V223-I246 HydrophobicContact CG1-CD1 4.4Å; V223-I246 HydrophobicContact CG1-CG1 3.98Å; V223-L388 HydrophobicContact CG2-CD1 3.86Å; V223-L430 HydrophobicContact CG2-CB 3.75Å; V223-E431 PolarHBondContact N-O 2.79Å; V223-E431 VanDerWaalsContact N-O 3.13Å; V223-C432 HydrophobicContact CB-CB 4Å; V223-C432 HydrophobicContact CG2-CB 3.92Å; V223-L440 HydrophobicContact CG1-CD1 3.94Å
224	P	98.1	Very high	91.7	Very high	52 Å²	52	74.4 Å²	74.4	34%	0.338	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-61.8	144.3	179.7	25.1	-33.9	0	0	0	111.2	Y238 V245 I246	P224-Y238 HydrophobicContact CG-CE1 4.28Å; P224-V245 HydrophobicContact CG-CB 4.47Å; P224-V245 HydrophobicContact CG-CG2 4.27Å; P224-V245 WeakPolarHBondContact O-CG2 3.48Å; P224-I246 PolarHBondContact O-N 2.92Å
225	R	98.4	Very high	93.6	Very high	84 Å²	84	74.8 Å²	74.8	32%	0.317	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	129.3	177.6	-56.1	178.9	69.9	102.1	-4.4	109	I246 E248 D438	R225-I246 WeakPolarHBondContact CA-O 3.45Å; R225-I246 HydrophobicContact CB-CB 4.47Å; R225-I246 HydrophobicContact CG-CB 4.01Å; R225-I246 HydrophobicContact CG-CD1 4.11Å; R225-I246 HydrophobicContact CG-CG2 4.35Å; R225-E248 HydrophobicContact CB-CG 4.47Å; R225-E248 IonicContact CZ-OE1 3.13Å; R225-E248 VanDerWaalsContact CZ-OE1 3.23Å; R225-E248 IonicContact NE-OE1 3.58Å; R225-E248 PolarHBondContact NE-OE1 3.48Å; R225-E248 IonicContact NH2-OE1 3.24Å; R225-E248 PolarHBondContact NH2-OE1 2.97Å; R225-D438 IonicContact CZ-OD1 2.75Å; R225-D438 IonicContact CZ-OD2 3.48Å; R225-D438 VanDerWaalsContact CZ-OD2 3.26Å; R225-D438 IonicContact NH1-OD2 3.49Å; R225-D438 PolarHBondContact NH1-OD2 2.81Å; R225-D438 IonicContact NH2-OD1 3.43Å; R225-D438 PolarHBondContact NH2-OD1 3.47Å; R225-D438 IonicContact NH2-OD2 2.84Å; R225-D438 PolarHBondContact NH2-OD2 3.06Å
226	I	98.4	Very high	95.3	Very high	35 Å²	35	74.6 Å²	74.6	18%	0.179	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	138.5	178.5	62.6	-177.8	0	0	0	110.3	P229 Y238 V245 I246 L247 E248	I226-P229 HydrophobicContact CD1-CB 3.82Å; I226-P229 HydrophobicContact CD1-CG 3.55Å; I226-P229 HydrophobicContact CG1-CB 4.44Å; I226-P229 HydrophobicContact CG1-CG 3.96Å; I226-Y238 HydrophobicContact CD1-CD2 3.98Å; I226-Y238 HydrophobicContact CD1-CE2 3.34Å; I226-Y238 WeakPolarHBondContact CG2-OH 3.36Å; I226-V245 HydrophobicContact CD1-CG2 3.62Å; I226-V245 HydrophobicContact CG1-CG2 3.64Å; I226-V245 HydrophobicContact CG2-CG2 4.4Å; I226-I246 PolarHBondContact N-O 3.29Å; I226-L247 HydrophobicContact CD1-CD2 3.79Å; I226-L247 HydrophobicContact CG1-CD2 3.72Å; I226-L247 WeakPolarHBondContact O-CA 3.5Å; I226-E248 PolarHBondContact O-N 3.37Å
227	K	98.5	Very high	96.3	Very high	161 Å²	161	70 Å²	70	70%	0.7	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93	120.1	-178.3	-171.9	173.2	-175.6	172.2	0	110.8	E248	K227-E248 WeakPolarHBondContact CA-O 3.4Å; K227-E248 HydrophobicContact CB-CB 4.46Å
228	C	97.9	Very high	96.9	Very high	66 Å²	66	70.2 Å²	70.2	45%	0.446	37%	0.371	S	S	.	.	S	Bend	trans	38.2	57.7	173.8	-53.1	0	0	0	0	114.3	E248 G249	C228-E248 PolarHBondContact N-O 3.1Å; C228-E248 PolarHBondContact SG-O 2.78Å; C228-G249 VanDerWaalsContact SG-C 3.56Å
229	P	98.4	Very high	97.3	Very high	17 Å²	17	65.1 Å²	65.1	11%	0.11	35%	0.35	C	S	.	.			trans	-62.3	151.7	178.1	30.5	-38.2	0	0	0	111.1	I226 F234 L247 Y342	I226-P229 HydrophobicContact CD1-CB 3.82Å; I226-P229 HydrophobicContact CD1-CG 3.55Å; I226-P229 HydrophobicContact CG1-CB 4.44Å; I226-P229 HydrophobicContact CG1-CG 3.96Å; P229-F234 HydrophobicContact CG-CB 4.31Å; P229-L247 HydrophobicContact CG-CD2 3.73Å; P229-Y342 WeakPolarHBondContact CD-OH 3.31Å; P229-Y342 HydrophobicContact CG-CE1 4.1Å; P229-Y342 WeakPolarHBondContact O-CE1 3.38Å; P229-Y342 PolarHBondContact O-OH 3.45Å
230	S	98.6	Very high	97.8	Very high	70 Å²	70	64.8 Å²	64.8	49%	0.49	35%	0.347	S	S	.	.			trans	-61.9	154.7	169	66.5	0	0	0	0	110.7	E232 S233 F234	S230-E232 PolarHBondContact O-N 3.19Å; S230-S233 PolarHBondContact O-N 3.41Å; S230-S233 VanDerWaalsContact O-N 3.11Å; S230-S233 VanDerWaalsContact OG-CB 3.27Å; S230-S233 WeakPolarHBondContact OG-CB 3.49Å; S230-S233 PolarHBondContact OG-N 3.14Å; S230-S233 VanDerWaalsContact OG-N 3.12Å; S230-F234 PolarHBondContact O-N 3.34Å
231	L	98.5	Very high	98.1	Very high	70 Å²	70	60.6 Å²	60.6	37%	0.366	33%	0.332	S	S	.	.	H	α-helix	trans	-53.2	-43.8	174.1	-68.6	175	0	0	0	111.5	S233 F234 N235 Y342 L345	L231-S233 PolarHBondContact O-N 2.86Å; L231-F234 PolarHBondContact O-N 2.76Å; L231-N235 WeakPolarHBondContact O-CB 3.26Å; L231-N235 PolarHBondContact O-N 3.5Å; L231-Y342 HydrophobicContact CD2-CD1 3.63Å; L231-Y342 HydrophobicContact CD2-CE1 4.08Å; L231-Y342 HydrophobicContact CD2-CG 4.17Å; L231-L345 HydrophobicContact CB-CD2 4.47Å; L231-L345 HydrophobicContact CD2-CD1 4.21Å; L231-L345 HydrophobicContact CD2-CG 4.42Å
232	E	98.4	Very high	98.3	Very high	160 Å²	160	61.8 Å²	61.8	75%	0.748	34%	0.339	S	S	*	.	H	α-helix	trans	-60.1	-46.3	176.5	-177.3	-178.9	-165.2	0	0	112.1	S230 N235 A236	S230-E232 PolarHBondContact O-N 3.19Å; E232-N235 PolarHBondContact O-N 3.36Å; E232-A236 WeakPolarHBondContact O-CB 3.44Å; E232-A236 PolarHBondContact O-N 2.98Å
233	S	98.4	Very high	98.4	Very high	43 Å²	43	65 Å²	65	30%	0.301	35%	0.347	S	S	.	.	H	α-helix	trans	-66.4	-40.5	179.2	179.4	0	0	0	0	111.8	S230 L231 N237	S230-S233 PolarHBondContact O-N 3.41Å; S230-S233 VanDerWaalsContact O-N 3.11Å; S230-S233 VanDerWaalsContact OG-CB 3.27Å; S230-S233 WeakPolarHBondContact OG-CB 3.49Å; S230-S233 PolarHBondContact OG-N 3.14Å; S230-S233 VanDerWaalsContact OG-N 3.12Å; L231-S233 PolarHBondContact O-N 2.86Å; S233-N237 VanDerWaalsContact O-CB 3.26Å; S233-N237 WeakPolarHBondContact O-CB 3.24Å; S233-N237 PolarHBondContact O-N 2.92Å; S233-N237 VanDerWaalsContact O-N 3.17Å; S233-N237 PolarHBondContact O-ND2 3.44Å; S233-N237 PolarHBondContact OG-ND2 2.71Å
234	F	98.7	Very high	98.4	Very high	0 Å²	0	65 Å²	65	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-63.4	-47.4	175	174.1	-102.2	0	0	0	110.8	P229 S230 L231 Y238 L239 V245 L247 Y342 L345 F376 F441	P229-F234 HydrophobicContact CG-CB 4.31Å; S230-F234 PolarHBondContact O-N 3.34Å; L231-F234 PolarHBondContact O-N 2.76Å; F234-Y238 HydrophobicContact CD2-CD2 4.37Å; F234-Y238 WeakPolarHBondContact O-CA 3.49Å; F234-Y238 WeakPolarHBondContact O-CB 3.48Å; F234-Y238 PolarHBondContact O-N 3.48Å; F234-L239 HydrophobicContact CD1-CB 4.33Å; F234-L239 HydrophobicContact CE1-CB 3.91Å; F234-L239 HydrophobicContact CE1-CD2 4.34Å; F234-L239 HydrophobicContact CZ-CB 4.4Å; F234-L239 PolarHBondContact O-N 3.46Å; F234-L239 VanDerWaalsContact O-N 3.08Å; F234-V245 HydrophobicContact CD2-CG1 4.37Å; F234-V245 HydrophobicContact CE2-CG1 4.01Å; F234-L247 HydrophobicContact CD2-CD1 4.28Å; F234-L247 HydrophobicContact CD2-CD2 4.07Å; F234-L247 HydrophobicContact CE2-CD1 4.14Å; F234-L247 HydrophobicContact CE2-CD2 4.38Å; F234-Y342 HydrophobicContact CB-CD1 3.66Å; F234-Y342 HydrophobicContact CB-CE1 3.7Å; F234-Y342 AromaticContact CD1-CD1 3.53Å; F234-Y342 HydrophobicContact CD1-CD1 3.53Å; F234-Y342 HydrophobicContact CD1-CE1 4.41Å; F234-Y342 HydrophobicContact CD1-CG 4.14Å; F234-Y342 HydrophobicContact CD2-CD1 4.3Å; F234-Y342 HydrophobicContact CE1-CD1 4.25Å; F234-Y342 HydrophobicContact CE1-CG 4.42Å; F234-Y342 AromaticContact CG-CD1 3.55Å; F234-Y342 HydrophobicContact CG-CD1 3.55Å; F234-Y342 AromaticContact CG-CE1 4Å; F234-Y342 HydrophobicContact CG-CE1 4Å; F234-Y342 HydrophobicContact CG-CG 4.37Å; F234-L345 HydrophobicContact CD1-CD1 3.71Å; F234-L345 HydrophobicContact CE1-CD1 4.25Å; F234-F376 AromaticContact CE1-CZ 4Å; F234-F376 HydrophobicContact CE1-CZ 4Å; F234-F376 HydrophobicContact CE2-CE1 4.21Å; F234-F376 HydrophobicContact CE2-CZ 4.32Å; F234-F376 AromaticContact CZ-CE1 3.86Å; F234-F376 HydrophobicContact CZ-CE1 3.86Å; F234-F376 AromaticContact CZ-CZ 3.6Å; F234-F376 HydrophobicContact CZ-CZ 3.6Å; F234-F441 HydrophobicContact CE2-CB 4.17Å; F234-F441 AromaticContact CE2-CD1 3.91Å; F234-F441 HydrophobicContact CE2-CD1 3.91Å; F234-F441 HydrophobicContact CE2-CD2 4.44Å; F234-F441 HydrophobicContact CE2-CE1 4.44Å; F234-F441 AromaticContact CE2-CG 3.91Å; F234-F441 HydrophobicContact CE2-CG 3.91Å; F234-F441 HydrophobicContact CZ-CB 4.41Å; F234-F441 AromaticContact CZ-CD1 3.92Å; F234-F441 HydrophobicContact CZ-CD1 3.92Å; F234-F441 AromaticContact CZ-CD2 3.87Å; F234-F441 HydrophobicContact CZ-CD2 3.87Å; F234-F441 HydrophobicContact CZ-CE1 4.12Å; F234-F441 HydrophobicContact CZ-CE2 4.08Å; F234-F441 AromaticContact CZ-CG 3.79Å; F234-F441 HydrophobicContact CZ-CG 3.79Å; F234-F441 HydrophobicContact CZ-CZ 4.21Å
235	N	98.4	Very high	98.4	Very high	47 Å²	47	62.5 Å²	62.5	25%	0.251	33%	0.331	S	S	.	.	I	π-helix	trans	-59.7	-54	-177.8	-167.7	19.6	0	0	0	111.8	L231 E232 L239 L240 L345	L231-N235 WeakPolarHBondContact O-CB 3.26Å; L231-N235 PolarHBondContact O-N 3.5Å; E232-N235 PolarHBondContact O-N 3.36Å; N235-L239 PolarHBondContact O-N 2.94Å; N235-L239 WeakPolarHBondContact OD1-CD2 3.38Å; N235-L240 WeakPolarHBondContact O-CB 3.28Å; N235-L240 WeakPolarHBondContact O-CG 3.42Å; N235-L240 PolarHBondContact O-N 2.85Å; N235-L240 WeakPolarHBondContact OD1-CG 3.35Å; N235-L345 HydrophobicContact CB-CD1 3.99Å; N235-L345 HydrophobicContact CB-CD2 4.44Å
236	A	98.4	Very high	98.4	Very high	57 Å²	57	58.6 Å²	58.6	47%	0.471	32%	0.316	S	S	.	.	I	π-helix	trans	-69	-36.9	-175.4	0	0	0	0	0	113.6	E232 P241	E232-A236 WeakPolarHBondContact O-CB 3.44Å; E232-A236 PolarHBondContact O-N 2.98Å; A236-P241 WeakPolarHBondContact O-CD 3.07Å
237	N	98.4	Very high	98.5	Very high	84 Å²	84	56.9 Å²	56.9	45%	0.449	31%	0.307	S	S	.	.	I	π-helix	trans	-98.6	-18	-170.6	-60.6	-57.8	0	0	0	114.3	S233 P241	S233-N237 VanDerWaalsContact O-CB 3.26Å; S233-N237 WeakPolarHBondContact O-CB 3.24Å; S233-N237 PolarHBondContact O-N 2.92Å; S233-N237 VanDerWaalsContact O-N 3.17Å; S233-N237 PolarHBondContact O-ND2 3.44Å; S233-N237 PolarHBondContact OG-ND2 2.71Å; N237-P241 WeakPolarHBondContact O-CG 3.3Å
238	Y	98.4	Very high	98.5	Very high	39 Å²	39	52.1 Å²	52.1	15%	0.153	29%	0.287	C	S	.	.	I	π-helix	trans	-132.9	-51.7	-173.3	-56.8	-80.9	0	0	0	113.9	P224 I226 F234 L242 K243 V245	P224-Y238 HydrophobicContact CG-CE1 4.28Å; I226-Y238 HydrophobicContact CD1-CD2 3.98Å; I226-Y238 HydrophobicContact CD1-CE2 3.34Å; I226-Y238 WeakPolarHBondContact CG2-OH 3.36Å; F234-Y238 HydrophobicContact CD2-CD2 4.37Å; F234-Y238 WeakPolarHBondContact O-CA 3.49Å; F234-Y238 WeakPolarHBondContact O-CB 3.48Å; F234-Y238 PolarHBondContact O-N 3.48Å; Y238-L242 WeakPolarHBondContact O-CA 3.05Å; Y238-L242 PolarHBondContact O-N 3.48Å; Y238-K243 HydrophobicContact CD1-CB 4.16Å; Y238-K243 PolarHBondContact O-N 2.74Å; Y238-V245 HydrophobicContact CD1-CB 3.43Å; Y238-V245 VanDerWaalsContact CD1-CB 3.43Å; Y238-V245 HydrophobicContact CD1-CG1 3.63Å; Y238-V245 HydrophobicContact CD1-CG2 3.88Å; Y238-V245 HydrophobicContact CD2-CG1 4.32Å; Y238-V245 HydrophobicContact CE1-CB 3.6Å; Y238-V245 HydrophobicContact CE1-CG1 4.19Å; Y238-V245 HydrophobicContact CE1-CG2 3.54Å; Y238-V245 HydrophobicContact CE2-CG2 4.45Å; Y238-V245 HydrophobicContact CG-CB 4.02Å; Y238-V245 HydrophobicContact CG-CG1 3.68Å; Y238-V245 HydrophobicContact CG-CG2 4.44Å
239	L	98.4	Very high	98.5	Very high	15 Å²	15	49.9 Å²	49.9	8%	0.079	28%	0.275	C	S	.	.	I	π-helix	trans	-65.6	-61.4	-178.4	-177	57.8	0	0	0	112.1	F234 N235 L242 L345 Q374 F441 W463	F234-L239 HydrophobicContact CD1-CB 4.33Å; F234-L239 HydrophobicContact CE1-CB 3.91Å; F234-L239 HydrophobicContact CE1-CD2 4.34Å; F234-L239 HydrophobicContact CZ-CB 4.4Å; F234-L239 PolarHBondContact O-N 3.46Å; F234-L239 VanDerWaalsContact O-N 3.08Å; N235-L239 PolarHBondContact O-N 2.94Å; N235-L239 WeakPolarHBondContact OD1-CD2 3.38Å; L239-L242 WeakPolarHBondContact O-CD2 3.21Å; L239-L242 PolarHBondContact O-N 2.86Å; L239-L345 HydrophobicContact CD2-CB 3.74Å; L239-L345 HydrophobicContact CD2-CD1 4.15Å; L239-Q374 HydrophobicContact CD1-CG 4.35Å; L239-F441 HydrophobicContact CD1-CE2 4.17Å; L239-F441 HydrophobicContact CD1-CZ 3.66Å; L239-W463 HydrophobicContact CD1-CH2 3.54Å; L239-W463 HydrophobicContact CD1-CZ2 4.08Å; L239-W463 HydrophobicContact CD1-CZ3 4.35Å; L239-W463 HydrophobicContact CD2-CH2 3.69Å; L239-W463 HydrophobicContact CD2-CZ3 4.27Å; L239-W463 HydrophobicContact CG-CH2 4.26Å
240	L	97.9	Very high	98.5	Very high	129 Å²	129	50.2 Å²	50.2	68%	0.675	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-43.6	179.8	-67.2	176.3	0	0	0	113.9	N235 L242	N235-L240 WeakPolarHBondContact O-CB 3.28Å; N235-L240 WeakPolarHBondContact O-CG 3.42Å; N235-L240 PolarHBondContact O-N 2.85Å; N235-L240 WeakPolarHBondContact OD1-CG 3.35Å; L240-L242 PolarHBondContact O-N 3.41Å
241	P	98	Very high	98.5	Very high	54 Å²	54	46.9 Å²	46.9	35%	0.351	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	3.7	177.2	33.4	-36.9	0	0	0	113.9	A236 N237 K243	A236-P241 WeakPolarHBondContact O-CD 3.07Å; N237-P241 WeakPolarHBondContact O-CG 3.3Å; P241-K243 HydrophobicContact CB-CD 4.28Å; P241-K243 HydrophobicContact CB-CG 4.22Å; P241-K243 HydrophobicContact CG-CD 4.21Å; P241-K243 HydrophobicContact CG-CG 4.24Å; P241-K243 PolarHBondContact O-N 3.34Å
242	L	98.3	Very high	98.4	Very high	64 Å²	64	47.8 Å²	47.8	34%	0.335	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	52	55.4	-179.1	-58.9	173.7	0	0	0	112.8	Y238 L239 L240 P443 V444 Y446	Y238-L242 WeakPolarHBondContact O-CA 3.05Å; Y238-L242 PolarHBondContact O-N 3.48Å; L239-L242 WeakPolarHBondContact O-CD2 3.21Å; L239-L242 PolarHBondContact O-N 2.86Å; L240-L242 PolarHBondContact O-N 3.41Å; L242-P443 HydrophobicContact CB-CB 3.93Å; L242-P443 HydrophobicContact CD2-CB 3.94Å; L242-V444 HydrophobicContact CD2-CG1 3.94Å; L242-Y446 WeakPolarHBondContact O-CE2 3.27Å; L242-Y446 PolarHBondContact O-OH 3.11Å
243	K	98.4	Very high	98.3	Very high	115 Å²	115	45.6 Å²	45.6	50%	0.5	25%	0.247	S	C	.	.			trans	-110.3	125.5	179.6	-68.4	-179.7	179.3	174.5	0	111.3	Y238 P241 F441	Y238-K243 HydrophobicContact CD1-CB 4.16Å; Y238-K243 PolarHBondContact O-N 2.74Å; P241-K243 HydrophobicContact CB-CD 4.28Å; P241-K243 HydrophobicContact CB-CG 4.22Å; P241-K243 HydrophobicContact CG-CD 4.21Å; P241-K243 HydrophobicContact CG-CG 4.24Å; P241-K243 PolarHBondContact O-N 3.34Å; K243-F441 WeakPolarHBondContact O-CD1 3.31Å
244	P	98.8	Very high	98.3	Very high	3 Å²	3	43.7 Å²	43.7	2%	0.019	23%	0.234	C	C	.	.			trans	-61.1	144.9	173.4	-20.6	31	0	0	0	112.3	V223 L388 L430 F441 P443 Y446	V223-P244 HydrophobicContact CG1-CB 4.32Å; P244-L388 HydrophobicContact CB-CD1 3.45Å; P244-L388 VanDerWaalsContact CB-CD1 3.45Å; P244-L388 HydrophobicContact CG-CD1 3.77Å; P244-L430 HydrophobicContact CG-CD1 4.36Å; P244-F441 WeakPolarHBondContact CA-O 3.48Å; P244-P443 HydrophobicContact CG-CG 4.14Å; P244-Y446 HydrophobicContact CG-CD1 3.64Å; P244-Y446 HydrophobicContact CG-CE1 3.38Å; P244-Y446 HydrophobicContact CG-CG 4.31Å
245	V	98.9	Very high	98.3	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	146.7	177.7	64.7	0	0	0	0	110.9	P224 I226 F234 Y238 L247 F441	P224-V245 HydrophobicContact CG-CB 4.47Å; P224-V245 HydrophobicContact CG-CG2 4.27Å; P224-V245 WeakPolarHBondContact O-CG2 3.48Å; I226-V245 HydrophobicContact CD1-CG2 3.62Å; I226-V245 HydrophobicContact CG1-CG2 3.64Å; I226-V245 HydrophobicContact CG2-CG2 4.4Å; F234-V245 HydrophobicContact CD2-CG1 4.37Å; F234-V245 HydrophobicContact CE2-CG1 4.01Å; Y238-V245 HydrophobicContact CD1-CB 3.43Å; Y238-V245 VanDerWaalsContact CD1-CB 3.43Å; Y238-V245 HydrophobicContact CD1-CG1 3.63Å; Y238-V245 HydrophobicContact CD1-CG2 3.88Å; Y238-V245 HydrophobicContact CD2-CG1 4.32Å; Y238-V245 HydrophobicContact CE1-CB 3.6Å; Y238-V245 HydrophobicContact CE1-CG1 4.19Å; Y238-V245 HydrophobicContact CE1-CG2 3.54Å; Y238-V245 HydrophobicContact CE2-CG2 4.45Å; Y238-V245 HydrophobicContact CG-CB 4.02Å; Y238-V245 HydrophobicContact CG-CG1 3.68Å; Y238-V245 HydrophobicContact CG-CG2 4.44Å; V245-L247 HydrophobicContact CG1-CD2 3.89Å; V245-L247 HydrophobicContact CG1-CG 4.45Å; V245-L247 HydrophobicContact CG2-CD2 4.44Å; V245-F441 HydrophobicContact CG1-CB 3.88Å; V245-F441 HydrophobicContact CG1-CD1 4.21Å; V245-F441 PolarHBondContact N-O 2.89Å; V245-F441 PolarHBondContact O-N 2.92Å
246	I	98.9	Very high	98.2	Very high	1 Å²	1	42 Å²	42	1%	0.005	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	122.4	169.1	-64	170.8	0	0	0	108.8	V223 P224 R225 I226 E248 C432 L434 D438 V439 L440	V223-I246 HydrophobicContact CB-CD1 4.34Å; V223-I246 HydrophobicContact CB-CG1 4.47Å; V223-I246 HydrophobicContact CG1-CD1 4.4Å; V223-I246 HydrophobicContact CG1-CG1 3.98Å; P224-I246 PolarHBondContact O-N 2.92Å; R225-I246 WeakPolarHBondContact CA-O 3.45Å; R225-I246 HydrophobicContact CB-CB 4.47Å; R225-I246 HydrophobicContact CG-CB 4.01Å; R225-I246 HydrophobicContact CG-CD1 4.11Å; R225-I246 HydrophobicContact CG-CG2 4.35Å; I226-I246 PolarHBondContact N-O 3.29Å; I246-E248 HydrophobicContact CG2-CG 4.21Å; I246-C432 HydrophobicContact CD1-CB 3.72Å; I246-L434 HydrophobicContact CD1-CD1 4.21Å; I246-L434 HydrophobicContact CG1-CD1 4.15Å; I246-L434 HydrophobicContact CG2-CD1 4.36Å; I246-D438 HydrophobicContact CG2-CB 3.87Å; I246-V439 CarbonylContact C-O 3.6Å; I246-V439 WeakPolarHBondContact CA-O 3.37Å; I246-L440 HydrophobicContact CG1-CD1 3.87Å
247	L	98.9	Very high	98.1	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	116.3	174	-53	-178.8	0	0	0	108.7	I226 P229 F234 V245 I250 Y342 F376 V439	I226-L247 HydrophobicContact CD1-CD2 3.79Å; I226-L247 HydrophobicContact CG1-CD2 3.72Å; I226-L247 WeakPolarHBondContact O-CA 3.5Å; P229-L247 HydrophobicContact CG-CD2 3.73Å; F234-L247 HydrophobicContact CD2-CD1 4.28Å; F234-L247 HydrophobicContact CD2-CD2 4.07Å; F234-L247 HydrophobicContact CE2-CD1 4.14Å; F234-L247 HydrophobicContact CE2-CD2 4.38Å; V245-L247 HydrophobicContact CG1-CD2 3.89Å; V245-L247 HydrophobicContact CG1-CG 4.45Å; V245-L247 HydrophobicContact CG2-CD2 4.44Å; L247-I250 HydrophobicContact CB-CD1 3.72Å; L247-I250 HydrophobicContact CB-CG1 3.92Å; L247-I250 HydrophobicContact CB-CG2 4.17Å; L247-I250 HydrophobicContact CD1-CD1 3.73Å; L247-I250 HydrophobicContact CG-CD1 4.37Å; L247-Y342 HydrophobicContact CD1-CD2 3.89Å; L247-Y342 HydrophobicContact CD1-CE2 3.88Å; L247-Y342 HydrophobicContact CD1-CG 4.33Å; L247-F376 HydrophobicContact CD1-CD1 4.38Å; L247-F376 HydrophobicContact CD1-CE1 3.67Å; L247-F376 HydrophobicContact CD1-CZ 4.33Å; L247-V439 HydrophobicContact CB-CB 4.38Å; L247-V439 PolarHBondContact N-O 2.96Å; L247-V439 PolarHBondContact O-N 3.14Å; L247-V439 VanDerWaalsContact O-N 3.08Å
248	E	98.7	Very high	97.8	Very high	60 Å²	60	42.1 Å²	42.1	28%	0.28	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	141.1	178.9	-60.3	-179.2	126.6	0	0	110.3	R225 I226 K227 C228 I246 I250	R225-E248 HydrophobicContact CB-CG 4.47Å; R225-E248 IonicContact CZ-OE1 3.13Å; R225-E248 VanDerWaalsContact CZ-OE1 3.23Å; R225-E248 IonicContact NE-OE1 3.58Å; R225-E248 PolarHBondContact NE-OE1 3.48Å; R225-E248 IonicContact NH2-OE1 3.24Å; R225-E248 PolarHBondContact NH2-OE1 2.97Å; I226-E248 PolarHBondContact O-N 3.37Å; K227-E248 WeakPolarHBondContact CA-O 3.4Å; K227-E248 HydrophobicContact CB-CB 4.46Å; C228-E248 PolarHBondContact N-O 3.1Å; C228-E248 PolarHBondContact SG-O 2.78Å; I246-E248 HydrophobicContact CG2-CG 4.21Å; E248-I250 VanDerWaalsContact C-N 3.3Å; E248-I250 PolarHBondContact O-N 3.22Å
249	G	98	Very high	97.6	Very high	19 Å²	19	46.3 Å²	46.3	20%	0.196	24%	0.239	C	C	.	.	S	Bend	trans	82.2	-0.6	173.7	0	0	0	0	0	115.6	C228 D252	C228-G249 VanDerWaalsContact SG-C 3.56Å; G249-D252 WeakPolarHBondContact CA-OD2 3.46Å
250	I	98.3	Very high	97.3	Very high	24 Å²	24	49.2 Å²	49.2	12%	0.123	25%	0.252	C	S	.	.	S	Bend	trans	-83.9	-18.2	-174.6	67.2	153.8	0	0	0	113.2	L247 E248 H253 P340 Y342 V439	L247-I250 HydrophobicContact CB-CD1 3.72Å; L247-I250 HydrophobicContact CB-CG1 3.92Å; L247-I250 HydrophobicContact CB-CG2 4.17Å; L247-I250 HydrophobicContact CD1-CD1 3.73Å; L247-I250 HydrophobicContact CG-CD1 4.37Å; E248-I250 VanDerWaalsContact C-N 3.3Å; E248-I250 PolarHBondContact O-N 3.22Å; I250-H253 PolarHBondContact O-CE1 2.98Å; I250-H253 PolarHBondContact O-ND1 3.42Å; I250-P340 HydrophobicContact CD1-CB 4.42Å; I250-Y342 HydrophobicContact CB-CE2 4.25Å; I250-Y342 HydrophobicContact CD1-CD2 4.07Å; I250-Y342 HydrophobicContact CD1-CE2 3.82Å; I250-Y342 HydrophobicContact CG2-CE2 3.81Å; I250-V439 HydrophobicContact CD1-CB 3.83Å; I250-V439 HydrophobicContact CD1-CG1 4.16Å; I250-V439 HydrophobicContact CD1-CG2 3.73Å; I250-V439 HydrophobicContact CG1-CB 4.12Å; I250-V439 HydrophobicContact CG1-CG2 3.69Å
251	I	98.3	Very high	97.2	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.005	24%	0.241	C	C	.	.	S	Bend	trans	-118.1	3.3	177.5	61.8	167.3	0	0	0	113.5	H253 W254 L257 A378 G437 V439	I251-H253 PolarHBondContact O-N 3.38Å; I251-W254 HydrophobicContact CB-CD2 3.77Å; I251-W254 HydrophobicContact CB-CE3 4.24Å; I251-W254 HydrophobicContact CB-CG 4.02Å; I251-W254 HydrophobicContact CB-CZ2 4.17Å; I251-W254 HydrophobicContact CD1-CE3 4.36Å; I251-W254 HydrophobicContact CD1-CZ3 4.34Å; I251-W254 HydrophobicContact CG2-CD2 3.97Å; I251-W254 HydrophobicContact CG2-CE3 4.47Å; I251-W254 HydrophobicContact CG2-CH2 4Å; I251-W254 HydrophobicContact CG2-CZ2 3.4Å; I251-W254 VanDerWaalsContact CG2-CZ2 3.4Å; I251-W254 HydrophobicContact CG2-CZ3 4.5Å; I251-W254 VanDerWaalsContact O-CB 3.31Å; I251-W254 WeakPolarHBondContact O-CB 3.48Å; I251-W254 PolarHBondContact O-N 3.26Å; I251-L257 HydrophobicContact CD1-CD1 4.23Å; I251-L257 HydrophobicContact CG1-CD1 4.12Å; I251-L257 WeakPolarHBondContact O-CD1 3.25Å; I251-A378 HydrophobicContact CD1-CB 4.01Å; I251-G437 VanDerWaalsContact CG1-O 3.25Å; I251-G437 WeakPolarHBondContact CG1-O 3.33Å; I251-V439 HydrophobicContact CB-CG2 4.34Å; I251-V439 HydrophobicContact CD1-CG2 3.79Å; I251-V439 HydrophobicContact CG1-CG2 3.88Å; I251-V439 HydrophobicContact CG2-CG2 3.56Å
252	D	97.2	Very high	97.1	Very high	89 Å²	89	44.3 Å²	44.3	48%	0.476	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-20.2	-178.3	-71.4	6.1	0	0	0	113.3	G249 N258	G249-D252 WeakPolarHBondContact CA-OD2 3.46Å; D252-N258 PolarHBondContact O-ND2 2.67Å
253	H	96.7	Very high	97	Very high	113 Å²	113	43.4 Å²	43.4	52%	0.523	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-6.9	179.5	66.8	-88.5	0	0	0	113.9	I250 I251	I250-H253 PolarHBondContact O-CE1 2.98Å; I250-H253 PolarHBondContact O-ND1 3.42Å; I251-H253 PolarHBondContact O-N 3.38Å
254	W	98.4	Very high	96.9	Very high	3 Å²	3	39.3 Å²	39.3	1%	0.011	21%	0.209	C	C	.	.			trans	-60.5	136.2	-179.7	-78.7	10.4	0	0	0	111.3	I251 A256 L257 N258 I337 R338 A378 V380 V459 F461	I251-W254 HydrophobicContact CB-CD2 3.77Å; I251-W254 HydrophobicContact CB-CE3 4.24Å; I251-W254 HydrophobicContact CB-CG 4.02Å; I251-W254 HydrophobicContact CB-CZ2 4.17Å; I251-W254 HydrophobicContact CD1-CE3 4.36Å; I251-W254 HydrophobicContact CD1-CZ3 4.34Å; I251-W254 HydrophobicContact CG2-CD2 3.97Å; I251-W254 HydrophobicContact CG2-CE3 4.47Å; I251-W254 HydrophobicContact CG2-CH2 4Å; I251-W254 HydrophobicContact CG2-CZ2 3.4Å; I251-W254 VanDerWaalsContact CG2-CZ2 3.4Å; I251-W254 HydrophobicContact CG2-CZ3 4.5Å; I251-W254 VanDerWaalsContact O-CB 3.31Å; I251-W254 WeakPolarHBondContact O-CB 3.48Å; I251-W254 PolarHBondContact O-N 3.26Å; W254-A256 HydrophobicContact CB-CB 4.47Å; W254-A256 PolarHBondContact O-N 2.84Å; W254-L257 PolarHBondContact O-N 2.82Å; W254-L257 VanDerWaalsContact O-N 3.11Å; W254-N258 PolarHBondContact O-ND2 2.95Å; W254-I337 HydrophobicContact CD2-CB 4.22Å; W254-I337 HydrophobicContact CD2-CG2 4.27Å; W254-I337 HydrophobicContact CE3-CB 4.09Å; W254-I337 HydrophobicContact CE3-CG2 3.69Å; W254-I337 HydrophobicContact CH2-CB 4.16Å; W254-I337 HydrophobicContact CH2-CG2 4.24Å; W254-I337 HydrophobicContact CZ2-CB 4.29Å; W254-I337 HydrophobicContact CZ3-CB 4.06Å; W254-I337 HydrophobicContact CZ3-CG2 3.67Å; W254-R338 WeakPolarHBondContact CZ2-O 3.47Å; W254-R338 PolarHBondContact NE1-O 2.87Å; W254-A378 HydrophobicContact CH2-CB 3.58Å; W254-A378 HydrophobicContact CZ3-CB 3.94Å; W254-V380 HydrophobicContact CE3-CG2 4.28Å; W254-V380 HydrophobicContact CZ3-CG2 3.96Å; W254-V459 HydrophobicContact CH2-CB 4.44Å; W254-V459 HydrophobicContact CZ3-CB 4.45Å; W254-V459 HydrophobicContact CZ3-CG2 4.28Å; W254-F461 AromaticContact CH2-CE2 3.66Å; W254-F461 HydrophobicContact CH2-CE2 3.66Å; W254-F461 AromaticContact CH2-CZ 3.58Å; W254-F461 HydrophobicContact CH2-CZ 3.58Å; W254-F461 HydrophobicContact CZ2-CE2 4.02Å; W254-F461 AromaticContact CZ2-CZ 3.74Å; W254-F461 HydrophobicContact CZ2-CZ 3.74Å
255	P	98.2	Very high	96.7	Very high	11 Å²	11	44.9 Å²	44.9	7%	0.071	24%	0.235	C	C	.	.	H	α-helix	trans	-54	-35.8	171.1	-24.3	29.1	0	0	0	112.7	L257 N258 Q259 H260 D336	P255-L257 PolarHBondContact O-N 3.04Å; P255-N258 PolarHBondContact O-N 3.23Å; P255-Q259 HydrophobicContact CB-CB 4.25Å; P255-Q259 VanDerWaalsContact CB-OE1 3.23Å; P255-Q259 PolarHBondContact O-N 2.92Å; P255-H260 CarbonylContact O-C 3.59Å; P255-H260 PolarHBondContact O-N 3.3Å; P255-D336 HydrophobicContact CB-CB 4.27Å; P255-D336 VanDerWaalsContact CD-O 3.26Å; P255-D336 WeakPolarHBondContact CD-O 3.5Å
256	A	97.8	Very high	96.5	Very high	2 Å²	2	46.9 Å²	46.9	2%	0.017	24%	0.242	C	C	.	.	H	α-helix	trans	-55.1	-25.1	177.7	0	0	0	0	0	114.7	W254 H260 P261 W262 D336 I337 V380	W254-A256 HydrophobicContact CB-CB 4.47Å; W254-A256 PolarHBondContact O-N 2.84Å; A256-H260 WeakPolarHBondContact CA-O 3.21Å; A256-P261 WeakPolarHBondContact O-CA 3.3Å; A256-W262 HydrophobicContact CB-CD2 4.08Å; A256-W262 HydrophobicContact CB-CG 4.43Å; A256-W262 HydrophobicContact CB-CH2 4.46Å; A256-W262 HydrophobicContact CB-CZ2 3.83Å; A256-D336 HydrophobicContact CB-CB 3.96Å; A256-D336 WeakPolarHBondContact CB-O 3.49Å; A256-D336 PolarHBondContact N-O 3.13Å; A256-D336 VanDerWaalsContact N-O 3.13Å; A256-I337 HydrophobicContact CB-CG2 4.48Å; A256-V380 HydrophobicContact CB-CG1 3.82Å
257	L	95.4	Very high	96.4	Very high	46 Å²	46	47 Å²	47	24%	0.241	24%	0.243	C	C	.	.	H	α-helix	trans	-97.9	-17.8	179.6	-66.8	178	0	0	0	113.3	I251 W254 P255 V380	I251-L257 HydrophobicContact CD1-CD1 4.23Å; I251-L257 HydrophobicContact CG1-CD1 4.12Å; I251-L257 WeakPolarHBondContact O-CD1 3.25Å; W254-L257 PolarHBondContact O-N 2.82Å; W254-L257 VanDerWaalsContact O-N 3.11Å; P255-L257 PolarHBondContact O-N 3.04Å; L257-V380 HydrophobicContact CD2-CG1 4.02Å
258	N	92.8	Very high	96.2	Very high	97 Å²	97	50.9 Å²	50.9	52%	0.519	26%	0.258	S	S	.	.	H	α-helix	trans	-130.1	-60.9	-166.5	-57.5	-74.1	0	0	0	113.7	D252 W254 P255	D252-N258 PolarHBondContact O-ND2 2.67Å; W254-N258 PolarHBondContact O-ND2 2.95Å; P255-N258 PolarHBondContact O-N 3.23Å
259	Q	93.3	Very high	95.8	Very high	127 Å²	127	51.2 Å²	51.2	59%	0.593	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-40.9	-170.3	-65.2	137.3	21.8	0	0	111	P255 P261	P255-Q259 HydrophobicContact CB-CB 4.25Å; P255-Q259 VanDerWaalsContact CB-OE1 3.23Å; P255-Q259 PolarHBondContact O-N 2.92Å; Q259-P261 VanDerWaalsContact C-CD 3.42Å; Q259-P261 WeakPolarHBondContact O-CD 3.22Å
260	H	93.1	Very high	95.6	Very high	76 Å²	76	50.7 Å²	50.7	35%	0.352	26%	0.26	S	S	.	.	S	Bend	trans	-124.1	65	-179.7	-56.7	152.1	0	0	0	109	P255 A256 W262 Y266 D336	P255-H260 CarbonylContact O-C 3.59Å; P255-H260 PolarHBondContact O-N 3.3Å; A256-H260 WeakPolarHBondContact CA-O 3.21Å; H260-W262 PolarHBondContact O-N 3.16Å; H260-W262 VanDerWaalsContact O-N 3.13Å; H260-Y266 HydrophobicContact CB-CE1 4.14Å; H260-Y266 HydrophobicContact CB-CE2 3.83Å; H260-D336 IonicContact CE1-OD1 3.1Å; H260-D336 IonicContact CG-OD1 3.45Å; H260-D336 IonicContact ND1-OD1 3.74Å; H260-D336 PolarHBondContact ND1-OD1 3.39Å
261	P	94.6	Very high	95.4	Very high	69 Å²	69	49.6 Å²	49.6	45%	0.448	25%	0.254	S	S	.	.			trans	-56.4	125.7	177.4	25.3	-33.4	0	0	0	109	A256 Q259 S263	A256-P261 WeakPolarHBondContact O-CA 3.3Å; Q259-P261 VanDerWaalsContact C-CD 3.42Å; Q259-P261 WeakPolarHBondContact O-CD 3.22Å; P261-S263 PolarHBondContact O-N 3.34Å; P261-S263 PolarHBondContact O-OG 3.03Å
262	W	97.2	Very high	95.3	Very high	10 Å²	10	49.6 Å²	49.6	4%	0.038	26%	0.255	C	S	.	.			trans	-70.4	60.4	-178.8	-69.3	-3	0	0	0	112.5	A256 H260 Y266 L267 F327 L333 D336 I337 V380 V381 F457 V459	A256-W262 HydrophobicContact CB-CD2 4.08Å; A256-W262 HydrophobicContact CB-CG 4.43Å; A256-W262 HydrophobicContact CB-CH2 4.46Å; A256-W262 HydrophobicContact CB-CZ2 3.83Å; H260-W262 PolarHBondContact O-N 3.16Å; H260-W262 VanDerWaalsContact O-N 3.13Å; W262-Y266 AromaticContact CD1-CD1 3.8Å; W262-Y266 AromaticContact CD1-CE1 3.72Å; W262-L267 HydrophobicContact CB-CD2 4.22Å; W262-L267 HydrophobicContact CB-CG 4.41Å; W262-L267 HydrophobicContact CG-CD2 4.27Å; W262-F327 AromaticContact CH2-CE1 3.62Å; W262-F327 HydrophobicContact CH2-CE1 3.62Å; W262-F327 AromaticContact CH2-CZ 3.87Å; W262-F327 HydrophobicContact CH2-CZ 3.87Å; W262-F327 HydrophobicContact CZ2-CE1 4.04Å; W262-L333 HydrophobicContact CZ2-CD2 4.39Å; W262-D336 HydrophobicContact CZ2-CB 4.04Å; W262-D336 PolarHBondContact NE1-OD2 2.94Å; W262-I337 HydrophobicContact CH2-CG2 3.72Å; W262-I337 HydrophobicContact CZ2-CG2 3.74Å; W262-V380 HydrophobicContact CD2-CG1 3.94Å; W262-V380 HydrophobicContact CE3-CB 3.94Å; W262-V380 HydrophobicContact CE3-CG1 3.58Å; W262-V380 HydrophobicContact CE3-CG2 4.27Å; W262-V380 HydrophobicContact CG-CG1 4.38Å; W262-V380 HydrophobicContact CH2-CG2 4.42Å; W262-V380 HydrophobicContact CZ3-CB 4.03Å; W262-V380 HydrophobicContact CZ3-CG1 4.02Å; W262-V380 HydrophobicContact CZ3-CG2 3.86Å; W262-V381 HydrophobicContact CB-CG2 3.91Å; W262-F457 HydrophobicContact CE3-CB 4.27Å; W262-F457 AromaticContact CE3-CD1 3.66Å; W262-F457 HydrophobicContact CE3-CD1 3.66Å; W262-F457 AromaticContact CE3-CD2 3.87Å; W262-F457 HydrophobicContact CE3-CD2 3.87Å; W262-F457 AromaticContact CE3-CE1 3.88Å; W262-F457 HydrophobicContact CE3-CE1 3.88Å; W262-F457 HydrophobicContact CE3-CE2 4.06Å; W262-F457 AromaticContact CE3-CG 3.67Å; W262-F457 HydrophobicContact CE3-CG 3.67Å; W262-F457 HydrophobicContact CE3-CZ 4.07Å; W262-F457 HydrophobicContact CH2-CE1 4.19Å; W262-F457 AromaticContact CZ3-CD1 3.39Å; W262-F457 HydrophobicContact CZ3-CD1 3.39Å; W262-F457 HydrophobicContact CZ3-CD2 4.37Å; W262-F457 AromaticContact CZ3-CE1 3.38Å; W262-F457 HydrophobicContact CZ3-CE1 3.38Å; W262-F457 HydrophobicContact CZ3-CE2 4.35Å; W262-F457 AromaticContact CZ3-CG 3.93Å; W262-F457 HydrophobicContact CZ3-CG 3.93Å; W262-F457 AromaticContact CZ3-CZ 3.89Å; W262-F457 HydrophobicContact CZ3-CZ 3.89Å; W262-V459 HydrophobicContact CH2-CG2 3.68Å; W262-V459 HydrophobicContact CZ3-CG2 3.78Å
263	S	95.7	Very high	95.2	Very high	46 Å²	46	46.4 Å²	46.4	32%	0.322	24%	0.239	S	C	.	.			trans	-67.8	160.6	167.1	59.1	0	0	0	0	110.5	P261 E265 Y266 L267	P261-S263 PolarHBondContact O-N 3.34Å; P261-S263 PolarHBondContact O-OG 3.03Å; S263-E265 PolarHBondContact O-N 3.48Å; S263-Y266 PolarHBondContact O-N 2.98Å; S263-Y266 VanDerWaalsContact OG-CB 3.3Å; S263-Y266 WeakPolarHBondContact OG-CB 3.26Å; S263-Y266 PolarHBondContact OG-N 3.08Å; S263-L267 VanDerWaalsContact O-CG 3.31Å; S263-L267 WeakPolarHBondContact O-CG 3.4Å; S263-L267 PolarHBondContact O-N 2.79Å
264	I	95.4	Very high	95.2	Very high	28 Å²	28	41 Å²	41	14%	0.144	21%	0.214	C	C	.	.	H	α-helix	trans	-58.5	-41.9	176.8	-62.1	-58.7	0	0	0	110.4	L267 R268 I300 I304 L305 F359	I264-L267 PolarHBondContact O-N 3.47Å; I264-R268 HydrophobicContact CG2-CG 4.39Å; I264-R268 VanDerWaalsContact O-CG 3.27Å; I264-R268 WeakPolarHBondContact O-CG 3.09Å; I264-R268 PolarHBondContact O-N 2.95Å; I264-I300 HydrophobicContact CG2-CD1 4.4Å; I264-I300 HydrophobicContact CG2-CG2 3.6Å; I264-I304 HydrophobicContact CD1-CG2 3.77Å; I264-L305 HydrophobicContact CG1-CD2 4.41Å; I264-L305 HydrophobicContact CG2-CD1 4.1Å; I264-L305 HydrophobicContact CG2-CD2 4.31Å; I264-L305 HydrophobicContact CG2-CG 4.42Å; I264-F359 HydrophobicContact CD1-CZ 4.13Å
265	E	94.2	Very high	95.2	Very high	120 Å²	120	41 Å²	41	56%	0.561	21%	0.214	S	C	*	.	H	α-helix	trans	-61.9	-46.3	178.7	-62.4	73.6	-161.9	0	0	111.4	S263 R268 S269	S263-E265 PolarHBondContact O-N 3.48Å; E265-R268 PolarHBondContact O-N 3.39Å; E265-S269 PolarHBondContact O-N 3.41Å
266	Y	95.4	Very high	95.1	Very high	42 Å²	42	40.4 Å²	40.4	17%	0.165	21%	0.211	C	C	.	.	H	α-helix	trans	-60.3	-50.9	176.1	-178.6	-100.1	0	0	0	111.1	H260 W262 S263 R268 S269 V270 L333 D336	H260-Y266 HydrophobicContact CB-CE1 4.14Å; H260-Y266 HydrophobicContact CB-CE2 3.83Å; W262-Y266 AromaticContact CD1-CD1 3.8Å; W262-Y266 AromaticContact CD1-CE1 3.72Å; S263-Y266 PolarHBondContact O-N 2.98Å; S263-Y266 VanDerWaalsContact OG-CB 3.3Å; S263-Y266 WeakPolarHBondContact OG-CB 3.26Å; S263-Y266 PolarHBondContact OG-N 3.08Å; Y266-R268 VanDerWaalsContact C-N 3.34Å; Y266-R268 PolarHBondContact O-N 2.94Å; Y266-S269 WeakPolarHBondContact O-CB 3.49Å; Y266-S269 PolarHBondContact O-N 2.81Å; Y266-S269 PolarHBondContact O-OG 3.1Å; Y266-V270 HydrophobicContact CD1-CG2 4.2Å; Y266-V270 HydrophobicContact CD2-CG1 4.39Å; Y266-V270 HydrophobicContact CE1-CG1 4.08Å; Y266-V270 HydrophobicContact CE1-CG2 3.89Å; Y266-V270 HydrophobicContact CE2-CG1 3.84Å; Y266-V270 WeakPolarHBondContact O-CG2 3.13Å; Y266-V270 PolarHBondContact O-N 3.42Å; Y266-L333 HydrophobicContact CE1-CD2 3.91Å; Y266-D336 WeakPolarHBondContact CE1-OD2 3.31Å; Y266-D336 PolarHBondContact OH-OD2 2.91Å; Y266-D336 VanDerWaalsContact OH-OD2 3.07Å
267	L	96.4	Very high	95	Very high	5 Å²	5	41.8 Å²	41.8	3%	0.026	22%	0.219	C	C	.	.	H	α-helix	trans	-58.8	-42	180	-67.9	174.2	0	0	0	112.3	W262 S263 I264 S269 V270 A271 G272 I300 L333 F359 F457	W262-L267 HydrophobicContact CB-CD2 4.22Å; W262-L267 HydrophobicContact CB-CG 4.41Å; W262-L267 HydrophobicContact CG-CD2 4.27Å; S263-L267 VanDerWaalsContact O-CG 3.31Å; S263-L267 WeakPolarHBondContact O-CG 3.4Å; S263-L267 PolarHBondContact O-N 2.79Å; I264-L267 PolarHBondContact O-N 3.47Å; L267-S269 VanDerWaalsContact C-N 3.33Å; L267-S269 PolarHBondContact O-N 3.44Å; L267-V270 PolarHBondContact O-N 3.42Å; L267-A271 WeakPolarHBondContact O-CA 3.35Å; L267-A271 WeakPolarHBondContact O-CB 3.41Å; L267-A271 PolarHBondContact O-N 2.74Å; L267-G272 PolarHBondContact O-N 2.83Å; L267-I300 HydrophobicContact CB-CD1 4.33Å; L267-L333 HydrophobicContact CD2-CD2 4.15Å; L267-F359 HydrophobicContact CD1-CE1 4.09Å; L267-F359 HydrophobicContact CD1-CE2 4.45Å; L267-F359 HydrophobicContact CD1-CZ 4Å; L267-F457 HydrophobicContact CD1-CD2 3.98Å; L267-F457 HydrophobicContact CD1-CE2 4.12Å; L267-F457 HydrophobicContact CD2-CD2 4.38Å; L267-F457 HydrophobicContact CD2-CE2 3.88Å
268	R	94.5	Very high	95.1	Very high	81 Å²	81	39.6 Å²	39.6	31%	0.306	21%	0.208	S	C	.	.	H	α-helix	trans	-60.9	-42.5	173.4	-69.5	-178.5	85.9	109.8	6.9	111.6	I264 E265 Y266 G272 N297 I300 D301	I264-R268 HydrophobicContact CG2-CG 4.39Å; I264-R268 VanDerWaalsContact O-CG 3.27Å; I264-R268 WeakPolarHBondContact O-CG 3.09Å; I264-R268 PolarHBondContact O-N 2.95Å; E265-R268 PolarHBondContact O-N 3.39Å; Y266-R268 VanDerWaalsContact C-N 3.34Å; Y266-R268 PolarHBondContact O-N 2.94Å; R268-G272 WeakPolarHBondContact O-CA 3.44Å; R268-G272 PolarHBondContact O-N 3.43Å; R268-N297 WeakPolarHBondContact CB-OD1 3.27Å; R268-N297 VanDerWaalsContact CG-OD1 3.32Å; R268-N297 WeakPolarHBondContact CG-OD1 3.33Å; R268-N297 PolarHBondContact NE-OD1 3.47Å; R268-I300 HydrophobicContact CG-CD1 3.78Å; R268-D301 IonicContact CZ-OD1 3.64Å; R268-D301 IonicContact CZ-OD2 3.77Å; R268-D301 IonicContact NH1-OD1 3.53Å; R268-D301 PolarHBondContact NH1-OD1 2.98Å; R268-D301 IonicContact NH1-OD2 3.86Å; R268-D301 IonicContact NH2-OD1 2.67Å; R268-D301 PolarHBondContact NH2-OD1 3.16Å; R268-D301 IonicContact NH2-OD2 3.7Å; R268-D301 PolarHBondContact NH2-OD2 2.87Å; R268-D301 VanDerWaalsContact NH2-OD2 3.1Å
269	S	91.9	Very high	95.1	Very high	66 Å²	66	36.4 Å²	36.4	46%	0.462	19%	0.19	S	C	.	.	H	α-helix	trans	-66.7	-38	-178	79.9	0	0	0	0	113.6	R190 E265 Y266 L267	R190-S269 PolarHBondContact NE-O 3.16Å; R190-S269 PolarHBondContact NH2-O 3.42Å; E265-S269 PolarHBondContact O-N 3.41Å; Y266-S269 WeakPolarHBondContact O-CB 3.49Å; Y266-S269 PolarHBondContact O-N 2.81Å; Y266-S269 PolarHBondContact O-OG 3.1Å; L267-S269 VanDerWaalsContact C-N 3.33Å; L267-S269 PolarHBondContact O-N 3.44Å
270	V	92.3	Very high	94.9	Very high	8 Å²	8	31.3 Å²	31.3	5%	0.048	17%	0.167	C	C	.	.	H	α-helix	trans	-91	-38.2	-176.1	-61.5	0	0	0	0	112.8	Q186 R190 Y266 L267 E332 L333	Q186-V270 PolarHBondContact NE2-O 2.77Å; Q186-V270 VanDerWaalsContact NE2-O 3.12Å; R190-V270 PolarHBondContact NH2-O 2.78Å; Y266-V270 HydrophobicContact CD1-CG2 4.2Å; Y266-V270 HydrophobicContact CD2-CG1 4.39Å; Y266-V270 HydrophobicContact CE1-CG1 4.08Å; Y266-V270 HydrophobicContact CE1-CG2 3.89Å; Y266-V270 HydrophobicContact CE2-CG1 3.84Å; Y266-V270 WeakPolarHBondContact O-CG2 3.13Å; Y266-V270 PolarHBondContact O-N 3.42Å; L267-V270 PolarHBondContact O-N 3.42Å; V270-E332 HydrophobicContact CB-CB 4.44Å; V270-L333 HydrophobicContact CG2-CD2 3.69Å; V270-L333 HydrophobicContact CG2-CG 4.1Å
271	A	94.9	Very high	94.5	Very high	2 Å²	2	28.1 Å²	28.1	2%	0.017	16%	0.155	C	C	.	.	H	α-helix	trans	-120.5	-8.7	-169.1	0	0	0	0	0	114.1	L267 C273 R274 V296 I330 L333	L267-A271 WeakPolarHBondContact O-CA 3.35Å; L267-A271 WeakPolarHBondContact O-CB 3.41Å; L267-A271 PolarHBondContact O-N 2.74Å; A271-C273 VanDerWaalsContact C-N 3.33Å; A271-C273 PolarHBondContact O-N 2.92Å; A271-C273 VanDerWaalsContact O-N 3.11Å; A271-R274 WeakPolarHBondContact O-CB 3.44Å; A271-R274 VanDerWaalsContact O-CG 3.32Å; A271-R274 WeakPolarHBondContact O-CG 3.13Å; A271-R274 PolarHBondContact O-N 2.96Å; A271-V296 HydrophobicContact CB-CB 4.38Å; A271-V296 HydrophobicContact CB-CG1 4.23Å; A271-V296 HydrophobicContact CB-CG2 4.11Å; A271-V296 WeakPolarHBondContact O-CB 3.27Å; A271-V296 WeakPolarHBondContact O-CG2 3.44Å; A271-I330 HydrophobicContact CB-CD1 3.4Å; A271-I330 VanDerWaalsContact CB-CD1 3.4Å; A271-I330 HydrophobicContact CB-CG2 4.43Å; A271-L333 HydrophobicContact CB-CD1 4.38Å
272	G	95.1	Very high	93.6	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.01	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-41.1	-165.9	0	0	0	0	0	115.9	L267 R268 R274 T295 V296 N297	L267-G272 PolarHBondContact O-N 2.83Å; R268-G272 WeakPolarHBondContact O-CA 3.44Å; R268-G272 PolarHBondContact O-N 3.43Å; G272-R274 VanDerWaalsContact C-N 3.33Å; G272-T295 WeakPolarHBondContact O-CB 3.42Å; G272-V296 PolarHBondContact O-N 2.82Å; G272-N297 VanDerWaalsContact CA-CG 3.47Å; G272-N297 VanDerWaalsContact CA-OD1 3.23Å; G272-N297 WeakPolarHBondContact CA-OD1 3.19Å; G272-N297 WeakPolarHBondContact O-CB 3.21Å; G272-N297 PolarHBondContact O-N 3.11Å
273	C	95.2	Very high	92.6	Very high	22 Å²	22	30.3 Å²	30.3	15%	0.149	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-4.1	178.9	60.4	0	0	0	0	114.5	L157 I160 A271	L157-C273 HydrophobicContact CD2-CB 3.69Å; I160-C273 HydrophobicContact CD1-CB 4.43Å; A271-C273 VanDerWaalsContact C-N 3.33Å; A271-C273 PolarHBondContact O-N 2.92Å; A271-C273 VanDerWaalsContact O-N 3.11Å
274	R	97.4	Very high	91.6	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.158	C	C	.	.			trans	-79.6	133	-176.2	-55.4	-57.1	-63.1	-82.8	3.7	110.6	D164 V182 A271 G272 T295 V296 Q329 I330	D164-R274 IonicContact OD1-CZ 2.97Å; D164-R274 VanDerWaalsContact OD1-CZ 3.31Å; D164-R274 IonicContact OD1-NE 3.31Å; D164-R274 PolarHBondContact OD1-NE 2.97Å; D164-R274 IonicContact OD1-NH2 3.98Å; D164-R274 PolarHBondContact OD1-NH2 3.06Å; D164-R274 VanDerWaalsContact OD2-CA 3.27Å; D164-R274 WeakPolarHBondContact OD2-CA 3.5Å; D164-R274 IonicContact OD2-NE 2.88Å; D164-R274 PolarHBondContact OD2-NE 2.92Å; V182-R274 VanDerWaalsContact CG1-CZ 3.45Å; A271-R274 WeakPolarHBondContact O-CB 3.44Å; A271-R274 VanDerWaalsContact O-CG 3.32Å; A271-R274 WeakPolarHBondContact O-CG 3.13Å; A271-R274 PolarHBondContact O-N 2.96Å; G272-R274 VanDerWaalsContact C-N 3.33Å; R274-T295 CarbonylContact O-C 3.59Å; R274-T295 WeakPolarHBondContact O-CA 3.34Å; R274-V296 PolarHBondContact O-N 3.02Å; R274-Q329 PolarHBondContact NH1-O 2.94Å; R274-Q329 PolarHBondContact NH2-O 2.85Å; R274-I330 HydrophobicContact CB-CD1 3.88Å; R274-I330 HydrophobicContact CB-CG1 4.49Å; R274-I330 HydrophobicContact CG-CD1 3.8Å; R274-I330 HydrophobicContact CG-CG1 4.18Å
275	T	97.6	Very high	90.4	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.006	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	125.8	177.9	-54.2	0	0	0	0	110.2	D164 L168 L293 L294 Q329	D164-T275 PolarHBondContact OD2-N 2.85Å; L168-T275 HydrophobicContact CD1-CG2 4.44Å; T275-L293 HydrophobicContact CG2-CB 3.98Å; T275-L294 CarbonylContact C-O 3.59Å; T275-L294 WeakPolarHBondContact CA-O 3.46Å; T275-Q329 PolarHBondContact O-NE2 2.77Å
276	V	97.1	Very high	89.7	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	149.5	-175.4	-66.2	0	0	0	0	111	V278 L294 V296 L321 L326	V276-V278 HydrophobicContact CG2-CG2 4.22Å; V276-L294 WeakPolarHBondContact CG2-O 3.5Å; V276-L294 PolarHBondContact N-O 2.9Å; V276-L294 PolarHBondContact O-N 3.11Å; V276-L294 VanDerWaalsContact O-N 3.14Å; V276-V296 HydrophobicContact CG1-CG2 3.8Å; V276-V296 HydrophobicContact CG2-CG2 3.88Å; V276-L321 HydrophobicContact CB-CD1 4.05Å; V276-L321 HydrophobicContact CB-CG 4.43Å; V276-L321 HydrophobicContact CG1-CD1 4.27Å; V276-L321 HydrophobicContact CG2-CD1 3.79Å; V276-L321 HydrophobicContact CG2-CG 4.36Å; V276-L326 HydrophobicContact CG1-CD1 3.66Å
277	P	96.4	Very high	88.8	Confident	31 Å²	31	35.7 Å²	35.7	20%	0.201	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	135.8	169.1	30.9	-33.5	0	0	0	110.8	L293 H324	P277-L293 HydrophobicContact CB-CD2 4.19Å; P277-H324 HydrophobicContact CG-CB 4.1Å
278	V	95.8	Very high	88	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	125	177.7	178.3	0	0	0	0	108.2	V276 V280 Q291 T292 L294 F299 Y303	V276-V278 HydrophobicContact CG2-CG2 4.22Å; V278-V280 HydrophobicContact CG1-CG2 4.29Å; V278-Q291 WeakPolarHBondContact O-CA 3.47Å; V278-T292 HydrophobicContact CB-CG2 4.29Å; V278-T292 PolarHBondContact N-O 3.48Å; V278-T292 PolarHBondContact O-N 2.81Å; V278-L294 HydrophobicContact CG2-CB 4.41Å; V278-L294 HydrophobicContact CG2-CD1 4.4Å; V278-F299 HydrophobicContact CB-CD2 4.34Å; V278-F299 HydrophobicContact CG1-CD2 3.69Å; V278-F299 HydrophobicContact CG1-CE2 3.8Å; V278-F299 HydrophobicContact CG2-CB 4.32Å; V278-F299 HydrophobicContact CG2-CD2 3.63Å; V278-F299 HydrophobicContact CG2-CE2 4.28Å; V278-F299 HydrophobicContact CG2-CG 4.18Å; V278-Y303 HydrophobicContact CG1-CE2 4.35Å
279	E	93.9	Very high	87.6	Confident	29 Å²	29	40.5 Å²	40.5	14%	0.136	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	134.5	167.6	-62.3	-169.2	-179.6	0	0	109.8	W289 Q291 G319 Y320 A322	E279-W289 HydrophobicContact CB-CZ2 4.31Å; E279-W289 HydrophobicContact CG-CZ2 3.69Å; E279-W289 PolarHBondContact OE2-NE1 2.85Å; E279-Q291 HydrophobicContact CG-CG 4.27Å; E279-G319 CarbonylContact O-C 3.59Å; E279-G319 VanDerWaalsContact O-CA 3.27Å; E279-G319 WeakPolarHBondContact O-CA 3.45Å; E279-Y320 PolarHBondContact N-O 3.28Å; E279-Y320 PolarHBondContact O-N 3.1Å; E279-A322 HydrophobicContact CG-CB 4.32Å
280	V	89	Confident	87.4	Confident	20 Å²	20	40.1 Å²	40.1	12%	0.121	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	119	179.8	-178.1	0	0	0	0	108.6	V278 W289 S290 T292 Y303 A317 V318	V278-V280 HydrophobicContact CG1-CG2 4.29Å; V280-W289 WeakPolarHBondContact O-CA 3.47Å; V280-S290 PolarHBondContact N-O 2.63Å; V280-S290 PolarHBondContact O-N 3.21Å; V280-T292 HydrophobicContact CG2-CG2 3.72Å; V280-Y303 WeakPolarHBondContact CG2-OH 3.42Å; V280-A317 HydrophobicContact CG1-CB 3.57Å; V280-V318 WeakPolarHBondContact CA-O 3.38Å
281	G	83.5	Confident	87.2	Confident	9 Å²	9	45.6 Å²	45.6	9%	0.093	24%	0.236	C	C	.	.	S	Bend	trans	140.8	167.7	-174	0	0	0	0	0	110.5	V318	G281-V318 PolarHBondContact N-O 3.33Å
282	S	76.3	Confident	87.1	Confident	65 Å²	65	48.1 Å²	48.1	46%	0.455	25%	0.252	S	S	.	.	S	Bend	trans	-67.3	-43.8	177.4	27	0	0	0	0	112.1	D286	S282-D286 WeakPolarHBondContact CB-OD2 3.39Å; S282-D286 PolarHBondContact OG-OD2 2.85Å
283	R	75.6	Confident	87	Confident	60 Å²	60	51 Å²	51	23%	0.226	27%	0.267	C	S	.	.			trans	-149.7	151.6	-178.3	-57.5	172.2	-170.1	152.3	-2.3	110.2	T285 D286 W289 V365 P367 E412	R283-T285 PolarHBondContact O-N 3.34Å; R283-T285 VanDerWaalsContact O-N 3.11Å; R283-D286 WeakPolarHBondContact CB-OD2 3.41Å; R283-D286 PolarHBondContact N-OD2 2.94Å; R283-D286 VanDerWaalsContact N-OD2 3.08Å; R283-D286 WeakPolarHBondContact O-CB 3.46Å; R283-D286 PolarHBondContact O-N 2.86Å; R283-D286 VanDerWaalsContact O-N 3.09Å; R283-W289 WeakPolarHBondContact O-CB 3.16Å; R283-V365 HydrophobicContact CG-CB 4.33Å; R283-V365 HydrophobicContact CG-CG1 4.16Å; R283-P367 HydrophobicContact CB-CG 3.76Å; R283-P367 HydrophobicContact CG-CG 4.09Å; R283-E412 IonicContact CZ-OE1 2.75Å; R283-E412 IonicContact CZ-OE2 3.29Å; R283-E412 IonicContact NH1-OE1 3.23Å; R283-E412 PolarHBondContact NH1-OE1 3.35Å; R283-E412 IonicContact NH1-OE2 2.65Å; R283-E412 PolarHBondContact NH1-OE2 2.82Å; R283-E412 IonicContact NH2-OE1 3.47Å; R283-E412 IonicContact NH2-OE2 3.09Å; R283-E412 PolarHBondContact NH2-OE2 2.62Å
284	Y	74.9	Confident	87	Confident	52 Å²	52	50.2 Å²	50.2	20%	0.204	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-8	176.2	68.3	-103.1	0	0	0	114.8	P367 H369 L405 T408	Y284-P367 HydrophobicContact CD1-CG 4.03Å; Y284-P367 HydrophobicContact CE1-CB 4.06Å; Y284-P367 HydrophobicContact CE1-CG 3.69Å; Y284-H369 WeakPolarHBondContact OH-CB 3.33Å; Y284-L405 HydrophobicContact CD2-CD2 4.44Å; Y284-L405 HydrophobicContact CE2-CD2 4.28Å; Y284-T408 HydrophobicContact CE2-CG2 3.84Å; Y284-T408 VanDerWaalsContact OH-CG2 3.31Å; Y284-T408 WeakPolarHBondContact OH-CG2 3.37Å; Y284-T408 PolarHBondContact OH-OG1 3.22Å
285	T	71.5	Confident	87	Confident	46 Å²	46	51.7 Å²	51.7	28%	0.282	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-11.1	174	50.6	0	0	0	0	113.4	R283 P367 T408	R283-T285 PolarHBondContact O-N 3.34Å; R283-T285 VanDerWaalsContact O-N 3.11Å; T285-P367 HydrophobicContact CG2-CB 4.23Å; T285-P367 HydrophobicContact CG2-CG 4.11Å; T285-T408 HydrophobicContact CG2-CG2 3.79Å
286	D	79.3	Confident	87	Confident	43 Å²	43	51.9 Å²	51.9	23%	0.23	27%	0.271	C	S	.	.	S	Bend	trans	-87.5	148.7	-173.4	-54.7	-18	0	0	0	110.7	S282 R283 D288 W289	S282-D286 WeakPolarHBondContact CB-OD2 3.39Å; S282-D286 PolarHBondContact OG-OD2 2.85Å; R283-D286 WeakPolarHBondContact CB-OD2 3.41Å; R283-D286 PolarHBondContact N-OD2 2.94Å; R283-D286 VanDerWaalsContact N-OD2 3.08Å; R283-D286 WeakPolarHBondContact O-CB 3.46Å; R283-D286 PolarHBondContact O-N 2.86Å; R283-D286 VanDerWaalsContact O-N 3.09Å; D286-D288 VanDerWaalsContact C-N 3.28Å; D286-D288 WeakPolarHBondContact CB-OD1 3.47Å; D286-D288 PolarHBondContact O-N 2.91Å; D286-W289 WeakPolarHBondContact O-CB 3.48Å; D286-W289 PolarHBondContact O-N 3.1Å
287	E	76.4	Confident	87	Confident	208 Å²	208	54.1 Å²	54.1	97%	0.972	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-25.8	-175.2	-66.6	-173.7	173.5	0	0	113.6	W289	E287-W289 VanDerWaalsContact C-N 3.33Å
288	D	79.9	Confident	86.9	Confident	113 Å²	113	56 Å²	56	60%	0.604	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	0.8	178.5	66.8	-35.2	0	0	0	113.3	D286	D286-D288 VanDerWaalsContact C-N 3.28Å; D286-D288 WeakPolarHBondContact CB-OD1 3.47Å; D286-D288 PolarHBondContact O-N 2.91Å
289	W	85.4	Confident	87	Confident	74 Å²	74	56 Å²	56	28%	0.28	29%	0.289	S	S	.	.			trans	-66	137.8	175.7	-178.5	93.9	0	0	0	111.7	E279 V280 R283 D286 E287 Q291	E279-W289 HydrophobicContact CB-CZ2 4.31Å; E279-W289 HydrophobicContact CG-CZ2 3.69Å; E279-W289 PolarHBondContact OE2-NE1 2.85Å; V280-W289 WeakPolarHBondContact O-CA 3.47Å; R283-W289 WeakPolarHBondContact O-CB 3.16Å; D286-W289 WeakPolarHBondContact O-CB 3.48Å; D286-W289 PolarHBondContact O-N 3.1Å; E287-W289 VanDerWaalsContact C-N 3.33Å; W289-Q291 VanDerWaalsContact CH2-CD 3.47Å; W289-Q291 HydrophobicContact CH2-CG 3.43Å; W289-Q291 VanDerWaalsContact CH2-CG 3.43Å; W289-Q291 HydrophobicContact CZ2-CG 3.61Å; W289-Q291 HydrophobicContact CZ3-CG 4.11Å
290	S	87	Confident	87.1	Confident	58 Å²	58	54.6 Å²	54.6	41%	0.406	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	165.8	175.1	61.6	0	0	0	0	111.3	V280	V280-S290 PolarHBondContact N-O 2.63Å; V280-S290 PolarHBondContact O-N 3.21Å
291	Q	88	Confident	87.3	Confident	123 Å²	123	56.4 Å²	56.4	58%	0.575	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.9	140.2	169	-75.4	179.2	-17.1	0	0	109.9	V278 E279 W289	V278-Q291 WeakPolarHBondContact O-CA 3.47Å; E279-Q291 HydrophobicContact CG-CG 4.27Å; W289-Q291 VanDerWaalsContact CH2-CD 3.47Å; W289-Q291 HydrophobicContact CH2-CG 3.43Å; W289-Q291 VanDerWaalsContact CH2-CG 3.43Å; W289-Q291 HydrophobicContact CZ2-CG 3.61Å; W289-Q291 HydrophobicContact CZ3-CG 4.11Å
292	T	92.8	Very high	87.7	Confident	56 Å²	56	61.7 Å²	61.7	34%	0.344	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	165	174.6	-166.1	0	0	0	0	110.8	V278 V280 L294	V278-T292 HydrophobicContact CB-CG2 4.29Å; V278-T292 PolarHBondContact N-O 3.48Å; V278-T292 PolarHBondContact O-N 2.81Å; V280-T292 HydrophobicContact CG2-CG2 3.72Å; T292-L294 HydrophobicContact CG2-CD1 4.06Å; T292-L294 HydrophobicContact CG2-CG 3.99Å
293	L	94.5	Very high	88.5	Confident	60 Å²	60	61 Å²	61	31%	0.314	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	118.8	177.4	-68.3	173.6	0	0	0	108.8	M165 L168 T275 P277	M165-L293 HydrophobicContact CE-CD1 3.69Å; M165-L293 HydrophobicContact SD-CD1 3.59Å; M165-L293 VanDerWaalsContact SD-CD1 3.59Å; L168-L293 HydrophobicContact CD1-CD2 3.87Å; T275-L293 HydrophobicContact CG2-CB 3.98Å; P277-L293 HydrophobicContact CB-CD2 4.19Å
294	L	95.3	Very high	89.3	Confident	7 Å²	7	58.2 Å²	58.2	4%	0.037	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	155.2	179.6	-63.9	174.8	0	0	0	109.5	T275 V276 V278 T292 E298 Y303	T275-L294 CarbonylContact C-O 3.59Å; T275-L294 WeakPolarHBondContact CA-O 3.46Å; V276-L294 WeakPolarHBondContact CG2-O 3.5Å; V276-L294 PolarHBondContact N-O 2.9Å; V276-L294 PolarHBondContact O-N 3.11Å; V276-L294 VanDerWaalsContact O-N 3.14Å; V278-L294 HydrophobicContact CG2-CB 4.41Å; V278-L294 HydrophobicContact CG2-CD1 4.4Å; T292-L294 HydrophobicContact CG2-CD1 4.06Å; T292-L294 HydrophobicContact CG2-CG 3.99Å; L294-E298 HydrophobicContact CB-CB 4.19Å; L294-E298 HydrophobicContact CD2-CB 4.41Å; L294-Y303 HydrophobicContact CD1-CD2 4.42Å; L294-Y303 HydrophobicContact CD1-CE2 3.63Å
295	T	97.3	Very high	90	Very high	30 Å²	30	59.4 Å²	59.4	18%	0.184	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	154.5	161.5	62.2	0	0	0	0	110.4	G272 R274 N297 E298 F299	G272-T295 WeakPolarHBondContact O-CB 3.42Å; R274-T295 CarbonylContact O-C 3.59Å; R274-T295 WeakPolarHBondContact O-CA 3.34Å; T295-N297 PolarHBondContact O-N 3.43Å; T295-E298 WeakPolarHBondContact CB-OE2 3.38Å; T295-E298 PolarHBondContact N-OE2 2.75Å; T295-E298 PolarHBondContact O-N 2.9Å; T295-E298 VanDerWaalsContact O-N 3.14Å; T295-E298 WeakPolarHBondContact OG1-CB 3.25Å; T295-E298 WeakPolarHBondContact OG1-CG 3.36Å; T295-E298 PolarHBondContact OG1-N 3.3Å; T295-E298 VanDerWaalsContact OG1-N 3.17Å; T295-E298 PolarHBondContact OG1-OE2 3.09Å; T295-F299 PolarHBondContact O-N 3.47Å
296	V	97.4	Very high	90.4	Very high	5 Å²	5	61.7 Å²	61.7	3%	0.03	31%	0.306	C	S	.	.	H	α-helix	trans	-58.7	-36.1	174.6	172.7	0	0	0	0	111.4	A271 G272 R274 V276 F299 I300	A271-V296 HydrophobicContact CB-CB 4.38Å; A271-V296 HydrophobicContact CB-CG1 4.23Å; A271-V296 HydrophobicContact CB-CG2 4.11Å; A271-V296 WeakPolarHBondContact O-CB 3.27Å; A271-V296 WeakPolarHBondContact O-CG2 3.44Å; G272-V296 PolarHBondContact O-N 2.82Å; R274-V296 PolarHBondContact O-N 3.02Å; V276-V296 HydrophobicContact CG1-CG2 3.8Å; V276-V296 HydrophobicContact CG2-CG2 3.88Å; V296-F299 PolarHBondContact O-N 3.2Å; V296-I300 HydrophobicContact CG1-CD1 3.73Å; V296-I300 HydrophobicContact CG1-CG1 4.3Å; V296-I300 WeakPolarHBondContact O-CB 3.38Å; V296-I300 VanDerWaalsContact O-CG1 3.26Å; V296-I300 WeakPolarHBondContact O-CG1 3.23Å; V296-I300 PolarHBondContact O-N 2.98Å
297	N	96.1	Very high	89.7	Confident	48 Å²	48	65.1 Å²	65.1	26%	0.257	32%	0.321	S	S	.	.	H	α-helix	trans	-60.7	-49.8	173.3	-81.3	-17.7	0	0	0	111.5	R268 G272 T295 F299 I300 D301	R268-N297 WeakPolarHBondContact CB-OD1 3.27Å; R268-N297 VanDerWaalsContact CG-OD1 3.32Å; R268-N297 WeakPolarHBondContact CG-OD1 3.33Å; R268-N297 PolarHBondContact NE-OD1 3.47Å; G272-N297 VanDerWaalsContact CA-CG 3.47Å; G272-N297 VanDerWaalsContact CA-OD1 3.23Å; G272-N297 WeakPolarHBondContact CA-OD1 3.19Å; G272-N297 WeakPolarHBondContact O-CB 3.21Å; G272-N297 PolarHBondContact O-N 3.11Å; T295-N297 PolarHBondContact O-N 3.43Å; N297-F299 VanDerWaalsContact C-N 3.3Å; N297-F299 PolarHBondContact O-N 2.65Å; N297-I300 PolarHBondContact O-N 3.42Å; N297-D301 WeakPolarHBondContact O-CB 3.4Å; N297-D301 VanDerWaalsContact O-CG 3.26Å; N297-D301 PolarHBondContact O-N 3.17Å
298	E	95.8	Very high	88.5	Confident	69 Å²	69	60.4 Å²	60.4	32%	0.322	31%	0.306	S	S	.	.	H	α-helix	trans	-61.9	-38.6	177	-73.1	169.9	118.5	0	0	112.2	L294 T295 R302	L294-E298 HydrophobicContact CB-CB 4.19Å; L294-E298 HydrophobicContact CD2-CB 4.41Å; T295-E298 WeakPolarHBondContact CB-OE2 3.38Å; T295-E298 PolarHBondContact N-OE2 2.75Å; T295-E298 PolarHBondContact O-N 2.9Å; T295-E298 VanDerWaalsContact O-N 3.14Å; T295-E298 WeakPolarHBondContact OG1-CB 3.25Å; T295-E298 WeakPolarHBondContact OG1-CG 3.36Å; T295-E298 PolarHBondContact OG1-N 3.3Å; T295-E298 VanDerWaalsContact OG1-N 3.17Å; T295-E298 PolarHBondContact OG1-OE2 3.09Å; E298-R302 WeakPolarHBondContact O-CB 3.04Å; E298-R302 WeakPolarHBondContact O-CG 3.49Å; E298-R302 PolarHBondContact O-N 3.42Å; E298-R302 IonicContact OE1-CZ 3.53Å; E298-R302 IonicContact OE1-NH2 2.69Å; E298-R302 PolarHBondContact OE1-NH2 3.33Å
299	F	96.4	Very high	86.6	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-61	-49.9	174.8	171.4	-104.6	0	0	0	111.5	V278 T295 V296 N297 R302 Y303 I304 L321 F359	V278-F299 HydrophobicContact CB-CD2 4.34Å; V278-F299 HydrophobicContact CG1-CD2 3.69Å; V278-F299 HydrophobicContact CG1-CE2 3.8Å; V278-F299 HydrophobicContact CG2-CB 4.32Å; V278-F299 HydrophobicContact CG2-CD2 3.63Å; V278-F299 HydrophobicContact CG2-CE2 4.28Å; V278-F299 HydrophobicContact CG2-CG 4.18Å; T295-F299 PolarHBondContact O-N 3.47Å; V296-F299 PolarHBondContact O-N 3.2Å; N297-F299 VanDerWaalsContact C-N 3.3Å; N297-F299 PolarHBondContact O-N 2.65Å; F299-R302 PolarHBondContact O-N 3.13Å; F299-Y303 AromaticContact CD2-CD2 3.67Å; F299-Y303 HydrophobicContact CD2-CD2 3.67Å; F299-Y303 HydrophobicContact CD2-CE2 4.46Å; F299-Y303 HydrophobicContact CD2-CG 4.39Å; F299-Y303 HydrophobicContact CE2-CD2 4.07Å; F299-Y303 HydrophobicContact CE2-CG 4.39Å; F299-Y303 PolarHBondContact O-N 3.08Å; F299-I304 HydrophobicContact CD1-CG1 4.3Å; F299-I304 HydrophobicContact CE1-CD1 3.88Å; F299-I304 HydrophobicContact CE1-CG1 3.82Å; F299-I304 HydrophobicContact CZ-CD1 3.98Å; F299-I304 HydrophobicContact CZ-CG1 4.27Å; F299-L321 HydrophobicContact CE1-CB 4.39Å; F299-L321 HydrophobicContact CZ-CB 4.23Å; F299-F359 AromaticContact CD1-CD1 3.94Å; F299-F359 HydrophobicContact CD1-CD1 3.94Å; F299-F359 AromaticContact CD1-CE1 3.78Å; F299-F359 HydrophobicContact CD1-CE1 3.78Å; F299-F359 AromaticContact CE1-CD1 3.42Å; F299-F359 HydrophobicContact CE1-CD1 3.42Å; F299-F359 VanDerWaalsContact CE1-CD1 3.42Å; F299-F359 AromaticContact CE1-CE1 3.48Å; F299-F359 HydrophobicContact CE1-CE1 3.48Å; F299-F359 VanDerWaalsContact CE1-CE1 3.48Å; F299-F359 AromaticContact CE1-CG 3.99Å; F299-F359 HydrophobicContact CE1-CG 3.99Å; F299-F359 HydrophobicContact CE1-CZ 4.08Å; F299-F359 HydrophobicContact CZ-CD1 4.5Å; F299-F359 WeakPolarHBondContact CZ-O 3.35Å
300	I	96	Very high	84.3	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	34%	0.341	C	S	.	.	I	π-helix	trans	-60	-48.6	178.1	-73.3	169.8	0	0	0	110.4	I264 L267 R268 V296 N297 I304 L305 F359	I264-I300 HydrophobicContact CG2-CD1 4.4Å; I264-I300 HydrophobicContact CG2-CG2 3.6Å; L267-I300 HydrophobicContact CB-CD1 4.33Å; R268-I300 HydrophobicContact CG-CD1 3.78Å; V296-I300 HydrophobicContact CG1-CD1 3.73Å; V296-I300 HydrophobicContact CG1-CG1 4.3Å; V296-I300 WeakPolarHBondContact O-CB 3.38Å; V296-I300 VanDerWaalsContact O-CG1 3.26Å; V296-I300 WeakPolarHBondContact O-CG1 3.23Å; V296-I300 PolarHBondContact O-N 2.98Å; N297-I300 PolarHBondContact O-N 3.42Å; I300-I304 HydrophobicContact CG1-CG1 4.47Å; I300-I304 HydrophobicContact CG2-CB 4.48Å; I300-I304 WeakPolarHBondContact O-CA 3.37Å; I300-I304 WeakPolarHBondContact O-CB 3.35Å; I300-I304 PolarHBondContact O-N 3.4Å; I300-L305 HydrophobicContact CG2-CD1 3.73Å; I300-L305 HydrophobicContact CG2-CG 3.78Å; I300-L305 PolarHBondContact O-N 2.84Å; I300-F359 HydrophobicContact CD1-CE1 4.31Å; I300-F359 HydrophobicContact CG1-CE1 3.89Å; I300-F359 HydrophobicContact CG1-CZ 4.11Å
301	D	94.1	Very high	82.2	Confident	58 Å²	58	68.9 Å²	68.9	31%	0.31	36%	0.355	S	S	.	.	I	π-helix	trans	-63.1	-46.8	-178.5	-71.6	-29	0	0	0	110.8	R268 N297 N306	R268-D301 IonicContact CZ-OD1 3.64Å; R268-D301 IonicContact CZ-OD2 3.77Å; R268-D301 IonicContact NH1-OD1 3.53Å; R268-D301 PolarHBondContact NH1-OD1 2.98Å; R268-D301 IonicContact NH1-OD2 3.86Å; R268-D301 IonicContact NH2-OD1 2.67Å; R268-D301 PolarHBondContact NH2-OD1 3.16Å; R268-D301 IonicContact NH2-OD2 3.7Å; R268-D301 PolarHBondContact NH2-OD2 2.87Å; R268-D301 VanDerWaalsContact NH2-OD2 3.1Å; N297-D301 WeakPolarHBondContact O-CB 3.4Å; N297-D301 VanDerWaalsContact O-CG 3.26Å; N297-D301 PolarHBondContact O-N 3.17Å; D301-N306 WeakPolarHBondContact O-CB 3.33Å; D301-N306 PolarHBondContact O-N 3.35Å; D301-N306 PolarHBondContact O-ND2 3.26Å
302	R	92.4	Very high	80	Confident	120 Å²	120	72.7 Å²	72.7	45%	0.453	37%	0.373	S	S	.	.	I	π-helix	trans	-76.1	-40.7	-174.3	-66.8	177.4	-161.6	-169.3	10.8	113.6	E298 F299	E298-R302 WeakPolarHBondContact O-CB 3.04Å; E298-R302 WeakPolarHBondContact O-CG 3.49Å; E298-R302 PolarHBondContact O-N 3.42Å; E298-R302 IonicContact OE1-CZ 3.53Å; E298-R302 IonicContact OE1-NH2 2.69Å; E298-R302 PolarHBondContact OE1-NH2 3.33Å; F299-R302 PolarHBondContact O-N 3.13Å
303	Y	92.4	Very high	77.6	Confident	50 Å²	50	74.9 Å²	74.9	20%	0.196	39%	0.39	C	S	.	.	I	π-helix	trans	-116.7	-16.7	-166.8	-58.8	-74.4	0	0	0	114.9	V278 V280 L294 F299 A317 G319 P361	V278-Y303 HydrophobicContact CG1-CE2 4.35Å; V280-Y303 WeakPolarHBondContact CG2-OH 3.42Å; L294-Y303 HydrophobicContact CD1-CD2 4.42Å; L294-Y303 HydrophobicContact CD1-CE2 3.63Å; F299-Y303 AromaticContact CD2-CD2 3.67Å; F299-Y303 HydrophobicContact CD2-CD2 3.67Å; F299-Y303 HydrophobicContact CD2-CE2 4.46Å; F299-Y303 HydrophobicContact CD2-CG 4.39Å; F299-Y303 HydrophobicContact CE2-CD2 4.07Å; F299-Y303 HydrophobicContact CE2-CG 4.39Å; F299-Y303 PolarHBondContact O-N 3.08Å; Y303-A317 WeakPolarHBondContact CE1-O 3.38Å; Y303-G319 VanDerWaalsContact CD1-N 3.28Å; Y303-P361 WeakPolarHBondContact O-CB 3.39Å; Y303-P361 WeakPolarHBondContact O-CG 3.46Å
304	I	92.9	Very high	75.2	Confident	2 Å²	2	79 Å²	79	1%	0.01	41%	0.413	C	S	.	.	I	π-helix	trans	-106.8	-50.3	-177.6	-53.2	-64.4	0	0	0	112.1	I264 F299 I300 F359 P361 I455	I264-I304 HydrophobicContact CD1-CG2 3.77Å; F299-I304 HydrophobicContact CD1-CG1 4.3Å; F299-I304 HydrophobicContact CE1-CD1 3.88Å; F299-I304 HydrophobicContact CE1-CG1 3.82Å; F299-I304 HydrophobicContact CZ-CD1 3.98Å; F299-I304 HydrophobicContact CZ-CG1 4.27Å; I300-I304 HydrophobicContact CG1-CG1 4.47Å; I300-I304 HydrophobicContact CG2-CB 4.48Å; I300-I304 WeakPolarHBondContact O-CA 3.37Å; I300-I304 WeakPolarHBondContact O-CB 3.35Å; I300-I304 PolarHBondContact O-N 3.4Å; I304-F359 HydrophobicContact CD1-CE2 3.99Å; I304-F359 HydrophobicContact CD1-CZ 4.07Å; I304-F359 HydrophobicContact CG1-CE1 4.49Å; I304-F359 HydrophobicContact CG1-CE2 4.3Å; I304-F359 HydrophobicContact CG1-CZ 3.88Å; I304-P361 HydrophobicContact CD1-CB 4.06Å; I304-P361 HydrophobicContact CD1-CG 4.4Å; I304-I455 HydrophobicContact CG2-CD1 3.69Å; I304-I455 HydrophobicContact CG2-CG1 4.1Å; I304-I455 HydrophobicContact CG2-CG2 4.07Å
305	L	89.6	Confident	73.3	Confident	77 Å²	77	86.8 Å²	86.8	40%	0.403	45%	0.448	S	S	.	.	I	π-helix	trans	-93.4	-31.1	-172.6	-66.3	-176.8	0	0	0	114.2	I264 I300 E307	I264-L305 HydrophobicContact CG1-CD2 4.41Å; I264-L305 HydrophobicContact CG2-CD1 4.1Å; I264-L305 HydrophobicContact CG2-CD2 4.31Å; I264-L305 HydrophobicContact CG2-CG 4.42Å; I300-L305 HydrophobicContact CG2-CD1 3.73Å; I300-L305 HydrophobicContact CG2-CG 3.78Å; I300-L305 PolarHBondContact O-N 2.84Å; L305-E307 PolarHBondContact O-N 3.43Å
306	N	79.8	Confident	71.6	Confident	94 Å²	94	93.1 Å²	93.1	50%	0.503	47%	0.473	S	S	.	.			trans	-76.5	51.3	179.4	-82	-30.7	0	0	0	113.1	D301 V308	D301-N306 WeakPolarHBondContact O-CB 3.33Å; D301-N306 PolarHBondContact O-N 3.35Å; D301-N306 PolarHBondContact O-ND2 3.26Å; N306-V308 VanDerWaalsContact C-N 3.35Å; N306-V308 PolarHBondContact O-N 3.02Å
307	E	63.5	Low	70.5	Confident	115 Å²	115	95.1 Å²	95.1	54%	0.537	49%	0.491	S	S	.	.			trans	-86.4	73.4	159.6	-67.6	-174.3	167.5	0	0	108.7	L305	L305-E307 PolarHBondContact O-N 3.43Å
308	V	51.5	Low	70	Confident	110 Å²	110	95 Å²	95	67%	0.667	49%	0.491	S	S	*	.			trans	-111.9	106.2	171.4	-176.4	0	0	0	0	110	N306	N306-V308 VanDerWaalsContact C-N 3.35Å; N306-V308 PolarHBondContact O-N 3.02Å
309	Q	39.5	Very low	69.9	Low	170 Å²	170	91.7 Å²	91.7	79%	0.794	48%	0.476	S	S	*	.			trans	43.2	111.7	138.5	-65.5	175.2	-23.7	0	0	118.4
310	D	37.9	Very low	69.9	Low	153 Å²	153	92.2 Å²	92.2	82%	0.818	48%	0.478	S	S	*	.			trans	64.6	133.2	143.7	-79.7	-28.5	0	0	0	121
311	S	42.1	Very low	69.9	Low	100 Å²	100	92.3 Å²	92.3	70%	0.699	48%	0.478	S	S	*	.			trans	83.9	112	145.4	65.1	0	0	0	0	118.8
312	E	42.5	Very low	69.9	Low	203 Å²	203	90 Å²	90	95%	0.949	47%	0.468	S	S	*	.	S	Bend	trans	85.7	13.4	145.4	-62.3	-175.7	172.7	0	0	121.1
313	S	41.7	Very low	70	Confident	101 Å²	101	89.1 Å²	89.1	71%	0.706	47%	0.469	S	S	*	.			trans	-127.2	111.7	163.1	58.6	0	0	0	0	112.2	H315	S313-H315 PolarHBondContact O-N 3.2Å
314	D	45.4	Very low	70.2	Confident	148 Å²	148	87.7 Å²	87.7	79%	0.791	46%	0.464	S	S	*	.	S	Bend	trans	-72.5	-4.9	-165.6	-139.2	-1	0	0	0	114.5
315	H	54	Low	70.2	Confident	170 Å²	170	92 Å²	92	79%	0.787	48%	0.484	S	S	*	.			trans	-148.6	79.6	-174.5	-57.1	-59.6	0	0	0	112.4	S313	S313-H315 PolarHBondContact O-N 3.2Å
316	K	61.8	Low	70.5	Confident	162 Å²	162	88.5 Å²	88.5	70%	0.704	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-86.7	119	163.8	-151.5	178.7	-175.5	-174.3	0	108.4	V318	K316-V318 PolarHBondContact O-N 2.87Å
317	A	74.7	Confident	71.3	Confident	48 Å²	48	84.1 Å²	84.1	40%	0.397	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-57.9	131.6	-175	0	0	0	0	0	111.8	V280 Y303	V280-A317 HydrophobicContact CG1-CB 3.57Å; Y303-A317 WeakPolarHBondContact CE1-O 3.38Å
318	V	86.5	Confident	72.5	Confident	45 Å²	45	82.6 Å²	82.6	27%	0.273	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-77.7	133.7	175.6	-179.6	0	0	0	0	108.5	V280 G281 K316 P361 T364	V280-V318 WeakPolarHBondContact CA-O 3.38Å; G281-V318 PolarHBondContact N-O 3.33Å; K316-V318 PolarHBondContact O-N 2.87Å; V318-P361 HydrophobicContact CG1-CG 4.12Å; V318-T364 HydrophobicContact CG1-CG2 3.6Å
319	G	92.5	Very high	74.5	Confident	0 Å²	0	77.9 Å²	77.9	0%	0	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	131.6	173.7	0	0	0	0	0	110.6	E279 Y303 P361	E279-G319 CarbonylContact O-C 3.59Å; E279-G319 VanDerWaalsContact O-CA 3.27Å; E279-G319 WeakPolarHBondContact O-CA 3.45Å; Y303-G319 VanDerWaalsContact CD1-N 3.28Å; G319-P361 WeakPolarHBondContact O-CD 3.41Å
320	Y	96.1	Very high	77	Confident	11 Å²	11	69.8 Å²	69.8	4%	0.043	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	118.8	178.9	-167	-159.6	0	0	0	111.3	E279 A322 W358 F359 T364 K384	E279-Y320 PolarHBondContact N-O 3.28Å; E279-Y320 PolarHBondContact O-N 3.1Å; Y320-A322 VanDerWaalsContact C-N 3.33Å; Y320-A322 HydrophobicContact CD1-CB 3.61Å; Y320-A322 HydrophobicContact CD2-CB 4.45Å; Y320-A322 HydrophobicContact CE1-CB 3.8Å; Y320-A322 HydrophobicContact CG-CB 3.96Å; Y320-A322 PolarHBondContact O-N 3.43Å; Y320-A322 VanDerWaalsContact O-N 3.11Å; Y320-W358 HydrophobicContact CE1-CE3 4.2Å; Y320-W358 HydrophobicContact CE2-CB 4.39Å; Y320-W358 AromaticContact CZ-CE3 3.94Å; Y320-F359 WeakPolarHBondContact CD2-O 3.38Å; Y320-T364 HydrophobicContact CD1-CG2 4.4Å; Y320-T364 HydrophobicContact CD2-CG2 3.84Å; Y320-T364 HydrophobicContact CE2-CG2 4.46Å; Y320-T364 HydrophobicContact CG-CG2 3.81Å; Y320-K384 PolarHBondContact OH-NZ 2.83Å
321	L	96.9	Very high	79.6	Confident	1 Å²	1	63.3 Å²	63.3	1%	0.005	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	90.7	166.2	-168.7	174.8	0	0	0	106.6	V276 F299 H324 A357 W358 F359	V276-L321 HydrophobicContact CB-CD1 4.05Å; V276-L321 HydrophobicContact CB-CG 4.43Å; V276-L321 HydrophobicContact CG1-CD1 4.27Å; V276-L321 HydrophobicContact CG2-CD1 3.79Å; V276-L321 HydrophobicContact CG2-CG 4.36Å; F299-L321 HydrophobicContact CE1-CB 4.39Å; F299-L321 HydrophobicContact CZ-CB 4.23Å; L321-H324 HydrophobicContact CD2-CB 3.72Å; L321-A357 HydrophobicContact CD2-CB 4.38Å; L321-W358 CarbonylContact O-C 3.6Å; L321-W358 WeakPolarHBondContact O-CA 3.47Å; L321-F359 HydrophobicContact CB-CB 4.26Å; L321-F359 WeakPolarHBondContact CB-O 3.45Å; L321-F359 PolarHBondContact N-O 3.08Å; L321-F359 PolarHBondContact O-N 3.07Å
322	A	94.9	Very high	82	Confident	11 Å²	11	60.3 Å²	60.3	9%	0.091	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	145.5	-174.4	0	0	0	0	0	111.1	E279 Y320 H324 W358	E279-A322 HydrophobicContact CG-CB 4.32Å; Y320-A322 VanDerWaalsContact C-N 3.33Å; Y320-A322 HydrophobicContact CD1-CB 3.61Å; Y320-A322 HydrophobicContact CD2-CB 4.45Å; Y320-A322 HydrophobicContact CE1-CB 3.8Å; Y320-A322 HydrophobicContact CG-CB 3.96Å; Y320-A322 PolarHBondContact O-N 3.43Å; Y320-A322 VanDerWaalsContact O-N 3.11Å; A322-H324 VanDerWaalsContact C-N 3.26Å; A322-H324 PolarHBondContact O-N 3.45Å; A322-H324 VanDerWaalsContact O-N 3.1Å; A322-W358 HydrophobicContact CB-CE3 3.99Å; A322-W358 HydrophobicContact CB-CZ3 4.02Å
323	Q	93.3	Very high	84.5	Confident	101 Å²	101	50.7 Å²	50.7	47%	0.472	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	48.7	43	168.6	-156.3	-179.4	3.2	0	0	114.6	A357 W358 W462	Q323-A357 PolarHBondContact N-O 2.85Å; Q323-W358 HydrophobicContact CB-CH2 3.75Å; Q323-W358 HydrophobicContact CB-CZ2 4.19Å; Q323-W358 HydrophobicContact CB-CZ3 4.05Å; Q323-W358 HydrophobicContact CG-CH2 4.06Å; Q323-W358 HydrophobicContact CG-CZ2 4.26Å; Q323-W462 VanDerWaalsContact NE2-CH2 3.27Å
324	H	96.1	Very high	87.1	Confident	20 Å²	20	50.9 Å²	50.9	9%	0.093	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	134.8	-179.6	-177.5	47.1	0	0	0	111.3	P277 L321 A322 L326 Q329 N356 A357	P277-H324 HydrophobicContact CG-CB 4.1Å; L321-H324 HydrophobicContact CD2-CB 3.72Å; A322-H324 VanDerWaalsContact C-N 3.26Å; A322-H324 PolarHBondContact O-N 3.45Å; A322-H324 VanDerWaalsContact O-N 3.1Å; H324-L326 PolarHBondContact O-N 2.54Å; H324-Q329 PolarHBondContact CE1-OE1 2.93Å; H324-Q329 PolarHBondContact NE2-OE1 3.44Å; H324-N356 CarbonylContact O-C 3.55Å; H324-N356 WeakPolarHBondContact O-CA 3.48Å; H324-A357 PolarHBondContact O-N 3.09Å
325	Q	94.7	Very high	89.5	Confident	92 Å²	92	50 Å²	50	43%	0.43	25%	0.246	S	C	.	.			trans	-74.8	57	174.6	-67.9	-180	71.3	0	0	111.2	F327 D328 Q329 T354 N356	Q325-F327 PolarHBondContact O-N 2.7Å; Q325-D328 PolarHBondContact O-N 3.16Å; Q325-D328 PolarHBondContact OE1-OD2 2.88Å; Q325-Q329 PolarHBondContact O-N 3.11Å; Q325-T354 HydrophobicContact CG-CG2 4.12Å; Q325-N356 WeakPolarHBondContact CG-OD1 3.36Å
326	L	95.8	Very high	91.6	Very high	4 Å²	4	42 Å²	42	2%	0.021	21%	0.209	C	C	.	.	H	α-helix	trans	-60	-31.1	-173.8	-171.9	71.5	0	0	0	112	V276 H324 Q329 I330 L333 A357 F457	V276-L326 HydrophobicContact CG1-CD1 3.66Å; H324-L326 PolarHBondContact O-N 2.54Å; L326-Q329 CarbonylContact O-C 3.48Å; L326-Q329 PolarHBondContact O-N 3.22Å; L326-I330 HydrophobicContact CD1-CD1 3.51Å; L326-I330 HydrophobicContact CD1-CG1 4.05Å; L326-I330 HydrophobicContact CG-CD1 3.99Å; L326-I330 HydrophobicContact CG-CG1 4.31Å; L326-I330 WeakPolarHBondContact O-CA 3.36Å; L326-I330 WeakPolarHBondContact O-CB 3.35Å; L326-I330 WeakPolarHBondContact O-CG1 3.32Å; L326-I330 PolarHBondContact O-N 2.97Å; L326-L333 HydrophobicContact CD2-CD1 3.74Å; L326-L333 HydrophobicContact CG-CD1 4.22Å; L326-A357 HydrophobicContact CB-CB 3.58Å; L326-A357 HydrophobicContact CD2-CB 3.76Å; L326-A357 HydrophobicContact CG-CB 4.34Å; L326-F457 HydrophobicContact CD2-CZ 3.86Å
327	F	95.2	Very high	93.4	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.009	18%	0.178	C	C	.	.	H	α-helix	trans	-73.5	-28.9	-175.2	-54.2	-71.3	0	0	0	112.8	W262 Q325 I330 L333 K334 I337 V355 A357 F457 V459	W262-F327 AromaticContact CH2-CE1 3.62Å; W262-F327 HydrophobicContact CH2-CE1 3.62Å; W262-F327 AromaticContact CH2-CZ 3.87Å; W262-F327 HydrophobicContact CH2-CZ 3.87Å; W262-F327 HydrophobicContact CZ2-CE1 4.04Å; Q325-F327 PolarHBondContact O-N 2.7Å; F327-I330 CarbonylContact O-C 3.56Å; F327-L333 HydrophobicContact CD1-CB 3.92Å; F327-L333 HydrophobicContact CE1-CB 4.09Å; F327-K334 HydrophobicContact CB-CB 3.97Å; F327-K334 HydrophobicContact CB-CD 4.39Å; F327-K334 HydrophobicContact CB-CG 4.11Å; F327-K334 WeakPolarHBondContact O-CB 3.4Å; F327-I337 HydrophobicContact CD1-CD1 3.7Å; F327-I337 HydrophobicContact CD1-CG1 4.41Å; F327-I337 HydrophobicContact CD2-CD1 4.02Å; F327-I337 HydrophobicContact CE1-CD1 3.84Å; F327-I337 HydrophobicContact CE2-CD1 4.14Å; F327-I337 HydrophobicContact CG-CD1 3.81Å; F327-I337 HydrophobicContact CZ-CD1 4.06Å; F327-V355 HydrophobicContact CD2-CB 4.2Å; F327-V355 HydrophobicContact CD2-CG1 3.52Å; F327-V355 HydrophobicContact CE2-CG1 3.87Å; F327-V355 HydrophobicContact CG-CG1 4.37Å; F327-A357 HydrophobicContact CE2-CB 3.88Å; F327-A357 HydrophobicContact CZ-CB 4Å; F327-F457 HydrophobicContact CZ-CE1 4.43Å; F327-V459 HydrophobicContact CE2-CG1 3.71Å; F327-V459 HydrophobicContact CE2-CG2 4.28Å; F327-V459 HydrophobicContact CZ-CB 4.39Å; F327-V459 HydrophobicContact CZ-CG1 3.94Å; F327-V459 HydrophobicContact CZ-CG2 3.69Å
328	D	90.4	Very high	94.5	Very high	83 Å²	83	38.2 Å²	38.2	44%	0.444	18%	0.181	S	C	.	.	H	α-helix	trans	-75.2	-35.8	171.7	-67.1	-24.6	0	0	0	111	Q325 K334	Q325-D328 PolarHBondContact O-N 3.16Å; Q325-D328 PolarHBondContact OE1-OD2 2.88Å; D328-K334 IonicContact OD1-NZ 3.39Å; D328-K334 PolarHBondContact OD1-NZ 2.93Å
329	Q	91.6	Very high	95	Very high	10 Å²	10	38.3 Å²	38.3	5%	0.047	18%	0.179	C	C	.	.	H	α-helix	trans	-70.9	-35.7	173.8	-174.4	179.1	10.8	0	0	112.2	D164 Q179 R274 T275 H324 Q325 L326 P331	D164-Q329 VanDerWaalsContact CG-NE2 3.27Å; D164-Q329 PolarHBondContact OD1-NE2 3.4Å; Q179-Q329 PolarHBondContact NE2-O 3.24Å; Q179-Q329 PolarHBondContact OE1-O 3.31Å; R274-Q329 PolarHBondContact NH1-O 2.94Å; R274-Q329 PolarHBondContact NH2-O 2.85Å; T275-Q329 PolarHBondContact O-NE2 2.77Å; H324-Q329 PolarHBondContact CE1-OE1 2.93Å; H324-Q329 PolarHBondContact NE2-OE1 3.44Å; Q325-Q329 PolarHBondContact O-N 3.11Å; L326-Q329 CarbonylContact O-C 3.48Å; L326-Q329 PolarHBondContact O-N 3.22Å; Q329-P331 WeakPolarHBondContact O-CD 3.44Å
330	I	93.4	Very high	95.3	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	18%	0.183	C	C	.	.			trans	-127.4	84.3	-172.3	-45.3	-172.8	0	0	0	109.9	A271 R274 L326 F327 E332 L333 K334	A271-I330 HydrophobicContact CB-CD1 3.4Å; A271-I330 VanDerWaalsContact CB-CD1 3.4Å; A271-I330 HydrophobicContact CB-CG2 4.43Å; R274-I330 HydrophobicContact CB-CD1 3.88Å; R274-I330 HydrophobicContact CB-CG1 4.49Å; R274-I330 HydrophobicContact CG-CD1 3.8Å; R274-I330 HydrophobicContact CG-CG1 4.18Å; L326-I330 HydrophobicContact CD1-CD1 3.51Å; L326-I330 HydrophobicContact CD1-CG1 4.05Å; L326-I330 HydrophobicContact CG-CD1 3.99Å; L326-I330 HydrophobicContact CG-CG1 4.31Å; L326-I330 WeakPolarHBondContact O-CA 3.36Å; L326-I330 WeakPolarHBondContact O-CB 3.35Å; L326-I330 WeakPolarHBondContact O-CG1 3.32Å; L326-I330 PolarHBondContact O-N 2.97Å; F327-I330 CarbonylContact O-C 3.56Å; I330-E332 PolarHBondContact O-N 3.23Å; I330-L333 HydrophobicContact CB-CD1 4.2Å; I330-L333 HydrophobicContact CB-CG 4.41Å; I330-L333 HydrophobicContact CD1-CD1 4.29Å; I330-L333 HydrophobicContact CG2-CB 4.41Å; I330-L333 HydrophobicContact CG2-CD1 4.06Å; I330-L333 HydrophobicContact CG2-CG 3.95Å; I330-L333 PolarHBondContact O-N 3.14Å; I330-K334 PolarHBondContact O-N 2.88Å
331	P	91.1	Very high	95.3	Very high	17 Å²	17	44.4 Å²	44.4	11%	0.11	21%	0.213	C	C	.	.	H	α-helix	trans	-57.4	-33.1	-176.5	-28.3	36.8	0	0	0	114	Q179 Q329 L333 K334 E335	Q179-P331 HydrophobicContact CG-CG 4.49Å; Q329-P331 WeakPolarHBondContact O-CD 3.44Å; P331-L333 PolarHBondContact O-N 2.79Å; P331-K334 WeakPolarHBondContact O-CA 3.26Å; P331-K334 WeakPolarHBondContact O-CB 3.48Å; P331-K334 PolarHBondContact O-N 3.08Å; P331-E335 WeakPolarHBondContact O-CG 3.44Å; P331-E335 PolarHBondContact O-N 2.78Å
332	E	92.6	Very high	95.4	Very high	37 Å²	37	45.2 Å²	45.2	17%	0.173	22%	0.216	C	C	.	.	H	α-helix	trans	-58.8	-36.2	175.3	-63.9	101.1	126.2	0	0	112.5	R190 V270 I330	R190-E332 IonicContact CZ-OE1 2.7Å; R190-E332 IonicContact NH1-OE1 3.9Å; R190-E332 IonicContact NH2-OE1 3.83Å; R190-E332 PolarHBondContact NH2-OE1 3.33Å; V270-E332 HydrophobicContact CB-CB 4.44Å; I330-E332 PolarHBondContact O-N 3.23Å
333	L	96.5	Very high	95.5	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-76.3	-28.8	174	-66.6	177.9	0	0	0	112.1	W262 Y266 L267 V270 A271 L326 F327 I330 P331 E335 D336	W262-L333 HydrophobicContact CZ2-CD2 4.39Å; Y266-L333 HydrophobicContact CE1-CD2 3.91Å; L267-L333 HydrophobicContact CD2-CD2 4.15Å; V270-L333 HydrophobicContact CG2-CD2 3.69Å; V270-L333 HydrophobicContact CG2-CG 4.1Å; A271-L333 HydrophobicContact CB-CD1 4.38Å; L326-L333 HydrophobicContact CD2-CD1 3.74Å; L326-L333 HydrophobicContact CG-CD1 4.22Å; F327-L333 HydrophobicContact CD1-CB 3.92Å; F327-L333 HydrophobicContact CE1-CB 4.09Å; I330-L333 HydrophobicContact CB-CD1 4.2Å; I330-L333 HydrophobicContact CB-CG 4.41Å; I330-L333 HydrophobicContact CD1-CD1 4.29Å; I330-L333 HydrophobicContact CG2-CB 4.41Å; I330-L333 HydrophobicContact CG2-CD1 4.06Å; I330-L333 HydrophobicContact CG2-CG 3.95Å; I330-L333 PolarHBondContact O-N 3.14Å; P331-L333 PolarHBondContact O-N 2.79Å; L333-E335 VanDerWaalsContact C-N 3.28Å; L333-E335 PolarHBondContact O-N 2.86Å; L333-D336 WeakPolarHBondContact O-CB 3.45Å; L333-D336 PolarHBondContact O-N 3.45Å
334	K	96.2	Very high	95.6	Very high	106 Å²	106	44.8 Å²	44.8	46%	0.461	22%	0.223	S	C	.	.	H	α-helix	trans	-65.3	-35	174.6	-165.9	168.7	-173.8	164	0	111.2	F327 D328 I330 P331 D336 I337	F327-K334 HydrophobicContact CB-CB 3.97Å; F327-K334 HydrophobicContact CB-CD 4.39Å; F327-K334 HydrophobicContact CB-CG 4.11Å; F327-K334 WeakPolarHBondContact O-CB 3.4Å; D328-K334 IonicContact OD1-NZ 3.39Å; D328-K334 PolarHBondContact OD1-NZ 2.93Å; I330-K334 PolarHBondContact O-N 2.88Å; P331-K334 WeakPolarHBondContact O-CA 3.26Å; P331-K334 WeakPolarHBondContact O-CB 3.48Å; P331-K334 PolarHBondContact O-N 3.08Å; K334-D336 PolarHBondContact O-N 2.89Å; K334-I337 PolarHBondContact O-N 3.44Å
335	E	96.3	Very high	95.7	Very high	130 Å²	130	46.3 Å²	46.3	61%	0.607	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-17.7	175.1	-70.3	173.4	-169.2	0	0	113	P331 L333 R338	P331-E335 WeakPolarHBondContact O-CG 3.44Å; P331-E335 PolarHBondContact O-N 2.78Å; L333-E335 VanDerWaalsContact C-N 3.28Å; L333-E335 PolarHBondContact O-N 2.86Å; E335-R338 PolarHBondContact O-NH1 3.22Å; E335-R338 PolarHBondContact O-NH2 3.05Å
336	D	98.1	Very high	95.6	Very high	1 Å²	1	43 Å²	43	1%	0.005	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-7.6	-178	-67.4	-19.3	0	0	0	115.2	P255 A256 H260 W262 Y266 L333 K334	P255-D336 HydrophobicContact CB-CB 4.27Å; P255-D336 VanDerWaalsContact CD-O 3.26Å; P255-D336 WeakPolarHBondContact CD-O 3.5Å; A256-D336 HydrophobicContact CB-CB 3.96Å; A256-D336 WeakPolarHBondContact CB-O 3.49Å; A256-D336 PolarHBondContact N-O 3.13Å; A256-D336 VanDerWaalsContact N-O 3.13Å; H260-D336 IonicContact CE1-OD1 3.1Å; H260-D336 IonicContact CG-OD1 3.45Å; H260-D336 IonicContact ND1-OD1 3.74Å; H260-D336 PolarHBondContact ND1-OD1 3.39Å; W262-D336 HydrophobicContact CZ2-CB 4.04Å; W262-D336 PolarHBondContact NE1-OD2 2.94Å; Y266-D336 WeakPolarHBondContact CE1-OD2 3.31Å; Y266-D336 PolarHBondContact OH-OD2 2.91Å; Y266-D336 VanDerWaalsContact OH-OD2 3.07Å; L333-D336 WeakPolarHBondContact O-CB 3.45Å; L333-D336 PolarHBondContact O-N 3.45Å; K334-D336 PolarHBondContact O-N 2.89Å
337	I	98.3	Very high	95.3	Very high	11 Å²	11	51.5 Å²	51.5	6%	0.056	26%	0.261	C	S	.	.			trans	-128.2	158.9	-175.7	64.1	169	0	0	0	111.2	W254 A256 W262 F327 K334 V355 V459 F461	W254-I337 HydrophobicContact CD2-CB 4.22Å; W254-I337 HydrophobicContact CD2-CG2 4.27Å; W254-I337 HydrophobicContact CE3-CB 4.09Å; W254-I337 HydrophobicContact CE3-CG2 3.69Å; W254-I337 HydrophobicContact CH2-CB 4.16Å; W254-I337 HydrophobicContact CH2-CG2 4.24Å; W254-I337 HydrophobicContact CZ2-CB 4.29Å; W254-I337 HydrophobicContact CZ3-CB 4.06Å; W254-I337 HydrophobicContact CZ3-CG2 3.67Å; A256-I337 HydrophobicContact CB-CG2 4.48Å; W262-I337 HydrophobicContact CH2-CG2 3.72Å; W262-I337 HydrophobicContact CZ2-CG2 3.74Å; F327-I337 HydrophobicContact CD1-CD1 3.7Å; F327-I337 HydrophobicContact CD1-CG1 4.41Å; F327-I337 HydrophobicContact CD2-CD1 4.02Å; F327-I337 HydrophobicContact CE1-CD1 3.84Å; F327-I337 HydrophobicContact CE2-CD1 4.14Å; F327-I337 HydrophobicContact CG-CD1 3.81Å; F327-I337 HydrophobicContact CZ-CD1 4.06Å; K334-I337 PolarHBondContact O-N 3.44Å; I337-V355 HydrophobicContact CD1-CG1 3.92Å; I337-V459 HydrophobicContact CD1-CG1 3.9Å; I337-V459 HydrophobicContact CG2-CG2 4.36Å; I337-F461 HydrophobicContact CD1-CE1 4.48Å; I337-F461 HydrophobicContact CD1-CZ 4.37Å
338	R	97.5	Very high	94.9	Very high	119 Å²	119	55 Å²	55	45%	0.449	28%	0.28	S	S	.	.			trans	-130.1	145.3	173.6	-60.5	-65.7	177.3	-87.3	-1.8	109.2	W254 E335	W254-R338 WeakPolarHBondContact CZ2-O 3.47Å; W254-R338 PolarHBondContact NE1-O 2.87Å; E335-R338 PolarHBondContact O-NH1 3.22Å; E335-R338 PolarHBondContact O-NH2 3.05Å
339	I	97.8	Very high	94.8	Very high	47 Å²	47	57 Å²	57	24%	0.241	29%	0.291	C	S	.	.			trans	-65.1	129.8	172.2	-68.7	172.6	0	0	0	107.6	D341 C343 E350 I353 F461	I339-D341 PolarHBondContact O-N 2.92Å; I339-C343 HydrophobicContact CG2-CB 3.94Å; I339-E350 HydrophobicContact CD1-CG 3.47Å; I339-E350 VanDerWaalsContact CD1-CG 3.47Å; I339-E350 WeakPolarHBondContact CD1-OE1 3.33Å; I339-I353 HydrophobicContact CD1-CD1 4.3Å; I339-I353 HydrophobicContact CG2-CD1 3.67Å; I339-F461 HydrophobicContact CG1-CD1 4.09Å; I339-F461 HydrophobicContact CG1-CE1 4.01Å
340	P	97.8	Very high	94.5	Very high	11 Å²	11	62.9 Å²	62.9	7%	0.071	32%	0.318	C	S	.	.			trans	-59.7	131.3	176.4	-25.1	34.8	0	0	0	111.5	I250 Y342 C343 F376 F461	I250-P340 HydrophobicContact CD1-CB 4.42Å; P340-Y342 HydrophobicContact CB-CD2 4.4Å; P340-Y342 PolarHBondContact O-N 3.42Å; P340-C343 WeakPolarHBondContact O-CB 3.39Å; P340-C343 PolarHBondContact O-N 2.92Å; P340-C343 PolarHBondContact O-SG 2.93Å; P340-F376 HydrophobicContact CB-CD2 4.15Å; P340-F376 HydrophobicContact CB-CE2 4.38Å; P340-F376 HydrophobicContact CG-CB 4.39Å; P340-F376 HydrophobicContact CG-CD2 4.16Å; P340-F376 HydrophobicContact CG-CG 4.41Å; P340-F461 HydrophobicContact CG-CD2 4.09Å; P340-F461 HydrophobicContact CG-CE2 4.17Å; P340-F461 HydrophobicContact CG-CG 4.48Å
341	D	97.5	Very high	94.2	Very high	129 Å²	129	70.5 Å²	70.5	69%	0.69	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-52.7	-29.8	-179	-64	-18.3	0	0	0	113	I339 C343 C344	I339-D341 PolarHBondContact O-N 2.92Å; D341-C343 PolarHBondContact O-N 2.89Å; D341-C343 VanDerWaalsContact O-N 3.15Å; D341-C344 WeakPolarHBondContact O-CB 3.43Å; D341-C344 PolarHBondContact O-N 2.87Å; D341-C344 PolarHBondContact O-SG 2.86Å
342	Y	98.3	Very high	94.3	Very high	18 Å²	18	74 Å²	74	7%	0.071	38%	0.377	C	S	.	.	G	3₁₀ helix	trans	-60.3	-21.7	178.1	-55.9	-83.6	0	0	0	114	P229 L231 F234 L247 I250 P340 C344 L345 F376	P229-Y342 WeakPolarHBondContact CD-OH 3.31Å; P229-Y342 HydrophobicContact CG-CE1 4.1Å; P229-Y342 WeakPolarHBondContact O-CE1 3.38Å; P229-Y342 PolarHBondContact O-OH 3.45Å; L231-Y342 HydrophobicContact CD2-CD1 3.63Å; L231-Y342 HydrophobicContact CD2-CE1 4.08Å; L231-Y342 HydrophobicContact CD2-CG 4.17Å; F234-Y342 HydrophobicContact CB-CD1 3.66Å; F234-Y342 HydrophobicContact CB-CE1 3.7Å; F234-Y342 AromaticContact CD1-CD1 3.53Å; F234-Y342 HydrophobicContact CD1-CD1 3.53Å; F234-Y342 HydrophobicContact CD1-CE1 4.41Å; F234-Y342 HydrophobicContact CD1-CG 4.14Å; F234-Y342 HydrophobicContact CD2-CD1 4.3Å; F234-Y342 HydrophobicContact CE1-CD1 4.25Å; F234-Y342 HydrophobicContact CE1-CG 4.42Å; F234-Y342 AromaticContact CG-CD1 3.55Å; F234-Y342 HydrophobicContact CG-CD1 3.55Å; F234-Y342 AromaticContact CG-CE1 4Å; F234-Y342 HydrophobicContact CG-CE1 4Å; F234-Y342 HydrophobicContact CG-CG 4.37Å; L247-Y342 HydrophobicContact CD1-CD2 3.89Å; L247-Y342 HydrophobicContact CD1-CE2 3.88Å; L247-Y342 HydrophobicContact CD1-CG 4.33Å; I250-Y342 HydrophobicContact CB-CE2 4.25Å; I250-Y342 HydrophobicContact CD1-CD2 4.07Å; I250-Y342 HydrophobicContact CD1-CE2 3.82Å; I250-Y342 HydrophobicContact CG2-CE2 3.81Å; P340-Y342 HydrophobicContact CB-CD2 4.4Å; P340-Y342 PolarHBondContact O-N 3.42Å; Y342-C344 PolarHBondContact O-N 3.21Å; Y342-L345 WeakPolarHBondContact O-CB 3.37Å; Y342-L345 PolarHBondContact O-N 2.89Å; Y342-F376 VanDerWaalsContact CB-CZ 3.5Å; Y342-F376 HydrophobicContact CG-CZ 4.24Å
343	C	97.3	Very high	94.4	Very high	8 Å²	8	73.3 Å²	73.3	5%	0.054	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-63.9	-22.4	173.8	-62.9	0	0	0	0	112.4	I339 P340 D341 L345 G346 I353 W463	I339-C343 HydrophobicContact CG2-CB 3.94Å; P340-C343 WeakPolarHBondContact O-CB 3.39Å; P340-C343 PolarHBondContact O-N 2.92Å; P340-C343 PolarHBondContact O-SG 2.93Å; D341-C343 PolarHBondContact O-N 2.89Å; D341-C343 VanDerWaalsContact O-N 3.15Å; C343-L345 PolarHBondContact O-N 3.02Å; C343-L345 VanDerWaalsContact O-N 3.09Å; C343-G346 PolarHBondContact O-N 2.95Å; C343-I353 HydrophobicContact CB-CD1 3.67Å; C343-W463 HydrophobicContact CB-CD2 4.36Å; C343-W463 HydrophobicContact CB-CG 4.34Å
344	C	96.4	Very high	94.4	Very high	94 Å²	94	75.1 Å²	75.1	64%	0.635	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-68.8	-6	177.3	85.3	0	0	0	0	113.7	D341 Y342 G346	D341-C344 WeakPolarHBondContact O-CB 3.43Å; D341-C344 PolarHBondContact O-N 2.87Å; D341-C344 PolarHBondContact O-SG 2.86Å; Y342-C344 PolarHBondContact O-N 3.21Å; C344-G346 VanDerWaalsContact C-N 3.26Å
345	L	96.7	Very high	94.5	Very high	53 Å²	53	71 Å²	71	28%	0.277	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-82.9	-7.9	172.8	-63.6	169	0	0	0	112.3	L231 F234 N235 L239 Y342 C343	L231-L345 HydrophobicContact CB-CD2 4.47Å; L231-L345 HydrophobicContact CD2-CD1 4.21Å; L231-L345 HydrophobicContact CD2-CG 4.42Å; F234-L345 HydrophobicContact CD1-CD1 3.71Å; F234-L345 HydrophobicContact CE1-CD1 4.25Å; N235-L345 HydrophobicContact CB-CD1 3.99Å; N235-L345 HydrophobicContact CB-CD2 4.44Å; L239-L345 HydrophobicContact CD2-CB 3.74Å; L239-L345 HydrophobicContact CD2-CD1 4.15Å; Y342-L345 WeakPolarHBondContact O-CB 3.37Å; Y342-L345 PolarHBondContact O-N 2.89Å; C343-L345 PolarHBondContact O-N 3.02Å; C343-L345 VanDerWaalsContact O-N 3.09Å
346	G	93.3	Very high	94.6	Very high	22 Å²	22	65.1 Å²	65.1	23%	0.227	34%	0.341	C	S	.	.	S	Bend	trans	-75.1	173.8	175.8	0	0	0	0	0	113.5	C343 C344 S464	C343-G346 PolarHBondContact O-N 2.95Å; C344-G346 VanDerWaalsContact C-N 3.26Å; G346-S464 CarbonylContact C-O 3.52Å; G346-S464 WeakPolarHBondContact CA-O 3.32Å
347	E	89	Confident	94.6	Very high	183 Å²	183	65 Å²	65	86%	0.855	34%	0.341	S	S	*	.	S	Bend	trans	-89.6	-27	178.3	-63.4	-172.7	174.1	0	0	112.7	S464	E347-S464 PolarHBondContact N-O 3.26Å
348	D	87.6	Confident	94.6	Very high	76 Å²	76	65.5 Å²	65.5	41%	0.406	34%	0.342	S	S	.	.	S	Bend	trans	-84.7	158.6	-175.5	-65.3	-24.7	0	0	0	112.5	D352 S464	D348-D352 HydrophobicContact CB-CB 4.03Å; D348-S464 WeakPolarHBondContact OD2-CB 3.42Å; D348-S464 PolarHBondContact OD2-OG 2.71Å
349	D	87.8	Confident	94.7	Very high	124 Å²	124	60.1 Å²	60.1	66%	0.663	32%	0.322	S	S	*	.			trans	-71	157	174	-75.8	-38.1	0	0	0	111	D351 D352	D349-D351 PolarHBondContact O-N 3.35Å; D349-D351 VanDerWaalsContact O-N 3.14Å; D349-D352 WeakPolarHBondContact O-CB 3.39Å; D349-D352 PolarHBondContact O-N 3.13Å
350	E	86.2	Confident	94.6	Very high	134 Å²	134	57.9 Å²	57.9	63%	0.626	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-57.4	-31.8	179	-172	179.2	152.6	0	0	112.6	I339 D352 I353	I339-E350 HydrophobicContact CD1-CG 3.47Å; I339-E350 VanDerWaalsContact CD1-CG 3.47Å; I339-E350 WeakPolarHBondContact CD1-OE1 3.33Å; E350-D352 PolarHBondContact O-N 2.99Å; E350-I353 HydrophobicContact CG-CD1 4.3Å; E350-I353 WeakPolarHBondContact O-CB 3.44Å; E350-I353 WeakPolarHBondContact O-CG1 3.41Å; E350-I353 PolarHBondContact O-N 3.49Å
351	D	87.3	Confident	94.5	Very high	159 Å²	159	57.9 Å²	57.9	85%	0.85	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-69.3	-17.2	178.8	-74.2	-30.2	0	0	0	113.4	D349	D349-D351 PolarHBondContact O-N 3.35Å; D349-D351 VanDerWaalsContact O-N 3.14Å
352	D	91.4	Very high	94.2	Very high	91 Å²	91	57.8 Å²	57.8	49%	0.487	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-87.6	-8.1	177	-67.2	-45.7	0	0	0	112.6	D348 D349 E350 T354	D348-D352 HydrophobicContact CB-CB 4.03Å; D349-D352 WeakPolarHBondContact O-CB 3.39Å; D349-D352 PolarHBondContact O-N 3.13Å; E350-D352 PolarHBondContact O-N 2.99Å; D352-T354 PolarHBondContact O-N 2.83Å
353	I	95.6	Very high	93.9	Very high	23 Å²	23	58.5 Å²	58.5	12%	0.118	32%	0.317	C	S	.	.			trans	-69.7	116.6	179.1	-61.1	176.1	0	0	0	109.7	I339 C343 E350 V355 F461 W462 W463	I339-I353 HydrophobicContact CD1-CD1 4.3Å; I339-I353 HydrophobicContact CG2-CD1 3.67Å; C343-I353 HydrophobicContact CB-CD1 3.67Å; E350-I353 HydrophobicContact CG-CD1 4.3Å; E350-I353 WeakPolarHBondContact O-CB 3.44Å; E350-I353 WeakPolarHBondContact O-CG1 3.41Å; E350-I353 PolarHBondContact O-N 3.49Å; I353-V355 HydrophobicContact CG2-CG2 4.18Å; I353-V355 PolarHBondContact O-N 2.9Å; I353-F461 HydrophobicContact CG2-CB 4.03Å; I353-F461 HydrophobicContact CG2-CD1 4.32Å; I353-W462 WeakPolarHBondContact CA-O 3.38Å; I353-W463 HydrophobicContact CD1-CB 4.48Å; I353-W463 HydrophobicContact CG1-CB 4.09Å
354	T	96.3	Very high	93.7	Very high	39 Å²	39	58.2 Å²	58.2	24%	0.239	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	118.1	176.8	-58.1	0	0	0	0	110	Q325 D352 W462	Q325-T354 HydrophobicContact CG-CG2 4.12Å; D352-T354 PolarHBondContact O-N 2.83Å; T354-W462 PolarHBondContact N-O 3.19Å; T354-W462 PolarHBondContact O-N 3.44Å
355	V	97.9	Very high	93.5	Very high	20 Å²	20	54.7 Å²	54.7	12%	0.121	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	113.8	-178.7	-167.7	0	0	0	0	110.6	F327 I337 I353 V459 S460 F461	F327-V355 HydrophobicContact CD2-CB 4.2Å; F327-V355 HydrophobicContact CD2-CG1 3.52Å; F327-V355 HydrophobicContact CE2-CG1 3.87Å; F327-V355 HydrophobicContact CG-CG1 4.37Å; I337-V355 HydrophobicContact CD1-CG1 3.92Å; I353-V355 HydrophobicContact CG2-CG2 4.18Å; I353-V355 PolarHBondContact O-N 2.9Å; V355-V459 HydrophobicContact CG1-CG1 3.62Å; V355-S460 WeakPolarHBondContact CA-O 3.24Å; V355-F461 HydrophobicContact CG1-CD1 4.03Å; V355-F461 HydrophobicContact CG1-CE1 3.83Å; V355-F461 HydrophobicContact CG1-CZ 4.39Å; V355-F461 HydrophobicContact CG2-CD1 3.78Å; V355-F461 HydrophobicContact CG2-CE1 4.09Å
356	N	98.3	Very high	93.5	Very high	5 Å²	5	52.6 Å²	52.6	3%	0.027	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	145	-178.7	-61.5	-63.5	0	0	0	112.7	H324 Q325 V459 S460	H324-N356 CarbonylContact O-C 3.55Å; H324-N356 WeakPolarHBondContact O-CA 3.48Å; Q325-N356 WeakPolarHBondContact CG-OD1 3.36Å; N356-V459 WeakPolarHBondContact O-CA 3.42Å; N356-S460 WeakPolarHBondContact CB-OG 3.39Å; N356-S460 PolarHBondContact N-O 3.2Å; N356-S460 PolarHBondContact O-N 3.39Å
357	A	98.4	Very high	93.6	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	145.8	170.9	0	0	0	0	0	111.3	L321 Q323 H324 L326 F327 F457	L321-A357 HydrophobicContact CD2-CB 4.38Å; Q323-A357 PolarHBondContact N-O 2.85Å; H324-A357 PolarHBondContact O-N 3.09Å; L326-A357 HydrophobicContact CB-CB 3.58Å; L326-A357 HydrophobicContact CD2-CB 3.76Å; L326-A357 HydrophobicContact CG-CB 4.34Å; F327-A357 HydrophobicContact CE2-CB 3.88Å; F327-A357 HydrophobicContact CZ-CB 4Å; A357-F457 HydrophobicContact CB-CE1 3.78Å; A357-F457 HydrophobicContact CB-CZ 4.05Å
358	W	98.6	Very high	94.1	Very high	20 Å²	20	43.3 Å²	43.3	8%	0.076	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	96.3	177.3	-54.6	85.2	0	0	0	109.2	Y320 L321 A322 Q323 F457 S458 S460	Y320-W358 HydrophobicContact CE1-CE3 4.2Å; Y320-W358 HydrophobicContact CE2-CB 4.39Å; Y320-W358 AromaticContact CZ-CE3 3.94Å; L321-W358 CarbonylContact O-C 3.6Å; L321-W358 WeakPolarHBondContact O-CA 3.47Å; A322-W358 HydrophobicContact CB-CE3 3.99Å; A322-W358 HydrophobicContact CB-CZ3 4.02Å; Q323-W358 HydrophobicContact CB-CH2 3.75Å; Q323-W358 HydrophobicContact CB-CZ2 4.19Å; Q323-W358 HydrophobicContact CB-CZ3 4.05Å; Q323-W358 HydrophobicContact CG-CH2 4.06Å; Q323-W358 HydrophobicContact CG-CZ2 4.26Å; W358-F457 CarbonylContact O-C 3.53Å; W358-F457 VanDerWaalsContact O-CA 3.27Å; W358-F457 WeakPolarHBondContact O-CA 3.47Å; W358-S458 PolarHBondContact N-O 3.27Å; W358-S458 PolarHBondContact O-N 2.82Å; W358-S460 VanDerWaalsContact NE1-CB 3.32Å; W358-S460 PolarHBondContact NE1-OG 2.99Å
359	F	98.3	Very high	94.6	Very high	6 Å²	6	40.4 Å²	40.4	3%	0.026	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	122.3	-175.8	176.9	-145.4	0	0	0	111.5	I264 L267 F299 I300 I304 Y320 L321 I455 S456 F457	I264-F359 HydrophobicContact CD1-CZ 4.13Å; L267-F359 HydrophobicContact CD1-CE1 4.09Å; L267-F359 HydrophobicContact CD1-CE2 4.45Å; L267-F359 HydrophobicContact CD1-CZ 4Å; F299-F359 AromaticContact CD1-CD1 3.94Å; F299-F359 HydrophobicContact CD1-CD1 3.94Å; F299-F359 AromaticContact CD1-CE1 3.78Å; F299-F359 HydrophobicContact CD1-CE1 3.78Å; F299-F359 AromaticContact CE1-CD1 3.42Å; F299-F359 HydrophobicContact CE1-CD1 3.42Å; F299-F359 VanDerWaalsContact CE1-CD1 3.42Å; F299-F359 AromaticContact CE1-CE1 3.48Å; F299-F359 HydrophobicContact CE1-CE1 3.48Å; F299-F359 VanDerWaalsContact CE1-CE1 3.48Å; F299-F359 AromaticContact CE1-CG 3.99Å; F299-F359 HydrophobicContact CE1-CG 3.99Å; F299-F359 HydrophobicContact CE1-CZ 4.08Å; F299-F359 HydrophobicContact CZ-CD1 4.5Å; F299-F359 WeakPolarHBondContact CZ-O 3.35Å; I300-F359 HydrophobicContact CD1-CE1 4.31Å; I300-F359 HydrophobicContact CG1-CE1 3.89Å; I300-F359 HydrophobicContact CG1-CZ 4.11Å; I304-F359 HydrophobicContact CD1-CE2 3.99Å; I304-F359 HydrophobicContact CD1-CZ 4.07Å; I304-F359 HydrophobicContact CG1-CE1 4.49Å; I304-F359 HydrophobicContact CG1-CE2 4.3Å; I304-F359 HydrophobicContact CG1-CZ 3.88Å; Y320-F359 WeakPolarHBondContact CD2-O 3.38Å; L321-F359 HydrophobicContact CB-CB 4.26Å; L321-F359 WeakPolarHBondContact CB-O 3.45Å; L321-F359 PolarHBondContact N-O 3.08Å; L321-F359 PolarHBondContact O-N 3.07Å; F359-I455 HydrophobicContact CE2-CG2 4.01Å; F359-S456 WeakPolarHBondContact CA-O 3.32Å; F359-S456 WeakPolarHBondContact CD2-O 3.46Å; F359-F457 HydrophobicContact CB-CD1 4.43Å; F359-F457 HydrophobicContact CB-CD2 3.74Å; F359-F457 HydrophobicContact CB-CE1 4.5Å; F359-F457 HydrophobicContact CB-CE2 3.82Å; F359-F457 HydrophobicContact CB-CG 4.06Å; F359-F457 HydrophobicContact CB-CZ 4.21Å; F359-F457 HydrophobicContact CD1-CD2 4.25Å; F359-F457 HydrophobicContact CD1-CE2 4.16Å; F359-F457 HydrophobicContact CD2-CB 4.35Å; F359-F457 AromaticContact CD2-CD2 3.79Å; F359-F457 HydrophobicContact CD2-CD2 3.79Å; F359-F457 HydrophobicContact CD2-CE2 4.48Å; F359-F457 HydrophobicContact CD2-CG 4.3Å; F359-F457 HydrophobicContact CE2-CD2 4.5Å; F359-F457 AromaticContact CG-CD2 3.67Å; F359-F457 HydrophobicContact CG-CD2 3.67Å; F359-F457 AromaticContact CG-CE2 3.92Å; F359-F457 HydrophobicContact CG-CE2 3.92Å; F359-F457 HydrophobicContact CG-CG 4.34Å
360	G	96.7	Very high	95	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.5	168.4	-178.4	0	0	0	0	0	114.6	I455 S456	G360-I455 WeakPolarHBondContact O-CA 3.25Å; G360-S456 PolarHBondContact N-O 3.37Å; G360-S456 PolarHBondContact O-N 3.33Å
361	P	94.8	Very high	95.5	Very high	12 Å²	12	29.8 Å²	29.8	8%	0.078	16%	0.163	C	C	.	.			trans	-71.3	175.9	174.3	31.6	-35.7	0	0	0	111.7	Y303 I304 V318 G319 G363 T364	Y303-P361 WeakPolarHBondContact O-CB 3.39Å; Y303-P361 WeakPolarHBondContact O-CG 3.46Å; I304-P361 HydrophobicContact CD1-CB 4.06Å; I304-P361 HydrophobicContact CD1-CG 4.4Å; V318-P361 HydrophobicContact CG1-CG 4.12Å; G319-P361 WeakPolarHBondContact O-CD 3.41Å; P361-G363 PolarHBondContact O-N 3.28Å; P361-T364 HydrophobicContact CG-CG2 4.04Å; P361-T364 PolarHBondContact O-N 3.38Å; P361-T364 PolarHBondContact O-OG1 3.49Å
362	K	92.9	Very high	95.9	Very high	126 Å²	126	25.8 Å²	25.8	55%	0.548	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	137.7	167.1	177.5	172.3	-178.7	-178.2	0	110.2	L453 E454	K362-L453 WeakPolarHBondContact CD-O 3.48Å; K362-L453 VanDerWaalsContact CE-O 3.22Å; K362-L453 WeakPolarHBondContact CE-O 3.16Å; K362-L453 VanDerWaalsContact CG-O 3.3Å; K362-L453 WeakPolarHBondContact CG-O 3.46Å; K362-E454 WeakPolarHBondContact CA-O 3.46Å; K362-E454 PolarHBondContact N-O 3.16Å
363	G	90.6	Very high	96.2	Very high	34 Å²	34	23.4 Å²	23.4	35%	0.351	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	90	-1.3	174.9	0	0	0	0	0	115.1	P361 V365 S452	P361-G363 PolarHBondContact O-N 3.28Å; G363-V365 PolarHBondContact O-N 3.26Å; G363-S452 PolarHBondContact N-O 2.66Å
364	T	92.9	Very high	96.3	Very high	2 Å²	2	23 Å²	23	1%	0.012	13%	0.129	C	C	.	.			trans	-59.4	136.6	168.8	54.7	0	0	0	0	110.6	V318 Y320 P361 R451 S452	V318-T364 HydrophobicContact CG1-CG2 3.6Å; Y320-T364 HydrophobicContact CD1-CG2 4.4Å; Y320-T364 HydrophobicContact CD2-CG2 3.84Å; Y320-T364 HydrophobicContact CE2-CG2 4.46Å; Y320-T364 HydrophobicContact CG-CG2 3.81Å; P361-T364 HydrophobicContact CG-CG2 4.04Å; P361-T364 PolarHBondContact O-N 3.38Å; P361-T364 PolarHBondContact O-OG1 3.49Å; T364-R451 CarbonylContact O-C 3.44Å; T364-R451 VanDerWaalsContact O-CA 3.32Å; T364-R451 WeakPolarHBondContact O-CA 3.44Å; T364-S452 PolarHBondContact O-N 2.94Å; T364-S452 VanDerWaalsContact OG1-CB 3.26Å; T364-S452 WeakPolarHBondContact OG1-CB 3.46Å; T364-S452 PolarHBondContact OG1-OG 3.09Å
365	V	93.8	Very high	96.5	Very high	19 Å²	19	21.3 Å²	21.3	12%	0.115	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	130	-178	171.8	0	0	0	0	109.3	R283 G363 P367 Y449 V450 R451	R283-V365 HydrophobicContact CG-CB 4.33Å; R283-V365 HydrophobicContact CG-CG1 4.16Å; G363-V365 PolarHBondContact O-N 3.26Å; V365-P367 WeakPolarHBondContact O-CD 3.4Å; V365-Y449 HydrophobicContact CG1-CD2 4.42Å; V365-Y449 HydrophobicContact CG1-CE2 3.5Å; V365-V450 CarbonylContact C-O 3.57Å; V365-V450 WeakPolarHBondContact CA-O 3.42Å; V365-R451 HydrophobicContact CG2-CB 4.19Å; V365-R451 HydrophobicContact CG2-CG 3.93Å
366	S	96	Very high	96.5	Very high	10 Å²	10	20.3 Å²	20.3	7%	0.07	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	109.6	158.4	-60.7	0	0	0	0	107.2	V450	S366-V450 PolarHBondContact N-O 3.06Å; S366-V450 PolarHBondContact O-N 3.06Å; S366-V450 VanDerWaalsContact O-N 3.13Å
367	P	96.2	Very high	96.5	Very high	9 Å²	9	20.5 Å²	20.5	6%	0.058	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-45.7	159.3	172.3	-31.1	32.4	0	0	0	113.7	R283 Y284 T285 V365 H369 T408	R283-P367 HydrophobicContact CB-CG 3.76Å; R283-P367 HydrophobicContact CG-CG 4.09Å; Y284-P367 HydrophobicContact CD1-CG 4.03Å; Y284-P367 HydrophobicContact CE1-CB 4.06Å; Y284-P367 HydrophobicContact CE1-CG 3.69Å; T285-P367 HydrophobicContact CG2-CB 4.23Å; T285-P367 HydrophobicContact CG2-CG 4.11Å; V365-P367 WeakPolarHBondContact O-CD 3.4Å; P367-H369 PolarHBondContact O-N 2.82Å; P367-H369 VanDerWaalsContact O-N 3.15Å; P367-H369 PolarHBondContact O-ND1 3.18Å; P367-T408 HydrophobicContact CB-CG2 4.29Å
368	L	98.4	Very high	96.6	Very high	1 Å²	1	20.5 Å²	20.5	1%	0.005	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	115.7	-179.7	-179.4	64.1	0	0	0	110.4	Y389 L397 S409 V413 F424 W447 H448	L368-Y389 HydrophobicContact CD1-CD2 3.87Å; L368-Y389 HydrophobicContact CD1-CE2 4.23Å; L368-Y389 HydrophobicContact CD2-CD2 4.05Å; L368-Y389 HydrophobicContact CD2-CE2 4.05Å; L368-L397 HydrophobicContact CD2-CD1 4.47Å; L368-L397 HydrophobicContact CD2-CD2 4.3Å; L368-S409 WeakPolarHBondContact O-CB 3.23Å; L368-S409 PolarHBondContact O-N 3.09Å; L368-V413 HydrophobicContact CB-CG2 3.59Å; L368-V413 HydrophobicContact CD2-CG2 3.83Å; L368-V413 HydrophobicContact CG-CG2 4.17Å; L368-F424 HydrophobicContact CD2-CE2 3.82Å; L368-F424 HydrophobicContact CD2-CZ 4.49Å; L368-W447 HydrophobicContact CD1-CB 3.86Å; L368-W447 HydrophobicContact CG-CB 4.38Å; L368-W447 HydrophobicContact CG-CE3 4.04Å; L368-H448 WeakPolarHBondContact CA-O 3.45Å
369	H	98.1	Very high	96.6	Very high	14 Å²	14	19.5 Å²	19.5	7%	0.065	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	169	-178.3	65.9	-70	0	0	0	111.6	Y284 P367 D371 N407 W447 H448	Y284-H369 WeakPolarHBondContact OH-CB 3.33Å; P367-H369 PolarHBondContact O-N 2.82Å; P367-H369 VanDerWaalsContact O-N 3.15Å; P367-H369 PolarHBondContact O-ND1 3.18Å; H369-D371 IonicContact CD2-OD1 3.26Å; H369-D371 IonicContact NE2-OD1 2.69Å; H369-N407 CarbonylContact C-O 3.59Å; H369-N407 WeakPolarHBondContact CA-O 3.36Å; H369-N407 VanDerWaalsContact CB-O 3.29Å; H369-N407 WeakPolarHBondContact CB-O 3.39Å; H369-W447 CarbonylContact O-C 3.53Å; H369-W447 VanDerWaalsContact O-CA 3.25Å; H369-W447 WeakPolarHBondContact O-CA 3.48Å; H369-H448 AromaticContact CD2-CE1 3.85Å; H369-H448 AromaticContact CD2-NE2 3.96Å; H369-H448 AromaticContact CE1-CD2 3.76Å; H369-H448 AromaticContact CE1-CE1 3.85Å; H369-H448 AromaticContact CE1-NE2 3.27Å; H369-H448 PolarHBondContact CE1-NE2 2.82Å; H369-H448 VanDerWaalsContact CE1-NE2 3.27Å; H369-H448 PolarHBondContact N-O 2.95Å; H369-H448 PolarHBondContact ND1-O 3.31Å; H369-H448 AromaticContact NE2-CE1 3.54Å; H369-H448 AromaticContact NE2-NE2 3.19Å; H369-H448 PolarHBondContact NE2-NE2 2.96Å; H369-H448 VanDerWaalsContact NE2-NE2 3.19Å; H369-H448 PolarHBondContact O-N 3.15Å; H369-H448 PolarHBondContact O-ND1 3.07Å
370	Q	97.4	Very high	96.6	Very high	26 Å²	26	19.6 Å²	19.6	12%	0.121	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	143.5	174.2	59.1	172.6	-10.3	0	0	111.4	N407 K445 W447	Q370-N407 HydrophobicContact CG-CB 3.94Å; Q370-N407 PolarHBondContact N-O 2.75Å; Q370-N407 PolarHBondContact O-ND2 3.11Å; Q370-N407 VanDerWaalsContact O-ND2 3.16Å; Q370-K445 WeakPolarHBondContact CB-O 3.34Å; Q370-K445 PolarHBondContact OE1-O 3.36Å; Q370-W447 HydrophobicContact CB-CD2 4.06Å; Q370-W447 HydrophobicContact CB-CE3 4.41Å; Q370-W447 HydrophobicContact CB-CG 4.28Å; Q370-W447 HydrophobicContact CG-CD2 4.25Å; Q370-W447 HydrophobicContact CG-CE3 4.48Å; Q370-W447 HydrophobicContact CG-CH2 4.21Å; Q370-W447 HydrophobicContact CG-CZ2 3.93Å; Q370-W447 HydrophobicContact CG-CZ3 4.47Å
371	D	96.7	Very high	96.7	Very high	9 Å²	9	21.5 Å²	21.5	5%	0.048	12%	0.122	C	C	.	.			trans	-103.2	154.6	179.2	-69.9	-28.6	0	0	0	111.9	H369 Q373 K445 H448 W462	H369-D371 IonicContact CD2-OD1 3.26Å; H369-D371 IonicContact NE2-OD1 2.69Å; D371-Q373 VanDerWaalsContact C-N 3.35Å; D371-K445 WeakPolarHBondContact O-CA 3.34Å; D371-K445 PolarHBondContact O-N 2.57Å; D371-K445 VanDerWaalsContact O-N 3.1Å; D371-H448 IonicContact OD2-CE1 3.3Å; D371-H448 PolarHBondContact OD2-CE1 3.09Å; D371-H448 IonicContact OD2-NE2 2.95Å; D371-H448 PolarHBondContact OD2-NE2 3.44Å; D371-W462 HydrophobicContact CB-CH2 4.34Å; D371-W462 HydrophobicContact CB-CZ2 4.31Å; D371-W462 VanDerWaalsContact CG-CZ2 3.44Å; D371-W462 WeakPolarHBondContact OD1-CH2 3.46Å; D371-W462 VanDerWaalsContact OD2-CZ2 3.3Å; D371-W462 WeakPolarHBondContact OD2-CZ2 3.23Å
372	P	95.4	Very high	96.8	Very high	75 Å²	75	21.3 Å²	21.3	49%	0.487	12%	0.123	S	C	.	.	S	Bend	trans	-82.1	-7.7	-177.8	34.2	-36.2	0	0	0	114.6	V444	P372-V444 WeakPolarHBondContact O-CG2 3.41Å
373	Q	97.1	Very high	97	Very high	42 Å²	42	16.8 Å²	16.8	20%	0.196	10%	0.104	C	C	.	.	S	Bend	trans	-126	166.6	-175	-75.8	-177.4	-77.2	0	0	111.2	D371 V444 W462 W463 S464	D371-Q373 VanDerWaalsContact C-N 3.35Å; Q373-V444 WeakPolarHBondContact O-CA 3.32Å; Q373-W462 HydrophobicContact CB-CB 4.25Å; Q373-W463 WeakPolarHBondContact CB-O 3.38Å; Q373-S464 PolarHBondContact NE2-OG 3.24Å
374	Q	98.4	Very high	97.4	Very high	13 Å²	13	15.2 Å²	15.2	6%	0.061	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	148.8	164.7	-52.6	-66	-6.7	0	0	109	L239 F441 P443 W462 W463	L239-Q374 HydrophobicContact CD1-CG 4.35Å; Q374-F441 HydrophobicContact CB-CE2 4.24Å; Q374-P443 VanDerWaalsContact OE1-CA 3.25Å; Q374-W462 WeakPolarHBondContact O-CA 3.18Å; Q374-W463 WeakPolarHBondContact CA-O 3.38Å; Q374-W463 HydrophobicContact CB-CD2 3.78Å; Q374-W463 VanDerWaalsContact CB-CE2 3.49Å; Q374-W463 HydrophobicContact CB-CE3 4.39Å; Q374-W463 HydrophobicContact CB-CG 4.06Å; Q374-W463 HydrophobicContact CB-CZ2 3.93Å; Q374-W463 VanDerWaalsContact CB-O 3.24Å; Q374-W463 WeakPolarHBondContact CB-O 3.43Å; Q374-W463 HydrophobicContact CG-CD2 4.23Å; Q374-W463 HydrophobicContact CG-CE3 4.34Å; Q374-W463 HydrophobicContact CG-CH2 4.36Å; Q374-W463 HydrophobicContact CG-CZ2 4.21Å; Q374-W463 HydrophobicContact CG-CZ3 4.39Å; Q374-W463 PolarHBondContact N-O 3.24Å; Q374-W463 PolarHBondContact O-N 2.69Å
375	N	98.7	Very high	97.6	Very high	4 Å²	4	15.7 Å²	15.7	2%	0.021	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	130.1	-179.9	-176.4	5.8	0	0	0	111.9	I442 S460 F461 W462	N375-I442 HydrophobicContact CB-CB 4.22Å; N375-I442 PolarHBondContact N-O 3.35Å; N375-I442 PolarHBondContact O-N 3Å; N375-S460 WeakPolarHBondContact OD1-CB 3.14Å; N375-F461 WeakPolarHBondContact CA-O 3.34Å; N375-F461 PolarHBondContact OD1-O 2.66Å; N375-W462 VanDerWaalsContact CG-CD1 3.46Å; N375-W462 PolarHBondContact ND2-NE1 3.02Å
376	F	98.9	Very high	97.9	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	114.3	160.5	-73.4	-59.8	0	0	0	109.8	F234 L247 P340 Y342 V439 L440 F441 S460 F461 W463	F234-F376 AromaticContact CE1-CZ 4Å; F234-F376 HydrophobicContact CE1-CZ 4Å; F234-F376 HydrophobicContact CE2-CE1 4.21Å; F234-F376 HydrophobicContact CE2-CZ 4.32Å; F234-F376 AromaticContact CZ-CE1 3.86Å; F234-F376 HydrophobicContact CZ-CE1 3.86Å; F234-F376 AromaticContact CZ-CZ 3.6Å; F234-F376 HydrophobicContact CZ-CZ 3.6Å; L247-F376 HydrophobicContact CD1-CD1 4.38Å; L247-F376 HydrophobicContact CD1-CE1 3.67Å; L247-F376 HydrophobicContact CD1-CZ 4.33Å; P340-F376 HydrophobicContact CB-CD2 4.15Å; P340-F376 HydrophobicContact CB-CE2 4.38Å; P340-F376 HydrophobicContact CG-CB 4.39Å; P340-F376 HydrophobicContact CG-CD2 4.16Å; P340-F376 HydrophobicContact CG-CG 4.41Å; Y342-F376 VanDerWaalsContact CB-CZ 3.5Å; Y342-F376 HydrophobicContact CG-CZ 4.24Å; F376-V439 HydrophobicContact CB-CG1 3.74Å; F376-V439 HydrophobicContact CD1-CG1 3.74Å; F376-V439 HydrophobicContact CG-CG1 4.05Å; F376-L440 CarbonylContact C-O 3.55Å; F376-L440 WeakPolarHBondContact CA-O 3.47Å; F376-F441 HydrophobicContact CD1-CB 4.04Å; F376-F441 HydrophobicContact CD1-CD2 4.12Å; F376-F441 HydrophobicContact CE1-CB 3.75Å; F376-F441 AromaticContact CE1-CD2 3.68Å; F376-F441 HydrophobicContact CE1-CD2 3.68Å; F376-F441 HydrophobicContact CE1-CG 4.03Å; F376-F441 HydrophobicContact CZ-CD2 4.1Å; F376-S460 CarbonylContact O-C 3.49Å; F376-S460 VanDerWaalsContact O-CA 3.23Å; F376-S460 WeakPolarHBondContact O-CA 3.37Å; F376-F461 HydrophobicContact CB-CB 4.36Å; F376-F461 HydrophobicContact CB-CD2 4.15Å; F376-F461 PolarHBondContact N-O 3.1Å; F376-F461 PolarHBondContact O-N 3.11Å; F376-W463 AromaticContact CD2-NE1 3.35Å; F376-W463 AromaticContact CE2-CE2 3.67Å; F376-W463 AromaticContact CE2-CZ2 3.66Å; F376-W463 HydrophobicContact CE2-CZ2 3.66Å; F376-W463 AromaticContact CE2-NE1 3.37Å; F376-W463 AromaticContact CZ-CZ2 3.96Å; F376-W463 HydrophobicContact CZ-CZ2 3.96Å
377	L	98.9	Very high	98	Very high	8 Å²	8	15.9 Å²	15.9	4%	0.042	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	101.9	171.3	-176.5	66.3	0	0	0	109.4	I386 L434 V439 L440 I442	L377-I386 HydrophobicContact CD2-CD1 3.76Å; L377-L434 HydrophobicContact CD2-CD2 4.12Å; L377-L434 HydrophobicContact CG-CD2 4.1Å; L377-L434 WeakPolarHBondContact O-CD2 3.45Å; L377-V439 WeakPolarHBondContact O-CA 3.48Å; L377-L440 HydrophobicContact CB-CB 4.43Å; L377-L440 PolarHBondContact N-O 3.05Å; L377-L440 PolarHBondContact O-N 2.81Å; L377-I442 HydrophobicContact CB-CD1 4.37Å
378	A	98.9	Very high	98.1	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	127.7	175.7	0	0	0	0	0	111	I251 W254 V439 S458 V459 F461	I251-A378 HydrophobicContact CD1-CB 4.01Å; W254-A378 HydrophobicContact CH2-CB 3.58Å; W254-A378 HydrophobicContact CZ3-CB 3.94Å; A378-V439 HydrophobicContact CB-CG1 4.49Å; A378-V439 HydrophobicContact CB-CG2 3.94Å; A378-S458 CarbonylContact O-C 3.47Å; A378-S458 VanDerWaalsContact O-CA 3.23Å; A378-S458 WeakPolarHBondContact O-CA 3.27Å; A378-S458 WeakPolarHBondContact O-CB 3.39Å; A378-V459 HydrophobicContact CB-CB 4.43Å; A378-V459 PolarHBondContact N-O 2.91Å; A378-V459 PolarHBondContact O-N 3.24Å; A378-F461 HydrophobicContact CB-CE2 4.21Å
379	Q	98.8	Very high	98.1	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	122.7	178.9	-171.1	69	14.9	0	0	110.6	V381 G382 L434 R435 P436 G437 D438 S456 S458	Q379-V381 PolarHBondContact NE2-O 3.3Å; Q379-G382 WeakPolarHBondContact CG-O 3.49Å; Q379-G382 PolarHBondContact NE2-O 3.15Å; Q379-L434 HydrophobicContact CB-CD2 3.88Å; Q379-L434 HydrophobicContact CB-CG 3.85Å; Q379-R435 WeakPolarHBondContact CB-O 3.21Å; Q379-P436 WeakPolarHBondContact O-CA 3.24Å; Q379-G437 PolarHBondContact O-N 3.31Å; Q379-D438 PolarHBondContact N-O 2.88Å; Q379-S456 PolarHBondContact NE2-OG 3.02Å; Q379-S458 PolarHBondContact OE1-OG 3.04Å
380	V	98.6	Very high	98.1	Very high	8 Å²	8	16.2 Å²	16.2	5%	0.048	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	-45.1	-176.7	-175.4	0	0	0	0	111.8	W254 A256 L257 W262 F457 V459	W254-V380 HydrophobicContact CE3-CG2 4.28Å; W254-V380 HydrophobicContact CZ3-CG2 3.96Å; A256-V380 HydrophobicContact CB-CG1 3.82Å; L257-V380 HydrophobicContact CD2-CG1 4.02Å; W262-V380 HydrophobicContact CD2-CG1 3.94Å; W262-V380 HydrophobicContact CE3-CB 3.94Å; W262-V380 HydrophobicContact CE3-CG1 3.58Å; W262-V380 HydrophobicContact CE3-CG2 4.27Å; W262-V380 HydrophobicContact CG-CG1 4.38Å; W262-V380 HydrophobicContact CH2-CG2 4.42Å; W262-V380 HydrophobicContact CZ3-CB 4.03Å; W262-V380 HydrophobicContact CZ3-CG1 4.02Å; W262-V380 HydrophobicContact CZ3-CG2 3.86Å; V380-F457 PolarHBondContact N-O 3.03Å; V380-V459 HydrophobicContact CG2-CG2 4.02Å
381	V	98.4	Very high	98.1	Very high	40 Å²	40	16.9 Å²	16.9	24%	0.242	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	137.2	-179.1	-179.3	0	0	0	0	109.7	W262 Q379 S456 F457	W262-V381 HydrophobicContact CB-CG2 3.91Å; Q379-V381 PolarHBondContact NE2-O 3.3Å; V381-S456 VanDerWaalsContact O-CA 3.25Å; V381-S456 WeakPolarHBondContact O-CA 3.5Å; V381-S456 PolarHBondContact O-OG 3.49Å; V381-F457 HydrophobicContact CB-CB 3.79Å; V381-F457 HydrophobicContact CG2-CB 3.96Å; V381-F457 PolarHBondContact N-O 3.09Å; V381-F457 PolarHBondContact O-N 3.03Å
382	G	97.4	Very high	98.2	Very high	8 Å²	8	25 Å²	25	8%	0.082	13%	0.134	C	C	.	.	S	Bend	trans	67.3	-172	176.7	0	0	0	0	0	113.7	Q379 P436 I455	Q379-G382 WeakPolarHBondContact CG-O 3.49Å; Q379-G382 PolarHBondContact NE2-O 3.15Å; G382-P436 VanDerWaalsContact O-CD 3.28Å; G382-P436 WeakPolarHBondContact O-CD 3.17Å; G382-P436 WeakPolarHBondContact O-CG 3.48Å; G382-I455 WeakPolarHBondContact CA-O 3.36Å
383	N	97.8	Very high	98.3	Very high	30 Å²	30	22.3 Å²	22.3	16%	0.16	12%	0.116	C	C	.	.			trans	-120.2	144.3	-176.9	-60.5	-76.7	0	0	0	111.3	V433 L434 R435 L453 E454	N383-V433 HydrophobicContact CB-CG1 4.07Å; N383-L434 WeakPolarHBondContact CA-O 3.21Å; N383-R435 WeakPolarHBondContact OD1-CA 3.44Å; N383-R435 WeakPolarHBondContact OD1-CG 3.44Å; N383-L453 HydrophobicContact CB-CB 4.27Å; N383-L453 HydrophobicContact CB-CD1 3.95Å; N383-L453 WeakPolarHBondContact O-CB 3.44Å; N383-L453 PolarHBondContact O-N 2.87Å; N383-E454 PolarHBondContact ND2-OE1 3.08Å; N383-E454 PolarHBondContact ND2-OE2 3.05Å
384	K	98.1	Very high	98.3	Very high	2 Å²	2	22.1 Å²	22.1	1%	0.009	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	134.4	173.5	-85.7	174.7	167.5	176.9	0	111	Y320 I386 V433 L434 V450 R451 S452 S456 S458	Y320-K384 PolarHBondContact OH-NZ 2.83Å; K384-I386 HydrophobicContact CB-CG1 4.37Å; K384-V433 CarbonylContact O-C 3.54Å; K384-V433 WeakPolarHBondContact O-CA 3.44Å; K384-L434 PolarHBondContact N-O 2.85Å; K384-L434 PolarHBondContact O-N 3.05Å; K384-V450 HydrophobicContact CB-CG1 4.17Å; K384-V450 HydrophobicContact CD-CG1 3.58Å; K384-V450 HydrophobicContact CG-CG1 3.99Å; K384-R451 WeakPolarHBondContact CA-O 3.35Å; K384-S452 WeakPolarHBondContact CE-OG 3.47Å; K384-S456 VanDerWaalsContact CE-OG 3.31Å; K384-S456 WeakPolarHBondContact CE-OG 3.49Å; K384-S458 WeakPolarHBondContact CD-OG 3.24Å; K384-S458 WeakPolarHBondContact CE-OG 3.32Å; K384-S458 PolarHBondContact NZ-OG 3.13Å
385	Y	98.3	Very high	98.2	Very high	11 Å²	11	30.1 Å²	30.1	4%	0.043	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	133.8	165.3	167.3	-103.9	0	0	0	109	V214 R387 E414 E431 C432 Y449 V450 R451	V214-Y385 HydrophobicContact CG1-CD2 4.08Å; Y385-R387 PolarHBondContact OH-NE 2.99Å; Y385-R387 PolarHBondContact OH-NH2 2.72Å; Y385-E414 HydrophobicContact CE1-CG 4.36Å; Y385-E431 HydrophobicContact CE2-CB 4.01Å; Y385-E431 HydrophobicContact CE2-CG 4.48Å; Y385-E431 PolarHBondContact OH-OE2 3.13Å; Y385-C432 WeakPolarHBondContact CA-O 3.44Å; Y385-Y449 HydrophobicContact CD1-CD1 4.31Å; Y385-Y449 AromaticContact CD1-CE1 3.94Å; Y385-Y449 HydrophobicContact CD1-CE1 3.94Å; Y385-Y449 HydrophobicContact CE1-CD1 4.04Å; Y385-Y449 AromaticContact CE1-CE1 3.88Å; Y385-Y449 HydrophobicContact CE1-CE1 3.88Å; Y385-V450 WeakPolarHBondContact O-CA 3.03Å; Y385-R451 PolarHBondContact N-O 3.48Å; Y385-R451 PolarHBondContact O-N 2.87Å
386	I	98.7	Very high	98.2	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	136	-176.2	-54.4	177.7	0	0	0	109.2	L377 K384 L388 E431 C432 L434 L440 Y449 V450	L377-I386 HydrophobicContact CD2-CD1 3.76Å; K384-I386 HydrophobicContact CB-CG1 4.37Å; I386-L388 HydrophobicContact CG2-CD2 3.83Å; I386-L388 HydrophobicContact CG2-CG 4.15Å; I386-E431 CarbonylContact O-C 3.16Å; I386-E431 WeakPolarHBondContact O-CA 3.24Å; I386-E431 WeakPolarHBondContact O-CB 3.26Å; I386-C432 PolarHBondContact N-O 3.1Å; I386-C432 PolarHBondContact O-N 3.37Å; I386-L434 HydrophobicContact CD1-CB 3.98Å; I386-L434 HydrophobicContact CD1-CD2 3.93Å; I386-L440 HydrophobicContact CB-CD2 4.44Å; I386-L440 HydrophobicContact CD1-CD2 3.59Å; I386-L440 HydrophobicContact CG2-CD2 3.88Å; I386-Y449 CarbonylContact C-O 3.55Å; I386-Y449 VanDerWaalsContact CA-O 3.23Å; I386-Y449 WeakPolarHBondContact CA-O 3.35Å; I386-Y449 WeakPolarHBondContact CG2-O 3.39Å; I386-V450 HydrophobicContact CG1-CG1 4.23Å; I386-V450 HydrophobicContact CG1-CG2 4.2Å; I386-V450 HydrophobicContact CG2-CG2 4.34Å
387	R	98.5	Very high	98.1	Very high	34 Å²	34	33 Å²	33	13%	0.128	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	135.6	169.2	-171.8	175.6	-70.1	165.7	-6.7	110.3	Y385 Y389 V413 Y429 L430 E431 H448 Y449	Y385-R387 PolarHBondContact OH-NE 2.99Å; Y385-R387 PolarHBondContact OH-NH2 2.72Å; R387-Y389 HydrophobicContact CB-CE2 4.48Å; R387-Y389 WeakPolarHBondContact CD-OH 3.44Å; R387-Y389 HydrophobicContact CG-CD2 4.32Å; R387-Y389 HydrophobicContact CG-CE2 3.61Å; R387-V413 HydrophobicContact CB-CG1 4.32Å; R387-V413 PolarHBondContact NH1-O 2.69Å; R387-Y429 HydrophobicContact CG-CD2 3.76Å; R387-Y429 HydrophobicContact CG-CG 3.96Å; R387-L430 CarbonylContact C-O 3.53Å; R387-L430 WeakPolarHBondContact CA-O 3.04Å; R387-E431 HydrophobicContact CB-CB 4.43Å; R387-E431 HydrophobicContact CG-CB 4.39Å; R387-E431 IonicContact CZ-OE2 3.75Å; R387-E431 IonicContact NE-OE2 2.69Å; R387-E431 PolarHBondContact NE-OE2 3.14Å; R387-E431 IonicContact NH2-OE2 3.51Å; R387-E431 PolarHBondContact NH2-OE2 2.95Å; R387-H448 CarbonylContact O-C 3.49Å; R387-H448 WeakPolarHBondContact O-CA 3.35Å; R387-Y449 PolarHBondContact N-O 3.41Å; R387-Y449 PolarHBondContact O-N 3.47Å
388	L	98.8	Very high	98	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	135.1	-172.7	-58.1	175	0	0	0	110.8	V223 P244 I386 Y429 L430 L440 Y446 W447 H448	V223-L388 HydrophobicContact CG2-CD1 3.86Å; P244-L388 HydrophobicContact CB-CD1 3.45Å; P244-L388 VanDerWaalsContact CB-CD1 3.45Å; P244-L388 HydrophobicContact CG-CD1 3.77Å; I386-L388 HydrophobicContact CG2-CD2 3.83Å; I386-L388 HydrophobicContact CG2-CG 4.15Å; L388-Y429 CarbonylContact O-C 3.51Å; L388-Y429 WeakPolarHBondContact O-CA 3.44Å; L388-Y429 VanDerWaalsContact O-CB 3.29Å; L388-Y429 WeakPolarHBondContact O-CB 3.41Å; L388-L430 HydrophobicContact CB-CB 4.43Å; L388-L430 PolarHBondContact N-O 2.63Å; L388-L430 PolarHBondContact O-N 2.83Å; L388-L440 HydrophobicContact CD1-CD1 4.25Å; L388-L440 HydrophobicContact CD1-CD2 4.31Å; L388-Y446 HydrophobicContact CB-CD1 4.34Å; L388-W447 CarbonylContact C-O 3.47Å; L388-W447 VanDerWaalsContact CA-O 3.24Å; L388-W447 WeakPolarHBondContact CA-O 3.39Å; L388-H448 HydrophobicContact CD2-CB 3.39Å
389	Y	98.7	Very high	97.9	Very high	4 Å²	4	36.4 Å²	36.4	2%	0.016	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	142.5	174.4	-61	-103.6	0	0	0	110.2	L368 R387 L397 F424 A427 P428 Y429 Y446 W447	L368-Y389 HydrophobicContact CD1-CD2 3.87Å; L368-Y389 HydrophobicContact CD1-CE2 4.23Å; L368-Y389 HydrophobicContact CD2-CD2 4.05Å; L368-Y389 HydrophobicContact CD2-CE2 4.05Å; R387-Y389 HydrophobicContact CB-CE2 4.48Å; R387-Y389 WeakPolarHBondContact CD-OH 3.44Å; R387-Y389 HydrophobicContact CG-CD2 4.32Å; R387-Y389 HydrophobicContact CG-CE2 3.61Å; Y389-L397 HydrophobicContact CD1-CD2 3.67Å; Y389-L397 HydrophobicContact CD2-CD2 4.45Å; Y389-L397 HydrophobicContact CE1-CD2 4.09Å; Y389-L397 HydrophobicContact CG-CD1 4.23Å; Y389-L397 HydrophobicContact CG-CD2 3.87Å; Y389-F424 HydrophobicContact CE1-CE2 4.29Å; Y389-F424 HydrophobicContact CE1-CZ 4.45Å; Y389-F424 HydrophobicContact CE2-CE2 4.35Å; Y389-F424 HydrophobicContact CE2-CZ 4.33Å; Y389-F424 AromaticContact CZ-CE2 3.9Å; Y389-F424 AromaticContact CZ-CZ 3.77Å; Y389-F424 WeakPolarHBondContact OH-CZ 3.49Å; Y389-A427 HydrophobicContact CD1-CB 3.85Å; Y389-A427 HydrophobicContact CE1-CB 3.83Å; Y389-P428 VanDerWaalsContact CD1-O 3.24Å; Y389-P428 WeakPolarHBondContact CD1-O 3.47Å; Y389-Y429 HydrophobicContact CE1-CD1 4.05Å; Y389-Y429 HydrophobicContact CE1-CG 4.23Å; Y389-Y446 VanDerWaalsContact O-CD1 3.26Å; Y389-Y446 WeakPolarHBondContact O-CD1 3.49Å; Y389-W447 PolarHBondContact N-O 3.15Å; Y389-W447 PolarHBondContact O-N 3.26Å
390	S	98.3	Very high	97.6	Very high	25 Å²	25	38.7 Å²	38.7	18%	0.175	19%	0.194	C	C	.	.			trans	-64.6	144.7	178.8	179.3	0	0	0	0	111	E392 D393	S390-E392 PolarHBondContact O-N 3.13Å; S390-E392 VanDerWaalsContact O-N 3.16Å; S390-E392 PolarHBondContact OG-N 2.81Å; S390-D393 PolarHBondContact O-N 3.46Å
391	P	97.9	Very high	97.1	Very high	41 Å²	41	46.7 Å²	46.7	27%	0.266	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-55.1	-28.1	169.1	-20.3	28.4	0	0	0	112.9	D393 T394 K445 Y446	P391-D393 PolarHBondContact O-N 3.04Å; P391-T394 VanDerWaalsContact O-CB 3.32Å; P391-T394 WeakPolarHBondContact O-CB 3.46Å; P391-T394 PolarHBondContact O-N 3.05Å; P391-T394 VanDerWaalsContact O-N 3.16Å; P391-T394 PolarHBondContact O-OG1 3.05Å; P391-K445 HydrophobicContact CB-CB 4.32Å; P391-K445 HydrophobicContact CG-CB 4.05Å; P391-Y446 HydrophobicContact CG-CD2 3.98Å; P391-Y446 HydrophobicContact CG-CE2 4.27Å
392	E	97.6	Very high	96.4	Very high	180 Å²	180	47.5 Å²	47.5	84%	0.841	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-62	-24.4	176.6	-62.9	-178.8	171.1	0	0	112.9	S390	S390-E392 PolarHBondContact O-N 3.13Å; S390-E392 VanDerWaalsContact O-N 3.16Å; S390-E392 PolarHBondContact OG-N 2.81Å
393	D	97.4	Very high	95.3	Very high	17 Å²	17	55.3 Å²	55.3	9%	0.091	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-94.9	7	-179.9	-69.1	-65.1	0	0	0	113.3	S390 P391 E395 K396 L397 P428	S390-D393 PolarHBondContact O-N 3.46Å; P391-D393 PolarHBondContact O-N 3.04Å; D393-E395 PolarHBondContact O-N 2.97Å; D393-K396 HydrophobicContact CB-CD 4.34Å; D393-K396 WeakPolarHBondContact O-CA 3.32Å; D393-K396 VanDerWaalsContact O-CB 3.32Å; D393-K396 WeakPolarHBondContact O-CB 3.33Å; D393-K396 PolarHBondContact O-N 2.94Å; D393-K396 WeakPolarHBondContact OD1-CE 3.44Å; D393-K396 IonicContact OD1-NZ 2.79Å; D393-K396 PolarHBondContact OD1-NZ 2.76Å; D393-L397 WeakPolarHBondContact O-CG 3.31Å; D393-P428 WeakPolarHBondContact OD2-CD 3.24Å; D393-P428 VanDerWaalsContact OD2-CG 3.25Å; D393-P428 WeakPolarHBondContact OD2-CG 2.98Å
394	T	97.4	Very high	94.4	Very high	38 Å²	38	61.4 Å²	61.4	23%	0.233	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-47.4	-41.3	-175.1	-68.8	0	0	0	0	113.6	P391 K396 L397 P399 W447	P391-T394 VanDerWaalsContact O-CB 3.32Å; P391-T394 WeakPolarHBondContact O-CB 3.46Å; P391-T394 PolarHBondContact O-N 3.05Å; P391-T394 VanDerWaalsContact O-N 3.16Å; P391-T394 PolarHBondContact O-OG1 3.05Å; T394-K396 PolarHBondContact O-N 2.8Å; T394-L397 PolarHBondContact O-N 3.49Å; T394-P399 HydrophobicContact CG2-CG 3.84Å; T394-P399 WeakPolarHBondContact O-CD 3.36Å; T394-W447 HydrophobicContact CG2-CZ2 3.84Å; T394-W447 PolarHBondContact OG1-NE1 3.42Å
395	E	96	Very high	93.8	Very high	181 Å²	181	63.6 Å²	63.6	85%	0.846	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-62.2	-30.3	179.7	-63.8	-173	166.9	0	0	112.9	D393 L397	D393-E395 PolarHBondContact O-N 2.97Å; E395-L397 VanDerWaalsContact C-N 3.28Å; E395-L397 PolarHBondContact O-N 3.13Å
396	K	98	Very high	93.3	Very high	65 Å²	65	68.3 Å²	68.3	28%	0.283	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-79	-11.7	177.4	-54.3	177.8	-174.2	159	0	112.8	D393 T394 Y398 E423 F424 A427	D393-K396 HydrophobicContact CB-CD 4.34Å; D393-K396 WeakPolarHBondContact O-CA 3.32Å; D393-K396 VanDerWaalsContact O-CB 3.32Å; D393-K396 WeakPolarHBondContact O-CB 3.33Å; D393-K396 PolarHBondContact O-N 2.94Å; D393-K396 WeakPolarHBondContact OD1-CE 3.44Å; D393-K396 IonicContact OD1-NZ 2.79Å; D393-K396 PolarHBondContact OD1-NZ 2.76Å; T394-K396 PolarHBondContact O-N 2.8Å; K396-Y398 WeakPolarHBondContact O-CD2 3.4Å; K396-Y398 VanDerWaalsContact O-CE2 3.24Å; K396-Y398 WeakPolarHBondContact O-CE2 3.21Å; K396-E423 HydrophobicContact CB-CB 4.16Å; K396-E423 HydrophobicContact CG-CB 4.19Å; K396-F424 VanDerWaalsContact O-CA 3.24Å; K396-F424 WeakPolarHBondContact O-CA 3.22Å; K396-F424 WeakPolarHBondContact O-CB 3.26Å; K396-F424 PolarHBondContact O-N 3.37Å; K396-A427 HydrophobicContact CB-CB 3.98Å; K396-A427 HydrophobicContact CD-CB 3.98Å
397	L	97.9	Very high	93	Very high	0 Å²	0	70.3 Å²	70.3	0%	0	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-97.5	1.3	-175.7	-51	-179.6	0	0	0	112.9	L368 Y389 D393 T394 E395 S409 F424 A427 W447	L368-L397 HydrophobicContact CD2-CD1 4.47Å; L368-L397 HydrophobicContact CD2-CD2 4.3Å; Y389-L397 HydrophobicContact CD1-CD2 3.67Å; Y389-L397 HydrophobicContact CD2-CD2 4.45Å; Y389-L397 HydrophobicContact CE1-CD2 4.09Å; Y389-L397 HydrophobicContact CG-CD1 4.23Å; Y389-L397 HydrophobicContact CG-CD2 3.87Å; D393-L397 WeakPolarHBondContact O-CG 3.31Å; T394-L397 PolarHBondContact O-N 3.49Å; E395-L397 VanDerWaalsContact C-N 3.28Å; E395-L397 PolarHBondContact O-N 3.13Å; L397-S409 VanDerWaalsContact O-CB 3.3Å; L397-S409 WeakPolarHBondContact O-CB 3.29Å; L397-S409 PolarHBondContact O-OG 2.81Å; L397-F424 HydrophobicContact CD2-CD2 3.79Å; L397-F424 HydrophobicContact CD2-CE2 3.88Å; L397-A427 HydrophobicContact CD2-CB 4.09Å; L397-W447 HydrophobicContact CD1-CB 3.67Å; L397-W447 VanDerWaalsContact CD1-CD1 3.41Å; L397-W447 HydrophobicContact CD1-CD2 3.55Å; L397-W447 HydrophobicContact CD1-CE3 4.27Å; L397-W447 HydrophobicContact CD1-CG 3.25Å
398	Y	97.1	Very high	92.9	Very high	56 Å²	56	68.8 Å²	68.8	22%	0.22	34%	0.343	C	S	.	.			trans	46.4	61.9	175.3	-57.8	-92.5	0	0	0	114.1	K396 Q410 V411 F421 P422 E423 F424	K396-Y398 WeakPolarHBondContact O-CD2 3.4Å; K396-Y398 VanDerWaalsContact O-CE2 3.24Å; K396-Y398 WeakPolarHBondContact O-CE2 3.21Å; Y398-Q410 WeakPolarHBondContact O-CB 3.42Å; Y398-Q410 VanDerWaalsContact O-CG 3.32Å; Y398-Q410 WeakPolarHBondContact O-CG 3.19Å; Y398-Q410 PolarHBondContact O-N 2.99Å; Y398-Q410 PolarHBondContact O-NE2 2.95Å; Y398-V411 HydrophobicContact CD2-CG2 3.97Å; Y398-V411 HydrophobicContact CG-CG2 4.47Å; Y398-F421 AromaticContact CD1-CD1 3.79Å; Y398-F421 HydrophobicContact CD1-CD1 3.79Å; Y398-F421 HydrophobicContact CD1-CE1 4.39Å; Y398-F421 HydrophobicContact CD2-CB 3.82Å; Y398-F421 AromaticContact CD2-CD1 3.71Å; Y398-F421 HydrophobicContact CD2-CD1 3.71Å; Y398-F421 HydrophobicContact CD2-CG 4.13Å; Y398-F421 HydrophobicContact CE1-CD1 4.2Å; Y398-F421 HydrophobicContact CE2-CB 3.65Å; Y398-F421 HydrophobicContact CE2-CD1 4.13Å; Y398-F421 HydrophobicContact CE2-CG 4.37Å; Y398-F421 AromaticContact CG-CD1 3.52Å; Y398-F421 HydrophobicContact CG-CD1 3.52Å; Y398-F421 HydrophobicContact CG-CE1 4.17Å; Y398-F421 HydrophobicContact CG-CG 4.39Å; Y398-P422 WeakPolarHBondContact OH-CD 3.3Å; Y398-E423 HydrophobicContact CE2-CB 4.22Å; Y398-E423 WeakPolarHBondContact OH-CB 3.24Å; Y398-E423 PolarHBondContact OH-N 3.38Å; Y398-E423 VanDerWaalsContact OH-N 3.11Å; Y398-F424 HydrophobicContact CD2-CB 4.39Å; Y398-F424 HydrophobicContact CE2-CB 4.16Å
399	P	96.4	Very high	92.9	Very high	24 Å²	24	68.9 Å²	68.9	16%	0.156	34%	0.344	C	S	.	.	B	Isolated β-bridge	trans	-55.9	148.8	176.2	-21.6	32.9	0	0	0	112	T394 Q401 H406 T408 Q410 W447	T394-P399 HydrophobicContact CG2-CG 3.84Å; T394-P399 WeakPolarHBondContact O-CD 3.36Å; P399-Q401 PolarHBondContact O-NE2 2.86Å; P399-H406 WeakPolarHBondContact CB-O 3.44Å; P399-T408 CarbonylContact C-O 3.57Å; P399-T408 WeakPolarHBondContact CA-O 3.49Å; P399-Q410 PolarHBondContact O-NE2 3.3Å; P399-W447 HydrophobicContact CB-CH2 3.92Å; P399-W447 HydrophobicContact CB-CZ2 4.4Å; P399-W447 HydrophobicContact CG-CH2 3.71Å; P399-W447 HydrophobicContact CG-CZ2 3.77Å
400	H	92.9	Very high	92.7	Very high	48 Å²	48	72.4 Å²	72.4	22%	0.222	36%	0.36	C	S	.	.			trans	-61.6	148.1	171.5	-75	-98.4	0	0	0	110.7	L405 H406 T408	H400-L405 HydrophobicContact CB-CB 3.73Å; H400-L405 WeakPolarHBondContact CB-O 3.47Å; H400-H406 WeakPolarHBondContact O-CA 3.25Å; H400-T408 PolarHBondContact CD2-O 3.18Å; H400-T408 PolarHBondContact N-O 2.75Å
401	Q	86.6	Confident	92.6	Very high	175 Å²	175	71.6 Å²	71.6	82%	0.818	36%	0.355	S	S	*	.	S	Bend	trans	-86.9	-9.7	179.3	-60	-61.6	-51.1	0	0	113	P399	P399-Q401 PolarHBondContact O-NE2 2.86Å
402	S	85.3	Confident	92.4	Very high	57 Å²	57	74 Å²	74	40%	0.399	36%	0.362	S	S	.	.	S	Bend	trans	-75.3	144.3	179.6	70.8	0	0	0	0	110.6	L404 L405 H406	S402-L404 PolarHBondContact O-N 3.23Å; S402-L404 VanDerWaalsContact O-N 3.15Å; S402-L405 PolarHBondContact O-N 3.17Å; S402-L405 WeakPolarHBondContact OG-CB 3.34Å; S402-L405 PolarHBondContact OG-N 3.17Å; S402-H406 WeakPolarHBondContact O-CB 3.11Å; S402-H406 PolarHBondContact O-N 3.48Å
403	Q	74.6	Confident	92.2	Very high	172 Å²	172	65.7 Å²	65.7	80%	0.804	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-30.7	-179.1	-71.3	-169.2	-13.2	0	0	113.2	H406	Q403-H406 PolarHBondContact O-ND1 2.81Å
404	L	77.8	Confident	92	Very high	158 Å²	158	69.1 Å²	69.1	83%	0.827	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-26.3	-177.7	-66.3	175.2	0	0	0	113.6	S402	S402-L404 PolarHBondContact O-N 3.23Å; S402-L404 VanDerWaalsContact O-N 3.15Å
405	L	85.3	Confident	91.8	Very high	49 Å²	49	71.4 Å²	71.4	26%	0.257	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.4	11.6	-174.9	-60.9	174.4	0	0	0	113	Y284 H400 S402 N407 T408	Y284-L405 HydrophobicContact CD2-CD2 4.44Å; Y284-L405 HydrophobicContact CE2-CD2 4.28Å; H400-L405 HydrophobicContact CB-CB 3.73Å; H400-L405 WeakPolarHBondContact CB-O 3.47Å; S402-L405 PolarHBondContact O-N 3.17Å; S402-L405 WeakPolarHBondContact OG-CB 3.34Å; S402-L405 PolarHBondContact OG-N 3.17Å; L405-N407 PolarHBondContact O-N 3.19Å; L405-T408 WeakPolarHBondContact O-CA 3.14Å; L405-T408 WeakPolarHBondContact O-CB 3.39Å; L405-T408 PolarHBondContact O-N 3.27Å
406	H	88.3	Confident	91.7	Very high	109 Å²	109	65.1 Å²	65.1	51%	0.505	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-18.5	-177.4	74	-82	0	0	0	114.5	P399 H400 S402 Q403	P399-H406 WeakPolarHBondContact CB-O 3.44Å; H400-H406 WeakPolarHBondContact O-CA 3.25Å; S402-H406 WeakPolarHBondContact O-CB 3.11Å; S402-H406 PolarHBondContact O-N 3.48Å; Q403-H406 PolarHBondContact O-ND1 2.81Å
407	N	93.2	Very high	91.6	Very high	42 Å²	42	65 Å²	65	23%	0.225	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	5.6	174.4	72	-38.3	0	0	0	113.4	H369 Q370 L405 W447	H369-N407 CarbonylContact C-O 3.59Å; H369-N407 WeakPolarHBondContact CA-O 3.36Å; H369-N407 VanDerWaalsContact CB-O 3.29Å; H369-N407 WeakPolarHBondContact CB-O 3.39Å; Q370-N407 HydrophobicContact CG-CB 3.94Å; Q370-N407 PolarHBondContact N-O 2.75Å; Q370-N407 PolarHBondContact O-ND2 3.11Å; Q370-N407 VanDerWaalsContact O-ND2 3.16Å; L405-N407 PolarHBondContact O-N 3.19Å; N407-W447 WeakPolarHBondContact O-CZ3 3.49Å
408	T	96.4	Very high	91.4	Very high	2 Å²	2	67.6 Å²	67.6	1%	0.012	36%	0.355	C	S	.	.	B	Isolated β-bridge	trans	-117	140.6	179.2	-60.2	0	0	0	0	110	Y284 T285 P367 P399 H400 L405	Y284-T408 HydrophobicContact CE2-CG2 3.84Å; Y284-T408 VanDerWaalsContact OH-CG2 3.31Å; Y284-T408 WeakPolarHBondContact OH-CG2 3.37Å; Y284-T408 PolarHBondContact OH-OG1 3.22Å; T285-T408 HydrophobicContact CG2-CG2 3.79Å; P367-T408 HydrophobicContact CB-CG2 4.29Å; P399-T408 CarbonylContact C-O 3.57Å; P399-T408 WeakPolarHBondContact CA-O 3.49Å; H400-T408 PolarHBondContact CD2-O 3.18Å; H400-T408 PolarHBondContact N-O 2.75Å; L405-T408 WeakPolarHBondContact O-CA 3.14Å; L405-T408 WeakPolarHBondContact O-CB 3.39Å; L405-T408 PolarHBondContact O-N 3.27Å
409	S	97	Very high	91.3	Very high	4 Å²	4	73.9 Å²	73.9	3%	0.028	39%	0.387	C	S	.	.	B	Isolated β-bridge	trans	-80.8	144.5	178.1	175.9	0	0	0	0	110.6	L368 L397 V411	L368-S409 WeakPolarHBondContact O-CB 3.23Å; L368-S409 PolarHBondContact O-N 3.09Å; L397-S409 VanDerWaalsContact O-CB 3.3Å; L397-S409 WeakPolarHBondContact O-CB 3.29Å; L397-S409 PolarHBondContact O-OG 2.81Å; S409-V411 PolarHBondContact O-N 3.15Å; S409-V411 WeakPolarHBondContact OG-CB 3.31Å; S409-V411 PolarHBondContact OG-N 2.93Å
410	Q	95.5	Very high	91.3	Very high	77 Å²	77	80.6 Å²	80.6	36%	0.36	41%	0.409	S	S	.	.	S	Bend	trans	-75	-8.6	170.7	-67.7	172.6	68.7	0	0	113.2	Y398 P399 F421	Y398-Q410 WeakPolarHBondContact O-CB 3.42Å; Y398-Q410 VanDerWaalsContact O-CG 3.32Å; Y398-Q410 WeakPolarHBondContact O-CG 3.19Å; Y398-Q410 PolarHBondContact O-N 2.99Å; Y398-Q410 PolarHBondContact O-NE2 2.95Å; P399-Q410 PolarHBondContact O-NE2 3.3Å; Q410-F421 HydrophobicContact CB-CE1 4.03Å; Q410-F421 HydrophobicContact CB-CZ 3.85Å
411	V	95.5	Very high	91.5	Very high	9 Å²	9	78.9 Å²	78.9	6%	0.055	40%	0.401	C	S	.	.	S	Bend	trans	-93.8	133.4	-167.4	-170.2	0	0	0	0	111.9	Y398 S409 V413 P416 F421 F424	Y398-V411 HydrophobicContact CD2-CG2 3.97Å; Y398-V411 HydrophobicContact CG-CG2 4.47Å; S409-V411 PolarHBondContact O-N 3.15Å; S409-V411 WeakPolarHBondContact OG-CB 3.31Å; S409-V411 PolarHBondContact OG-N 2.93Å; V411-V413 PolarHBondContact O-N 3.08Å; V411-P416 HydrophobicContact CG1-CB 3.79Å; V411-F421 HydrophobicContact CB-CD2 4.33Å; V411-F421 HydrophobicContact CG1-CD2 4.1Å; V411-F421 HydrophobicContact CG2-CB 3.95Å; V411-F421 HydrophobicContact CG2-CD1 4Å; V411-F421 HydrophobicContact CG2-CD2 3.81Å; V411-F421 HydrophobicContact CG2-CE1 4.43Å; V411-F421 HydrophobicContact CG2-CE2 4.25Å; V411-F421 HydrophobicContact CG2-CG 3.66Å; V411-F424 HydrophobicContact CB-CD2 4Å; V411-F424 HydrophobicContact CB-CE2 4.1Å; V411-F424 HydrophobicContact CB-CG 4.26Å; V411-F424 HydrophobicContact CB-CZ 4.44Å; V411-F424 HydrophobicContact CG1-CB 4.38Å; V411-F424 HydrophobicContact CG1-CD1 3.62Å; V411-F424 HydrophobicContact CG1-CD2 3.88Å; V411-F424 HydrophobicContact CG1-CE1 3.75Å; V411-F424 HydrophobicContact CG1-CE2 4.01Å; V411-F424 HydrophobicContact CG1-CG 3.68Å; V411-F424 HydrophobicContact CG1-CZ 3.94Å; V411-F424 HydrophobicContact CG2-CB 4.34Å; V411-F424 HydrophobicContact CG2-CD2 3.95Å; V411-F424 HydrophobicContact CG2-CE2 4.5Å; V411-F424 HydrophobicContact CG2-CG 4.16Å
412	E	93.3	Very high	91.9	Very high	92 Å²	92	73.3 Å²	73.3	43%	0.43	38%	0.38	S	S	.	.			trans	-76.5	101.7	166.5	-60.6	-154	-177.8	0	0	111.1	R283 E414 S415 P416	R283-E412 IonicContact CZ-OE1 2.75Å; R283-E412 IonicContact CZ-OE2 3.29Å; R283-E412 IonicContact NH1-OE1 3.23Å; R283-E412 PolarHBondContact NH1-OE1 3.35Å; R283-E412 IonicContact NH1-OE2 2.65Å; R283-E412 PolarHBondContact NH1-OE2 2.82Å; R283-E412 IonicContact NH2-OE1 3.47Å; R283-E412 IonicContact NH2-OE2 3.09Å; R283-E412 PolarHBondContact NH2-OE2 2.62Å; E412-E414 VanDerWaalsContact C-N 3.3Å; E412-E414 PolarHBondContact O-N 3.1Å; E412-S415 CarbonylContact O-C 3.57Å; E412-S415 PolarHBondContact O-N 3.41Å; E412-S415 VanDerWaalsContact O-N 3.1Å; E412-P416 VanDerWaalsContact O-CA 3.26Å; E412-P416 WeakPolarHBondContact O-CA 3.26Å; E412-P416 WeakPolarHBondContact O-CD 3.32Å
413	V	94.9	Very high	92.5	Very high	4 Å²	4	74.1 Å²	74.1	2%	0.024	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-38.3	-170.4	176.3	0	0	0	0	114.7	L368 R387 V411 F424 Y449	L368-V413 HydrophobicContact CB-CG2 3.59Å; L368-V413 HydrophobicContact CD2-CG2 3.83Å; L368-V413 HydrophobicContact CG-CG2 4.17Å; R387-V413 HydrophobicContact CB-CG1 4.32Å; R387-V413 PolarHBondContact NH1-O 2.69Å; V411-V413 PolarHBondContact O-N 3.08Å; V413-F424 HydrophobicContact CB-CZ 4.34Å; V413-F424 HydrophobicContact CG1-CZ 4.35Å; V413-F424 HydrophobicContact CG2-CZ 4.04Å; V413-Y449 HydrophobicContact CB-CD1 4.31Å; V413-Y449 HydrophobicContact CB-CD2 3.87Å; V413-Y449 HydrophobicContact CB-CE2 4.28Å; V413-Y449 HydrophobicContact CB-CG 3.88Å; V413-Y449 HydrophobicContact CG1-CD1 4.15Å; V413-Y449 HydrophobicContact CG1-CG 4.05Å; V413-Y449 HydrophobicContact CG2-CD2 3.8Å; V413-Y449 HydrophobicContact CG2-CG 3.89Å
414	E	92.7	Very high	93.6	Very high	89 Å²	89	66.2 Å²	66.2	42%	0.416	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-10.3	-177.3	-67.9	-166.3	-128.1	0	0	113.8	Y385 E412 Y449 R451	Y385-E414 HydrophobicContact CE1-CG 4.36Å; E412-E414 VanDerWaalsContact C-N 3.3Å; E412-E414 PolarHBondContact O-N 3.1Å; E414-Y449 HydrophobicContact CG-CE1 4.01Å; E414-Y449 WeakPolarHBondContact OE1-CE1 3.41Å; E414-Y449 PolarHBondContact OE1-OH 3.25Å; E414-R451 VanDerWaalsContact CD-NH2 3.33Å; E414-R451 IonicContact OE1-CZ 2.78Å; E414-R451 VanDerWaalsContact OE1-CZ 3.29Å; E414-R451 IonicContact OE1-NE 2.92Å; E414-R451 PolarHBondContact OE1-NE 3.19Å; E414-R451 IonicContact OE1-NH2 3.76Å; E414-R451 PolarHBondContact OE1-NH2 3.01Å; E414-R451 VanDerWaalsContact OE1-NH2 3.09Å; E414-R451 IonicContact OE2-CZ 2.77Å; E414-R451 IonicContact OE2-NE 2.83Å; E414-R451 PolarHBondContact OE2-NE 3.24Å; E414-R451 IonicContact OE2-NH2 2.74Å; E414-R451 PolarHBondContact OE2-NH2 3.16Å
415	S	92.9	Very high	94.5	Very high	87 Å²	87	63.1 Å²	63.1	61%	0.608	33%	0.328	S	S	*	.	S	Bend	trans	-146.2	62.8	175.7	-176.4	0	0	0	0	110.6	E412 D417	E412-S415 CarbonylContact O-C 3.57Å; E412-S415 PolarHBondContact O-N 3.41Å; E412-S415 VanDerWaalsContact O-N 3.1Å; S415-D417 PolarHBondContact O-N 3.05Å
416	P	94.2	Very high	95	Very high	49 Å²	49	67 Å²	67	32%	0.318	34%	0.343	S	S	.	.			trans	-69.5	133.5	-172.8	28.1	-34.9	0	0	0	111.2	V411 E412 A418 F424	V411-P416 HydrophobicContact CG1-CB 3.79Å; E412-P416 VanDerWaalsContact O-CA 3.26Å; E412-P416 WeakPolarHBondContact O-CA 3.26Å; E412-P416 WeakPolarHBondContact O-CD 3.32Å; P416-A418 PolarHBondContact O-N 3.46Å; P416-F424 HydrophobicContact CB-CD1 3.62Å; P416-F424 HydrophobicContact CB-CE1 3.77Å; P416-F424 HydrophobicContact CG-CD1 4.17Å; P416-F424 HydrophobicContact CG-CE1 4.11Å
417	D	94.9	Very high	95.4	Very high	63 Å²	63	62.1 Å²	62.1	34%	0.337	32%	0.321	S	S	.	.			trans	-73.3	95.5	168.7	-173.8	-32.6	0	0	0	109.1	S415 E419 R420 F421	S415-D417 PolarHBondContact O-N 3.05Å; D417-E419 PolarHBondContact O-N 3.49Å; D417-E419 PolarHBondContact OD1-N 3.12Å; D417-R420 HydrophobicContact CB-CB 4.16Å; D417-R420 HydrophobicContact CB-CG 4.49Å; D417-R420 PolarHBondContact O-N 3.11Å; D417-R420 PolarHBondContact OD1-N 2.96Å; D417-R420 WeakPolarHBondContact OD2-CD 3.48Å; D417-R420 WeakPolarHBondContact OD2-CG 3.26Å; D417-F421 HydrophobicContact CB-CD2 4.16Å; D417-F421 HydrophobicContact CB-CE2 4.45Å; D417-F421 WeakPolarHBondContact O-CB 3.48Å; D417-F421 PolarHBondContact O-N 3.36Å
418	A	93.9	Very high	95.6	Very high	54 Å²	54	63.8 Å²	63.8	45%	0.446	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-18.3	-176.4	0	0	0	0	0	113.7	P416 P422 V425	P416-A418 PolarHBondContact O-N 3.46Å; A418-P422 VanDerWaalsContact O-CA 3.32Å; A418-P422 WeakPolarHBondContact O-CA 3.27Å; A418-V425 HydrophobicContact CB-CG2 3.87Å
419	E	95.6	Very high	95.7	Very high	187 Å²	187	66.9 Å²	66.9	87%	0.874	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-41.9	174.7	-63.7	-172.2	175.8	0	0	110.5	D417	D417-E419 PolarHBondContact O-N 3.49Å; D417-E419 PolarHBondContact OD1-N 3.12Å
420	R	95.9	Very high	95.7	Very high	165 Å²	165	69 Å²	69	62%	0.623	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-35.2	177.4	-68.6	175.9	65.1	-164.5	-4.7	113.2	D417 P422	D417-R420 HydrophobicContact CB-CB 4.16Å; D417-R420 HydrophobicContact CB-CG 4.49Å; D417-R420 PolarHBondContact O-N 3.11Å; D417-R420 PolarHBondContact OD1-N 2.96Å; D417-R420 WeakPolarHBondContact OD2-CD 3.48Å; D417-R420 WeakPolarHBondContact OD2-CG 3.26Å; R420-P422 WeakPolarHBondContact O-CD 3.38Å
421	F	96.8	Very high	95.8	Very high	13 Å²	13	66.1 Å²	66.1	6%	0.057	34%	0.343	C	S	.	.			trans	-125.5	57.7	-172.9	-50.6	-60.4	0	0	0	112.4	Y398 Q410 V411 D417 E423 F424	Y398-F421 AromaticContact CD1-CD1 3.79Å; Y398-F421 HydrophobicContact CD1-CD1 3.79Å; Y398-F421 HydrophobicContact CD1-CE1 4.39Å; Y398-F421 HydrophobicContact CD2-CB 3.82Å; Y398-F421 AromaticContact CD2-CD1 3.71Å; Y398-F421 HydrophobicContact CD2-CD1 3.71Å; Y398-F421 HydrophobicContact CD2-CG 4.13Å; Y398-F421 HydrophobicContact CE1-CD1 4.2Å; Y398-F421 HydrophobicContact CE2-CB 3.65Å; Y398-F421 HydrophobicContact CE2-CD1 4.13Å; Y398-F421 HydrophobicContact CE2-CG 4.37Å; Y398-F421 AromaticContact CG-CD1 3.52Å; Y398-F421 HydrophobicContact CG-CD1 3.52Å; Y398-F421 HydrophobicContact CG-CE1 4.17Å; Y398-F421 HydrophobicContact CG-CG 4.39Å; Q410-F421 HydrophobicContact CB-CE1 4.03Å; Q410-F421 HydrophobicContact CB-CZ 3.85Å; V411-F421 HydrophobicContact CB-CD2 4.33Å; V411-F421 HydrophobicContact CG1-CD2 4.1Å; V411-F421 HydrophobicContact CG2-CB 3.95Å; V411-F421 HydrophobicContact CG2-CD1 4Å; V411-F421 HydrophobicContact CG2-CD2 3.81Å; V411-F421 HydrophobicContact CG2-CE1 4.43Å; V411-F421 HydrophobicContact CG2-CE2 4.25Å; V411-F421 HydrophobicContact CG2-CG 3.66Å; D417-F421 HydrophobicContact CB-CD2 4.16Å; D417-F421 HydrophobicContact CB-CE2 4.45Å; D417-F421 WeakPolarHBondContact O-CB 3.48Å; D417-F421 PolarHBondContact O-N 3.36Å; F421-E423 VanDerWaalsContact C-N 3.27Å; F421-E423 PolarHBondContact O-N 3.31Å; F421-F424 HydrophobicContact CB-CB 4.13Å; F421-F424 WeakPolarHBondContact O-CB 3.44Å; F421-F424 PolarHBondContact O-N 2.87Å; F421-F424 VanDerWaalsContact O-N 3.13Å
422	P	96.9	Very high	95.9	Very high	57 Å²	57	66 Å²	66	37%	0.37	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-28.1	-171.3	24.9	-36.1	0	0	0	114.4	Y398 A418 R420	Y398-P422 WeakPolarHBondContact OH-CD 3.3Å; A418-P422 VanDerWaalsContact O-CA 3.32Å; A418-P422 WeakPolarHBondContact O-CA 3.27Å; R420-P422 WeakPolarHBondContact O-CD 3.38Å
423	E	97.7	Very high	96.2	Very high	74 Å²	74	62.9 Å²	62.9	35%	0.346	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-23.3	179.5	-61.3	-52.4	122.9	0	0	112.8	K396 Y398 F421 V425 K426 A427	K396-E423 HydrophobicContact CB-CB 4.16Å; K396-E423 HydrophobicContact CG-CB 4.19Å; Y398-E423 HydrophobicContact CE2-CB 4.22Å; Y398-E423 WeakPolarHBondContact OH-CB 3.24Å; Y398-E423 PolarHBondContact OH-N 3.38Å; Y398-E423 VanDerWaalsContact OH-N 3.11Å; F421-E423 VanDerWaalsContact C-N 3.27Å; F421-E423 PolarHBondContact O-N 3.31Å; E423-V425 VanDerWaalsContact C-N 3.3Å; E423-V425 PolarHBondContact O-N 2.84Å; E423-K426 PolarHBondContact O-N 2.92Å; E423-K426 VanDerWaalsContact O-N 3.08Å; E423-K426 IonicContact OE1-NZ 3.46Å; E423-K426 PolarHBondContact OE1-NZ 2.96Å; E423-K426 IonicContact OE2-NZ 3.26Å; E423-K426 PolarHBondContact OE2-NZ 3.08Å; E423-A427 PolarHBondContact O-N 2.84Å
424	F	97.8	Very high	96.3	Very high	6 Å²	6	62.7 Å²	62.7	3%	0.026	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-62.3	-39.7	179.8	178.9	-96	0	0	0	111.6	L368 Y389 K396 L397 Y398 V411 V413 P416 F421 K426 A427	L368-F424 HydrophobicContact CD2-CE2 3.82Å; L368-F424 HydrophobicContact CD2-CZ 4.49Å; Y389-F424 HydrophobicContact CE1-CE2 4.29Å; Y389-F424 HydrophobicContact CE1-CZ 4.45Å; Y389-F424 HydrophobicContact CE2-CE2 4.35Å; Y389-F424 HydrophobicContact CE2-CZ 4.33Å; Y389-F424 AromaticContact CZ-CE2 3.9Å; Y389-F424 AromaticContact CZ-CZ 3.77Å; Y389-F424 WeakPolarHBondContact OH-CZ 3.49Å; K396-F424 VanDerWaalsContact O-CA 3.24Å; K396-F424 WeakPolarHBondContact O-CA 3.22Å; K396-F424 WeakPolarHBondContact O-CB 3.26Å; K396-F424 PolarHBondContact O-N 3.37Å; L397-F424 HydrophobicContact CD2-CD2 3.79Å; L397-F424 HydrophobicContact CD2-CE2 3.88Å; Y398-F424 HydrophobicContact CD2-CB 4.39Å; Y398-F424 HydrophobicContact CE2-CB 4.16Å; V411-F424 HydrophobicContact CB-CD2 4Å; V411-F424 HydrophobicContact CB-CE2 4.1Å; V411-F424 HydrophobicContact CB-CG 4.26Å; V411-F424 HydrophobicContact CB-CZ 4.44Å; V411-F424 HydrophobicContact CG1-CB 4.38Å; V411-F424 HydrophobicContact CG1-CD1 3.62Å; V411-F424 HydrophobicContact CG1-CD2 3.88Å; V411-F424 HydrophobicContact CG1-CE1 3.75Å; V411-F424 HydrophobicContact CG1-CE2 4.01Å; V411-F424 HydrophobicContact CG1-CG 3.68Å; V411-F424 HydrophobicContact CG1-CZ 3.94Å; V411-F424 HydrophobicContact CG2-CB 4.34Å; V411-F424 HydrophobicContact CG2-CD2 3.95Å; V411-F424 HydrophobicContact CG2-CE2 4.5Å; V411-F424 HydrophobicContact CG2-CG 4.16Å; V413-F424 HydrophobicContact CB-CZ 4.34Å; V413-F424 HydrophobicContact CG1-CZ 4.35Å; V413-F424 HydrophobicContact CG2-CZ 4.04Å; P416-F424 HydrophobicContact CB-CD1 3.62Å; P416-F424 HydrophobicContact CB-CE1 3.77Å; P416-F424 HydrophobicContact CG-CD1 4.17Å; P416-F424 HydrophobicContact CG-CE1 4.11Å; F421-F424 HydrophobicContact CB-CB 4.13Å; F421-F424 WeakPolarHBondContact O-CB 3.44Å; F421-F424 PolarHBondContact O-N 2.87Å; F421-F424 VanDerWaalsContact O-N 3.13Å; F424-K426 PolarHBondContact O-N 3.17Å; F424-K426 VanDerWaalsContact O-N 3.12Å; F424-A427 WeakPolarHBondContact O-CB 3.4Å; F424-A427 PolarHBondContact O-N 3.18Å
425	V	94.8	Very high	96.6	Very high	93 Å²	93	65.2 Å²	65.2	56%	0.564	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-63.6	-20.5	179.6	-173.4	0	0	0	0	112	A418 E423	A418-V425 HydrophobicContact CB-CG2 3.87Å; E423-V425 VanDerWaalsContact C-N 3.3Å; E423-V425 PolarHBondContact O-N 2.84Å
426	K	96	Very high	96.9	Very high	131 Å²	131	64.1 Å²	64.1	57%	0.57	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-97.8	-7.1	179.1	-52.8	174	-165.1	160.7	0	112.9	E423 F424	E423-K426 PolarHBondContact O-N 2.92Å; E423-K426 VanDerWaalsContact O-N 3.08Å; E423-K426 IonicContact OE1-NZ 3.46Å; E423-K426 PolarHBondContact OE1-NZ 2.96Å; E423-K426 IonicContact OE2-NZ 3.26Å; E423-K426 PolarHBondContact OE2-NZ 3.08Å; F424-K426 PolarHBondContact O-N 3.17Å; F424-K426 VanDerWaalsContact O-N 3.12Å
427	A	97.4	Very high	97.1	Very high	6 Å²	6	62.1 Å²	62.1	5%	0.05	31%	0.313	C	S	.	.			trans	-71.3	124.8	-178.5	0	0	0	0	0	109.8	Y389 K396 L397 E423 F424	Y389-A427 HydrophobicContact CD1-CB 3.85Å; Y389-A427 HydrophobicContact CE1-CB 3.83Å; K396-A427 HydrophobicContact CB-CB 3.98Å; K396-A427 HydrophobicContact CD-CB 3.98Å; L397-A427 HydrophobicContact CD2-CB 4.09Å; E423-A427 PolarHBondContact O-N 2.84Å; F424-A427 WeakPolarHBondContact O-CB 3.4Å; F424-A427 PolarHBondContact O-N 3.18Å
428	P	97.2	Very high	97.2	Very high	77 Å²	77	59.6 Å²	59.6	50%	0.5	30%	0.3	S	S	.	.			trans	-66.6	146.6	174.5	30.7	-34.5	0	0	0	109.8	Y389 D393	Y389-P428 VanDerWaalsContact CD1-O 3.24Å; Y389-P428 WeakPolarHBondContact CD1-O 3.47Å; D393-P428 WeakPolarHBondContact OD2-CD 3.24Å; D393-P428 VanDerWaalsContact OD2-CG 3.25Å; D393-P428 WeakPolarHBondContact OD2-CG 2.98Å
429	Y	98	Very high	97.5	Very high	67 Å²	67	57 Å²	57	26%	0.263	28%	0.279	S	S	.	.			trans	-143.7	162.2	179	60.4	-93.6	0	0	0	111.6	L221 R387 L388 Y389 E431	L221-Y429 HydrophobicContact CB-CE2 4.43Å; L221-Y429 HydrophobicContact CD1-CE2 3.81Å; L221-Y429 HydrophobicContact CD2-CE2 4.45Å; L221-Y429 HydrophobicContact CG-CE2 4.45Å; R387-Y429 HydrophobicContact CG-CD2 3.76Å; R387-Y429 HydrophobicContact CG-CG 3.96Å; L388-Y429 CarbonylContact O-C 3.51Å; L388-Y429 WeakPolarHBondContact O-CA 3.44Å; L388-Y429 VanDerWaalsContact O-CB 3.29Å; L388-Y429 WeakPolarHBondContact O-CB 3.41Å; Y389-Y429 HydrophobicContact CE1-CD1 4.05Å; Y389-Y429 HydrophobicContact CE1-CG 4.23Å; Y429-E431 HydrophobicContact CD2-CB 4.34Å; Y429-E431 HydrophobicContact CD2-CG 4.42Å; Y429-E431 HydrophobicContact CE2-CB 4.47Å; Y429-E431 HydrophobicContact CE2-CG 4.14Å; Y429-E431 VanDerWaalsContact CE2-OE2 3.24Å; Y429-E431 WeakPolarHBondContact CE2-OE2 3.33Å
430	L	98.4	Very high	97.6	Very high	48 Å²	48	48.1 Å²	48.1	25%	0.251	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	152.1	161.3	-60	174.8	0	0	0	109.2	L221 V223 P244 R387 L388	L221-L430 CarbonylContact O-C 3.39Å; L221-L430 WeakPolarHBondContact O-CA 3.27Å; V223-L430 HydrophobicContact CG2-CB 3.75Å; P244-L430 HydrophobicContact CG-CD1 4.36Å; R387-L430 CarbonylContact C-O 3.53Å; R387-L430 WeakPolarHBondContact CA-O 3.04Å; L388-L430 HydrophobicContact CB-CB 4.43Å; L388-L430 PolarHBondContact N-O 2.63Å; L388-L430 PolarHBondContact O-N 2.83Å
431	E	97.7	Very high	97.8	Very high	17 Å²	17	40.3 Å²	40.3	8%	0.079	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	154.9	175.1	64.8	-174.9	-162.5	0	0	112	I217 L221 S222 V223 Y385 I386 R387 Y429	I217-E431 HydrophobicContact CB-CG 4.49Å; I217-E431 HydrophobicContact CD1-CG 4.23Å; I217-E431 HydrophobicContact CG1-CG 4.14Å; I217-E431 HydrophobicContact CG2-CG 3.71Å; L221-E431 HydrophobicContact CB-CG 4.44Å; L221-E431 PolarHBondContact O-N 2.92Å; S222-E431 WeakPolarHBondContact CA-O 3.41Å; V223-E431 PolarHBondContact N-O 2.79Å; V223-E431 VanDerWaalsContact N-O 3.13Å; Y385-E431 HydrophobicContact CE2-CB 4.01Å; Y385-E431 HydrophobicContact CE2-CG 4.48Å; Y385-E431 PolarHBondContact OH-OE2 3.13Å; I386-E431 CarbonylContact O-C 3.16Å; I386-E431 WeakPolarHBondContact O-CA 3.24Å; I386-E431 WeakPolarHBondContact O-CB 3.26Å; R387-E431 HydrophobicContact CB-CB 4.43Å; R387-E431 HydrophobicContact CG-CB 4.39Å; R387-E431 IonicContact CZ-OE2 3.75Å; R387-E431 IonicContact NE-OE2 2.69Å; R387-E431 PolarHBondContact NE-OE2 3.14Å; R387-E431 IonicContact NH2-OE2 3.51Å; R387-E431 PolarHBondContact NH2-OE2 2.95Å; Y429-E431 HydrophobicContact CD2-CB 4.34Å; Y429-E431 HydrophobicContact CD2-CG 4.42Å; Y429-E431 HydrophobicContact CE2-CB 4.47Å; Y429-E431 HydrophobicContact CE2-CG 4.14Å; Y429-E431 VanDerWaalsContact CE2-OE2 3.24Å; Y429-E431 WeakPolarHBondContact CE2-OE2 3.33Å
432	C	97.9	Very high	97.9	Very high	7 Å²	7	39.9 Å²	39.9	5%	0.047	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	164.2	178.6	67	0	0	0	0	112.3	V223 I246 Y385 I386	V223-C432 HydrophobicContact CB-CB 4Å; V223-C432 HydrophobicContact CG2-CB 3.92Å; I246-C432 HydrophobicContact CD1-CB 3.72Å; Y385-C432 WeakPolarHBondContact CA-O 3.44Å; I386-C432 PolarHBondContact N-O 3.1Å; I386-C432 PolarHBondContact O-N 3.37Å
433	V	98.1	Very high	98	Very high	27 Å²	27	37.2 Å²	37.2	16%	0.164	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	114.2	160.3	179.7	0	0	0	0	107.4	V214 I217 N383 K384 R435 L453	V214-V433 HydrophobicContact CB-CG2 4.01Å; V214-V433 HydrophobicContact CG1-CG2 3.79Å; V214-V433 HydrophobicContact CG2-CG2 3.75Å; I217-V433 HydrophobicContact CD1-CG2 3.95Å; N383-V433 HydrophobicContact CB-CG1 4.07Å; K384-V433 CarbonylContact O-C 3.54Å; K384-V433 WeakPolarHBondContact O-CA 3.44Å; V433-R435 HydrophobicContact CG1-CG 4.48Å; V433-L453 HydrophobicContact CG1-CD1 3.8Å; V433-L453 HydrophobicContact CG2-CD1 4.33Å
434	L	98.2	Very high	98	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	123.5	176.5	-159.6	68.9	0	0	0	109.5	I246 L377 Q379 N383 K384 I386 D438 L440	I246-L434 HydrophobicContact CD1-CD1 4.21Å; I246-L434 HydrophobicContact CG1-CD1 4.15Å; I246-L434 HydrophobicContact CG2-CD1 4.36Å; L377-L434 HydrophobicContact CD2-CD2 4.12Å; L377-L434 HydrophobicContact CG-CD2 4.1Å; L377-L434 WeakPolarHBondContact O-CD2 3.45Å; Q379-L434 HydrophobicContact CB-CD2 3.88Å; Q379-L434 HydrophobicContact CB-CG 3.85Å; N383-L434 WeakPolarHBondContact CA-O 3.21Å; K384-L434 PolarHBondContact N-O 2.85Å; K384-L434 PolarHBondContact O-N 3.05Å; I386-L434 HydrophobicContact CD1-CB 3.98Å; I386-L434 HydrophobicContact CD1-CD2 3.93Å; L434-D438 HydrophobicContact CD1-CB 3.42Å; L434-D438 VanDerWaalsContact CD1-CB 3.42Å; L434-D438 HydrophobicContact CG-CB 3.94Å; L434-L440 HydrophobicContact CD1-CB 3.81Å; L434-L440 HydrophobicContact CD2-CB 4.05Å
435	R	98.1	Very high	98	Very high	142 Å²	142	39.1 Å²	39.1	54%	0.536	20%	0.199	S	C	.	.			trans	-109.8	159.6	-173.2	-57	177.1	179.1	168.5	1.1	111.1	Q379 N383 V433 G437 D438	Q379-R435 WeakPolarHBondContact CB-O 3.21Å; N383-R435 WeakPolarHBondContact OD1-CA 3.44Å; N383-R435 WeakPolarHBondContact OD1-CG 3.44Å; V433-R435 HydrophobicContact CG1-CG 4.48Å; R435-G437 PolarHBondContact O-N 3.22Å; R435-D438 WeakPolarHBondContact CB-OD2 3.29Å; R435-D438 PolarHBondContact N-OD2 3Å; R435-D438 WeakPolarHBondContact O-CB 3.3Å; R435-D438 PolarHBondContact O-N 3.16Å
436	P	98.5	Very high	98.2	Very high	64 Å²	64	36.2 Å²	36.2	42%	0.416	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.7	127.4	174	-27.8	37.5	0	0	0	111.9	Q379 G382	Q379-P436 WeakPolarHBondContact O-CA 3.24Å; G382-P436 VanDerWaalsContact O-CD 3.28Å; G382-P436 WeakPolarHBondContact O-CD 3.17Å; G382-P436 WeakPolarHBondContact O-CG 3.48Å
437	G	98.4	Very high	98.3	Very high	6 Å²	6	30 Å²	30	6%	0.062	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	95	-15	-174.9	0	0	0	0	0	114.9	I251 Q379 R435	I251-G437 VanDerWaalsContact CG1-O 3.25Å; I251-G437 WeakPolarHBondContact CG1-O 3.33Å; Q379-G437 PolarHBondContact O-N 3.31Å; R435-G437 PolarHBondContact O-N 3.22Å
438	D	98.8	Very high	98.4	Very high	11 Å²	11	30.1 Å²	30.1	6%	0.059	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	146	174.2	-64.5	-15.3	0	0	0	111.3	R225 I246 Q379 L434 R435	R225-D438 IonicContact CZ-OD1 2.75Å; R225-D438 IonicContact CZ-OD2 3.48Å; R225-D438 VanDerWaalsContact CZ-OD2 3.26Å; R225-D438 IonicContact NH1-OD2 3.49Å; R225-D438 PolarHBondContact NH1-OD2 2.81Å; R225-D438 IonicContact NH2-OD1 3.43Å; R225-D438 PolarHBondContact NH2-OD1 3.47Å; R225-D438 IonicContact NH2-OD2 2.84Å; R225-D438 PolarHBondContact NH2-OD2 3.06Å; I246-D438 HydrophobicContact CG2-CB 3.87Å; Q379-D438 PolarHBondContact N-O 2.88Å; L434-D438 HydrophobicContact CD1-CB 3.42Å; L434-D438 VanDerWaalsContact CD1-CB 3.42Å; L434-D438 HydrophobicContact CG-CB 3.94Å; R435-D438 WeakPolarHBondContact CB-OD2 3.29Å; R435-D438 PolarHBondContact N-OD2 3Å; R435-D438 WeakPolarHBondContact O-CB 3.3Å; R435-D438 PolarHBondContact O-N 3.16Å
439	V	98.9	Very high	98.4	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	119.6	167.6	-175.7	0	0	0	0	109.9	I246 L247 I250 I251 F376 L377 A378	I246-V439 CarbonylContact C-O 3.6Å; I246-V439 WeakPolarHBondContact CA-O 3.37Å; L247-V439 HydrophobicContact CB-CB 4.38Å; L247-V439 PolarHBondContact N-O 2.96Å; L247-V439 PolarHBondContact O-N 3.14Å; L247-V439 VanDerWaalsContact O-N 3.08Å; I250-V439 HydrophobicContact CD1-CB 3.83Å; I250-V439 HydrophobicContact CD1-CG1 4.16Å; I250-V439 HydrophobicContact CD1-CG2 3.73Å; I250-V439 HydrophobicContact CG1-CB 4.12Å; I250-V439 HydrophobicContact CG1-CG2 3.69Å; I251-V439 HydrophobicContact CB-CG2 4.34Å; I251-V439 HydrophobicContact CD1-CG2 3.79Å; I251-V439 HydrophobicContact CG1-CG2 3.88Å; I251-V439 HydrophobicContact CG2-CG2 3.56Å; F376-V439 HydrophobicContact CB-CG1 3.74Å; F376-V439 HydrophobicContact CD1-CG1 3.74Å; F376-V439 HydrophobicContact CG-CG1 4.05Å; L377-V439 WeakPolarHBondContact O-CA 3.48Å; A378-V439 HydrophobicContact CB-CG1 4.49Å; A378-V439 HydrophobicContact CB-CG2 3.94Å
440	L	98.9	Very high	98.5	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	121.9	173.5	178.4	64.6	0	0	0	110.1	V223 I246 F376 L377 I386 L388 L434 I442	V223-L440 HydrophobicContact CG1-CD1 3.94Å; I246-L440 HydrophobicContact CG1-CD1 3.87Å; F376-L440 CarbonylContact C-O 3.55Å; F376-L440 WeakPolarHBondContact CA-O 3.47Å; L377-L440 HydrophobicContact CB-CB 4.43Å; L377-L440 PolarHBondContact N-O 3.05Å; L377-L440 PolarHBondContact O-N 2.81Å; I386-L440 HydrophobicContact CB-CD2 4.44Å; I386-L440 HydrophobicContact CD1-CD2 3.59Å; I386-L440 HydrophobicContact CG2-CD2 3.88Å; L388-L440 HydrophobicContact CD1-CD1 4.25Å; L388-L440 HydrophobicContact CD1-CD2 4.31Å; L434-L440 HydrophobicContact CD1-CB 3.81Å; L434-L440 HydrophobicContact CD2-CB 4.05Å; L440-I442 HydrophobicContact CD2-CD1 4.03Å; L440-I442 HydrophobicContact CD2-CG1 3.72Å; L440-I442 HydrophobicContact CG-CG1 3.78Å
441	F	98.9	Very high	98.4	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	118	162.5	178.4	-126	0	0	0	109.6	F234 L239 K243 P244 V245 Q374 F376 P443 W463	F234-F441 HydrophobicContact CE2-CB 4.17Å; F234-F441 AromaticContact CE2-CD1 3.91Å; F234-F441 HydrophobicContact CE2-CD1 3.91Å; F234-F441 HydrophobicContact CE2-CD2 4.44Å; F234-F441 HydrophobicContact CE2-CE1 4.44Å; F234-F441 AromaticContact CE2-CG 3.91Å; F234-F441 HydrophobicContact CE2-CG 3.91Å; F234-F441 HydrophobicContact CZ-CB 4.41Å; F234-F441 AromaticContact CZ-CD1 3.92Å; F234-F441 HydrophobicContact CZ-CD1 3.92Å; F234-F441 AromaticContact CZ-CD2 3.87Å; F234-F441 HydrophobicContact CZ-CD2 3.87Å; F234-F441 HydrophobicContact CZ-CE1 4.12Å; F234-F441 HydrophobicContact CZ-CE2 4.08Å; F234-F441 AromaticContact CZ-CG 3.79Å; F234-F441 HydrophobicContact CZ-CG 3.79Å; F234-F441 HydrophobicContact CZ-CZ 4.21Å; L239-F441 HydrophobicContact CD1-CE2 4.17Å; L239-F441 HydrophobicContact CD1-CZ 3.66Å; K243-F441 WeakPolarHBondContact O-CD1 3.31Å; P244-F441 WeakPolarHBondContact CA-O 3.48Å; V245-F441 HydrophobicContact CG1-CB 3.88Å; V245-F441 HydrophobicContact CG1-CD1 4.21Å; V245-F441 PolarHBondContact N-O 2.89Å; V245-F441 PolarHBondContact O-N 2.92Å; Q374-F441 HydrophobicContact CB-CE2 4.24Å; F376-F441 HydrophobicContact CD1-CB 4.04Å; F376-F441 HydrophobicContact CD1-CD2 4.12Å; F376-F441 HydrophobicContact CE1-CB 3.75Å; F376-F441 AromaticContact CE1-CD2 3.68Å; F376-F441 HydrophobicContact CE1-CD2 3.68Å; F376-F441 HydrophobicContact CE1-CG 4.03Å; F376-F441 HydrophobicContact CZ-CD2 4.1Å; F441-P443 HydrophobicContact CD1-CG 4.17Å; F441-P443 HydrophobicContact CE1-CB 4.13Å; F441-P443 HydrophobicContact CE1-CG 3.73Å; F441-P443 HydrophobicContact CZ-CB 4.09Å; F441-P443 HydrophobicContact CZ-CG 4.17Å; F441-W463 HydrophobicContact CE2-CZ2 4.1Å
442	I	98.9	Very high	98.3	Very high	4 Å²	4	24.1 Å²	24.1	2%	0.021	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	108.4	172.5	-52.9	175.1	0	0	0	106.2	N375 L377 L440 H448	N375-I442 HydrophobicContact CB-CB 4.22Å; N375-I442 PolarHBondContact N-O 3.35Å; N375-I442 PolarHBondContact O-N 3Å; L377-I442 HydrophobicContact CB-CD1 4.37Å; L440-I442 HydrophobicContact CD2-CD1 4.03Å; L440-I442 HydrophobicContact CD2-CG1 3.72Å; L440-I442 HydrophobicContact CG-CG1 3.78Å; I442-H448 HydrophobicContact CD1-CB 4.41Å; I442-H448 HydrophobicContact CG2-CB 4.42Å
443	P	98.7	Very high	98.2	Very high	2 Å²	2	24 Å²	24	1%	0.013	11%	0.114	C	C	.	.			trans	-63.6	153.9	-179.7	-16.3	27	0	0	0	111.6	L242 P244 Q374 F441 K445 Y446	L242-P443 HydrophobicContact CB-CB 3.93Å; L242-P443 HydrophobicContact CD2-CB 3.94Å; P244-P443 HydrophobicContact CG-CG 4.14Å; Q374-P443 VanDerWaalsContact OE1-CA 3.25Å; F441-P443 HydrophobicContact CD1-CG 4.17Å; F441-P443 HydrophobicContact CE1-CB 4.13Å; F441-P443 HydrophobicContact CE1-CG 3.73Å; F441-P443 HydrophobicContact CZ-CB 4.09Å; F441-P443 HydrophobicContact CZ-CG 4.17Å; P443-K445 PolarHBondContact O-N 3.22Å; P443-Y446 HydrophobicContact CB-CD2 3.66Å; P443-Y446 HydrophobicContact CB-CE2 4.08Å; P443-Y446 HydrophobicContact CB-CG 4.44Å; P443-Y446 HydrophobicContact CG-CD2 3.72Å; P443-Y446 HydrophobicContact CG-CE2 3.91Å; P443-Y446 HydrophobicContact CG-CG 4.24Å; P443-Y446 WeakPolarHBondContact O-CB 3.46Å; P443-Y446 PolarHBondContact O-N 2.94Å
444	V	98.2	Very high	98	Very high	38 Å²	38	23.9 Å²	23.9	23%	0.23	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.1	135	176.6	64.8	0	0	0	0	111.4	L242 P372 Q373 Y446	L242-V444 HydrophobicContact CD2-CG1 3.94Å; P372-V444 WeakPolarHBondContact O-CG2 3.41Å; Q373-V444 WeakPolarHBondContact O-CA 3.32Å; V444-Y446 PolarHBondContact O-N 3.02Å; V444-Y446 VanDerWaalsContact O-N 3.14Å
445	K	98	Very high	97.9	Very high	82 Å²	82	26.5 Å²	26.5	36%	0.357	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.5	2.4	-175.4	-58.8	-66.6	176.3	-172.6	0	116.8	Q370 D371 P391 P443 W447	Q370-K445 WeakPolarHBondContact CB-O 3.34Å; Q370-K445 PolarHBondContact OE1-O 3.36Å; D371-K445 WeakPolarHBondContact O-CA 3.34Å; D371-K445 PolarHBondContact O-N 2.57Å; D371-K445 VanDerWaalsContact O-N 3.1Å; P391-K445 HydrophobicContact CB-CB 4.32Å; P391-K445 HydrophobicContact CG-CB 4.05Å; P443-K445 PolarHBondContact O-N 3.22Å; K445-W447 PolarHBondContact O-N 3.22Å
446	Y	98.6	Very high	97.9	Very high	32 Å²	32	19.7 Å²	19.7	13%	0.125	10%	0.099	C	C	.	.			trans	-63.1	131.8	171.4	-102	-108.1	0	0	0	110.8	L242 P244 L388 Y389 P391 P443 V444 H448	L242-Y446 WeakPolarHBondContact O-CE2 3.27Å; L242-Y446 PolarHBondContact O-OH 3.11Å; P244-Y446 HydrophobicContact CG-CD1 3.64Å; P244-Y446 HydrophobicContact CG-CE1 3.38Å; P244-Y446 HydrophobicContact CG-CG 4.31Å; L388-Y446 HydrophobicContact CB-CD1 4.34Å; Y389-Y446 VanDerWaalsContact O-CD1 3.26Å; Y389-Y446 WeakPolarHBondContact O-CD1 3.49Å; P391-Y446 HydrophobicContact CG-CD2 3.98Å; P391-Y446 HydrophobicContact CG-CE2 4.27Å; P443-Y446 HydrophobicContact CB-CD2 3.66Å; P443-Y446 HydrophobicContact CB-CE2 4.08Å; P443-Y446 HydrophobicContact CB-CG 4.44Å; P443-Y446 HydrophobicContact CG-CD2 3.72Å; P443-Y446 HydrophobicContact CG-CE2 3.91Å; P443-Y446 HydrophobicContact CG-CG 4.24Å; P443-Y446 WeakPolarHBondContact O-CB 3.46Å; P443-Y446 PolarHBondContact O-N 2.94Å; V444-Y446 PolarHBondContact O-N 3.02Å; V444-Y446 VanDerWaalsContact O-N 3.14Å; Y446-H448 PolarHBondContact O-ND1 3.32Å; Y446-H448 VanDerWaalsContact O-ND1 3.17Å
447	W	98.8	Very high	97.9	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	127.1	174.7	-71.1	86.8	0	0	0	108.8	L368 H369 Q370 L388 Y389 T394 L397 P399 N407 K445	L368-W447 HydrophobicContact CD1-CB 3.86Å; L368-W447 HydrophobicContact CG-CB 4.38Å; L368-W447 HydrophobicContact CG-CE3 4.04Å; H369-W447 CarbonylContact O-C 3.53Å; H369-W447 VanDerWaalsContact O-CA 3.25Å; H369-W447 WeakPolarHBondContact O-CA 3.48Å; Q370-W447 HydrophobicContact CB-CD2 4.06Å; Q370-W447 HydrophobicContact CB-CE3 4.41Å; Q370-W447 HydrophobicContact CB-CG 4.28Å; Q370-W447 HydrophobicContact CG-CD2 4.25Å; Q370-W447 HydrophobicContact CG-CE3 4.48Å; Q370-W447 HydrophobicContact CG-CH2 4.21Å; Q370-W447 HydrophobicContact CG-CZ2 3.93Å; Q370-W447 HydrophobicContact CG-CZ3 4.47Å; L388-W447 CarbonylContact C-O 3.47Å; L388-W447 VanDerWaalsContact CA-O 3.24Å; L388-W447 WeakPolarHBondContact CA-O 3.39Å; Y389-W447 PolarHBondContact N-O 3.15Å; Y389-W447 PolarHBondContact O-N 3.26Å; T394-W447 HydrophobicContact CG2-CZ2 3.84Å; T394-W447 PolarHBondContact OG1-NE1 3.42Å; L397-W447 HydrophobicContact CD1-CB 3.67Å; L397-W447 VanDerWaalsContact CD1-CD1 3.41Å; L397-W447 HydrophobicContact CD1-CD2 3.55Å; L397-W447 HydrophobicContact CD1-CE3 4.27Å; L397-W447 HydrophobicContact CD1-CG 3.25Å; P399-W447 HydrophobicContact CB-CH2 3.92Å; P399-W447 HydrophobicContact CB-CZ2 4.4Å; P399-W447 HydrophobicContact CG-CH2 3.71Å; P399-W447 HydrophobicContact CG-CZ2 3.77Å; N407-W447 WeakPolarHBondContact O-CZ3 3.49Å; K445-W447 PolarHBondContact O-N 3.22Å
448	H	98.8	Very high	97.9	Very high	8 Å²	8	16.5 Å²	16.5	4%	0.037	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	133.8	-177.5	61	-78.4	0	0	0	111.9	L368 H369 D371 R387 L388 I442 Y446	L368-H448 WeakPolarHBondContact CA-O 3.45Å; H369-H448 AromaticContact CD2-CE1 3.85Å; H369-H448 AromaticContact CD2-NE2 3.96Å; H369-H448 AromaticContact CE1-CD2 3.76Å; H369-H448 AromaticContact CE1-CE1 3.85Å; H369-H448 AromaticContact CE1-NE2 3.27Å; H369-H448 PolarHBondContact CE1-NE2 2.82Å; H369-H448 VanDerWaalsContact CE1-NE2 3.27Å; H369-H448 PolarHBondContact N-O 2.95Å; H369-H448 PolarHBondContact ND1-O 3.31Å; H369-H448 AromaticContact NE2-CE1 3.54Å; H369-H448 AromaticContact NE2-NE2 3.19Å; H369-H448 PolarHBondContact NE2-NE2 2.96Å; H369-H448 VanDerWaalsContact NE2-NE2 3.19Å; H369-H448 PolarHBondContact O-N 3.15Å; H369-H448 PolarHBondContact O-ND1 3.07Å; D371-H448 IonicContact OD2-CE1 3.3Å; D371-H448 PolarHBondContact OD2-CE1 3.09Å; D371-H448 IonicContact OD2-NE2 2.95Å; D371-H448 PolarHBondContact OD2-NE2 3.44Å; R387-H448 CarbonylContact O-C 3.49Å; R387-H448 WeakPolarHBondContact O-CA 3.35Å; L388-H448 HydrophobicContact CD2-CB 3.39Å; I442-H448 HydrophobicContact CD1-CB 4.41Å; I442-H448 HydrophobicContact CG2-CB 4.42Å; Y446-H448 PolarHBondContact O-ND1 3.32Å; Y446-H448 VanDerWaalsContact O-ND1 3.17Å
449	Y	98.6	Very high	97.9	Very high	12 Å²	12	16 Å²	16	5%	0.047	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	138	172.6	166.8	-91.4	0	0	0	108.4	V365 Y385 I386 R387 V413 E414 R451	V365-Y449 HydrophobicContact CG1-CD2 4.42Å; V365-Y449 HydrophobicContact CG1-CE2 3.5Å; Y385-Y449 HydrophobicContact CD1-CD1 4.31Å; Y385-Y449 AromaticContact CD1-CE1 3.94Å; Y385-Y449 HydrophobicContact CD1-CE1 3.94Å; Y385-Y449 HydrophobicContact CE1-CD1 4.04Å; Y385-Y449 AromaticContact CE1-CE1 3.88Å; Y385-Y449 HydrophobicContact CE1-CE1 3.88Å; I386-Y449 CarbonylContact C-O 3.55Å; I386-Y449 VanDerWaalsContact CA-O 3.23Å; I386-Y449 WeakPolarHBondContact CA-O 3.35Å; I386-Y449 WeakPolarHBondContact CG2-O 3.39Å; R387-Y449 PolarHBondContact N-O 3.41Å; R387-Y449 PolarHBondContact O-N 3.47Å; V413-Y449 HydrophobicContact CB-CD1 4.31Å; V413-Y449 HydrophobicContact CB-CD2 3.87Å; V413-Y449 HydrophobicContact CB-CE2 4.28Å; V413-Y449 HydrophobicContact CB-CG 3.88Å; V413-Y449 HydrophobicContact CG1-CD1 4.15Å; V413-Y449 HydrophobicContact CG1-CG 4.05Å; V413-Y449 HydrophobicContact CG2-CD2 3.8Å; V413-Y449 HydrophobicContact CG2-CG 3.89Å; E414-Y449 HydrophobicContact CG-CE1 4.01Å; E414-Y449 WeakPolarHBondContact OE1-CE1 3.41Å; E414-Y449 PolarHBondContact OE1-OH 3.25Å; Y449-R451 HydrophobicContact CE1-CB 4Å
450	V	98.3	Very high	97.9	Very high	8 Å²	8	16 Å²	16	5%	0.048	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	132.8	-177.2	-175.8	0	0	0	0	110.5	V365 S366 K384 Y385 I386	V365-V450 CarbonylContact C-O 3.57Å; V365-V450 WeakPolarHBondContact CA-O 3.42Å; S366-V450 PolarHBondContact N-O 3.06Å; S366-V450 PolarHBondContact O-N 3.06Å; S366-V450 VanDerWaalsContact O-N 3.13Å; K384-V450 HydrophobicContact CB-CG1 4.17Å; K384-V450 HydrophobicContact CD-CG1 3.58Å; K384-V450 HydrophobicContact CG-CG1 3.99Å; Y385-V450 WeakPolarHBondContact O-CA 3.03Å; I386-V450 HydrophobicContact CG1-CG1 4.23Å; I386-V450 HydrophobicContact CG1-CG2 4.2Å; I386-V450 HydrophobicContact CG2-CG2 4.34Å
451	R	97.1	Very high	97.9	Very high	63 Å²	63	16 Å²	16	24%	0.238	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	129.9	169.4	-179.6	169	53.7	77.6	0.9	112	T364 V365 K384 Y385 E414 Y449	T364-R451 CarbonylContact O-C 3.44Å; T364-R451 VanDerWaalsContact O-CA 3.32Å; T364-R451 WeakPolarHBondContact O-CA 3.44Å; V365-R451 HydrophobicContact CG2-CB 4.19Å; V365-R451 HydrophobicContact CG2-CG 3.93Å; K384-R451 WeakPolarHBondContact CA-O 3.35Å; Y385-R451 PolarHBondContact N-O 3.48Å; Y385-R451 PolarHBondContact O-N 2.87Å; E414-R451 VanDerWaalsContact CD-NH2 3.33Å; E414-R451 IonicContact OE1-CZ 2.78Å; E414-R451 VanDerWaalsContact OE1-CZ 3.29Å; E414-R451 IonicContact OE1-NE 2.92Å; E414-R451 PolarHBondContact OE1-NE 3.19Å; E414-R451 IonicContact OE1-NH2 3.76Å; E414-R451 PolarHBondContact OE1-NH2 3.01Å; E414-R451 VanDerWaalsContact OE1-NH2 3.09Å; E414-R451 IonicContact OE2-CZ 2.77Å; E414-R451 IonicContact OE2-NE 2.83Å; E414-R451 PolarHBondContact OE2-NE 3.24Å; E414-R451 IonicContact OE2-NH2 2.74Å; E414-R451 PolarHBondContact OE2-NH2 3.16Å; Y449-R451 HydrophobicContact CE1-CB 4Å
452	S	96.3	Very high	97.8	Very high	1 Å²	1	17.1 Å²	17.1	1%	0.007	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	126.8	174.3	-56.6	0	0	0	0	110.9	G363 T364 K384	G363-S452 PolarHBondContact N-O 2.66Å; T364-S452 PolarHBondContact O-N 2.94Å; T364-S452 VanDerWaalsContact OG1-CB 3.26Å; T364-S452 WeakPolarHBondContact OG1-CB 3.46Å; T364-S452 PolarHBondContact OG1-OG 3.09Å; K384-S452 WeakPolarHBondContact CE-OG 3.47Å
453	L	95.1	Very high	97.8	Very high	5 Å²	5	17.1 Å²	17.1	3%	0.026	8%	0.078	C	C	.	.	S	Bend	trans	-89.6	-18.4	-178.5	-57.1	175.2	0	0	0	112.8	P212 V214 K362 N383 V433	P212-L453 HydrophobicContact CB-CB 3.79Å; P212-L453 HydrophobicContact CG-CB 3.68Å; P212-L453 WeakPolarHBondContact CG-O 3.44Å; V214-L453 HydrophobicContact CG2-CD1 3.28Å; V214-L453 HydrophobicContact CG2-CD2 3.85Å; V214-L453 HydrophobicContact CG2-CG 4.19Å; K362-L453 WeakPolarHBondContact CD-O 3.48Å; K362-L453 VanDerWaalsContact CE-O 3.22Å; K362-L453 WeakPolarHBondContact CE-O 3.16Å; K362-L453 VanDerWaalsContact CG-O 3.3Å; K362-L453 WeakPolarHBondContact CG-O 3.46Å; N383-L453 HydrophobicContact CB-CB 4.27Å; N383-L453 HydrophobicContact CB-CD1 3.95Å; N383-L453 WeakPolarHBondContact O-CB 3.44Å; N383-L453 PolarHBondContact O-N 2.87Å; V433-L453 HydrophobicContact CG1-CD1 3.8Å; V433-L453 HydrophobicContact CG2-CD1 4.33Å
454	E	93.7	Very high	97.5	Very high	24 Å²	24	19.9 Å²	19.9	11%	0.112	10%	0.097	C	C	.	.	S	Bend	trans	-145.9	179.5	-178.7	-66.3	167.7	-156	0	0	108	I209 P212 K362 N383 S456	I209-E454 HydrophobicContact CG2-CG 4.04Å; I209-E454 WeakPolarHBondContact CG2-OE2 3.45Å; P212-E454 WeakPolarHBondContact CD-OE1 3.1Å; P212-E454 HydrophobicContact CG-CG 3.59Å; P212-E454 WeakPolarHBondContact CG-OE1 3.4Å; K362-E454 WeakPolarHBondContact CA-O 3.46Å; K362-E454 PolarHBondContact N-O 3.16Å; N383-E454 PolarHBondContact ND2-OE1 3.08Å; N383-E454 PolarHBondContact ND2-OE2 3.05Å; E454-S456 PolarHBondContact O-N 3.12Å; E454-S456 VanDerWaalsContact O-N 3.14Å
455	I	95.9	Very high	97.5	Very high	54 Å²	54	19 Å²	19	28%	0.277	9%	0.091	S	C	.	.	S	Bend	trans	-52.9	123.5	160.2	-62.9	166.7	0	0	0	107.3	I304 F359 G360 G382	I304-I455 HydrophobicContact CG2-CD1 3.69Å; I304-I455 HydrophobicContact CG2-CG1 4.1Å; I304-I455 HydrophobicContact CG2-CG2 4.07Å; F359-I455 HydrophobicContact CE2-CG2 4.01Å; G360-I455 WeakPolarHBondContact O-CA 3.25Å; G382-I455 WeakPolarHBondContact CA-O 3.36Å
456	S	97.6	Very high	97.5	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	139.5	-169.1	177.6	0	0	0	0	111.5	F359 G360 Q379 V381 K384 E454	F359-S456 WeakPolarHBondContact CA-O 3.32Å; F359-S456 WeakPolarHBondContact CD2-O 3.46Å; G360-S456 PolarHBondContact N-O 3.37Å; G360-S456 PolarHBondContact O-N 3.33Å; Q379-S456 PolarHBondContact NE2-OG 3.02Å; V381-S456 VanDerWaalsContact O-CA 3.25Å; V381-S456 WeakPolarHBondContact O-CA 3.5Å; V381-S456 PolarHBondContact O-OG 3.49Å; K384-S456 VanDerWaalsContact CE-OG 3.31Å; K384-S456 WeakPolarHBondContact CE-OG 3.49Å; E454-S456 PolarHBondContact O-N 3.12Å; E454-S456 VanDerWaalsContact O-N 3.14Å
457	F	98.6	Very high	97.4	Very high	2 Å²	2	14.8 Å²	14.8	1%	0.009	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	119.1	168.7	-153.5	-46.1	0	0	0	109.2	W262 L267 L326 F327 A357 W358 F359 V380 V381	W262-F457 HydrophobicContact CE3-CB 4.27Å; W262-F457 AromaticContact CE3-CD1 3.66Å; W262-F457 HydrophobicContact CE3-CD1 3.66Å; W262-F457 AromaticContact CE3-CD2 3.87Å; W262-F457 HydrophobicContact CE3-CD2 3.87Å; W262-F457 AromaticContact CE3-CE1 3.88Å; W262-F457 HydrophobicContact CE3-CE1 3.88Å; W262-F457 HydrophobicContact CE3-CE2 4.06Å; W262-F457 AromaticContact CE3-CG 3.67Å; W262-F457 HydrophobicContact CE3-CG 3.67Å; W262-F457 HydrophobicContact CE3-CZ 4.07Å; W262-F457 HydrophobicContact CH2-CE1 4.19Å; W262-F457 AromaticContact CZ3-CD1 3.39Å; W262-F457 HydrophobicContact CZ3-CD1 3.39Å; W262-F457 HydrophobicContact CZ3-CD2 4.37Å; W262-F457 AromaticContact CZ3-CE1 3.38Å; W262-F457 HydrophobicContact CZ3-CE1 3.38Å; W262-F457 HydrophobicContact CZ3-CE2 4.35Å; W262-F457 AromaticContact CZ3-CG 3.93Å; W262-F457 HydrophobicContact CZ3-CG 3.93Å; W262-F457 AromaticContact CZ3-CZ 3.89Å; W262-F457 HydrophobicContact CZ3-CZ 3.89Å; L267-F457 HydrophobicContact CD1-CD2 3.98Å; L267-F457 HydrophobicContact CD1-CE2 4.12Å; L267-F457 HydrophobicContact CD2-CD2 4.38Å; L267-F457 HydrophobicContact CD2-CE2 3.88Å; L326-F457 HydrophobicContact CD2-CZ 3.86Å; F327-F457 HydrophobicContact CZ-CE1 4.43Å; A357-F457 HydrophobicContact CB-CE1 3.78Å; A357-F457 HydrophobicContact CB-CZ 4.05Å; W358-F457 CarbonylContact O-C 3.53Å; W358-F457 VanDerWaalsContact O-CA 3.27Å; W358-F457 WeakPolarHBondContact O-CA 3.47Å; F359-F457 HydrophobicContact CB-CD1 4.43Å; F359-F457 HydrophobicContact CB-CD2 3.74Å; F359-F457 HydrophobicContact CB-CE1 4.5Å; F359-F457 HydrophobicContact CB-CE2 3.82Å; F359-F457 HydrophobicContact CB-CG 4.06Å; F359-F457 HydrophobicContact CB-CZ 4.21Å; F359-F457 HydrophobicContact CD1-CD2 4.25Å; F359-F457 HydrophobicContact CD1-CE2 4.16Å; F359-F457 HydrophobicContact CD2-CB 4.35Å; F359-F457 AromaticContact CD2-CD2 3.79Å; F359-F457 HydrophobicContact CD2-CD2 3.79Å; F359-F457 HydrophobicContact CD2-CE2 4.48Å; F359-F457 HydrophobicContact CD2-CG 4.3Å; F359-F457 HydrophobicContact CE2-CD2 4.5Å; F359-F457 AromaticContact CG-CD2 3.67Å; F359-F457 HydrophobicContact CG-CD2 3.67Å; F359-F457 AromaticContact CG-CE2 3.92Å; F359-F457 HydrophobicContact CG-CE2 3.92Å; F359-F457 HydrophobicContact CG-CG 4.34Å; V380-F457 PolarHBondContact N-O 3.03Å; V381-F457 HydrophobicContact CB-CB 3.79Å; V381-F457 HydrophobicContact CG2-CB 3.96Å; V381-F457 PolarHBondContact N-O 3.09Å; V381-F457 PolarHBondContact O-N 3.03Å
458	S	98.8	Very high	97.3	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	158	174.6	-34.7	0	0	0	0	111.4	W358 A378 Q379 K384	W358-S458 PolarHBondContact N-O 3.27Å; W358-S458 PolarHBondContact O-N 2.82Å; A378-S458 CarbonylContact O-C 3.47Å; A378-S458 VanDerWaalsContact O-CA 3.23Å; A378-S458 WeakPolarHBondContact O-CA 3.27Å; A378-S458 WeakPolarHBondContact O-CB 3.39Å; Q379-S458 PolarHBondContact OE1-OG 3.04Å; K384-S458 WeakPolarHBondContact CD-OG 3.24Å; K384-S458 WeakPolarHBondContact CE-OG 3.32Å; K384-S458 PolarHBondContact NZ-OG 3.13Å
459	V	98.8	Very high	97.2	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	126.6	173.9	-173.9	0	0	0	0	108	W254 W262 F327 I337 V355 N356 A378 V380 F461	W254-V459 HydrophobicContact CH2-CB 4.44Å; W254-V459 HydrophobicContact CZ3-CB 4.45Å; W254-V459 HydrophobicContact CZ3-CG2 4.28Å; W262-V459 HydrophobicContact CH2-CG2 3.68Å; W262-V459 HydrophobicContact CZ3-CG2 3.78Å; F327-V459 HydrophobicContact CE2-CG1 3.71Å; F327-V459 HydrophobicContact CE2-CG2 4.28Å; F327-V459 HydrophobicContact CZ-CB 4.39Å; F327-V459 HydrophobicContact CZ-CG1 3.94Å; F327-V459 HydrophobicContact CZ-CG2 3.69Å; I337-V459 HydrophobicContact CD1-CG1 3.9Å; I337-V459 HydrophobicContact CG2-CG2 4.36Å; V355-V459 HydrophobicContact CG1-CG1 3.62Å; N356-V459 WeakPolarHBondContact O-CA 3.42Å; A378-V459 HydrophobicContact CB-CB 4.43Å; A378-V459 PolarHBondContact N-O 2.91Å; A378-V459 PolarHBondContact O-N 3.24Å; V380-V459 HydrophobicContact CG2-CG2 4.02Å; V459-F461 HydrophobicContact CB-CE2 4.24Å; V459-F461 HydrophobicContact CB-CZ 4.49Å; V459-F461 HydrophobicContact CG1-CD2 4.47Å; V459-F461 HydrophobicContact CG1-CE1 4.34Å; V459-F461 HydrophobicContact CG1-CE2 3.73Å; V459-F461 HydrophobicContact CG1-CZ 3.65Å
460	S	98.7	Very high	97.1	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	139.7	173.5	64.5	0	0	0	0	111.3	V355 N356 W358 N375 F376	V355-S460 WeakPolarHBondContact CA-O 3.24Å; N356-S460 WeakPolarHBondContact CB-OG 3.39Å; N356-S460 PolarHBondContact N-O 3.2Å; N356-S460 PolarHBondContact O-N 3.39Å; W358-S460 VanDerWaalsContact NE1-CB 3.32Å; W358-S460 PolarHBondContact NE1-OG 2.99Å; N375-S460 WeakPolarHBondContact OD1-CB 3.14Å; F376-S460 CarbonylContact O-C 3.49Å; F376-S460 VanDerWaalsContact O-CA 3.23Å; F376-S460 WeakPolarHBondContact O-CA 3.37Å
461	F	98.6	Very high	97.1	Very high	1 Å²	1	17 Å²	17	0%	0.004	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	111.8	173.6	-55.1	-97.1	0	0	0	108.3	W254 I337 I339 P340 I353 V355 N375 F376 A378 V459	W254-F461 AromaticContact CH2-CE2 3.66Å; W254-F461 HydrophobicContact CH2-CE2 3.66Å; W254-F461 AromaticContact CH2-CZ 3.58Å; W254-F461 HydrophobicContact CH2-CZ 3.58Å; W254-F461 HydrophobicContact CZ2-CE2 4.02Å; W254-F461 AromaticContact CZ2-CZ 3.74Å; W254-F461 HydrophobicContact CZ2-CZ 3.74Å; I337-F461 HydrophobicContact CD1-CE1 4.48Å; I337-F461 HydrophobicContact CD1-CZ 4.37Å; I339-F461 HydrophobicContact CG1-CD1 4.09Å; I339-F461 HydrophobicContact CG1-CE1 4.01Å; P340-F461 HydrophobicContact CG-CD2 4.09Å; P340-F461 HydrophobicContact CG-CE2 4.17Å; P340-F461 HydrophobicContact CG-CG 4.48Å; I353-F461 HydrophobicContact CG2-CB 4.03Å; I353-F461 HydrophobicContact CG2-CD1 4.32Å; V355-F461 HydrophobicContact CG1-CD1 4.03Å; V355-F461 HydrophobicContact CG1-CE1 3.83Å; V355-F461 HydrophobicContact CG1-CZ 4.39Å; V355-F461 HydrophobicContact CG2-CD1 3.78Å; V355-F461 HydrophobicContact CG2-CE1 4.09Å; N375-F461 WeakPolarHBondContact CA-O 3.34Å; N375-F461 PolarHBondContact OD1-O 2.66Å; F376-F461 HydrophobicContact CB-CB 4.36Å; F376-F461 HydrophobicContact CB-CD2 4.15Å; F376-F461 PolarHBondContact N-O 3.1Å; F376-F461 PolarHBondContact O-N 3.11Å; A378-F461 HydrophobicContact CB-CE2 4.21Å; V459-F461 HydrophobicContact CB-CE2 4.24Å; V459-F461 HydrophobicContact CB-CZ 4.49Å; V459-F461 HydrophobicContact CG1-CD2 4.47Å; V459-F461 HydrophobicContact CG1-CE1 4.34Å; V459-F461 HydrophobicContact CG1-CE2 3.73Å; V459-F461 HydrophobicContact CG1-CZ 3.65Å
462	W	98.1	Very high	97.1	Very high	23 Å²	23	13.5 Å²	13.5	9%	0.087	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	122.9	176.6	-65.9	10.4	0	0	0	109.3	Q323 I353 T354 D371 Q373 Q374 N375	Q323-W462 VanDerWaalsContact NE2-CH2 3.27Å; I353-W462 WeakPolarHBondContact CA-O 3.38Å; T354-W462 PolarHBondContact N-O 3.19Å; T354-W462 PolarHBondContact O-N 3.44Å; D371-W462 HydrophobicContact CB-CH2 4.34Å; D371-W462 HydrophobicContact CB-CZ2 4.31Å; D371-W462 VanDerWaalsContact CG-CZ2 3.44Å; D371-W462 WeakPolarHBondContact OD1-CH2 3.46Å; D371-W462 VanDerWaalsContact OD2-CZ2 3.3Å; D371-W462 WeakPolarHBondContact OD2-CZ2 3.23Å; Q373-W462 HydrophobicContact CB-CB 4.25Å; Q374-W462 WeakPolarHBondContact O-CA 3.18Å; N375-W462 VanDerWaalsContact CG-CD1 3.46Å; N375-W462 PolarHBondContact ND2-NE1 3.02Å
463	W	97.8	Very high	97.1	Very high	5 Å²	5	14.5 Å²	14.5	2%	0.019	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	162.8	-173.7	64	-77.5	0	0	0	110.2	L239 C343 I353 Q373 Q374 F376 F441	L239-W463 HydrophobicContact CD1-CH2 3.54Å; L239-W463 HydrophobicContact CD1-CZ2 4.08Å; L239-W463 HydrophobicContact CD1-CZ3 4.35Å; L239-W463 HydrophobicContact CD2-CH2 3.69Å; L239-W463 HydrophobicContact CD2-CZ3 4.27Å; L239-W463 HydrophobicContact CG-CH2 4.26Å; C343-W463 HydrophobicContact CB-CD2 4.36Å; C343-W463 HydrophobicContact CB-CG 4.34Å; I353-W463 HydrophobicContact CD1-CB 4.48Å; I353-W463 HydrophobicContact CG1-CB 4.09Å; Q373-W463 WeakPolarHBondContact CB-O 3.38Å; Q374-W463 WeakPolarHBondContact CA-O 3.38Å; Q374-W463 HydrophobicContact CB-CD2 3.78Å; Q374-W463 VanDerWaalsContact CB-CE2 3.49Å; Q374-W463 HydrophobicContact CB-CE3 4.39Å; Q374-W463 HydrophobicContact CB-CG 4.06Å; Q374-W463 HydrophobicContact CB-CZ2 3.93Å; Q374-W463 VanDerWaalsContact CB-O 3.24Å; Q374-W463 WeakPolarHBondContact CB-O 3.43Å; Q374-W463 HydrophobicContact CG-CD2 4.23Å; Q374-W463 HydrophobicContact CG-CE3 4.34Å; Q374-W463 HydrophobicContact CG-CH2 4.36Å; Q374-W463 HydrophobicContact CG-CZ2 4.21Å; Q374-W463 HydrophobicContact CG-CZ3 4.39Å; Q374-W463 PolarHBondContact N-O 3.24Å; Q374-W463 PolarHBondContact O-N 2.69Å; F376-W463 AromaticContact CD2-NE1 3.35Å; F376-W463 AromaticContact CE2-CE2 3.67Å; F376-W463 AromaticContact CE2-CZ2 3.66Å; F376-W463 HydrophobicContact CE2-CZ2 3.66Å; F376-W463 AromaticContact CE2-NE1 3.37Å; F376-W463 AromaticContact CZ-CZ2 3.96Å; F376-W463 HydrophobicContact CZ-CZ2 3.96Å; F441-W463 HydrophobicContact CE2-CZ2 4.1Å
464	S	93.9	Very high	97.3	Very high	60 Å²	60	15.4 Å²	15.4	42%	0.42	8%	0.084	S	C	.	.			trans	-116.8	0	-174.5	-42.6	0	0	0	0	112.5	G346 E347 D348 Q373	G346-S464 CarbonylContact C-O 3.52Å; G346-S464 WeakPolarHBondContact CA-O 3.32Å; E347-S464 PolarHBondContact N-O 3.26Å; D348-S464 WeakPolarHBondContact OD2-CB 3.42Å; D348-S464 PolarHBondContact OD2-OG 2.71Å; Q373-S464 PolarHBondContact NE2-OG 3.24Å

Retrieved 464 of 464 residues in 270.4 ms (Link to these results)

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