A0A077Z4F5_TRITR Loading...

Ectonucleoside triphosphate diphosphohydrolase

AlphaFold DB , UniProt , Accession A0A077Z4F5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 525 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.2	Very low	34.8	Very low	240 Å²	240	176.9 Å²	176.9	100%	1.182	87%	0.867	S	S	*	*				0	144	0	-82.4	175.9	168.8	0	0	108.6
2	S	35.1	Very low	34.6	Very low	98 Å²	98	180.6 Å²	180.6	69%	0.685	86%	0.864	S	S	*	*			trans	60	113.8	171.1	66.1	0	0	0	0	119.9
3	H	37.7	Very low	34.3	Very low	178 Å²	178	177 Å²	177	82%	0.824	86%	0.86	S	S	*	*				-178.2	93.1	111.2	-93.4	-64.7	0	0	0	109.6
4	W	31.6	Very low	34.2	Very low	239 Å²	239	172.1 Å²	172.1	91%	0.905	85%	0.853	S	S	*	*			trans	-115.6	107.1	161.4	-86.7	65.2	0	0	0	106.7
5	A	36	Very low	34.2	Very low	94 Å²	94	171.5 Å²	171.5	78%	0.777	85%	0.853	S	S	*	*			trans	-105.4	106.7	175.5	0	0	0	0	0	108.7
6	R	37.1	Very low	34.4	Very low	223 Å²	223	168.9 Å²	168.9	84%	0.842	85%	0.852	S	S	*	*			trans	-95.2	117.4	168.2	-91.3	-177	178.1	-178.6	-0.2	108.6
7	N	35.2	Very low	34.3	Very low	166 Å²	166	166.3 Å²	166.3	89%	0.888	85%	0.854	S	S	*	*			trans	-87.7	109.4	169.4	-82.5	-33.8	0	0	0	109.4
8	S	35.7	Very low	34.5	Very low	110 Å²	110	161.3 Å²	161.3	77%	0.769	85%	0.85	S	S	*	*			trans	-113	114.4	165	54.5	0	0	0	0	109
9	K	36.1	Very low	34.4	Very low	212 Å²	212	161.3 Å²	161.3	92%	0.922	85%	0.85	S	S	*	*			trans	-83.4	114.6	175.6	-75.4	-177.9	175.1	-179.9	0	109.4
10	E	33.5	Very low	34.6	Very low	179 Å²	179	165.7 Å²	165.7	84%	0.836	86%	0.855	S	S	*	*			trans	-72.2	134.7	169	-73	180	145.2	0	0	110.9
11	F	30.4	Very low	34.5	Very low	207 Å²	207	167.3 Å²	167.3	91%	0.908	86%	0.856	S	S	*	*			trans	-110.9	111.6	173.1	-142.4	-95.8	0	0	0	108.8
12	R	32.2	Very low	34.4	Very low	221 Å²	221	160.3 Å²	160.3	83%	0.834	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-78.8	131	-179.1	-86.1	179.8	-176	172.3	1.4	111.3
13	V	31.1	Very low	34.5	Very low	134 Å²	134	167.5 Å²	167.5	81%	0.812	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-94.9	126.8	167.9	177.4	0	0	0	0	108.6
14	S	33.2	Very low	34.2	Very low	109 Å²	109	167.9 Å²	167.9	76%	0.762	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-101.3	123.3	178.2	-28.4	0	0	0	0	109.3
15	L	34.6	Very low	34.4	Very low	163 Å²	163	160 Å²	160	85%	0.853	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-95.9	130.8	173.2	-73.4	164.7	0	0	0	109.3
16	P	36	Very low	34	Very low	129 Å²	129	159.7 Å²	159.7	84%	0.838	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-78.1	127.7	176.2	-5.3	22.1	0	0	0	111
17	S	34.1	Very low	34	Very low	125 Å²	125	154 Å²	154	87%	0.874	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-77.4	135.4	166.3	45.1	0	0	0	0	110.3
18	G	37.5	Very low	33.9	Very low	76 Å²	76	152.5 Å²	152.5	78%	0.784	85%	0.851	S	S	*	*			trans	-153.8	88.2	-179.5	0	0	0	0	0	111.8
19	D	33.1	Very low	33.7	Very low	161 Å²	161	154.6 Å²	154.6	86%	0.861	85%	0.853	S	S	*	*			trans	-57.8	132.6	162.4	-86.1	-45	0	0	0	111.2
20	R	37.1	Very low	33.7	Very low	249 Å²	249	150.6 Å²	150.6	94%	0.94	85%	0.847	S	S	*	*			trans	-163.8	131.5	140	-115.1	170.4	-112.9	-139	1.2	114.5
21	K	33.5	Very low	33.9	Very low	200 Å²	200	148.4 Å²	148.4	87%	0.87	85%	0.848	S	S	*	*			trans	-69.7	151	179.8	-75.2	168.7	166.9	172.2	0	114
22	A	31.8	Very low	34.2	Very low	93 Å²	93	143.3 Å²	143.3	77%	0.769	84%	0.838	S	S	*	*			trans	54	120.9	134.2	0	0	0	0	0	120.6
23	R	36.4	Very low	34.3	Very low	249 Å²	249	137.8 Å²	137.8	94%	0.94	83%	0.833	S	S	*	*				-173.1	123.8	114.1	-106.7	176	-176.1	-175.2	1.1	111
24	L	31.9	Very low	34.7	Very low	187 Å²	187	137.5 Å²	137.5	98%	0.979	83%	0.834	S	S	*	*			trans	-68.8	123.2	160.7	-80.9	123.2	0	0	0	108.5
25	G	35.2	Very low	34.9	Very low	74 Å²	74	139.7 Å²	139.7	76%	0.763	84%	0.837	S	S	*	*			trans	-140.2	107.6	169.3	0	0	0	0	0	108.3
26	G	28.6	Very low	35.1	Very low	87 Å²	87	141.4 Å²	141.4	90%	0.897	84%	0.84	S	S	*	*			trans	-72.1	132.8	171	0	0	0	0	0	110.3
27	A	37.5	Very low	35.2	Very low	102 Å²	102	143.7 Å²	143.7	84%	0.843	85%	0.845	S	S	*	*			trans	-148.5	128.3	162.1	0	0	0	0	0	108.8
28	T	33	Very low	35.5	Very low	135 Å²	135	144 Å²	144	83%	0.828	84%	0.841	S	S	*	*			trans	-77.6	138.9	-168.3	-40.3	0	0	0	0	111.8
29	L	30.9	Very low	35.7	Very low	155 Å²	155	144.6 Å²	144.6	81%	0.812	84%	0.838	S	S	*	*			trans	-2.4	118	157	-61.3	158	0	0	0	117.9
30	T	36.3	Very low	36.2	Very low	127 Å²	127	144.1 Å²	144.1	78%	0.779	84%	0.836	S	S	*	*				-152.4	123.6	127.4	49.1	0	0	0	0	109.7	S32	T30-S32 PolarHBondContact O-N 3.24Å
31	P	36.9	Very low	36.6	Very low	134 Å²	134	139.2 Å²	139.2	87%	0.87	83%	0.828	S	S	*	*			trans	-81.5	98.1	176.1	31	-29.6	0	0	0	109.9
32	S	37.9	Very low	37.4	Very low	100 Å²	100	134.2 Å²	134.2	70%	0.699	81%	0.811	S	S	*	*			trans	-96.9	110.7	166.1	54.4	0	0	0	0	109.9	T30	T30-S32 PolarHBondContact O-N 3.24Å
33	S	34.1	Very low	38.2	Very low	104 Å²	104	135 Å²	135	73%	0.727	81%	0.809	S	S	*	*			trans	-3.4	113	163.2	53.1	0	0	0	0	118.3
34	P	38.1	Very low	38.8	Very low	128 Å²	128	129.5 Å²	129.5	83%	0.831	80%	0.799	S	S	*	*			trans	-89.2	102.6	167.8	32.1	-26.2	0	0	0	110.1
35	L	37.6	Very low	40	Very low	156 Å²	156	123.3 Å²	123.3	82%	0.817	77%	0.771	S	S	*	*			trans	-154	69.9	175.2	-119	147.4	0	0	0	109.6
36	Q	39.9	Very low	41.2	Very low	199 Å²	199	124.8 Å²	124.8	93%	0.93	75%	0.754	S	S	*	*	S	Bend	trans	-170.1	8.3	159.2	-111.6	160	4.5	0	0	119.5
37	L	37.7	Very low	42.9	Very low	177 Å²	177	124.1 Å²	124.1	93%	0.927	74%	0.735	S	S	*	*	S	Bend	trans	-113.2	20.4	-169.9	-102.9	152.2	0	0	0	117.4
38	V	40.5	Very low	44.7	Very low	132 Å²	132	121 Å²	121	80%	0.8	71%	0.714	S	S	*	*			trans	-120	13.1	-174	-169.3	0	0	0	0	114.4
39	A	42.5	Very low	46.7	Very low	87 Å²	87	120.8 Å²	120.8	72%	0.719	70%	0.698	S	S	*	*	S	Bend	trans	-82.5	-18.5	-170.9	0	0	0	0	0	116.4
40	D	42.2	Very low	49	Very low	152 Å²	152	115.8 Å²	115.8	81%	0.813	67%	0.671	S	S	*	*	S	Bend	trans	-102.2	-12.8	-167.1	-82.9	-33.6	0	0	0	116.8
41	D	46.1	Very low	51.2	Low	146 Å²	146	111.4 Å²	111.4	78%	0.781	65%	0.651	S	S	*	*	S	Bend	trans	-83.8	-19.9	178.3	-93.3	-22.7	0	0	0	113.7	C43	D41-C43 VanDerWaalsContact C-N 3.34Å; D41-C43 PolarHBondContact O-N 3.39Å
42	D	49.3	Very low	53.4	Low	95 Å²	95	110.1 Å²	110.1	51%	0.508	64%	0.636	S	S	.	*	H	α-helix	trans	-77	-23.9	-169.5	-133.1	21.2	0	0	0	112.5	R46	D42-R46 PolarHBondContact O-N 3.41Å
43	C	49.5	Very low	55.6	Low	109 Å²	109	105.5 Å²	105.5	74%	0.736	61%	0.605	S	S	*	*	H	α-helix	trans	-76.8	-33	-175.5	-140	0	0	0	0	112.4	D41	D41-C43 VanDerWaalsContact C-N 3.34Å; D41-C43 PolarHBondContact O-N 3.39Å
44	N	49.2	Very low	58.2	Low	134 Å²	134	105.5 Å²	105.5	72%	0.717	60%	0.596	S	S	*	*	H	α-helix	trans	-77.7	-33.6	176.4	-124.5	4.6	0	0	0	111.9	S47	N44-S47 PolarHBondContact O-OG 3.49Å
45	S	58.2	Low	60.6	Low	57 Å²	57	103 Å²	103	40%	0.399	58%	0.578	S	S	.	*	H	α-helix	trans	-63.6	-43.5	179.1	-178.1	0	0	0	0	112.5	S47 G48 W49	S45-S47 VanDerWaalsContact C-N 3.35Å; S45-S47 PolarHBondContact O-N 3.14Å; S45-G48 PolarHBondContact O-N 3.24Å; S45-G48 VanDerWaalsContact O-N 3.14Å; S45-W49 PolarHBondContact O-N 3.05Å; S45-W49 PolarHBondContact OG-NE1 3.47Å
46	R	58.6	Low	63	Low	104 Å²	104	97.2 Å²	97.2	39%	0.392	55%	0.552	S	S	.	*	H	α-helix	trans	-63.7	-34.7	-178.2	-73.6	-174.3	-174.9	-159.3	3.8	113.9	D42 G48 W49 L50 R522	D42-R46 PolarHBondContact O-N 3.41Å; R46-G48 VanDerWaalsContact C-N 3.29Å; R46-G48 PolarHBondContact O-N 3.36Å; R46-W49 PolarHBondContact O-N 3.46Å; R46-L50 PolarHBondContact O-N 3.41Å; R46-R522 PolarHBondContact NH1-O 3.39Å
47	S	65	Low	65.4	Low	74 Å²	74	88.6 Å²	88.6	52%	0.517	51%	0.514	S	S	.	.	H	α-helix	trans	-66.2	-35.2	176.8	87.5	0	0	0	0	111.4	N44 S45 G51	N44-S47 PolarHBondContact O-OG 3.49Å; S45-S47 VanDerWaalsContact C-N 3.35Å; S45-S47 PolarHBondContact O-N 3.14Å; S47-G51 PolarHBondContact O-N 3.14Å; S47-G51 VanDerWaalsContact O-N 3.1Å
48	G	74.9	Confident	68	Low	37 Å²	37	83.8 Å²	83.8	38%	0.381	49%	0.491	S	S	.	.	H	α-helix	trans	-63.2	-42.8	175.6	0	0	0	0	0	113.3	S45 R46 G51 L52	S45-G48 PolarHBondContact O-N 3.24Å; S45-G48 VanDerWaalsContact O-N 3.14Å; R46-G48 VanDerWaalsContact C-N 3.29Å; R46-G48 PolarHBondContact O-N 3.36Å; G48-G51 PolarHBondContact O-N 3.38Å; G48-L52 WeakPolarHBondContact O-CG 3.47Å; G48-L52 PolarHBondContact O-N 3.44Å
49	W	76.2	Confident	70.4	Confident	130 Å²	130	81.6 Å²	81.6	49%	0.492	47%	0.474	S	S	.	.	H	α-helix	trans	-66.1	-40.8	179.2	-69	106.9	0	0	0	113.2	S45 R46 G51 L52 A53 F515 V519	S45-W49 PolarHBondContact O-N 3.05Å; S45-W49 PolarHBondContact OG-NE1 3.47Å; R46-W49 PolarHBondContact O-N 3.46Å; W49-G51 VanDerWaalsContact C-N 3.3Å; W49-L52 HydrophobicContact CE3-CD1 4.17Å; W49-L52 HydrophobicContact CZ3-CD1 4.43Å; W49-L52 PolarHBondContact O-N 3.33Å; W49-A53 WeakPolarHBondContact O-CB 3.36Å; W49-A53 PolarHBondContact O-N 3.32Å; W49-F515 HydrophobicContact CB-CE1 4.04Å; W49-F515 HydrophobicContact CB-CZ 4.2Å; W49-F515 HydrophobicContact CD2-CZ 4.09Å; W49-F515 AromaticContact CE3-CE1 3.91Å; W49-F515 HydrophobicContact CE3-CE1 3.91Å; W49-F515 AromaticContact CE3-CZ 3.51Å; W49-F515 HydrophobicContact CE3-CZ 3.51Å; W49-F515 HydrophobicContact CG-CZ 4.4Å; W49-F515 HydrophobicContact CZ3-CZ 4.23Å; W49-V519 HydrophobicContact CB-CG2 4.46Å
50	L	78.5	Confident	72.7	Confident	50 Å²	50	77.5 Å²	77.5	26%	0.262	44%	0.44	S	S	.	.	H	α-helix	trans	-61.6	-41.9	172.5	-76.8	168.2	0	0	0	111.1	R46 A53 L54 L516 V519 I520	R46-L50 PolarHBondContact O-N 3.41Å; L50-A53 PolarHBondContact O-N 2.97Å; L50-L54 WeakPolarHBondContact O-CB 3.18Å; L50-L54 PolarHBondContact O-N 3.33Å; L50-L516 HydrophobicContact CD2-CD1 4.37Å; L50-V519 HydrophobicContact CD1-CG1 4.37Å; L50-V519 HydrophobicContact CD2-CB 4.01Å; L50-V519 HydrophobicContact CD2-CG1 3.6Å; L50-V519 HydrophobicContact CG-CG1 3.65Å; L50-I520 HydrophobicContact CD2-CG1 4.44Å
51	G	81.9	Confident	75.1	Confident	35 Å²	35	74 Å²	74	36%	0.361	42%	0.421	S	S	.	.	H	α-helix	trans	-58.3	-49.1	174.8	0	0	0	0	0	112.2	S47 G48 W49 L54 V55	S47-G51 PolarHBondContact O-N 3.14Å; S47-G51 VanDerWaalsContact O-N 3.1Å; G48-G51 PolarHBondContact O-N 3.38Å; W49-G51 VanDerWaalsContact C-N 3.3Å; G51-L54 PolarHBondContact O-N 2.99Å; G51-V55 WeakPolarHBondContact O-CB 3.41Å; G51-V55 WeakPolarHBondContact O-CG2 3.38Å; G51-V55 PolarHBondContact O-N 3.31Å
52	L	84	Confident	77.4	Confident	106 Å²	106	71.2 Å²	71.2	56%	0.555	41%	0.409	S	S	*	.	H	α-helix	trans	-62.7	-43.4	178.9	-72.4	169.2	0	0	0	112.8	G48 W49 L54 V55 A56	G48-L52 WeakPolarHBondContact O-CG 3.47Å; G48-L52 PolarHBondContact O-N 3.44Å; W49-L52 HydrophobicContact CE3-CD1 4.17Å; W49-L52 HydrophobicContact CZ3-CD1 4.43Å; W49-L52 PolarHBondContact O-N 3.33Å; L52-L54 VanDerWaalsContact C-N 3.33Å; L52-L54 PolarHBondContact O-N 2.89Å; L52-V55 PolarHBondContact O-N 3.1Å; L52-A56 PolarHBondContact O-N 2.87Å
53	A	84.3	Confident	79.4	Confident	4 Å²	4	68.8 Å²	68.8	3%	0.033	40%	0.399	C	S	.	.	H	α-helix	trans	-57.8	-48	177	0	0	0	0	0	111.4	W49 L50 A56 V57 F515 L516	W49-A53 WeakPolarHBondContact O-CB 3.36Å; W49-A53 PolarHBondContact O-N 3.32Å; L50-A53 PolarHBondContact O-N 2.97Å; A53-A56 PolarHBondContact O-N 3.36Å; A53-V57 WeakPolarHBondContact O-CG2 3.2Å; A53-V57 PolarHBondContact O-N 3.05Å; A53-V57 VanDerWaalsContact O-N 3.11Å; A53-F515 HydrophobicContact CB-CD1 3.61Å; A53-F515 HydrophobicContact CB-CE1 4.26Å; A53-L516 HydrophobicContact CB-CB 4.29Å; A53-L516 HydrophobicContact CB-CD1 3.82Å
54	L	88.4	Confident	81.4	Confident	104 Å²	104	66.2 Å²	66.2	55%	0.545	38%	0.378	S	S	.	.	H	α-helix	trans	-66.3	-41	-179.5	-170.9	129.8	0	0	0	111.1	L50 G51 L52 A56 V57 V58	L50-L54 WeakPolarHBondContact O-CB 3.18Å; L50-L54 PolarHBondContact O-N 3.33Å; G51-L54 PolarHBondContact O-N 2.99Å; L52-L54 VanDerWaalsContact C-N 3.33Å; L52-L54 PolarHBondContact O-N 2.89Å; L54-A56 PolarHBondContact O-N 2.91Å; L54-V57 PolarHBondContact O-N 3.46Å; L54-V58 HydrophobicContact CD2-CG2 4.27Å; L54-V58 WeakPolarHBondContact O-CB 3.38Å; L54-V58 VanDerWaalsContact O-CG2 3.25Å; L54-V58 WeakPolarHBondContact O-CG2 3.21Å; L54-V58 PolarHBondContact O-N 3.42Å
55	V	89	Confident	83.4	Confident	76 Å²	76	64.6 Å²	64.6	46%	0.461	37%	0.368	S	S	.	.	H	α-helix	trans	-59.5	-44.1	174.2	168.6	0	0	0	0	111.3	G51 L52 V57 V58 I59	G51-V55 WeakPolarHBondContact O-CB 3.41Å; G51-V55 WeakPolarHBondContact O-CG2 3.38Å; G51-V55 PolarHBondContact O-N 3.31Å; L52-V55 PolarHBondContact O-N 3.1Å; V55-V57 PolarHBondContact O-N 2.98Å; V55-V58 PolarHBondContact O-N 2.91Å; V55-I59 HydrophobicContact CG1-CD1 3.63Å; V55-I59 HydrophobicContact CG1-CG1 4.3Å; V55-I59 WeakPolarHBondContact O-CB 3.46Å; V55-I59 VanDerWaalsContact O-CG1 3.25Å; V55-I59 WeakPolarHBondContact O-CG1 3.41Å; V55-I59 PolarHBondContact O-N 2.92Å
56	A	87	Confident	84.9	Confident	33 Å²	33	64.1 Å²	64.1	27%	0.273	37%	0.367	S	S	.	.	H	α-helix	trans	-62.8	-43	178.1	0	0	0	0	0	112.6	L52 A53 L54 I59 G60	L52-A56 PolarHBondContact O-N 2.87Å; A53-A56 PolarHBondContact O-N 3.36Å; L54-A56 PolarHBondContact O-N 2.91Å; A56-I59 PolarHBondContact O-N 3.23Å; A56-G60 PolarHBondContact O-N 3.37Å
57	V	90.5	Very high	86.4	Confident	19 Å²	19	59.3 Å²	59.3	12%	0.115	35%	0.35	C	S	.	.	H	α-helix	trans	-62.4	-46.2	175	174.5	0	0	0	0	110.8	A53 L54 V55 G60 I61 G512 L513	A53-V57 WeakPolarHBondContact O-CG2 3.2Å; A53-V57 PolarHBondContact O-N 3.05Å; A53-V57 VanDerWaalsContact O-N 3.11Å; L54-V57 PolarHBondContact O-N 3.46Å; V55-V57 PolarHBondContact O-N 2.98Å; V57-G60 PolarHBondContact O-N 2.89Å; V57-I61 HydrophobicContact CG1-CD1 3.68Å; V57-I61 HydrophobicContact CG1-CG1 4.35Å; V57-I61 VanDerWaalsContact O-CG1 3.31Å; V57-I61 WeakPolarHBondContact O-CG1 3.35Å; V57-I61 PolarHBondContact O-N 3.46Å; V57-G512 VanDerWaalsContact CG2-C 3.46Å; V57-L513 HydrophobicContact CG1-CD2 4.39Å; V57-L513 HydrophobicContact CG2-CD2 4.19Å; V57-L513 HydrophobicContact CG2-CG 4.11Å
58	V	91.9	Very high	87.4	Confident	75 Å²	75	58.5 Å²	58.5	46%	0.455	34%	0.342	S	S	.	.	H	α-helix	trans	-61.5	-46.5	179.2	169.9	0	0	0	0	111	L54 V55 G60 I61 V62	L54-V58 HydrophobicContact CD2-CG2 4.27Å; L54-V58 WeakPolarHBondContact O-CB 3.38Å; L54-V58 VanDerWaalsContact O-CG2 3.25Å; L54-V58 WeakPolarHBondContact O-CG2 3.21Å; L54-V58 PolarHBondContact O-N 3.42Å; V55-V58 PolarHBondContact O-N 2.91Å; V58-G60 PolarHBondContact O-N 3.48Å; V58-I61 PolarHBondContact O-N 2.87Å; V58-V62 HydrophobicContact CG1-CG2 4.28Å; V58-V62 WeakPolarHBondContact O-CB 3.43Å; V58-V62 VanDerWaalsContact O-CG2 3.24Å; V58-V62 WeakPolarHBondContact O-CG2 3.46Å; V58-V62 PolarHBondContact O-N 3.2Å
59	I	91.3	Very high	88	Confident	87 Å²	87	60.3 Å²	60.3	45%	0.446	35%	0.345	S	S	.	.	H	α-helix	trans	-59.9	-47.6	176.9	-68.7	168.4	0	0	0	110.3	V55 A56 I61 V62 S63 M508	V55-I59 HydrophobicContact CG1-CD1 3.63Å; V55-I59 HydrophobicContact CG1-CG1 4.3Å; V55-I59 WeakPolarHBondContact O-CB 3.46Å; V55-I59 VanDerWaalsContact O-CG1 3.25Å; V55-I59 WeakPolarHBondContact O-CG1 3.41Å; V55-I59 PolarHBondContact O-N 2.92Å; A56-I59 PolarHBondContact O-N 3.23Å; I59-I61 PolarHBondContact O-N 3.37Å; I59-V62 PolarHBondContact O-N 3.47Å; I59-S63 WeakPolarHBondContact O-CB 3.35Å; I59-S63 PolarHBondContact O-N 3.43Å; I59-S63 PolarHBondContact O-OG 2.94Å; I59-S63 VanDerWaalsContact O-OG 3.09Å; I59-M508 HydrophobicContact CG2-CE 3.93Å
60	G	91.5	Very high	88.4	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-59.5	-43.8	178.6	0	0	0	0	0	113	A56 V57 V58 S63 L64	A56-G60 PolarHBondContact O-N 3.37Å; V57-G60 PolarHBondContact O-N 2.89Å; V58-G60 PolarHBondContact O-N 3.48Å; G60-S63 PolarHBondContact O-N 2.96Å; G60-L64 WeakPolarHBondContact O-CB 3.33Å; G60-L64 PolarHBondContact O-N 3.33Å
61	I	92.8	Very high	88.6	Confident	80 Å²	80	59.8 Å²	59.8	41%	0.41	35%	0.345	S	S	.	.	H	α-helix	trans	-64.2	-45.8	176	-68.8	170.4	0	0	0	110.8	V57 V58 I59 S63 L64 I65 V509	V57-I61 HydrophobicContact CG1-CD1 3.68Å; V57-I61 HydrophobicContact CG1-CG1 4.35Å; V57-I61 VanDerWaalsContact O-CG1 3.31Å; V57-I61 WeakPolarHBondContact O-CG1 3.35Å; V57-I61 PolarHBondContact O-N 3.46Å; V58-I61 PolarHBondContact O-N 2.87Å; I59-I61 PolarHBondContact O-N 3.37Å; I61-S63 VanDerWaalsContact C-N 3.34Å; I61-S63 PolarHBondContact O-N 3.5Å; I61-L64 PolarHBondContact O-N 3.43Å; I61-I65 HydrophobicContact CG2-CD1 3.73Å; I61-I65 HydrophobicContact CG2-CG1 4.36Å; I61-I65 VanDerWaalsContact O-CG1 3.32Å; I61-I65 WeakPolarHBondContact O-CG1 3.33Å; I61-I65 PolarHBondContact O-N 2.98Å; I61-V509 HydrophobicContact CG1-CG2 4.01Å
62	V	93.8	Very high	88.6	Confident	87 Å²	87	62.6 Å²	62.6	53%	0.527	36%	0.358	S	S	.	.	H	α-helix	trans	-62.3	-42.2	178.6	170.3	0	0	0	0	111	V58 I59 L64 I65 A66	V58-V62 HydrophobicContact CG1-CG2 4.28Å; V58-V62 WeakPolarHBondContact O-CB 3.43Å; V58-V62 VanDerWaalsContact O-CG2 3.24Å; V58-V62 WeakPolarHBondContact O-CG2 3.46Å; V58-V62 PolarHBondContact O-N 3.2Å; I59-V62 PolarHBondContact O-N 3.47Å; V62-L64 VanDerWaalsContact C-N 3.35Å; V62-L64 PolarHBondContact O-N 2.96Å; V62-I65 PolarHBondContact O-N 2.93Å; V62-A66 VanDerWaalsContact O-CB 3.26Å; V62-A66 WeakPolarHBondContact O-CB 3.32Å; V62-A66 PolarHBondContact O-N 2.86Å
63	S	90.6	Very high	88.4	Confident	43 Å²	43	61.7 Å²	61.7	30%	0.301	35%	0.353	S	S	.	.	H	α-helix	trans	-62.8	-40	174.8	-64.1	0	0	0	0	112.2	I59 G60 I61 A66 V67	I59-S63 WeakPolarHBondContact O-CB 3.35Å; I59-S63 PolarHBondContact O-N 3.43Å; I59-S63 PolarHBondContact O-OG 2.94Å; I59-S63 VanDerWaalsContact O-OG 3.09Å; G60-S63 PolarHBondContact O-N 2.96Å; I61-S63 VanDerWaalsContact C-N 3.34Å; I61-S63 PolarHBondContact O-N 3.5Å; S63-A66 PolarHBondContact O-N 3.11Å; S63-V67 WeakPolarHBondContact O-CB 3.45Å; S63-V67 PolarHBondContact O-N 3.31Å
64	L	91.9	Very high	88.1	Confident	56 Å²	56	62.4 Å²	62.4	29%	0.293	36%	0.358	S	S	.	.	H	α-helix	trans	-68.3	-42.7	178.1	-163.8	146.4	0	0	0	111.5	G60 I61 V62 V67 V68 A505	G60-L64 WeakPolarHBondContact O-CB 3.33Å; G60-L64 PolarHBondContact O-N 3.33Å; I61-L64 PolarHBondContact O-N 3.43Å; V62-L64 VanDerWaalsContact C-N 3.35Å; V62-L64 PolarHBondContact O-N 2.96Å; L64-V67 WeakPolarHBondContact O-CG1 3.37Å; L64-V67 PolarHBondContact O-N 2.88Å; L64-V68 HydrophobicContact CD2-CG2 4.13Å; L64-V68 WeakPolarHBondContact O-CB 3.49Å; L64-V68 WeakPolarHBondContact O-CG2 3.36Å; L64-V68 PolarHBondContact O-N 3.34Å; L64-A505 HydrophobicContact CB-CB 4.18Å
65	I	91.6	Very high	87.3	Confident	99 Å²	99	59.8 Å²	59.8	51%	0.508	36%	0.356	S	S	.	.	H	α-helix	trans	-61.5	-47.1	173.2	-66.7	168.2	0	0	0	109.8	I61 V62 V67 V68 V69	I61-I65 HydrophobicContact CG2-CD1 3.73Å; I61-I65 HydrophobicContact CG2-CG1 4.36Å; I61-I65 VanDerWaalsContact O-CG1 3.32Å; I61-I65 WeakPolarHBondContact O-CG1 3.33Å; I61-I65 PolarHBondContact O-N 2.98Å; V62-I65 PolarHBondContact O-N 2.93Å; I65-V67 PolarHBondContact O-N 2.92Å; I65-V68 PolarHBondContact O-N 2.89Å; I65-V69 HydrophobicContact CG2-CG2 4.3Å; I65-V69 WeakPolarHBondContact O-CB 3.45Å; I65-V69 WeakPolarHBondContact O-CG2 3.25Å; I65-V69 PolarHBondContact O-N 3.38Å
66	A	90.1	Very high	86.8	Confident	47 Å²	47	59 Å²	59	39%	0.388	35%	0.353	S	S	.	.	H	α-helix	trans	-61.4	-43.9	-179.8	0	0	0	0	0	112.3	V62 S63 V69 L70	V62-A66 VanDerWaalsContact O-CB 3.26Å; V62-A66 WeakPolarHBondContact O-CB 3.32Å; V62-A66 PolarHBondContact O-N 2.86Å; S63-A66 PolarHBondContact O-N 3.11Å; A66-V69 PolarHBondContact O-N 3.46Å; A66-L70 WeakPolarHBondContact O-CB 3.25Å; A66-L70 VanDerWaalsContact O-CG 3.26Å; A66-L70 WeakPolarHBondContact O-CG 3.48Å; A66-L70 PolarHBondContact O-N 3.31Å
67	V	89.3	Confident	86.4	Confident	3 Å²	3	60 Å²	60	2%	0.018	35%	0.354	C	S	.	.	H	α-helix	trans	-70.7	-38.1	-178.8	86.7	0	0	0	0	111.9	S63 L64 I65 L70 Y71 I493 F498 V501 T502	S63-V67 WeakPolarHBondContact O-CB 3.45Å; S63-V67 PolarHBondContact O-N 3.31Å; L64-V67 WeakPolarHBondContact O-CG1 3.37Å; L64-V67 PolarHBondContact O-N 2.88Å; I65-V67 PolarHBondContact O-N 2.92Å; V67-L70 PolarHBondContact O-N 2.87Å; V67-Y71 VanDerWaalsContact O-CB 3.3Å; V67-Y71 WeakPolarHBondContact O-CB 3.37Å; V67-Y71 PolarHBondContact O-N 2.99Å; V67-I493 HydrophobicContact CG2-CD1 3.43Å; V67-I493 VanDerWaalsContact CG2-CD1 3.43Å; V67-F498 HydrophobicContact CB-CD2 4.44Å; V67-F498 HydrophobicContact CG1-CD2 4.15Å; V67-F498 HydrophobicContact CG1-CE2 4.01Å; V67-F498 HydrophobicContact CG2-CD2 3.77Å; V67-F498 HydrophobicContact CG2-CE2 4.44Å; V67-V501 HydrophobicContact CB-CG1 3.94Å; V67-V501 HydrophobicContact CG1-CG1 4.47Å; V67-V501 HydrophobicContact CG2-CB 3.83Å; V67-V501 HydrophobicContact CG2-CG1 3.7Å; V67-T502 VanDerWaalsContact CG1-OG1 3.29Å; V67-T502 WeakPolarHBondContact CG1-OG1 3.25Å
68	V	86.9	Confident	86.2	Confident	58 Å²	58	59.9 Å²	59.9	35%	0.352	35%	0.353	S	S	.	.	H	α-helix	trans	-64.8	-44.5	173.8	170.4	0	0	0	0	110.3	L64 I65 Y71 C72 F498	L64-V68 HydrophobicContact CD2-CG2 4.13Å; L64-V68 WeakPolarHBondContact O-CB 3.49Å; L64-V68 WeakPolarHBondContact O-CG2 3.36Å; L64-V68 PolarHBondContact O-N 3.34Å; I65-V68 PolarHBondContact O-N 2.89Å; V68-Y71 PolarHBondContact O-N 3Å; V68-C72 WeakPolarHBondContact O-CB 3.47Å; V68-C72 PolarHBondContact O-N 2.96Å; V68-C72 PolarHBondContact O-SG 3.49Å; V68-F498 HydrophobicContact CG2-CE2 4.39Å
69	V	86.3	Confident	86.2	Confident	74 Å²	74	58.7 Å²	58.7	45%	0.448	34%	0.344	S	S	.	.	H	α-helix	trans	-61	-47.7	175.3	169.9	0	0	0	0	110.7	I65 A66 Y71 C72 L73	I65-V69 HydrophobicContact CG2-CG2 4.3Å; I65-V69 WeakPolarHBondContact O-CB 3.45Å; I65-V69 WeakPolarHBondContact O-CG2 3.25Å; I65-V69 PolarHBondContact O-N 3.38Å; A66-V69 PolarHBondContact O-N 3.46Å; V69-Y71 VanDerWaalsContact C-N 3.3Å; V69-Y71 PolarHBondContact O-N 3.46Å; V69-C72 PolarHBondContact O-N 3.49Å; V69-L73 HydrophobicContact CG1-CD1 3.81Å; V69-L73 HydrophobicContact CG1-CG 4.35Å; V69-L73 WeakPolarHBondContact O-CB 3.34Å; V69-L73 WeakPolarHBondContact O-CG 3.41Å; V69-L73 PolarHBondContact O-N 2.99Å
70	L	85.6	Confident	86.4	Confident	67 Å²	67	55.4 Å²	55.4	35%	0.351	33%	0.327	S	S	.	.	H	α-helix	trans	-59.5	-40.5	177.1	-74.9	168.7	0	0	0	112	A66 V67 L73 S74 L492 I493	A66-L70 WeakPolarHBondContact O-CB 3.25Å; A66-L70 VanDerWaalsContact O-CG 3.26Å; A66-L70 WeakPolarHBondContact O-CG 3.48Å; A66-L70 PolarHBondContact O-N 3.31Å; V67-L70 PolarHBondContact O-N 2.87Å; L70-L73 PolarHBondContact O-N 3.46Å; L70-S74 PolarHBondContact O-N 2.91Å; L70-S74 PolarHBondContact O-OG 3.32Å; L70-L492 HydrophobicContact CD2-CB 4.25Å; L70-L492 HydrophobicContact CD2-CD2 3.86Å; L70-I493 HydrophobicContact CB-CB 4.42Å; L70-I493 HydrophobicContact CB-CG2 3.97Å
71	Y	83	Confident	86.7	Confident	103 Å²	103	56.6 Å²	56.6	40%	0.404	33%	0.332	S	S	.	.	H	α-helix	trans	-71.6	-38.5	177.7	-174.9	-98.7	0	0	0	113.2	V67 V68 V69 L73 S74 I493 F498	V67-Y71 VanDerWaalsContact O-CB 3.3Å; V67-Y71 WeakPolarHBondContact O-CB 3.37Å; V67-Y71 PolarHBondContact O-N 2.99Å; V68-Y71 PolarHBondContact O-N 3Å; V69-Y71 VanDerWaalsContact C-N 3.3Å; V69-Y71 PolarHBondContact O-N 3.46Å; Y71-L73 VanDerWaalsContact C-N 3.26Å; Y71-L73 PolarHBondContact O-N 3.24Å; Y71-S74 WeakPolarHBondContact O-CB 3.28Å; Y71-S74 PolarHBondContact O-N 3.33Å; Y71-I493 HydrophobicContact CD2-CG2 4.41Å; Y71-F498 HydrophobicContact CD1-CE1 4.49Å; Y71-F498 HydrophobicContact CD1-CE2 4.24Å; Y71-F498 HydrophobicContact CD1-CZ 4.23Å; Y71-F498 HydrophobicContact CD2-CB 3.94Å; Y71-F498 AromaticContact CD2-CD1 3.96Å; Y71-F498 HydrophobicContact CD2-CD1 3.96Å; Y71-F498 AromaticContact CD2-CD2 3.85Å; Y71-F498 HydrophobicContact CD2-CD2 3.85Å; Y71-F498 HydrophobicContact CD2-CE1 4.46Å; Y71-F498 HydrophobicContact CD2-CE2 4.36Å; Y71-F498 AromaticContact CD2-CG 3.62Å; Y71-F498 HydrophobicContact CD2-CG 3.62Å; Y71-F498 HydrophobicContact CE2-CD1 4.18Å; Y71-F498 HydrophobicContact CE2-CG 4.26Å; Y71-F498 HydrophobicContact CG-CD1 4.27Å; Y71-F498 AromaticContact CG-CD2 3.67Å; Y71-F498 HydrophobicContact CG-CD2 3.67Å; Y71-F498 HydrophobicContact CG-CE1 4.37Å; Y71-F498 AromaticContact CG-CE2 3.8Å; Y71-F498 HydrophobicContact CG-CE2 3.8Å; Y71-F498 AromaticContact CG-CG 3.92Å; Y71-F498 HydrophobicContact CG-CG 3.92Å; Y71-F498 HydrophobicContact CG-CZ 4.16Å
72	C	81.6	Confident	86.9	Confident	94 Å²	94	52.8 Å²	52.8	64%	0.635	31%	0.313	S	S	*	.	H	α-helix	trans	-67	-28.6	173.2	-71.4	0	0	0	0	112.4	V68 V69	V68-C72 WeakPolarHBondContact O-CB 3.47Å; V68-C72 PolarHBondContact O-N 2.96Å; V68-C72 PolarHBondContact O-SG 3.49Å; V69-C72 PolarHBondContact O-N 3.49Å
73	L	79.3	Confident	87.1	Confident	87 Å²	87	48.7 Å²	48.7	46%	0.455	29%	0.287	S	S	.	.	H	α-helix	trans	-81	-29.1	172.8	-67.2	174.6	0	0	0	112	V69 L70 Y71 S76 L492	V69-L73 HydrophobicContact CG1-CD1 3.81Å; V69-L73 HydrophobicContact CG1-CG 4.35Å; V69-L73 WeakPolarHBondContact O-CB 3.34Å; V69-L73 WeakPolarHBondContact O-CG 3.41Å; V69-L73 PolarHBondContact O-N 2.99Å; L70-L73 PolarHBondContact O-N 3.46Å; Y71-L73 VanDerWaalsContact C-N 3.26Å; Y71-L73 PolarHBondContact O-N 3.24Å; L73-S76 WeakPolarHBondContact O-CB 3.42Å; L73-S76 PolarHBondContact O-N 3.34Å; L73-S76 PolarHBondContact O-OG 3.44Å; L73-L492 HydrophobicContact CB-CD1 4.34Å; L73-L492 HydrophobicContact CB-CD2 4.39Å
74	S	76.8	Confident	87.5	Confident	19 Å²	19	46.6 Å²	46.6	13%	0.133	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	145.6	166.6	-74.1	0	0	0	0	110.2	L70 Y71 S76 T490 L492 I493	L70-S74 PolarHBondContact O-N 2.91Å; L70-S74 PolarHBondContact O-OG 3.32Å; Y71-S74 WeakPolarHBondContact O-CB 3.28Å; Y71-S74 PolarHBondContact O-N 3.33Å; S74-S76 PolarHBondContact O-N 3.02Å; S74-T490 CarbonylContact C-O 3.53Å; S74-T490 VanDerWaalsContact CA-O 3.31Å; S74-T490 WeakPolarHBondContact CA-O 3.35Å; S74-L492 PolarHBondContact OG-N 3.2Å; S74-L492 VanDerWaalsContact OG-N 3.13Å; S74-I493 PolarHBondContact OG-N 2.88Å; S74-I493 VanDerWaalsContact OG-N 3.12Å; S74-I493 PolarHBondContact OG-O 3.44Å
75	G	72.4	Confident	87.8	Confident	49 Å²	49	44 Å²	44	51%	0.505	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.6	-10.3	-178.2	0	0	0	0	0	114.3	I77 T490	G75-I77 PolarHBondContact O-N 3.35Å; G75-T490 PolarHBondContact N-O 3.43Å
76	S	78	Confident	88.2	Confident	58 Å²	58	40.7 Å²	40.7	41%	0.406	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-66.1	122.9	170.2	62.5	0	0	0	0	109.5	L73 S74 T490	L73-S76 WeakPolarHBondContact O-CB 3.42Å; L73-S76 PolarHBondContact O-N 3.34Å; L73-S76 PolarHBondContact O-OG 3.44Å; S74-S76 PolarHBondContact O-N 3.02Å; S76-T490 PolarHBondContact O-N 3.43Å; S76-T490 PolarHBondContact O-OG1 3.3Å
77	I	79.8	Confident	88.5	Confident	55 Å²	55	38.5 Å²	38.5	28%	0.282	23%	0.225	S	C	.	.	P	Polyproline II helix	trans	-73.4	127	170.8	-60.6	167.1	0	0	0	105.8	G75 N100 E487 P489	G75-I77 PolarHBondContact O-N 3.35Å; I77-N100 WeakPolarHBondContact CB-OD1 3.39Å; I77-N100 PolarHBondContact O-ND2 3.21Å; I77-N100 PolarHBondContact O-OD1 3.47Å; I77-E487 HydrophobicContact CG2-CB 4.41Å; I77-P489 HydrophobicContact CG1-CG 4.26Å
78	P	86.1	Confident	88.8	Confident	16 Å²	16	38.8 Å²	38.8	10%	0.104	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-71.6	155	179.3	29.2	-34.9	0	0	0	111.9	E80 E487 K488	P78-E80 PolarHBondContact O-N 2.91Å; P78-E487 HydrophobicContact CG-CB 4.14Å; P78-E487 HydrophobicContact CG-CG 4.3Å; P78-K488 WeakPolarHBondContact CD-O 3.25Å
79	D	92.1	Very high	88.9	Confident	50 Å²	50	37.4 Å²	37.4	27%	0.267	22%	0.221	S	C	.	.	P	Polyproline II helix	trans	-62.8	125.7	171.2	-77.6	3.7	0	0	0	109.8	Y81 K98 W99 N100 R151	D79-Y81 HydrophobicContact CB-CE2 3.93Å; D79-Y81 WeakPolarHBondContact O-CE2 3.41Å; D79-K98 IonicContact OD2-NZ 2.89Å; D79-K98 PolarHBondContact OD2-NZ 2.85Å; D79-W99 WeakPolarHBondContact CA-O 3.45Å; D79-N100 PolarHBondContact OD1-ND2 3.45Å; D79-N100 VanDerWaalsContact OD1-ND2 3.12Å; D79-R151 WeakPolarHBondContact O-CD 3.24Å
80	E	94.8	Very high	89.1	Confident	18 Å²	18	36.5 Å²	36.5	8%	0.084	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	153	167	-71.7	176.7	-98.8	0	0	109.3	P78 K98 W99 R102 E487	P78-E80 PolarHBondContact O-N 2.91Å; E80-K98 WeakPolarHBondContact O-CA 3.29Å; E80-K98 WeakPolarHBondContact O-CB 3.2Å; E80-W99 HydrophobicContact CB-CD2 3.96Å; E80-W99 HydrophobicContact CB-CG 4.34Å; E80-W99 HydrophobicContact CB-CH2 4.24Å; E80-W99 HydrophobicContact CB-CZ2 3.51Å; E80-W99 HydrophobicContact CG-CZ2 4.33Å; E80-W99 PolarHBondContact N-O 3.5Å; E80-W99 PolarHBondContact O-N 3.44Å; E80-W99 PolarHBondContact OE1-NE1 3.46Å; E80-W99 PolarHBondContact OE2-NE1 2.87Å; E80-R102 IonicContact OE1-NH2 3.03Å; E80-R102 IonicContact OE2-NH2 3.43Å; E80-R102 PolarHBondContact OE2-NH2 3.45Å; E80-E487 HydrophobicContact CG-CB 4.05Å; E80-E487 HydrophobicContact CG-CG 3.41Å; E80-E487 VanDerWaalsContact CG-CG 3.41Å
81	Y	97.2	Very high	89.5	Confident	26 Å²	26	36.7 Å²	36.7	10%	0.102	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	145.2	-178.4	-63.4	-99.3	0	0	0	111	D79 L96 Y97 K98 V147 P148 R151 S155 A156	D79-Y81 HydrophobicContact CB-CE2 3.93Å; D79-Y81 WeakPolarHBondContact O-CE2 3.41Å; Y81-L96 HydrophobicContact CD1-CD1 4.14Å; Y81-Y97 VanDerWaalsContact CA-O 3.3Å; Y81-Y97 WeakPolarHBondContact CA-O 3.21Å; Y81-K98 HydrophobicContact CD1-CB 3.92Å; Y81-K98 HydrophobicContact CE1-CB 4Å; Y81-K98 HydrophobicContact CE1-CD 4.42Å; Y81-V147 HydrophobicContact CD1-CG1 4.35Å; Y81-V147 HydrophobicContact CD1-CG2 4Å; Y81-V147 HydrophobicContact CD2-CG1 4.18Å; Y81-V147 HydrophobicContact CE1-CG2 4.47Å; Y81-V147 HydrophobicContact CG-CG1 4.07Å; Y81-V147 HydrophobicContact CG-CG2 4.37Å; Y81-P148 HydrophobicContact CE2-CG 4.39Å; Y81-P148 VanDerWaalsContact OH-CD 3.31Å; Y81-P148 WeakPolarHBondContact OH-CD 3.18Å; Y81-R151 HydrophobicContact CD2-CB 3.97Å; Y81-R151 HydrophobicContact CD2-CG 4.28Å; Y81-R151 HydrophobicContact CE2-CB 4.09Å; Y81-R151 HydrophobicContact CE2-CG 4.03Å; Y81-S155 WeakPolarHBondContact CB-OG 3.49Å; Y81-S155 VanDerWaalsContact O-CA 3.31Å; Y81-S155 WeakPolarHBondContact O-CA 3.39Å; Y81-A156 PolarHBondContact O-N 2.97Å; Y81-A156 VanDerWaalsContact O-N 3.15Å
82	G	97.8	Very high	90.1	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	138.8	176.2	0	0	0	0	0	110.5	Y97 A156	G82-Y97 PolarHBondContact N-O 2.93Å; G82-Y97 PolarHBondContact O-N 2.98Å; G82-A156 CarbonylContact C-O 3.45Å; G82-A156 WeakPolarHBondContact CA-O 3.31Å
83	I	98.7	Very high	90.9	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	127.5	179	-60.7	163.4	0	0	0	107.6	I85 V94 F95 L96 L140 I143 A156 L157 Y158 F192	I83-I85 HydrophobicContact CG2-CG1 4.49Å; I83-V94 HydrophobicContact CG2-CG1 3.66Å; I83-F95 VanDerWaalsContact CA-O 3.28Å; I83-F95 WeakPolarHBondContact CA-O 3.36Å; I83-L96 HydrophobicContact CD1-CD1 4.36Å; I83-L96 HydrophobicContact CG1-CD1 3.64Å; I83-L140 HydrophobicContact CG2-CD2 4.24Å; I83-I143 HydrophobicContact CD1-CG2 3.76Å; I83-I143 HydrophobicContact CG1-CG2 4.03Å; I83-A156 PolarHBondContact N-O 3.47Å; I83-L157 HydrophobicContact CB-CD1 3.84Å; I83-L157 HydrophobicContact CG2-CD1 3.59Å; I83-Y158 PolarHBondContact O-N 3.15Å; I83-F192 HydrophobicContact CD1-CB 4.49Å; I83-F192 HydrophobicContact CD1-CD1 3.65Å; I83-F192 HydrophobicContact CD1-CD2 3.47Å; I83-F192 VanDerWaalsContact CD1-CD2 3.47Å; I83-F192 HydrophobicContact CD1-CE1 3.51Å; I83-F192 HydrophobicContact CD1-CE2 3.33Å; I83-F192 HydrophobicContact CD1-CG 3.61Å; I83-F192 HydrophobicContact CD1-CZ 3.33Å
84	V	98.7	Very high	91.8	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	122	173.7	-175.8	0	0	0	0	107.9	F95 Y97 Y158 W472 T473 Y476 M477	V84-F95 PolarHBondContact N-O 3.41Å; V84-F95 PolarHBondContact O-N 2.96Å; V84-Y97 HydrophobicContact CB-CE2 4.31Å; V84-Y97 HydrophobicContact CG2-CD2 4.29Å; V84-Y97 HydrophobicContact CG2-CE2 4.24Å; V84-Y158 WeakPolarHBondContact CA-O 3.41Å; V84-W472 HydrophobicContact CG1-CH2 3.91Å; V84-W472 HydrophobicContact CG1-CZ3 3.82Å; V84-T473 HydrophobicContact CB-CG2 4.39Å; V84-T473 HydrophobicContact CG1-CG2 3.79Å; V84-Y476 HydrophobicContact CG1-CD1 4.3Å; V84-Y476 HydrophobicContact CG1-CG 4.5Å; V84-Y476 HydrophobicContact CG2-CD1 4.13Å; V84-M477 HydrophobicContact CG2-CB 3.95Å; V84-M477 HydrophobicContact CG2-CG 4.33Å; V84-M477 HydrophobicContact CG2-SD 3.81Å
85	I	98.7	Very high	92.8	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	117.4	172.2	-51	177.8	0	0	0	108	I83 G93 V94 L136 L140 L157 Y158 L159 A160 L187	I83-I85 HydrophobicContact CG2-CG1 4.49Å; I85-G93 CarbonylContact C-O 3.59Å; I85-G93 WeakPolarHBondContact CA-O 3.26Å; I85-V94 HydrophobicContact CD1-CG2 4.49Å; I85-V94 HydrophobicContact CG1-CG1 4.22Å; I85-V94 HydrophobicContact CG1-CG2 4.13Å; I85-V94 HydrophobicContact CG2-CG2 4.26Å; I85-L136 HydrophobicContact CD1-CD1 4.07Å; I85-L136 HydrophobicContact CG2-CD1 4.47Å; I85-L136 HydrophobicContact CG2-CD2 4.13Å; I85-L140 HydrophobicContact CD1-CD1 4.3Å; I85-L140 HydrophobicContact CD1-CD2 4.2Å; I85-L157 HydrophobicContact CD1-CD1 4.1Å; I85-L157 HydrophobicContact CG1-CD1 4.29Å; I85-Y158 PolarHBondContact N-O 3.31Å; I85-L159 HydrophobicContact CB-CB 4.03Å; I85-L159 HydrophobicContact CB-CD1 3.86Å; I85-L159 HydrophobicContact CB-CG 3.96Å; I85-L159 HydrophobicContact CD1-CD1 4.1Å; I85-L159 HydrophobicContact CG2-CD1 3.7Å; I85-L159 HydrophobicContact CG2-CG 4.18Å; I85-L159 WeakPolarHBondContact O-CA 3.41Å; I85-A160 PolarHBondContact O-N 3.31Å; I85-L187 HydrophobicContact CD1-CD1 4.3Å; I85-L187 HydrophobicContact CD1-CD2 3.72Å
86	D	98.2	Very high	94	Very high	30 Å²	30	21 Å²	21	16%	0.16	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	112.1	166.2	-173.2	-8.5	0	0	0	109	G88 S92 G93 F95 W472 T473	D86-G88 PolarHBondContact O-N 2.94Å; D86-G88 PolarHBondContact OD1-N 3.39Å; D86-S92 CarbonylContact O-C 3.45Å; D86-S92 WeakPolarHBondContact O-CA 3.33Å; D86-S92 WeakPolarHBondContact O-CB 3.37Å; D86-G93 PolarHBondContact N-O 2.93Å; D86-G93 PolarHBondContact O-N 3.39Å; D86-F95 HydrophobicContact CB-CE2 4.11Å; D86-W472 HydrophobicContact CB-CH2 4.45Å; D86-W472 HydrophobicContact CB-CZ2 3.69Å; D86-W472 VanDerWaalsContact CG-CZ2 3.44Å; D86-W472 WeakPolarHBondContact OD1-CZ2 3.26Å; D86-W472 PolarHBondContact OD1-NE1 2.84Å; D86-W472 PolarHBondContact OD2-NE1 3.26Å; D86-T473 HydrophobicContact CB-CG2 3.68Å
87	A	97.7	Very high	94.9	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.008	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	80.8	170.5	0	0	0	0	0	109.2	L122 L159 A160 A161 T162	A87-L122 HydrophobicContact CB-CB 4.4Å; A87-L122 HydrophobicContact CB-CD1 3.39Å; A87-L122 HydrophobicContact CB-CG 3.65Å; A87-L159 HydrophobicContact CB-CD2 4.28Å; A87-L159 HydrophobicContact CB-CG 4.46Å; A87-A160 PolarHBondContact N-O 3.09Å; A87-A161 HydrophobicContact CB-CB 3.77Å; A87-A161 WeakPolarHBondContact O-CA 3.44Å; A87-T162 PolarHBondContact O-N 2.88Å; A87-T162 PolarHBondContact O-OG1 3.29Å
88	G	94.3	Very high	95.7	Very high	9 Å²	9	19 Å²	19	9%	0.093	10%	0.102	C	C	.	.			trans	-69.2	166.4	-178	0	0	0	0	0	113.9	D86 S90 H91 S121 T162	D86-G88 PolarHBondContact O-N 2.94Å; D86-G88 PolarHBondContact OD1-N 3.39Å; G88-S90 VanDerWaalsContact C-N 3.29Å; G88-S90 PolarHBondContact O-N 3.5Å; G88-H91 CarbonylContact C-O 3.56Å; G88-H91 WeakPolarHBondContact CA-O 3.4Å; G88-H91 PolarHBondContact N-O 3.38Å; G88-S121 VanDerWaalsContact O-CB 3.26Å; G88-S121 WeakPolarHBondContact O-CB 3.5Å; G88-T162 WeakPolarHBondContact CA-OG1 3.28Å
89	S	90.5	Very high	96.1	Very high	29 Å²	29	18.5 Å²	18.5	20%	0.203	10%	0.099	C	C	.	.	S	Bend	trans	-70.9	-18.9	177.7	57.2	0	0	0	0	114.9	G247 A248	S89-G247 VanDerWaalsContact OG-CA 3.31Å; S89-G247 WeakPolarHBondContact OG-CA 3Å; S89-G247 PolarHBondContact OG-N 2.9Å; S89-A248 PolarHBondContact OG-N 3.48Å
90	S	89.5	Confident	95.9	Very high	56 Å²	56	20 Å²	20	39%	0.392	11%	0.107	S	C	.	.	S	Bend	trans	-116.8	-31	-178.4	-55.5	0	0	0	0	113.2	G88 E119 N288	G88-S90 VanDerWaalsContact C-N 3.29Å; G88-S90 PolarHBondContact O-N 3.5Å; S90-E119 VanDerWaalsContact O-O 3.07Å; S90-N288 PolarHBondContact OG-ND2 2.87Å
91	H	93.6	Very high	95.3	Very high	71 Å²	71	19.7 Å²	19.7	33%	0.329	11%	0.108	S	C	.	.			trans	-153.3	173.4	-178.6	71.4	107.4	0	0	0	108.4	G88 D117 V118 E119	G88-H91 CarbonylContact C-O 3.56Å; G88-H91 WeakPolarHBondContact CA-O 3.4Å; G88-H91 PolarHBondContact N-O 3.38Å; H91-D117 IonicContact CE1-OD1 3.72Å; H91-D117 PolarHBondContact CE1-OD1 3.22Å; H91-D117 IonicContact CG-OD1 3.11Å; H91-D117 IonicContact ND1-OD1 2.67Å; H91-D117 PolarHBondContact ND1-OD1 3.41Å; H91-V118 WeakPolarHBondContact CB-O 3.32Å; H91-E119 WeakPolarHBondContact CA-O 3.31Å; H91-E119 WeakPolarHBondContact CB-O 3.44Å
92	S	97.1	Very high	94.7	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	150.8	168.2	-46.5	0	0	0	0	111	D86 V118 D120	D86-S92 CarbonylContact O-C 3.45Å; D86-S92 WeakPolarHBondContact O-CA 3.33Å; D86-S92 WeakPolarHBondContact O-CB 3.37Å; S92-V118 PolarHBondContact N-O 3.29Å; S92-V118 PolarHBondContact O-N 3.42Å; S92-D120 PolarHBondContact OG-O 3.37Å
93	G	96.7	Very high	93.9	Very high	1 Å²	1	22.3 Å²	22.3	1%	0.01	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	132.9	-180	0	0	0	0	0	112.2	I85 D86 F95 C116	I85-G93 CarbonylContact C-O 3.59Å; I85-G93 WeakPolarHBondContact CA-O 3.26Å; D86-G93 PolarHBondContact N-O 2.93Å; D86-G93 PolarHBondContact O-N 3.39Å; G93-F95 WeakPolarHBondContact O-CD2 3.32Å; G93-C116 WeakPolarHBondContact CA-O 3.4Å
94	V	98.2	Very high	93	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	113.9	177.1	-172.8	0	0	0	0	109.9	I83 I85 Y115 C116 C139 L140 I143	I83-V94 HydrophobicContact CG2-CG1 3.66Å; I85-V94 HydrophobicContact CD1-CG2 4.49Å; I85-V94 HydrophobicContact CG1-CG1 4.22Å; I85-V94 HydrophobicContact CG1-CG2 4.13Å; I85-V94 HydrophobicContact CG2-CG2 4.26Å; V94-Y115 WeakPolarHBondContact O-CA 3.36Å; V94-Y115 WeakPolarHBondContact O-CB 3.21Å; V94-C116 HydrophobicContact CB-CB 4.34Å; V94-C116 PolarHBondContact N-O 2.84Å; V94-C116 PolarHBondContact O-N 3.43Å; V94-C139 HydrophobicContact CB-CB 4.12Å; V94-C139 HydrophobicContact CG2-CB 3.57Å; V94-L140 HydrophobicContact CG1-CD2 4.04Å; V94-I143 HydrophobicContact CB-CG1 4.43Å; V94-I143 HydrophobicContact CG1-CG1 3.82Å
95	F	98.2	Very high	92.2	Very high	18 Å²	18	33 Å²	33	8%	0.079	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	132.7	-177.5	-63.1	-101.5	0	0	0	110.8	I83 V84 D86 G93 Y97 Y115 D469 T473	I83-F95 VanDerWaalsContact CA-O 3.28Å; I83-F95 WeakPolarHBondContact CA-O 3.36Å; V84-F95 PolarHBondContact N-O 3.41Å; V84-F95 PolarHBondContact O-N 2.96Å; D86-F95 HydrophobicContact CB-CE2 4.11Å; G93-F95 WeakPolarHBondContact O-CD2 3.32Å; F95-Y97 HydrophobicContact CB-CD2 4.42Å; F95-Y97 HydrophobicContact CB-CE2 3.61Å; F95-Y115 HydrophobicContact CD1-CG 4.37Å; F95-Y115 VanDerWaalsContact CE1-CB 3.49Å; F95-Y115 AromaticContact CE1-CD1 3.85Å; F95-Y115 HydrophobicContact CE1-CD1 3.85Å; F95-Y115 AromaticContact CE1-CG 3.76Å; F95-Y115 HydrophobicContact CE1-CG 3.76Å; F95-Y115 HydrophobicContact CE2-CD2 4.5Å; F95-Y115 HydrophobicContact CE2-CG 4.34Å; F95-Y115 HydrophobicContact CZ-CD1 4.05Å; F95-Y115 HydrophobicContact CZ-CD2 4.16Å; F95-Y115 AromaticContact CZ-CG 3.73Å; F95-Y115 HydrophobicContact CZ-CG 3.73Å; F95-D469 HydrophobicContact CE1-CB 4.17Å; F95-T473 HydrophobicContact CD2-CG2 3.79Å; F95-T473 HydrophobicContact CE2-CG2 3.99Å; F95-T473 HydrophobicContact CG-CG2 4.4Å
96	L	98.3	Very high	91.6	Very high	2 Å²	2	33 Å²	33	1%	0.01	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	130.9	172.4	-179.9	65.8	0	0	0	110.4	Y81 I83 V112 I143 L146 V147	Y81-L96 HydrophobicContact CD1-CD1 4.14Å; I83-L96 HydrophobicContact CD1-CD1 4.36Å; I83-L96 HydrophobicContact CG1-CD1 3.64Å; L96-V112 HydrophobicContact CB-CB 4.27Å; L96-V112 HydrophobicContact CD2-CB 3.8Å; L96-V112 HydrophobicContact CD2-CG1 3.82Å; L96-V112 HydrophobicContact CD2-CG2 4.37Å; L96-V112 HydrophobicContact CG-CB 3.89Å; L96-V112 HydrophobicContact CG-CG1 4.47Å; L96-V112 HydrophobicContact CG-CG2 4.24Å; L96-V112 PolarHBondContact O-N 3.42Å; L96-I143 HydrophobicContact CB-CD1 4.11Å; L96-I143 HydrophobicContact CB-CG2 4.04Å; L96-I143 HydrophobicContact CD1-CG2 4.08Å; L96-I143 HydrophobicContact CD2-CG2 4.18Å; L96-I143 HydrophobicContact CG-CG2 4.32Å; L96-L146 HydrophobicContact CD2-CB 3.67Å; L96-L146 HydrophobicContact CD2-CD1 4.28Å; L96-V147 HydrophobicContact CD1-CG2 3.68Å; L96-V147 HydrophobicContact CD2-CG2 3.72Å; L96-V147 HydrophobicContact CG-CG2 4.38Å
97	Y	97.8	Very high	91	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	149.2	178.1	-65.8	-65.4	0	0	0	110.2	Y81 G82 V84 F95 I109 K110 Q111 T473 L474 M477	Y81-Y97 VanDerWaalsContact CA-O 3.3Å; Y81-Y97 WeakPolarHBondContact CA-O 3.21Å; G82-Y97 PolarHBondContact N-O 2.93Å; G82-Y97 PolarHBondContact O-N 2.98Å; V84-Y97 HydrophobicContact CB-CE2 4.31Å; V84-Y97 HydrophobicContact CG2-CD2 4.29Å; V84-Y97 HydrophobicContact CG2-CE2 4.24Å; F95-Y97 HydrophobicContact CB-CD2 4.42Å; F95-Y97 HydrophobicContact CB-CE2 3.61Å; Y97-I109 HydrophobicContact CD1-CG2 3.61Å; Y97-I109 HydrophobicContact CG-CG2 3.85Å; Y97-K110 CarbonylContact C-O 3.45Å; Y97-K110 WeakPolarHBondContact CA-O 3.45Å; Y97-Q111 HydrophobicContact CD1-CB 4.11Å; Y97-Q111 HydrophobicContact CD1-CG 4.43Å; Y97-Q111 HydrophobicContact CE1-CB 3.89Å; Y97-Q111 HydrophobicContact CE1-CG 4.03Å; Y97-T473 PolarHBondContact OH-OG1 2.92Å; Y97-L474 HydrophobicContact CE1-CB 3.9Å; Y97-L474 HydrophobicContact CE1-CD1 4.01Å; Y97-L474 HydrophobicContact CE1-CG 4.05Å; Y97-L474 WeakPolarHBondContact OH-CA 3.4Å; Y97-L474 PolarHBondContact OH-N 3.38Å; Y97-L474 VanDerWaalsContact OH-N 3.15Å; Y97-M477 HydrophobicContact CD2-CB 3.79Å; Y97-M477 HydrophobicContact CD2-CG 3.84Å; Y97-M477 HydrophobicContact CE2-CB 4.23Å; Y97-M477 HydrophobicContact CG-CB 4.29Å; Y97-M477 HydrophobicContact CG-CG 4.13Å
98	K	96	Very high	90.6	Very high	71 Å²	71	34.3 Å²	34.3	31%	0.309	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	150.6	170.4	73.1	177.2	-174	161	0	112.1	D79 E80 Y81 K110 V112	D79-K98 IonicContact OD2-NZ 2.89Å; D79-K98 PolarHBondContact OD2-NZ 2.85Å; E80-K98 WeakPolarHBondContact O-CA 3.29Å; E80-K98 WeakPolarHBondContact O-CB 3.2Å; Y81-K98 HydrophobicContact CD1-CB 3.92Å; Y81-K98 HydrophobicContact CE1-CB 4Å; Y81-K98 HydrophobicContact CE1-CD 4.42Å; K98-K110 HydrophobicContact CG-CB 4.48Å; K98-K110 PolarHBondContact N-O 3.07Å; K98-K110 PolarHBondContact O-N 3.19Å; K98-V112 HydrophobicContact CB-CG2 3.77Å; K98-V112 HydrophobicContact CD-CG2 3.61Å; K98-V112 HydrophobicContact CG-CG2 3.47Å; K98-V112 VanDerWaalsContact CG-CG2 3.47Å
99	W	93.7	Very high	90.5	Very high	6 Å²	6	34 Å²	34	2%	0.023	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	164	172.5	62	92.8	0	0	0	110.1	D79 E80 V108 I109 M477 T481 L484	D79-W99 WeakPolarHBondContact CA-O 3.45Å; E80-W99 HydrophobicContact CB-CD2 3.96Å; E80-W99 HydrophobicContact CB-CG 4.34Å; E80-W99 HydrophobicContact CB-CH2 4.24Å; E80-W99 HydrophobicContact CB-CZ2 3.51Å; E80-W99 HydrophobicContact CG-CZ2 4.33Å; E80-W99 PolarHBondContact N-O 3.5Å; E80-W99 PolarHBondContact O-N 3.44Å; E80-W99 PolarHBondContact OE1-NE1 3.46Å; E80-W99 PolarHBondContact OE2-NE1 2.87Å; W99-V108 VanDerWaalsContact CB-O 3.27Å; W99-V108 WeakPolarHBondContact CB-O 3.21Å; W99-I109 HydrophobicContact CB-CG1 4.11Å; W99-I109 HydrophobicContact CD2-CG1 4.33Å; W99-I109 HydrophobicContact CE3-CD1 4.26Å; W99-I109 HydrophobicContact CE3-CG1 4.02Å; W99-I109 HydrophobicContact CG-CG1 4.39Å; W99-M477 HydrophobicContact CH2-CE 3.89Å; W99-M477 HydrophobicContact CZ3-CE 4.12Å; W99-M477 HydrophobicContact CZ3-CG 4.21Å; W99-M477 HydrophobicContact CZ3-SD 4.41Å; W99-T481 HydrophobicContact CD2-CG2 3.94Å; W99-T481 HydrophobicContact CE3-CG2 4.18Å; W99-T481 HydrophobicContact CH2-CG2 4.13Å; W99-T481 HydrophobicContact CZ2-CG2 3.87Å; W99-T481 HydrophobicContact CZ3-CG2 4.27Å; W99-L484 HydrophobicContact CH2-CD1 4.04Å; W99-L484 HydrophobicContact CZ2-CD1 3.96Å
100	N	88.4	Confident	90.6	Very high	83 Å²	83	39.4 Å²	39.4	44%	0.444	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	109.9	178.5	-170.6	-50.4	0	0	0	108.1	I77 D79	I77-N100 WeakPolarHBondContact CB-OD1 3.39Å; I77-N100 PolarHBondContact O-ND2 3.21Å; I77-N100 PolarHBondContact O-OD1 3.47Å; D79-N100 PolarHBondContact OD1-ND2 3.45Å; D79-N100 VanDerWaalsContact OD1-ND2 3.12Å
101	G	81.8	Confident	90.9	Very high	11 Å²	11	38 Å²	38	11%	0.113	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	64.1	-168.9	-174.5	0	0	0	0	0	113.6
102	R	84	Confident	91	Very high	62 Å²	62	36 Å²	36	23%	0.234	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	149.7	-173.7	-59.2	-175.8	-172.2	152.1	3.4	111.4	E80 D105 T106 L484 P485	E80-R102 IonicContact OE1-NH2 3.03Å; E80-R102 IonicContact OE2-NH2 3.43Å; E80-R102 PolarHBondContact OE2-NH2 3.45Å; R102-D105 WeakPolarHBondContact CD-O 3.05Å; R102-T106 WeakPolarHBondContact CA-O 3.38Å; R102-L484 PolarHBondContact NH1-O 2.87Å; R102-L484 PolarHBondContact NH2-O 3.4Å; R102-P485 PolarHBondContact NH2-O 2.86Å
103	N	81.2	Confident	90.7	Very high	18 Å²	18	38.5 Å²	38.5	10%	0.096	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	114.7	168.7	-176.1	-8.7	0	0	0	109	D105 T106 V222 D224 Y271	N103-D105 VanDerWaalsContact C-N 3.31Å; N103-D105 PolarHBondContact O-N 2.66Å; N103-T106 PolarHBondContact N-O 3Å; N103-T106 PolarHBondContact O-N 2.94Å; N103-T106 VanDerWaalsContact O-N 3.09Å; N103-V222 PolarHBondContact ND2-O 2.94Å; N103-D224 PolarHBondContact ND2-OD1 2.9Å; N103-Y271 HydrophobicContact CB-CD1 4.19Å; N103-Y271 HydrophobicContact CB-CE1 4.46Å
104	K	80.3	Confident	90.4	Very high	104 Å²	104	43.1 Å²	43.1	45%	0.452	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.8	54.7	-176.2	-61.5	165.6	-179	-179.5	0	111.5	T106 Y271	K104-T106 PolarHBondContact O-N 3.49Å; K104-T106 VanDerWaalsContact O-N 3.08Å; K104-Y271 VanDerWaalsContact CD-C 3.42Å; K104-Y271 WeakPolarHBondContact CD-O 3.39Å; K104-Y271 PolarHBondContact NZ-O 2.93Å
105	D	81.5	Confident	90.2	Very high	120 Å²	120	46.7 Å²	46.7	64%	0.642	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.8	-8.8	-179.7	-49.7	-48.8	0	0	0	116.5	R102 N103 N482	R102-D105 WeakPolarHBondContact CD-O 3.05Å; N103-D105 VanDerWaalsContact C-N 3.31Å; N103-D105 PolarHBondContact O-N 2.66Å; D105-N482 WeakPolarHBondContact O-CA 3.26Å; D105-N482 PolarHBondContact O-OD1 3.19Å; D105-N482 VanDerWaalsContact O-OD1 3.09Å
106	T	85.7	Confident	90.1	Very high	2 Å²	2	47 Å²	47	1%	0.012	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	129.6	176.8	-48.8	0	0	0	0	111.4	R102 N103 K104 L270 Y271 L478 N482	R102-T106 WeakPolarHBondContact CA-O 3.38Å; N103-T106 PolarHBondContact N-O 3Å; N103-T106 PolarHBondContact O-N 2.94Å; N103-T106 VanDerWaalsContact O-N 3.09Å; K104-T106 PolarHBondContact O-N 3.49Å; K104-T106 VanDerWaalsContact O-N 3.08Å; T106-L270 HydrophobicContact CG2-CD2 4.21Å; T106-Y271 HydrophobicContact CG2-CD1 4.16Å; T106-Y271 HydrophobicContact CG2-CD2 4.42Å; T106-Y271 HydrophobicContact CG2-CE1 3.64Å; T106-Y271 HydrophobicContact CG2-CE2 3.91Å; T106-Y271 VanDerWaalsContact CG2-CZ 3.5Å; T106-Y271 PolarHBondContact OG1-N 3.43Å; T106-L478 HydrophobicContact CG2-CD2 4.32Å; T106-N482 WeakPolarHBondContact CA-OD1 3.44Å; T106-N482 VanDerWaalsContact CB-OD1 3.28Å; T106-N482 WeakPolarHBondContact CB-OD1 3.41Å; T106-N482 PolarHBondContact N-OD1 3.44Å; T106-N482 PolarHBondContact OG1-OD1 3.14Å
107	G	86.8	Confident	90	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	144.4	177.5	0	0	0	0	0	112.8	I109 Y271 L478 T481	G107-I109 PolarHBondContact O-N 3.25Å; G107-Y271 PolarHBondContact O-OH 3.32Å; G107-L478 WeakPolarHBondContact O-CD2 3.41Å; G107-T481 PolarHBondContact N-OG1 3.46Å
108	V	89.5	Confident	89.9	Confident	57 Å²	57	51.2 Å²	51.2	35%	0.345	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	94.6	170.7	-176.3	0	0	0	0	108.3	W99 Y215 V222	W99-V108 VanDerWaalsContact CB-O 3.27Å; W99-V108 WeakPolarHBondContact CB-O 3.21Å; V108-Y215 VanDerWaalsContact CG1-OH 3.31Å; V108-Y215 WeakPolarHBondContact CG1-OH 3.3Å; V108-V222 HydrophobicContact CG1-CG1 4.47Å; V108-V222 HydrophobicContact CG2-CG1 3.79Å
109	I	91.6	Very high	89.6	Confident	4 Å²	4	55.7 Å²	55.7	2%	0.021	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	140.4	-167.4	-61.6	-178.2	0	0	0	113.1	Y97 W99 G107 Y215 M477 L478 T481	Y97-I109 HydrophobicContact CD1-CG2 3.61Å; Y97-I109 HydrophobicContact CG-CG2 3.85Å; W99-I109 HydrophobicContact CB-CG1 4.11Å; W99-I109 HydrophobicContact CD2-CG1 4.33Å; W99-I109 HydrophobicContact CE3-CD1 4.26Å; W99-I109 HydrophobicContact CE3-CG1 4.02Å; W99-I109 HydrophobicContact CG-CG1 4.39Å; G107-I109 PolarHBondContact O-N 3.25Å; I109-Y215 PolarHBondContact N-OH 2.72Å; I109-Y215 WeakPolarHBondContact O-CE1 3.23Å; I109-Y215 PolarHBondContact O-OH 3.12Å; I109-M477 HydrophobicContact CD1-CB 3.91Å; I109-M477 HydrophobicContact CD1-CG 3.69Å; I109-L478 HydrophobicContact CB-CD2 4.03Å; I109-L478 HydrophobicContact CB-CG 4.49Å; I109-L478 HydrophobicContact CD1-CB 4.3Å; I109-L478 HydrophobicContact CD1-CD2 3.73Å; I109-L478 HydrophobicContact CD1-CG 3.87Å; I109-L478 HydrophobicContact CG1-CD2 3.77Å; I109-L478 HydrophobicContact CG1-CG 4.37Å; I109-T481 HydrophobicContact CD1-CG2 3.69Å; I109-T481 HydrophobicContact CG1-CG2 4.25Å
110	K	93.1	Very high	89.6	Confident	141 Å²	141	59.4 Å²	59.4	61%	0.613	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.4	138.4	167.2	-62.5	-180	-177.8	177.5	0	110	Y97 K98	Y97-K110 CarbonylContact C-O 3.45Å; Y97-K110 WeakPolarHBondContact CA-O 3.45Å; K98-K110 HydrophobicContact CG-CB 4.48Å; K98-K110 PolarHBondContact N-O 3.07Å; K98-K110 PolarHBondContact O-N 3.19Å
111	Q	95.5	Very high	89.9	Confident	28 Å²	28	56.1 Å²	56.1	13%	0.131	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	141.8	167.7	-170.4	178	-37.1	0	0	110	Y97 G113 A468 D469	Y97-Q111 HydrophobicContact CD1-CB 4.11Å; Y97-Q111 HydrophobicContact CD1-CG 4.43Å; Y97-Q111 HydrophobicContact CE1-CB 3.89Å; Y97-Q111 HydrophobicContact CE1-CG 4.03Å; Q111-G113 PolarHBondContact NE2-O 2.89Å; Q111-A468 HydrophobicContact CB-CB 4.32Å; Q111-D469 PolarHBondContact NE2-OD2 2.87Å
112	V	95.6	Very high	90.6	Very high	27 Å²	27	55.6 Å²	55.6	16%	0.164	30%	0.296	C	S	.	.			trans	-110.2	105.5	179.3	-176.7	0	0	0	0	109.1	L96 K98 L146	L96-V112 HydrophobicContact CB-CB 4.27Å; L96-V112 HydrophobicContact CD2-CB 3.8Å; L96-V112 HydrophobicContact CD2-CG1 3.82Å; L96-V112 HydrophobicContact CD2-CG2 4.37Å; L96-V112 HydrophobicContact CG-CB 3.89Å; L96-V112 HydrophobicContact CG-CG1 4.47Å; L96-V112 HydrophobicContact CG-CG2 4.24Å; L96-V112 PolarHBondContact O-N 3.42Å; K98-V112 HydrophobicContact CB-CG2 3.77Å; K98-V112 HydrophobicContact CD-CG2 3.61Å; K98-V112 HydrophobicContact CG-CG2 3.47Å; K98-V112 VanDerWaalsContact CG-CG2 3.47Å; V112-L146 HydrophobicContact CG1-CB 4.5Å
113	G	91.2	Very high	91.2	Very high	53 Å²	53	54 Å²	54	55%	0.546	29%	0.294	S	S	.	.	S	Bend	trans	67	-170.6	-178.6	0	0	0	0	0	113.2	Q111	Q111-G113 PolarHBondContact NE2-O 2.89Å
114	S	90.6	Very high	91.8	Very high	99 Å²	99	56 Å²	56	69%	0.692	31%	0.31	S	S	*	.	P	Polyproline II helix	trans	-77.2	152	171.8	-56.7	0	0	0	0	110.6
115	Y	93.4	Very high	92.7	Very high	74 Å²	74	52.6 Å²	52.6	29%	0.29	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-65.7	155.8	170.1	73.4	-85.2	0	0	0	111	V94 F95 D117	V94-Y115 WeakPolarHBondContact O-CA 3.36Å; V94-Y115 WeakPolarHBondContact O-CB 3.21Å; F95-Y115 HydrophobicContact CD1-CG 4.37Å; F95-Y115 VanDerWaalsContact CE1-CB 3.49Å; F95-Y115 AromaticContact CE1-CD1 3.85Å; F95-Y115 HydrophobicContact CE1-CD1 3.85Å; F95-Y115 AromaticContact CE1-CG 3.76Å; F95-Y115 HydrophobicContact CE1-CG 3.76Å; F95-Y115 HydrophobicContact CE2-CD2 4.5Å; F95-Y115 HydrophobicContact CE2-CG 4.34Å; F95-Y115 HydrophobicContact CZ-CD1 4.05Å; F95-Y115 HydrophobicContact CZ-CD2 4.16Å; F95-Y115 AromaticContact CZ-CG 3.73Å; F95-Y115 HydrophobicContact CZ-CG 3.73Å; Y115-D117 HydrophobicContact CD2-CB 4.38Å; Y115-D117 HydrophobicContact CE2-CB 3.78Å
116	C	96.8	Very high	93.3	Very high	24 Å²	24	47.7 Å²	47.7	16%	0.162	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	120.9	171.4	-174.1	0	0	0	0	109.2	G93 V94 C139	G93-C116 WeakPolarHBondContact CA-O 3.4Å; V94-C116 HydrophobicContact CB-CB 4.34Å; V94-C116 PolarHBondContact N-O 2.84Å; V94-C116 PolarHBondContact O-N 3.43Å; C116-C139 HydrophobicContact CB-CB 3.63Å; C116-C139 WeakPolarHBondContact CB-SG 3.44Å; C116-C139 WeakPolarHBondContact SG-CA 3.38Å; C116-C139 WeakPolarHBondContact SG-CB 3.47Å; C116-C139 CovalentContact SG-SG 2.04Å; C116-C139 PolarHBondContact SG-SG 3.46Å
117	D	95.4	Very high	93.8	Very high	76 Å²	76	54.4 Å²	54.4	41%	0.406	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	137.5	-179.1	-167.1	55.5	0	0	0	111.5	H91 Y115	H91-D117 IonicContact CE1-OD1 3.72Å; H91-D117 PolarHBondContact CE1-OD1 3.22Å; H91-D117 IonicContact CG-OD1 3.11Å; H91-D117 IonicContact ND1-OD1 2.67Å; H91-D117 PolarHBondContact ND1-OD1 3.41Å; Y115-D117 HydrophobicContact CD2-CB 4.38Å; Y115-D117 HydrophobicContact CE2-CB 3.78Å
118	V	95.5	Very high	94.3	Very high	16 Å²	16	60.1 Å²	60.1	10%	0.097	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	108.5	171.7	179.8	0	0	0	0	106.2	H91 S92 D120 L136 C139	H91-V118 WeakPolarHBondContact CB-O 3.32Å; S92-V118 PolarHBondContact N-O 3.29Å; S92-V118 PolarHBondContact O-N 3.42Å; V118-D120 PolarHBondContact O-N 2.88Å; V118-D120 VanDerWaalsContact O-N 3.15Å; V118-L136 HydrophobicContact CG2-CD2 4.3Å; V118-C139 HydrophobicContact CG2-CB 4.28Å; V118-C139 VanDerWaalsContact CG2-SG 3.54Å
119	E	89.4	Confident	94.7	Very high	164 Å²	164	58.2 Å²	58.2	77%	0.766	32%	0.32	S	S	*	.	S	Bend	trans	-55.3	-38.1	-168	-64.6	-175.7	169.1	0	0	113.1	S90 H91	S90-E119 VanDerWaalsContact O-O 3.07Å; H91-E119 WeakPolarHBondContact CA-O 3.31Å; H91-E119 WeakPolarHBondContact CB-O 3.44Å
120	D	93.3	Very high	94.8	Very high	85 Å²	85	63.1 Å²	63.1	46%	0.455	34%	0.343	S	S	.	.	S	Bend	trans	-83.2	135.4	-178.8	-73.4	-41.3	0	0	0	113.1	S92 V118 Y125	S92-D120 PolarHBondContact OG-O 3.37Å; V118-D120 PolarHBondContact O-N 2.88Å; V118-D120 VanDerWaalsContact O-N 3.15Å; D120-Y125 HydrophobicContact CB-CE2 3.95Å
121	S	94.7	Very high	95	Very high	14 Å²	14	59.7 Å²	59.7	10%	0.098	33%	0.331	C	S	.	.			trans	-70.3	148.5	166.5	66.7	0	0	0	0	111.1	G88 S123 S124	G88-S121 VanDerWaalsContact O-CB 3.26Å; G88-S121 WeakPolarHBondContact O-CB 3.5Å; S121-S123 PolarHBondContact O-N 3.12Å; S121-S123 VanDerWaalsContact O-N 3.14Å; S121-S123 PolarHBondContact OG-OG 3.13Å; S121-S123 VanDerWaalsContact OG-OG 3.05Å; S121-S124 VanDerWaalsContact O-CB 3.3Å; S121-S124 WeakPolarHBondContact O-CB 3.29Å; S121-S124 PolarHBondContact O-N 3.35Å; S121-S124 PolarHBondContact O-OG 3.44Å
122	L	97.8	Very high	95.1	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-57.5	-31.9	175	-69	-168	0	0	0	113	A87 S124 Y125 A132 L159 M165 I179 V183	A87-L122 HydrophobicContact CB-CB 4.4Å; A87-L122 HydrophobicContact CB-CD1 3.39Å; A87-L122 HydrophobicContact CB-CG 3.65Å; L122-S124 PolarHBondContact O-N 3.26Å; L122-Y125 PolarHBondContact O-N 2.8Å; L122-A132 HydrophobicContact CD2-CB 4.37Å; L122-L159 HydrophobicContact CD1-CD1 4.22Å; L122-L159 HydrophobicContact CD1-CD2 4.29Å; L122-M165 HydrophobicContact CB-CG 4.12Å; L122-M165 HydrophobicContact CB-SD 3.93Å; L122-I179 HydrophobicContact CB-CG2 4.29Å; L122-V183 HydrophobicContact CD1-CG2 4.12Å; L122-V183 HydrophobicContact CD2-CG2 4.4Å
123	S	95.9	Very high	95.2	Very high	27 Å²	27	57.1 Å²	57.1	19%	0.189	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-66.4	-18	178.1	43.9	0	0	0	0	114.3	S121 Y125	S121-S123 PolarHBondContact O-N 3.12Å; S121-S123 VanDerWaalsContact O-N 3.14Å; S121-S123 PolarHBondContact OG-OG 3.13Å; S121-S123 VanDerWaalsContact OG-OG 3.05Å; S123-Y125 PolarHBondContact O-N 2.91Å
124	S	95	Very high	95.5	Very high	61 Å²	61	59.8 Å²	59.8	43%	0.427	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-67.9	-25	175.2	71.4	0	0	0	0	112.6	S121 L122 A126	S121-S124 VanDerWaalsContact O-CB 3.3Å; S121-S124 WeakPolarHBondContact O-CB 3.29Å; S121-S124 PolarHBondContact O-N 3.35Å; S121-S124 PolarHBondContact O-OG 3.44Å; L122-S124 PolarHBondContact O-N 3.26Å; S124-A126 PolarHBondContact O-N 3.21Å
125	Y	97.5	Very high	95.9	Very high	33 Å²	33	56.1 Å²	56.1	13%	0.129	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-81.5	15.8	-179.4	-63.7	-80.3	0	0	0	113.9	D120 L122 S123 N127 K128 P129 D131 A132 S135	D120-Y125 HydrophobicContact CB-CE2 3.95Å; L122-Y125 PolarHBondContact O-N 2.8Å; S123-Y125 PolarHBondContact O-N 2.91Å; Y125-N127 PolarHBondContact O-N 3.3Å; Y125-K128 CarbonylContact O-C 3.41Å; Y125-K128 PolarHBondContact O-N 3.24Å; Y125-P129 WeakPolarHBondContact O-CA 3.42Å; Y125-P129 VanDerWaalsContact O-N 3.09Å; Y125-D131 HydrophobicContact CD1-CB 3.65Å; Y125-D131 HydrophobicContact CE1-CB 3.64Å; Y125-A132 HydrophobicContact CD2-CB 4.02Å; Y125-A132 HydrophobicContact CG-CB 3.9Å; Y125-S135 VanDerWaalsContact OH-CB 3.28Å; Y125-S135 WeakPolarHBondContact OH-CB 3.44Å
126	A	95.4	Very high	96.1	Very high	16 Å²	16	52.6 Å²	52.6	13%	0.132	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-52.7	-33.5	-179.5	0	0	0	0	0	113.5	S124 L168 A175	S124-A126 PolarHBondContact O-N 3.21Å; A126-L168 HydrophobicContact CB-CD1 3.79Å; A126-L168 HydrophobicContact CB-CD2 4.21Å; A126-A175 HydrophobicContact CB-CB 4.46Å
127	N	95.9	Very high	96.2	Very high	143 Å²	143	53.3 Å²	53.3	77%	0.765	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-95.6	-8.7	178.9	-63.8	-34	0	0	0	114.1	Y125	Y125-N127 PolarHBondContact O-N 3.3Å
128	K	97	Very high	96.3	Very high	121 Å²	121	54 Å²	54	53%	0.526	29%	0.288	S	S	.	.			trans	-141.2	63.8	177.3	-62.3	-175.7	-178.1	179.4	0	111.4	Y125 E130 D131	Y125-K128 CarbonylContact O-C 3.41Å; Y125-K128 PolarHBondContact O-N 3.24Å; K128-E130 PolarHBondContact O-N 2.83Å; K128-E130 VanDerWaalsContact O-N 3.08Å; K128-D131 WeakPolarHBondContact CD-OD2 3.41Å; K128-D131 PolarHBondContact O-N 3.32Å; K128-D131 VanDerWaalsContact O-N 3.15Å
129	P	97.2	Very high	96.4	Very high	17 Å²	17	53.5 Å²	53.5	11%	0.11	29%	0.285	C	S	.	.	H	α-helix	trans	-58.4	-24.4	-173.7	-27.1	37.7	0	0	0	114.9	Y125 D131 A132 R178 I179 N182	Y125-P129 WeakPolarHBondContact O-CA 3.42Å; Y125-P129 VanDerWaalsContact O-N 3.09Å; P129-D131 VanDerWaalsContact C-N 3.29Å; P129-D131 PolarHBondContact O-N 3.41Å; P129-A132 WeakPolarHBondContact O-CB 3.31Å; P129-A132 PolarHBondContact O-N 3.41Å; P129-R178 HydrophobicContact CB-CB 3.73Å; P129-R178 HydrophobicContact CG-CB 3.93Å; P129-I179 HydrophobicContact CB-CG1 3.82Å; P129-I179 HydrophobicContact CG-CG1 4.28Å; P129-N182 WeakPolarHBondContact O-CB 3.35Å; P129-N182 VanDerWaalsContact O-CG 3.25Å; P129-N182 PolarHBondContact O-OD1 2.78Å
130	E	94.7	Very high	96.8	Very high	107 Å²	107	45.7 Å²	45.7	50%	0.5	25%	0.249	S	C	.	.	H	α-helix	trans	-64.6	-28.6	178.6	61.8	-79.2	-175.8	0	0	114.1	K128 N182	K128-E130 PolarHBondContact O-N 2.83Å; K128-E130 VanDerWaalsContact O-N 3.08Å; E130-N182 WeakPolarHBondContact CA-ND2 3.41Å; E130-N182 PolarHBondContact O-ND2 2.73Å; E130-N182 PolarHBondContact O-OD1 3.38Å
131	D	97.4	Very high	97	Very high	69 Å²	69	43.8 Å²	43.8	37%	0.369	25%	0.245	S	C	.	.	H	α-helix	trans	-83.8	-15.6	-178.6	-66.5	-21.7	0	0	0	112	Y125 K128 P129 E134 S135	Y125-D131 HydrophobicContact CD1-CB 3.65Å; Y125-D131 HydrophobicContact CE1-CB 3.64Å; K128-D131 WeakPolarHBondContact CD-OD2 3.41Å; K128-D131 PolarHBondContact O-N 3.32Å; K128-D131 VanDerWaalsContact O-N 3.15Å; P129-D131 VanDerWaalsContact C-N 3.29Å; P129-D131 PolarHBondContact O-N 3.41Å; D131-E134 PolarHBondContact O-N 3.09Å; D131-S135 PolarHBondContact O-N 2.95Å
132	A	98	Very high	97	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-63.7	-49.2	-170.9	0	0	0	0	0	112.8	L122 Y125 P129 S135 I179 V183	L122-A132 HydrophobicContact CD2-CB 4.37Å; Y125-A132 HydrophobicContact CD2-CB 4.02Å; Y125-A132 HydrophobicContact CG-CB 3.9Å; P129-A132 WeakPolarHBondContact O-CB 3.31Å; P129-A132 PolarHBondContact O-N 3.41Å; A132-S135 PolarHBondContact O-OG 2.91Å; A132-I179 HydrophobicContact CB-CB 4.48Å; A132-I179 HydrophobicContact CB-CG1 4.38Å; A132-I179 HydrophobicContact CB-CG2 3.81Å; A132-V183 HydrophobicContact CB-CG2 4.15Å
133	G	97.9	Very high	96.9	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-69.9	-40.3	176.5	0	0	0	0	0	112.3	S135 L136 N182 V186	G133-S135 PolarHBondContact O-N 3.27Å; G133-L136 WeakPolarHBondContact O-CB 3.45Å; G133-L136 PolarHBondContact O-N 2.89Å; G133-L136 VanDerWaalsContact O-N 3.09Å; G133-N182 VanDerWaalsContact CA-OD1 3.32Å; G133-N182 WeakPolarHBondContact CA-OD1 3.49Å; G133-N182 PolarHBondContact N-OD1 2.81Å; G133-V186 WeakPolarHBondContact O-CG1 3.47Å
134	E	97.5	Very high	96.9	Very high	109 Å²	109	46.6 Å²	46.6	51%	0.509	26%	0.258	S	S	.	.	H	α-helix	trans	-61.5	-33.2	179	-69.3	-59.1	148.4	0	0	112.2	D131 L136 V137 V186	D131-E134 PolarHBondContact O-N 3.09Å; E134-L136 PolarHBondContact O-N 3.47Å; E134-L136 VanDerWaalsContact O-N 3.08Å; E134-V137 WeakPolarHBondContact O-CB 3.49Å; E134-V137 PolarHBondContact O-N 3.43Å; E134-V137 VanDerWaalsContact O-N 3.09Å; E134-V186 HydrophobicContact CG-CG2 4.46Å
135	S	97.8	Very high	97	Very high	23 Å²	23	48.3 Å²	48.3	16%	0.161	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-24.6	175.1	78.7	0	0	0	0	114	Y125 D131 A132 G133	Y125-S135 VanDerWaalsContact OH-CB 3.28Å; Y125-S135 WeakPolarHBondContact OH-CB 3.44Å; D131-S135 PolarHBondContact O-N 2.95Å; A132-S135 PolarHBondContact O-OG 2.91Å; G133-S135 PolarHBondContact O-N 3.27Å
136	L	98.3	Very high	96.9	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-17.6	-177.9	-56	173.9	0	0	0	112.9	I85 V118 G133 E134 C139 L140 L159 V183 L187	I85-L136 HydrophobicContact CD1-CD1 4.07Å; I85-L136 HydrophobicContact CG2-CD1 4.47Å; I85-L136 HydrophobicContact CG2-CD2 4.13Å; V118-L136 HydrophobicContact CG2-CD2 4.3Å; G133-L136 WeakPolarHBondContact O-CB 3.45Å; G133-L136 PolarHBondContact O-N 2.89Å; G133-L136 VanDerWaalsContact O-N 3.09Å; E134-L136 PolarHBondContact O-N 3.47Å; E134-L136 VanDerWaalsContact O-N 3.08Å; L136-C139 PolarHBondContact O-N 3.48Å; L136-L140 HydrophobicContact CB-CD1 4.27Å; L136-L140 WeakPolarHBondContact O-CG 3.34Å; L136-L140 PolarHBondContact O-N 2.97Å; L136-L159 HydrophobicContact CD1-CD1 3.62Å; L136-V183 HydrophobicContact CD1-CG1 4.39Å; L136-L187 HydrophobicContact CD1-CD2 4.34Å
137	V	97.9	Very high	97	Very high	38 Å²	38	49.8 Å²	49.8	23%	0.23	27%	0.273	C	S	.	.	H	α-helix	trans	-61	-44.3	-173.3	176	0	0	0	0	112.8	E134 C139 L140 A141 V186	E134-V137 WeakPolarHBondContact O-CB 3.49Å; E134-V137 PolarHBondContact O-N 3.43Å; E134-V137 VanDerWaalsContact O-N 3.09Å; V137-C139 VanDerWaalsContact C-N 3.31Å; V137-C139 PolarHBondContact O-N 2.91Å; V137-L140 PolarHBondContact O-N 3.05Å; V137-A141 WeakPolarHBondContact O-CB 3.39Å; V137-A141 PolarHBondContact O-N 3.32Å; V137-V186 HydrophobicContact CG2-CG1 3.61Å
138	P	97.5	Very high	97	Very high	90 Å²	90	45.6 Å²	45.6	58%	0.584	25%	0.254	S	S	*	.	H	α-helix	trans	-58.3	-42.1	178.1	-25.6	35.8	0	0	0	112.9	A141 N142	P138-A141 PolarHBondContact O-N 3.23Å; P138-N142 PolarHBondContact O-N 3.3Å
139	C	98	Very high	97	Very high	6 Å²	6	43 Å²	43	4%	0.041	25%	0.251	C	S	.	.	H	α-helix	trans	-68.3	-41	177.3	-83	0	0	0	0	112.2	V94 C116 V118 L136 V137 A141 N142 I143	V94-C139 HydrophobicContact CB-CB 4.12Å; V94-C139 HydrophobicContact CG2-CB 3.57Å; C116-C139 HydrophobicContact CB-CB 3.63Å; C116-C139 WeakPolarHBondContact CB-SG 3.44Å; C116-C139 WeakPolarHBondContact SG-CA 3.38Å; C116-C139 WeakPolarHBondContact SG-CB 3.47Å; C116-C139 CovalentContact SG-SG 2.04Å; C116-C139 PolarHBondContact SG-SG 3.46Å; V118-C139 HydrophobicContact CG2-CB 4.28Å; V118-C139 VanDerWaalsContact CG2-SG 3.54Å; L136-C139 PolarHBondContact O-N 3.48Å; V137-C139 VanDerWaalsContact C-N 3.31Å; V137-C139 PolarHBondContact O-N 2.91Å; C139-A141 VanDerWaalsContact C-N 3.32Å; C139-A141 PolarHBondContact O-N 3.12Å; C139-N142 PolarHBondContact O-N 3.25Å; C139-I143 WeakPolarHBondContact O-CB 3.4Å; C139-I143 VanDerWaalsContact O-CG1 3.31Å; C139-I143 WeakPolarHBondContact O-CG1 3.39Å; C139-I143 PolarHBondContact O-N 3.02Å
140	L	97.9	Very high	96.8	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-64.7	-37.2	176.4	-70.1	167.7	0	0	0	112.2	I83 I85 V94 L136 V137 S144 L157 L187 Q190 F192	I83-L140 HydrophobicContact CG2-CD2 4.24Å; I85-L140 HydrophobicContact CD1-CD1 4.3Å; I85-L140 HydrophobicContact CD1-CD2 4.2Å; V94-L140 HydrophobicContact CG1-CD2 4.04Å; L136-L140 HydrophobicContact CB-CD1 4.27Å; L136-L140 WeakPolarHBondContact O-CG 3.34Å; L136-L140 PolarHBondContact O-N 2.97Å; V137-L140 PolarHBondContact O-N 3.05Å; L140-S144 WeakPolarHBondContact O-CB 3.47Å; L140-S144 PolarHBondContact O-N 2.69Å; L140-L157 HydrophobicContact CD2-CD1 3.92Å; L140-L187 HydrophobicContact CD1-CD2 3.48Å; L140-L187 VanDerWaalsContact CD1-CD2 3.48Å; L140-Q190 HydrophobicContact CD1-CG 3.95Å; L140-F192 HydrophobicContact CD2-CD2 4.36Å; L140-F192 HydrophobicContact CD2-CE2 4.24Å
141	A	97	Very high	96.8	Very high	46 Å²	46	47.1 Å²	47.1	38%	0.38	27%	0.266	S	S	.	.	H	α-helix	trans	-62.5	-45.6	172.7	0	0	0	0	0	111.4	V137 P138 C139 S144	V137-A141 WeakPolarHBondContact O-CB 3.39Å; V137-A141 PolarHBondContact O-N 3.32Å; P138-A141 PolarHBondContact O-N 3.23Å; C139-A141 VanDerWaalsContact C-N 3.32Å; C139-A141 PolarHBondContact O-N 3.12Å; A141-S144 WeakPolarHBondContact O-CB 3.36Å; A141-S144 PolarHBondContact O-N 2.99Å; A141-S144 PolarHBondContact O-OG 3.03Å
142	N	95.9	Very high	96.8	Very high	89 Å²	89	46.3 Å²	46.3	48%	0.476	26%	0.258	S	S	.	.	H	α-helix	trans	-59.7	-52.2	175.2	-174.8	-5.3	0	0	0	111.4	P138 C139 S144 T145	P138-N142 PolarHBondContact O-N 3.3Å; C139-N142 PolarHBondContact O-N 3.25Å; N142-S144 PolarHBondContact O-N 2.75Å; N142-T145 WeakPolarHBondContact O-CB 3.46Å; N142-T145 WeakPolarHBondContact O-CG2 3.43Å; N142-T145 PolarHBondContact O-N 3.11Å; N142-T145 PolarHBondContact O-OG1 3.38Å
143	I	96.1	Very high	96.8	Very high	3 Å²	3	50.3 Å²	50.3	2%	0.015	28%	0.284	C	S	.	.	H	α-helix	trans	-57.1	-35.3	178.4	-70	-60	0	0	0	112.1	I83 V94 L96 C139 T145 L146 F192	I83-I143 HydrophobicContact CD1-CG2 3.76Å; I83-I143 HydrophobicContact CG1-CG2 4.03Å; V94-I143 HydrophobicContact CB-CG1 4.43Å; V94-I143 HydrophobicContact CG1-CG1 3.82Å; L96-I143 HydrophobicContact CB-CD1 4.11Å; L96-I143 HydrophobicContact CB-CG2 4.04Å; L96-I143 HydrophobicContact CD1-CG2 4.08Å; L96-I143 HydrophobicContact CD2-CG2 4.18Å; L96-I143 HydrophobicContact CG-CG2 4.32Å; C139-I143 WeakPolarHBondContact O-CB 3.4Å; C139-I143 VanDerWaalsContact O-CG1 3.31Å; C139-I143 WeakPolarHBondContact O-CG1 3.39Å; C139-I143 PolarHBondContact O-N 3.02Å; I143-T145 PolarHBondContact O-N 2.85Å; I143-T145 VanDerWaalsContact O-N 3.16Å; I143-L146 HydrophobicContact CD1-CD1 4.34Å; I143-L146 WeakPolarHBondContact O-CB 3.46Å; I143-L146 PolarHBondContact O-N 2.75Å; I143-F192 HydrophobicContact CG2-CZ 4.25Å
144	S	95.9	Very high	96.6	Very high	8 Å²	8	55.3 Å²	55.3	6%	0.056	31%	0.31	C	S	.	.	H	α-helix	trans	-60.7	-25.1	177.5	83.4	0	0	0	0	114	L140 A141 N142 L146 V147 R152 M191	L140-S144 WeakPolarHBondContact O-CB 3.47Å; L140-S144 PolarHBondContact O-N 2.69Å; A141-S144 WeakPolarHBondContact O-CB 3.36Å; A141-S144 PolarHBondContact O-N 2.99Å; A141-S144 PolarHBondContact O-OG 3.03Å; N142-S144 PolarHBondContact O-N 2.75Å; S144-L146 VanDerWaalsContact C-N 3.25Å; S144-L146 PolarHBondContact O-N 2.68Å; S144-V147 PolarHBondContact O-N 2.97Å; S144-R152 VanDerWaalsContact O-CZ 3.23Å; S144-R152 PolarHBondContact O-NE 3.44Å; S144-R152 PolarHBondContact O-NH2 3.45Å; S144-M191 VanDerWaalsContact CB-CE 3.42Å; S144-M191 VanDerWaalsContact OG-CE 3.29Å; S144-M191 WeakPolarHBondContact OG-CE 3.47Å
145	T	95.9	Very high	96.6	Very high	96 Å²	96	50.2 Å²	50.2	59%	0.589	29%	0.287	S	S	*	.	H	α-helix	trans	-69.7	-25.3	176.7	72.2	0	0	0	0	112.4	N142 I143	N142-T145 WeakPolarHBondContact O-CB 3.46Å; N142-T145 WeakPolarHBondContact O-CG2 3.43Å; N142-T145 PolarHBondContact O-N 3.11Å; N142-T145 PolarHBondContact O-OG1 3.38Å; I143-T145 PolarHBondContact O-N 2.85Å; I143-T145 VanDerWaalsContact O-N 3.16Å
146	L	96.6	Very high	96.6	Very high	78 Å²	78	49.2 Å²	49.2	41%	0.408	28%	0.28	S	S	.	.	H	α-helix	trans	-86.3	-11.3	178.6	-55.2	178.5	0	0	0	112.9	L96 V112 I143 S144	L96-L146 HydrophobicContact CD2-CB 3.67Å; L96-L146 HydrophobicContact CD2-CD1 4.28Å; V112-L146 HydrophobicContact CG1-CB 4.5Å; I143-L146 HydrophobicContact CD1-CD1 4.34Å; I143-L146 WeakPolarHBondContact O-CB 3.46Å; I143-L146 PolarHBondContact O-N 2.75Å; S144-L146 VanDerWaalsContact C-N 3.25Å; S144-L146 PolarHBondContact O-N 2.68Å
147	V	97.3	Very high	96.6	Very high	2 Å²	2	49.2 Å²	49.2	1%	0.012	28%	0.28	C	S	.	.	S	Bend	trans	-106.8	125.1	-179.7	-176.7	0	0	0	0	109.9	Y81 L96 S144 S149 R151 R152 F192	Y81-V147 HydrophobicContact CD1-CG1 4.35Å; Y81-V147 HydrophobicContact CD1-CG2 4Å; Y81-V147 HydrophobicContact CD2-CG1 4.18Å; Y81-V147 HydrophobicContact CE1-CG2 4.47Å; Y81-V147 HydrophobicContact CG-CG1 4.07Å; Y81-V147 HydrophobicContact CG-CG2 4.37Å; L96-V147 HydrophobicContact CD1-CG2 3.68Å; L96-V147 HydrophobicContact CD2-CG2 3.72Å; L96-V147 HydrophobicContact CG-CG2 4.38Å; S144-V147 PolarHBondContact O-N 2.97Å; V147-S149 PolarHBondContact O-N 3.16Å; V147-R151 HydrophobicContact CG1-CB 3.96Å; V147-R152 HydrophobicContact CB-CG 4.08Å; V147-R152 HydrophobicContact CG1-CG 3.82Å; V147-R152 PolarHBondContact O-NE 2.87Å; V147-R152 PolarHBondContact O-NH2 2.64Å; V147-F192 HydrophobicContact CB-CE1 4.33Å; V147-F192 HydrophobicContact CG1-CE1 4.48Å; V147-F192 HydrophobicContact CG2-CE1 4.21Å
148	P	96.1	Very high	96.7	Very high	55 Å²	55	48.4 Å²	48.4	36%	0.357	27%	0.273	S	S	.	.			trans	-52.7	137.4	175.3	-26.1	34.2	0	0	0	111.7	Y81 Q150 R151 R152	Y81-P148 HydrophobicContact CE2-CG 4.39Å; Y81-P148 VanDerWaalsContact OH-CD 3.31Å; Y81-P148 WeakPolarHBondContact OH-CD 3.18Å; P148-Q150 PolarHBondContact O-N 3.03Å; P148-Q150 VanDerWaalsContact O-N 3.09Å; P148-R151 HydrophobicContact CB-CB 4.32Å; P148-R151 HydrophobicContact CB-CG 4.12Å; P148-R151 HydrophobicContact CG-CG 4.38Å; P148-R151 WeakPolarHBondContact O-CA 3.44Å; P148-R151 WeakPolarHBondContact O-CB 3.46Å; P148-R151 PolarHBondContact O-N 3.43Å; P148-R152 PolarHBondContact O-N 2.97Å
149	S	96.3	Very high	96.7	Very high	67 Å²	67	44.1 Å²	44.1	47%	0.469	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-36.6	-171.5	-65	0	0	0	0	113.3	V147 R151 R152	V147-S149 PolarHBondContact O-N 3.16Å; S149-R151 VanDerWaalsContact C-N 3.27Å; S149-R151 PolarHBondContact O-N 3.43Å; S149-R152 PolarHBondContact O-N 3.18Å
150	Q	93.1	Very high	96.8	Very high	154 Å²	154	43.8 Å²	43.8	72%	0.72	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-22.4	178.2	-58.6	76.3	14.5	0	0	112.7	P148	P148-Q150 PolarHBondContact O-N 3.03Å; P148-Q150 VanDerWaalsContact O-N 3.09Å
151	R	94.9	Very high	96.8	Very high	57 Å²	57	43.8 Å²	43.8	22%	0.215	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89	-22.2	179.5	-66.7	-72.8	166.5	-159.7	-12.8	112.9	D79 Y81 V147 P148 S149 L154 S155 E487	D79-R151 WeakPolarHBondContact O-CD 3.24Å; Y81-R151 HydrophobicContact CD2-CB 3.97Å; Y81-R151 HydrophobicContact CD2-CG 4.28Å; Y81-R151 HydrophobicContact CE2-CB 4.09Å; Y81-R151 HydrophobicContact CE2-CG 4.03Å; V147-R151 HydrophobicContact CG1-CB 3.96Å; P148-R151 HydrophobicContact CB-CB 4.32Å; P148-R151 HydrophobicContact CB-CG 4.12Å; P148-R151 HydrophobicContact CG-CG 4.38Å; P148-R151 WeakPolarHBondContact O-CA 3.44Å; P148-R151 WeakPolarHBondContact O-CB 3.46Å; P148-R151 PolarHBondContact O-N 3.43Å; S149-R151 VanDerWaalsContact C-N 3.27Å; S149-R151 PolarHBondContact O-N 3.43Å; R151-L154 PolarHBondContact O-N 3.02Å; R151-L154 VanDerWaalsContact O-N 3.11Å; R151-S155 PolarHBondContact O-N 2.96Å; R151-S155 PolarHBondContact O-OG 3.05Å; R151-E487 IonicContact NH1-OE1 2.65Å; R151-E487 PolarHBondContact NH1-OE1 3.43Å
152	R	97.6	Very high	96.9	Very high	51 Å²	51	41.8 Å²	41.8	19%	0.192	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-55.7	-52.1	-175.3	-57	174.3	-173.2	162.3	-0.2	112.9	S144 V147 P148 S149 L154 S155 M191 F192	S144-R152 VanDerWaalsContact O-CZ 3.23Å; S144-R152 PolarHBondContact O-NE 3.44Å; S144-R152 PolarHBondContact O-NH2 3.45Å; V147-R152 HydrophobicContact CB-CG 4.08Å; V147-R152 HydrophobicContact CG1-CG 3.82Å; V147-R152 PolarHBondContact O-NE 2.87Å; V147-R152 PolarHBondContact O-NH2 2.64Å; P148-R152 PolarHBondContact O-N 2.97Å; S149-R152 PolarHBondContact O-N 3.18Å; R152-L154 PolarHBondContact O-N 3.25Å; R152-S155 WeakPolarHBondContact O-CB 3.31Å; R152-S155 PolarHBondContact O-N 2.87Å; R152-M191 CarbonylContact C-O 3.04Å; R152-M191 HydrophobicContact CB-CB 4.3Å; R152-M191 WeakPolarHBondContact CB-O 3.47Å; R152-F192 HydrophobicContact CB-CD1 4.07Å; R152-F192 HydrophobicContact CB-CE1 4.06Å; R152-F192 HydrophobicContact CG-CE1 4.08Å; R152-F192 WeakPolarHBondContact O-CA 3.44Å
153	P	96.4	Very high	96.9	Very high	85 Å²	85	37.6 Å²	37.6	55%	0.552	20%	0.204	S	C	*	.	G	3₁₀ helix	trans	-64.5	-17.2	-178.1	-21.2	34.7	0	0	0	114.3	M191 S193	P153-M191 WeakPolarHBondContact CA-O 3.36Å; P153-S193 WeakPolarHBondContact O-CB 3.28Å
154	L	94.8	Very high	97	Very high	105 Å²	105	37.7 Å²	37.7	55%	0.55	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-94.7	-21	177.7	-57.9	176.2	0	0	0	112.6	R151 R152 A156	R151-L154 PolarHBondContact O-N 3.02Å; R151-L154 VanDerWaalsContact O-N 3.11Å; R152-L154 PolarHBondContact O-N 3.25Å; L154-A156 PolarHBondContact O-N 3.31Å
155	S	97.5	Very high	97.1	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.014	20%	0.203	C	C	.	.	S	Bend	trans	-69.3	125.7	-175.2	-53.5	0	0	0	0	109.7	Y81 R151 R152 S193	Y81-S155 WeakPolarHBondContact CB-OG 3.49Å; Y81-S155 VanDerWaalsContact O-CA 3.31Å; Y81-S155 WeakPolarHBondContact O-CA 3.39Å; R151-S155 PolarHBondContact O-N 2.96Å; R151-S155 PolarHBondContact O-OG 3.05Å; R152-S155 WeakPolarHBondContact O-CB 3.31Å; R152-S155 PolarHBondContact O-N 2.87Å; S155-S193 WeakPolarHBondContact O-CA 3.34Å; S155-S193 WeakPolarHBondContact O-CB 3.43Å; S155-S193 PolarHBondContact O-N 3.37Å
156	A	98	Very high	97.2	Very high	2 Å²	2	34.3 Å²	34.3	2%	0.017	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	133.2	-175.5	0	0	0	0	0	110.9	Y81 G82 I83 L154 Y158 K195 L484	Y81-A156 PolarHBondContact O-N 2.97Å; Y81-A156 VanDerWaalsContact O-N 3.15Å; G82-A156 CarbonylContact C-O 3.45Å; G82-A156 WeakPolarHBondContact CA-O 3.31Å; I83-A156 PolarHBondContact N-O 3.47Å; L154-A156 PolarHBondContact O-N 3.31Å; A156-Y158 HydrophobicContact CB-CD2 4.29Å; A156-Y158 HydrophobicContact CB-CE2 3.54Å; A156-K195 HydrophobicContact CB-CG 3.82Å; A156-L484 HydrophobicContact CB-CD1 4Å; A156-L484 HydrophobicContact CB-CD2 4.16Å
157	L	98.7	Very high	97.2	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	120.6	178.9	173.7	61.9	0	0	0	110.5	I83 I85 L140 L187 Q190 F192 S193 K195	I83-L157 HydrophobicContact CB-CD1 3.84Å; I83-L157 HydrophobicContact CG2-CD1 3.59Å; I85-L157 HydrophobicContact CD1-CD1 4.1Å; I85-L157 HydrophobicContact CG1-CD1 4.29Å; L140-L157 HydrophobicContact CD2-CD1 3.92Å; L157-L187 HydrophobicContact CD2-CB 4.09Å; L157-L187 HydrophobicContact CD2-CD2 4.07Å; L157-Q190 HydrophobicContact CD2-CB 4.35Å; L157-F192 HydrophobicContact CB-CB 3.88Å; L157-F192 HydrophobicContact CD2-CB 4.13Å; L157-F192 HydrophobicContact CD2-CD2 4.43Å; L157-S193 PolarHBondContact N-O 3.39Å; L157-K195 PolarHBondContact O-N 3.23Å
158	Y	98.7	Very high	97.1	Very high	20 Å²	20	31.8 Å²	31.8	8%	0.078	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	147.7	178.2	-61.4	-90.6	0	0	0	110.8	I83 V84 I85 A156 K195 N196 Y476 M477 A480	I83-Y158 PolarHBondContact O-N 3.15Å; V84-Y158 WeakPolarHBondContact CA-O 3.41Å; I85-Y158 PolarHBondContact N-O 3.31Å; A156-Y158 HydrophobicContact CB-CD2 4.29Å; A156-Y158 HydrophobicContact CB-CE2 3.54Å; Y158-K195 HydrophobicContact CD1-CB 3.78Å; Y158-K195 HydrophobicContact CE1-CB 3.28Å; Y158-K195 HydrophobicContact CE1-CG 3.98Å; Y158-K195 HydrophobicContact CE2-CB 4.14Å; Y158-K195 HydrophobicContact CE2-CG 4Å; Y158-K195 HydrophobicContact CG-CB 4.39Å; Y158-K195 VanDerWaalsContact CZ-CB 3.48Å; Y158-N196 CarbonylContact C-O 3.52Å; Y158-N196 WeakPolarHBondContact CA-O 3.49Å; Y158-N196 HydrophobicContact CD1-CB 4.12Å; Y158-Y476 AromaticContact CD1-CE1 3.69Å; Y158-Y476 HydrophobicContact CD1-CE1 3.69Å; Y158-Y476 HydrophobicContact CD2-CE1 4.35Å; Y158-Y476 HydrophobicContact CE1-CE1 4.29Å; Y158-Y476 AromaticContact CG-CE1 3.73Å; Y158-Y476 HydrophobicContact CG-CE1 3.73Å; Y158-M477 HydrophobicContact CD2-SD 4.33Å; Y158-M477 HydrophobicContact CE2-CE 4.01Å; Y158-M477 HydrophobicContact CE2-SD 4.32Å; Y158-A480 HydrophobicContact CE2-CB 4.31Å
159	L	98.6	Very high	97.2	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	134.3	162.9	-179.5	145.8	0	0	0	109.5	I85 A87 L122 L136 A161 M180 V183 L187 N196 A197 S198	I85-L159 HydrophobicContact CB-CB 4.03Å; I85-L159 HydrophobicContact CB-CD1 3.86Å; I85-L159 HydrophobicContact CB-CG 3.96Å; I85-L159 HydrophobicContact CD1-CD1 4.1Å; I85-L159 HydrophobicContact CG2-CD1 3.7Å; I85-L159 HydrophobicContact CG2-CG 4.18Å; I85-L159 WeakPolarHBondContact O-CA 3.41Å; A87-L159 HydrophobicContact CB-CD2 4.28Å; A87-L159 HydrophobicContact CB-CG 4.46Å; L122-L159 HydrophobicContact CD1-CD1 4.22Å; L122-L159 HydrophobicContact CD1-CD2 4.29Å; L136-L159 HydrophobicContact CD1-CD1 3.62Å; L159-A161 HydrophobicContact CD2-CB 4.32Å; L159-M180 HydrophobicContact CD2-CE 3.92Å; L159-V183 HydrophobicContact CD1-CG1 3.66Å; L159-V183 HydrophobicContact CD2-CG1 4.26Å; L159-V183 HydrophobicContact CG-CG1 4.47Å; L159-L187 HydrophobicContact CB-CD1 3.8Å; L159-L187 HydrophobicContact CD1-CD1 4.13Å; L159-N196 PolarHBondContact N-O 2.96Å; L159-A197 HydrophobicContact CB-CB 3.95Å; L159-A197 HydrophobicContact CD2-CB 4.25Å; L159-A197 VanDerWaalsContact O-CA 3.29Å; L159-A197 WeakPolarHBondContact O-CA 3.34Å; L159-S198 PolarHBondContact O-N 3.12Å; L159-S198 VanDerWaalsContact O-N 3.16Å
160	A	98.7	Very high	97.2	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	118.8	171.1	0	0	0	0	0	109.5	I85 A87 S198 I200 W472 Y476	I85-A160 PolarHBondContact O-N 3.31Å; A87-A160 PolarHBondContact N-O 3.09Å; A160-S198 WeakPolarHBondContact CA-O 3.47Å; A160-I200 HydrophobicContact CB-CB 4.42Å; A160-I200 HydrophobicContact CB-CD1 4.06Å; A160-I200 HydrophobicContact CB-CG1 4.13Å; A160-I200 HydrophobicContact CB-CG2 3.46Å; A160-I200 VanDerWaalsContact CB-CG2 3.46Å; A160-W472 HydrophobicContact CB-CH2 3.17Å; A160-W472 HydrophobicContact CB-CZ2 3.99Å; A160-W472 HydrophobicContact CB-CZ3 3.63Å; A160-W472 WeakPolarHBondContact O-CZ2 3.37Å; A160-Y476 HydrophobicContact CB-CD2 4.5Å; A160-Y476 HydrophobicContact CB-CE2 4.13Å
161	A	98.6	Very high	97.2	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	135.9	178.4	0	0	0	0	0	110.7	A87 L159 M165 M180 S198 I199 I200	A87-A161 HydrophobicContact CB-CB 3.77Å; A87-A161 WeakPolarHBondContact O-CA 3.44Å; L159-A161 HydrophobicContact CD2-CB 4.32Å; A161-M165 HydrophobicContact CB-CB 3.74Å; A161-M165 HydrophobicContact CB-CG 3.63Å; A161-M180 HydrophobicContact CB-SD 4.3Å; A161-S198 PolarHBondContact N-O 2.82Å; A161-I199 HydrophobicContact CB-CG1 4.28Å; A161-I199 CarbonylContact O-C 3.5Å; A161-I199 WeakPolarHBondContact O-CA 3.46Å; A161-I200 PolarHBondContact O-N 3.38Å
162	T	98.1	Very high	97.2	Very high	4 Å²	4	32 Å²	32	3%	0.025	17%	0.169	C	C	.	.			trans	-102.4	-147.4	-170	65.5	0	0	0	0	111.3	A87 G88 G164 M165 R166 I200 E205 W472	A87-T162 PolarHBondContact O-N 2.88Å; A87-T162 PolarHBondContact O-OG1 3.29Å; G88-T162 WeakPolarHBondContact CA-OG1 3.28Å; T162-G164 VanDerWaalsContact C-N 3.28Å; T162-G164 PolarHBondContact O-N 3.32Å; T162-M165 PolarHBondContact O-N 3.34Å; T162-R166 PolarHBondContact O-N 3.26Å; T162-I200 HydrophobicContact CG2-CD1 4.37Å; T162-I200 HydrophobicContact CG2-CG1 4.47Å; T162-E205 WeakPolarHBondContact CB-OE1 3.32Å; T162-E205 HydrophobicContact CG2-CG 4.42Å; T162-W472 HydrophobicContact CG2-CZ2 4Å
163	A	97.4	Very high	97.2	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.008	19%	0.185	C	C	.	.	H	α-helix	trans	-56.8	-33.5	-171.3	0	0	0	0	0	114.5	M165 R166 L167 A248 S249 L283	A163-M165 PolarHBondContact O-N 3.44Å; A163-R166 PolarHBondContact O-N 2.8Å; A163-L167 WeakPolarHBondContact O-CG 3.31Å; A163-L167 PolarHBondContact O-N 3.01Å; A163-A248 HydrophobicContact CB-CB 3.53Å; A163-S249 WeakPolarHBondContact CB-OG 3.43Å; A163-L283 HydrophobicContact CB-CD1 3.76Å
164	G	96.6	Very high	97.3	Very high	5 Å²	5	35.8 Å²	35.8	5%	0.052	19%	0.192	C	C	.	.	H	α-helix	trans	-59.4	-45.7	179.1	0	0	0	0	0	112.5	T162 L167 L168	T162-G164 VanDerWaalsContact C-N 3.28Å; T162-G164 PolarHBondContact O-N 3.32Å; G164-L167 PolarHBondContact O-N 3.17Å; G164-L168 PolarHBondContact O-N 3.5Å
165	M	98.2	Very high	97.4	Very high	2 Å²	2	31.4 Å²	31.4	1%	0.01	17%	0.171	C	C	.	.	H	α-helix	trans	-73.8	-29.9	176	-73.5	-60.5	-68.9	0	0	113	L122 A161 T162 A163 L168 E169 S176 I179 M180 I199	L122-M165 HydrophobicContact CB-CG 4.12Å; L122-M165 HydrophobicContact CB-SD 3.93Å; A161-M165 HydrophobicContact CB-CB 3.74Å; A161-M165 HydrophobicContact CB-CG 3.63Å; T162-M165 PolarHBondContact O-N 3.34Å; A163-M165 PolarHBondContact O-N 3.44Å; M165-L168 HydrophobicContact CE-CD2 4.23Å; M165-L168 PolarHBondContact O-N 3.08Å; M165-L168 HydrophobicContact SD-CD2 3.9Å; M165-E169 WeakPolarHBondContact O-CB 3.19Å; M165-E169 PolarHBondContact O-N 2.86Å; M165-S176 WeakPolarHBondContact CE-OG 3.37Å; M165-I179 HydrophobicContact CE-CB 4.01Å; M165-I179 HydrophobicContact CE-CD1 4.33Å; M165-I179 HydrophobicContact CE-CG2 3.69Å; M165-I179 HydrophobicContact SD-CD1 4.43Å; M165-I179 HydrophobicContact SD-CG2 4.24Å; M165-M180 HydrophobicContact CE-CG 3.88Å; M165-M180 HydrophobicContact CE-SD 3.91Å; M165-I199 HydrophobicContact CB-CD1 4.02Å; M165-I199 HydrophobicContact CB-CG1 4.01Å; M165-I199 HydrophobicContact CB-CG2 4.33Å; M165-I199 HydrophobicContact CE-CD1 4.42Å
166	R	98	Very high	97.4	Very high	30 Å²	30	31.4 Å²	31.4	11%	0.113	17%	0.171	C	C	.	.	H	α-helix	trans	-62.1	-43.3	170.1	-68.8	-176.5	-88	146.6	-4.1	111.5	T162 A163 E169 L170 I199 I200 E205 S249 L283	T162-R166 PolarHBondContact O-N 3.26Å; A163-R166 PolarHBondContact O-N 2.8Å; R166-E169 PolarHBondContact O-N 2.67Å; R166-L170 WeakPolarHBondContact O-CG 3.27Å; R166-L170 PolarHBondContact O-N 3.09Å; R166-L170 VanDerWaalsContact O-N 3.12Å; R166-I199 HydrophobicContact CB-CG2 4.44Å; R166-I199 HydrophobicContact CG-CG2 3.42Å; R166-I199 VanDerWaalsContact CG-CG2 3.42Å; R166-I200 WeakPolarHBondContact CD-O 3.44Å; R166-I200 PolarHBondContact NE-O 3.16Å; R166-E205 IonicContact CZ-OE2 3.89Å; R166-E205 IonicContact NH2-OE2 2.68Å; R166-E205 PolarHBondContact NH2-OE2 2.95Å; R166-S249 PolarHBondContact NH2-OG 3.39Å; R166-L283 HydrophobicContact CB-CD1 4.43Å
167	L	96.3	Very high	97.5	Very high	14 Å²	14	35.3 Å²	35.3	7%	0.073	20%	0.197	C	C	.	.	H	α-helix	trans	-64.7	-41.8	175.3	-66.7	-178.2	0	0	0	111.7	A163 G164 L170 A171 A248 L283 E289 P330 C331	A163-L167 WeakPolarHBondContact O-CG 3.31Å; A163-L167 PolarHBondContact O-N 3.01Å; G164-L167 PolarHBondContact O-N 3.17Å; L167-L170 PolarHBondContact O-N 3.02Å; L167-A171 WeakPolarHBondContact O-CB 3.42Å; L167-A171 PolarHBondContact O-N 3.32Å; L167-A248 HydrophobicContact CD1-CB 3.58Å; L167-A248 HydrophobicContact CG-CB 4.42Å; L167-L283 HydrophobicContact CD2-CD1 3.85Å; L167-L283 HydrophobicContact CD2-CD2 3.93Å; L167-L283 HydrophobicContact CD2-CG 3.79Å; L167-L283 HydrophobicContact CG-CD1 4.11Å; L167-E289 HydrophobicContact CD1-CG 3.98Å; L167-P330 HydrophobicContact CB-CG 4.31Å; L167-P330 HydrophobicContact CD2-CG 3.54Å; L167-C331 WeakPolarHBondContact CD2-SG 3.47Å
168	L	96.7	Very high	97.5	Very high	14 Å²	14	43.4 Å²	43.4	7%	0.073	23%	0.228	C	C	.	.	H	α-helix	trans	-65.1	-38.7	175.5	-175.5	64.4	0	0	0	112.1	A126 G164 M165 L170 A171 Q172 I179	A126-L168 HydrophobicContact CB-CD1 3.79Å; A126-L168 HydrophobicContact CB-CD2 4.21Å; G164-L168 PolarHBondContact O-N 3.5Å; M165-L168 HydrophobicContact CE-CD2 4.23Å; M165-L168 PolarHBondContact O-N 3.08Å; M165-L168 HydrophobicContact SD-CD2 3.9Å; L168-L170 VanDerWaalsContact C-N 3.3Å; L168-L170 PolarHBondContact O-N 3.37Å; L168-A171 PolarHBondContact O-N 3.19Å; L168-Q172 HydrophobicContact CD1-CB 3.96Å; L168-Q172 HydrophobicContact CD1-CG 4.42Å; L168-Q172 CarbonylContact O-C 3.16Å; L168-Q172 VanDerWaalsContact O-C 3.25Å; L168-Q172 WeakPolarHBondContact O-CA 3.42Å; L168-Q172 PolarHBondContact O-N 3.35Å; L168-I179 HydrophobicContact CD2-CD1 3.45Å; L168-I179 VanDerWaalsContact CD2-CD1 3.45Å
169	E	97.5	Very high	97.5	Very high	98 Å²	98	42.5 Å²	42.5	46%	0.458	22%	0.224	S	C	.	.	H	α-helix	trans	-61.3	-39.6	175.9	-177.1	174.1	-124.9	0	0	111.7	M165 R166 P173 I199	M165-E169 WeakPolarHBondContact O-CB 3.19Å; M165-E169 PolarHBondContact O-N 2.86Å; R166-E169 PolarHBondContact O-N 2.67Å; E169-P173 WeakPolarHBondContact O-CA 3.3Å; E169-P173 WeakPolarHBondContact O-CD 3.31Å; E169-P173 WeakPolarHBondContact O-CG 3.39Å; E169-I199 HydrophobicContact CB-CD1 4.31Å
170	L	95.4	Very high	97.5	Very high	110 Å²	110	43.1 Å²	43.1	58%	0.576	23%	0.228	S	C	*	.	H	α-helix	trans	-68.9	-40.1	174.8	-68.2	172.1	0	0	0	112.7	R166 L167 L168 L283 P330	R166-L170 WeakPolarHBondContact O-CG 3.27Å; R166-L170 PolarHBondContact O-N 3.09Å; R166-L170 VanDerWaalsContact O-N 3.12Å; L167-L170 PolarHBondContact O-N 3.02Å; L168-L170 VanDerWaalsContact C-N 3.3Å; L168-L170 PolarHBondContact O-N 3.37Å; L170-L283 HydrophobicContact CD1-CD2 3.95Å; L170-P330 HydrophobicContact CB-CB 4.1Å; L170-P330 HydrophobicContact CB-CG 3.98Å; L170-P330 HydrophobicContact CD1-CB 4.38Å; L170-P330 HydrophobicContact CD1-CG 4.03Å
171	A	93.9	Very high	97.5	Very high	45 Å²	45	45.9 Å²	45.9	37%	0.372	25%	0.247	S	C	.	.	H	α-helix	trans	-83	-42	-175.4	0	0	0	0	0	113.5	L167 L168	L167-A171 WeakPolarHBondContact O-CB 3.42Å; L167-A171 PolarHBondContact O-N 3.32Å; L168-A171 PolarHBondContact O-N 3.19Å
172	Q	95.5	Very high	97.5	Very high	84 Å²	84	47.5 Å²	47.5	39%	0.393	26%	0.256	S	S	.	.			trans	-142.7	72.6	-174.4	-60.5	179.8	-69.8	0	0	110.4	L168 L174 A175 S176	L168-Q172 HydrophobicContact CD1-CB 3.96Å; L168-Q172 HydrophobicContact CD1-CG 4.42Å; L168-Q172 CarbonylContact O-C 3.16Å; L168-Q172 VanDerWaalsContact O-C 3.25Å; L168-Q172 WeakPolarHBondContact O-CA 3.42Å; L168-Q172 PolarHBondContact O-N 3.35Å; Q172-L174 VanDerWaalsContact C-N 3.25Å; Q172-L174 PolarHBondContact O-N 2.83Å; Q172-L174 VanDerWaalsContact O-N 3.11Å; Q172-A175 HydrophobicContact CB-CB 3.86Å; Q172-A175 PolarHBondContact O-N 3.21Å; Q172-S176 PolarHBondContact O-N 3.34Å; Q172-S176 VanDerWaalsContact O-N 3.09Å
173	P	97.1	Very high	97.5	Very high	81 Å²	81	47.3 Å²	47.3	53%	0.526	26%	0.255	S	S	.	.	H	α-helix	trans	-52.8	-39.6	-174.4	-22	24.9	0	0	0	114.1	E169 S176 C177	E169-P173 WeakPolarHBondContact O-CA 3.3Å; E169-P173 WeakPolarHBondContact O-CD 3.31Å; E169-P173 WeakPolarHBondContact O-CG 3.39Å; P173-S176 PolarHBondContact O-N 3.3Å; P173-C177 WeakPolarHBondContact O-CB 3.42Å; P173-C177 PolarHBondContact O-N 2.89Å
174	L	97.9	Very high	97.6	Very high	134 Å²	134	51 Å²	51	70%	0.702	27%	0.27	S	S	*	.	H	α-helix	trans	-68.4	-36.7	179.3	-65.4	179.6	0	0	0	112.9	Q172 R178	Q172-L174 VanDerWaalsContact C-N 3.25Å; Q172-L174 PolarHBondContact O-N 2.83Å; Q172-L174 VanDerWaalsContact O-N 3.11Å; L174-R178 VanDerWaalsContact O-CG 3.32Å; L174-R178 WeakPolarHBondContact O-CG 3.17Å; L174-R178 PolarHBondContact O-N 2.93Å
175	A	97.7	Very high	97.6	Very high	13 Å²	13	54.4 Å²	54.4	11%	0.107	29%	0.287	C	S	.	.	H	α-helix	trans	-68	-45.8	176.7	0	0	0	0	0	110.3	A126 Q172 C177 R178 I179	A126-A175 HydrophobicContact CB-CB 4.46Å; Q172-A175 HydrophobicContact CB-CB 3.86Å; Q172-A175 PolarHBondContact O-N 3.21Å; A175-C177 VanDerWaalsContact C-N 3.33Å; A175-C177 PolarHBondContact O-N 3.05Å; A175-R178 PolarHBondContact O-N 2.81Å; A175-I179 WeakPolarHBondContact O-CG1 3.46Å; A175-I179 PolarHBondContact O-N 3.01Å
176	S	98.2	Very high	97.7	Very high	2 Å²	2	54.8 Å²	54.8	1%	0.014	29%	0.29	C	S	.	.	H	α-helix	trans	-55.4	-47.1	173.9	-177.6	0	0	0	0	111.9	M165 Q172 P173 R178 I179 M180 I199	M165-S176 WeakPolarHBondContact CE-OG 3.37Å; Q172-S176 PolarHBondContact O-N 3.34Å; Q172-S176 VanDerWaalsContact O-N 3.09Å; P173-S176 PolarHBondContact O-N 3.3Å; S176-R178 PolarHBondContact O-N 2.85Å; S176-I179 PolarHBondContact O-N 3.37Å; S176-M180 WeakPolarHBondContact O-CG 3.2Å; S176-M180 PolarHBondContact O-N 3.09Å; S176-I199 WeakPolarHBondContact OG-CD1 3.28Å
177	C	98.5	Very high	97.7	Very high	84 Å²	84	53.3 Å²	53.3	57%	0.568	28%	0.284	S	S	*	.	H	α-helix	trans	-60.7	-45	177.1	-176.2	0	0	0	0	112.6	P173 A175 M180 S181	P173-C177 WeakPolarHBondContact O-CB 3.42Å; P173-C177 PolarHBondContact O-N 2.89Å; A175-C177 VanDerWaalsContact C-N 3.33Å; A175-C177 PolarHBondContact O-N 3.05Å; C177-M180 PolarHBondContact O-N 3.03Å; C177-S181 WeakPolarHBondContact O-CB 3.4Å; C177-S181 PolarHBondContact O-N 2.76Å
178	R	98.7	Very high	97.8	Very high	171 Å²	171	58 Å²	58	65%	0.645	30%	0.304	S	S	*	.	H	α-helix	trans	-62.5	-44.1	177.9	-75.5	175.7	179.5	-179.8	0.1	112.3	P129 L174 A175 S176 S181 N182	P129-R178 HydrophobicContact CB-CB 3.73Å; P129-R178 HydrophobicContact CG-CB 3.93Å; L174-R178 VanDerWaalsContact O-CG 3.32Å; L174-R178 WeakPolarHBondContact O-CG 3.17Å; L174-R178 PolarHBondContact O-N 2.93Å; A175-R178 PolarHBondContact O-N 2.81Å; S176-R178 PolarHBondContact O-N 2.85Å; R178-S181 PolarHBondContact O-N 2.82Å; R178-N182 PolarHBondContact O-N 3.21Å
179	I	98.8	Very high	97.8	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-58.5	-52.6	175.5	-72.8	163.1	0	0	0	109.8	L122 P129 A132 M165 L168 A175 S176 S181 N182 V183	L122-I179 HydrophobicContact CB-CG2 4.29Å; P129-I179 HydrophobicContact CB-CG1 3.82Å; P129-I179 HydrophobicContact CG-CG1 4.28Å; A132-I179 HydrophobicContact CB-CB 4.48Å; A132-I179 HydrophobicContact CB-CG1 4.38Å; A132-I179 HydrophobicContact CB-CG2 3.81Å; M165-I179 HydrophobicContact CE-CB 4.01Å; M165-I179 HydrophobicContact CE-CD1 4.33Å; M165-I179 HydrophobicContact CE-CG2 3.69Å; M165-I179 HydrophobicContact SD-CD1 4.43Å; M165-I179 HydrophobicContact SD-CG2 4.24Å; L168-I179 HydrophobicContact CD2-CD1 3.45Å; L168-I179 VanDerWaalsContact CD2-CD1 3.45Å; A175-I179 WeakPolarHBondContact O-CG1 3.46Å; A175-I179 PolarHBondContact O-N 3.01Å; S176-I179 PolarHBondContact O-N 3.37Å; I179-S181 VanDerWaalsContact C-N 3.25Å; I179-S181 PolarHBondContact O-N 3.08Å; I179-N182 PolarHBondContact O-N 3.4Å; I179-V183 HydrophobicContact CG2-CG2 4.33Å; I179-V183 WeakPolarHBondContact O-CB 3.33Å; I179-V183 VanDerWaalsContact O-CG2 3.28Å; I179-V183 WeakPolarHBondContact O-CG2 3.28Å; I179-V183 PolarHBondContact O-N 2.65Å
180	M	98.7	Very high	97.8	Very high	13 Å²	13	61.1 Å²	61.1	6%	0.064	32%	0.323	C	S	.	.	H	α-helix	trans	-64.9	-30	-178.4	-67.8	-54.1	-56.6	0	0	112.7	L159 A161 M165 S176 C177 K184 A197 I199	L159-M180 HydrophobicContact CD2-CE 3.92Å; A161-M180 HydrophobicContact CB-SD 4.3Å; M165-M180 HydrophobicContact CE-CG 3.88Å; M165-M180 HydrophobicContact CE-SD 3.91Å; S176-M180 WeakPolarHBondContact O-CG 3.2Å; S176-M180 PolarHBondContact O-N 3.09Å; C177-M180 PolarHBondContact O-N 3.03Å; M180-K184 WeakPolarHBondContact O-CB 3.12Å; M180-K184 WeakPolarHBondContact O-CD 3.47Å; M180-K184 WeakPolarHBondContact O-CG 3.05Å; M180-K184 PolarHBondContact O-N 3.39Å; M180-K184 VanDerWaalsContact O-N 3.12Å; M180-A197 HydrophobicContact CE-CB 4.22Å; M180-I199 HydrophobicContact CG-CD1 4.23Å; M180-I199 HydrophobicContact CG-CG1 4.12Å; M180-I199 HydrophobicContact SD-CG1 4.16Å
181	S	98.7	Very high	97.8	Very high	59 Å²	59	60.1 Å²	60.1	41%	0.413	32%	0.316	S	S	.	.	H	α-helix	trans	-67.5	-51.7	172.8	-166.6	0	0	0	0	111.4	C177 R178 I179 V183 K184 D185	C177-S181 WeakPolarHBondContact O-CB 3.4Å; C177-S181 PolarHBondContact O-N 2.76Å; R178-S181 PolarHBondContact O-N 2.82Å; I179-S181 VanDerWaalsContact C-N 3.25Å; I179-S181 PolarHBondContact O-N 3.08Å; S181-V183 VanDerWaalsContact C-N 3.34Å; S181-V183 PolarHBondContact O-N 3.03Å; S181-K184 WeakPolarHBondContact O-CB 3.44Å; S181-K184 PolarHBondContact O-N 2.93Å; S181-K184 VanDerWaalsContact O-N 3.16Å; S181-D185 PolarHBondContact O-N 2.89Å
182	N	98.6	Very high	98	Very high	34 Å²	34	58.5 Å²	58.5	18%	0.182	30%	0.301	C	S	.	.	H	α-helix	trans	-58.3	-46.5	178.4	168.9	-89.5	0	0	0	111.3	P129 E130 G133 R178 I179 K184 D185 V186	P129-N182 WeakPolarHBondContact O-CB 3.35Å; P129-N182 VanDerWaalsContact O-CG 3.25Å; P129-N182 PolarHBondContact O-OD1 2.78Å; E130-N182 WeakPolarHBondContact CA-ND2 3.41Å; E130-N182 PolarHBondContact O-ND2 2.73Å; E130-N182 PolarHBondContact O-OD1 3.38Å; G133-N182 VanDerWaalsContact CA-OD1 3.32Å; G133-N182 WeakPolarHBondContact CA-OD1 3.49Å; G133-N182 PolarHBondContact N-OD1 2.81Å; R178-N182 PolarHBondContact O-N 3.21Å; I179-N182 PolarHBondContact O-N 3.4Å; N182-K184 VanDerWaalsContact C-N 3.34Å; N182-K184 PolarHBondContact O-N 2.87Å; N182-D185 PolarHBondContact O-N 2.92Å; N182-D185 VanDerWaalsContact O-N 3.12Å; N182-V186 WeakPolarHBondContact O-CG2 3.45Å; N182-V186 PolarHBondContact O-N 3.32Å
183	V	98.8	Very high	98.1	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-55.6	-47.8	175.1	167.1	0	0	0	0	111.3	L122 A132 L136 L159 I179 S181 D185 V186 L187 A197	L122-V183 HydrophobicContact CD1-CG2 4.12Å; L122-V183 HydrophobicContact CD2-CG2 4.4Å; A132-V183 HydrophobicContact CB-CG2 4.15Å; L136-V183 HydrophobicContact CD1-CG1 4.39Å; L159-V183 HydrophobicContact CD1-CG1 3.66Å; L159-V183 HydrophobicContact CD2-CG1 4.26Å; L159-V183 HydrophobicContact CG-CG1 4.47Å; I179-V183 HydrophobicContact CG2-CG2 4.33Å; I179-V183 WeakPolarHBondContact O-CB 3.33Å; I179-V183 VanDerWaalsContact O-CG2 3.28Å; I179-V183 WeakPolarHBondContact O-CG2 3.28Å; I179-V183 PolarHBondContact O-N 2.65Å; S181-V183 VanDerWaalsContact C-N 3.34Å; S181-V183 PolarHBondContact O-N 3.03Å; V183-D185 VanDerWaalsContact C-N 3.3Å; V183-D185 PolarHBondContact O-N 3.44Å; V183-V186 PolarHBondContact O-N 3.16Å; V183-L187 HydrophobicContact CG1-CD1 3.77Å; V183-L187 HydrophobicContact CG1-CG 4.19Å; V183-L187 WeakPolarHBondContact O-CB 3.48Å; V183-L187 WeakPolarHBondContact O-CG 3.19Å; V183-L187 PolarHBondContact O-N 3.09Å; V183-A197 HydrophobicContact CG1-CB 4.42Å
184	K	98.8	Very high	98.1	Very high	77 Å²	77	54.5 Å²	54.5	34%	0.335	28%	0.278	S	S	.	.	H	α-helix	trans	-58.4	-42.9	177.1	-77.7	168.5	-177	178.8	0	112.1	M180 S181 N182 K188 F194 A197	M180-K184 WeakPolarHBondContact O-CB 3.12Å; M180-K184 WeakPolarHBondContact O-CD 3.47Å; M180-K184 WeakPolarHBondContact O-CG 3.05Å; M180-K184 PolarHBondContact O-N 3.39Å; M180-K184 VanDerWaalsContact O-N 3.12Å; S181-K184 WeakPolarHBondContact O-CB 3.44Å; S181-K184 PolarHBondContact O-N 2.93Å; S181-K184 VanDerWaalsContact O-N 3.16Å; N182-K184 VanDerWaalsContact C-N 3.34Å; N182-K184 PolarHBondContact O-N 2.87Å; K184-K188 WeakPolarHBondContact O-CB 3.37Å; K184-K188 WeakPolarHBondContact O-CD 3.03Å; K184-K188 WeakPolarHBondContact O-CG 3.06Å; K184-K188 PolarHBondContact O-N 2.68Å; K184-F194 HydrophobicContact CG-CZ 4.09Å; K184-A197 WeakPolarHBondContact CE-O 3.5Å; K184-A197 HydrophobicContact CG-CB 3.81Å
185	D	98.6	Very high	98.1	Very high	77 Å²	77	52.4 Å²	52.4	41%	0.412	26%	0.263	S	S	.	.	H	α-helix	trans	-69	-41.8	-177.4	-65.7	-24.4	0	0	0	111.5	S181 N182 V183 K188 N189	S181-D185 PolarHBondContact O-N 2.89Å; N182-D185 PolarHBondContact O-N 2.92Å; N182-D185 VanDerWaalsContact O-N 3.12Å; V183-D185 VanDerWaalsContact C-N 3.3Å; V183-D185 PolarHBondContact O-N 3.44Å; D185-K188 IonicContact OD1-NZ 3.69Å; D185-N189 PolarHBondContact O-N 3.35Å; D185-N189 PolarHBondContact O-ND2 2.92Å; D185-N189 VanDerWaalsContact O-ND2 3.09Å
186	V	98.6	Very high	98.1	Very high	10 Å²	10	54.7 Å²	54.7	6%	0.061	27%	0.274	C	S	.	.	H	α-helix	trans	-63.6	-47	174.4	175.1	0	0	0	0	111.3	G133 E134 V137 N182 V183 K188 N189 Q190	G133-V186 WeakPolarHBondContact O-CG1 3.47Å; E134-V186 HydrophobicContact CG-CG2 4.46Å; V137-V186 HydrophobicContact CG2-CG1 3.61Å; N182-V186 WeakPolarHBondContact O-CG2 3.45Å; N182-V186 PolarHBondContact O-N 3.32Å; V183-V186 PolarHBondContact O-N 3.16Å; V186-K188 PolarHBondContact O-N 3.41Å; V186-N189 PolarHBondContact O-N 3.22Å; V186-N189 VanDerWaalsContact O-N 3.17Å; V186-Q190 WeakPolarHBondContact O-CG 3.43Å; V186-Q190 PolarHBondContact O-NE2 3.34Å
187	L	98.7	Very high	98.1	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-66.6	-33.9	-177.7	-64.9	-178.6	0	0	0	112.9	I85 L136 L140 L157 L159 V183 N189 Q190 F194 A197	I85-L187 HydrophobicContact CD1-CD1 4.3Å; I85-L187 HydrophobicContact CD1-CD2 3.72Å; L136-L187 HydrophobicContact CD1-CD2 4.34Å; L140-L187 HydrophobicContact CD1-CD2 3.48Å; L140-L187 VanDerWaalsContact CD1-CD2 3.48Å; L157-L187 HydrophobicContact CD2-CB 4.09Å; L157-L187 HydrophobicContact CD2-CD2 4.07Å; L159-L187 HydrophobicContact CB-CD1 3.8Å; L159-L187 HydrophobicContact CD1-CD1 4.13Å; V183-L187 HydrophobicContact CG1-CD1 3.77Å; V183-L187 HydrophobicContact CG1-CG 4.19Å; V183-L187 WeakPolarHBondContact O-CB 3.48Å; V183-L187 WeakPolarHBondContact O-CG 3.19Å; V183-L187 PolarHBondContact O-N 3.09Å; L187-N189 PolarHBondContact O-N 3.3Å; L187-Q190 PolarHBondContact O-N 2.66Å; L187-F194 HydrophobicContact CB-CD2 3.73Å; L187-F194 HydrophobicContact CB-CE2 4.13Å; L187-F194 HydrophobicContact CD1-CD2 4.47Å; L187-F194 HydrophobicContact CD1-CE2 4.3Å; L187-A197 HydrophobicContact CD1-CB 4.3Å
188	K	98.4	Very high	98.1	Very high	111 Å²	111	52.3 Å²	52.3	48%	0.483	26%	0.258	S	S	.	.	H	α-helix	trans	-63.1	-27.4	174.4	-78.5	169	-173.2	168	0	113.3	K184 D185 V186 F194	K184-K188 WeakPolarHBondContact O-CB 3.37Å; K184-K188 WeakPolarHBondContact O-CD 3.03Å; K184-K188 WeakPolarHBondContact O-CG 3.06Å; K184-K188 PolarHBondContact O-N 2.68Å; D185-K188 IonicContact OD1-NZ 3.69Å; V186-K188 PolarHBondContact O-N 3.41Å; K188-F194 HydrophobicContact CG-CB 4.23Å; K188-F194 HydrophobicContact CG-CD1 3.55Å; K188-F194 HydrophobicContact CG-CE1 4.05Å; K188-F194 HydrophobicContact CG-CG 3.86Å
189	N	97	Very high	98.1	Very high	137 Å²	137	46 Å²	46	73%	0.733	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.2	5.9	-177.8	-67.8	-33.4	0	0	0	113.2	D185 V186 L187	D185-N189 PolarHBondContact O-N 3.35Å; D185-N189 PolarHBondContact O-ND2 2.92Å; D185-N189 VanDerWaalsContact O-ND2 3.09Å; V186-N189 PolarHBondContact O-N 3.22Å; V186-N189 VanDerWaalsContact O-N 3.17Å; L187-N189 PolarHBondContact O-N 3.3Å
190	Q	96.8	Very high	98.1	Very high	42 Å²	42	46.6 Å²	46.6	20%	0.196	24%	0.24	C	C	.	.	S	Bend	trans	-83	168.7	177.7	-59.5	-59.8	-46.6	0	0	112.4	L140 L157 V186 L187 F192	L140-Q190 HydrophobicContact CD1-CG 3.95Å; L157-Q190 HydrophobicContact CD2-CB 4.35Å; V186-Q190 WeakPolarHBondContact O-CG 3.43Å; V186-Q190 PolarHBondContact O-NE2 3.34Å; L187-Q190 PolarHBondContact O-N 2.66Å; Q190-F192 PolarHBondContact O-N 3.08Å
191	M	95.2	Very high	98.1	Very high	89 Å²	89	48.4 Å²	48.4	44%	0.438	25%	0.253	S	S	.	.	S	Bend	trans	-67.8	-0.2	178.7	-65.9	179.8	-81.4	0	0	114.7	S144 R152 P153	S144-M191 VanDerWaalsContact CB-CE 3.42Å; S144-M191 VanDerWaalsContact OG-CE 3.29Å; S144-M191 WeakPolarHBondContact OG-CE 3.47Å; R152-M191 CarbonylContact C-O 3.04Å; R152-M191 HydrophobicContact CB-CB 4.3Å; R152-M191 WeakPolarHBondContact CB-O 3.47Å; P153-M191 WeakPolarHBondContact CA-O 3.36Å
192	F	98.1	Very high	98	Very high	10 Å²	10	45.8 Å²	45.8	4%	0.044	24%	0.236	C	C	.	.	S	Bend	trans	-111.5	160.5	-173.4	-55.4	-63.4	0	0	0	112.1	I83 L140 I143 V147 R152 L157 Q190 F194	I83-F192 HydrophobicContact CD1-CB 4.49Å; I83-F192 HydrophobicContact CD1-CD1 3.65Å; I83-F192 HydrophobicContact CD1-CD2 3.47Å; I83-F192 VanDerWaalsContact CD1-CD2 3.47Å; I83-F192 HydrophobicContact CD1-CE1 3.51Å; I83-F192 HydrophobicContact CD1-CE2 3.33Å; I83-F192 HydrophobicContact CD1-CG 3.61Å; I83-F192 HydrophobicContact CD1-CZ 3.33Å; L140-F192 HydrophobicContact CD2-CD2 4.36Å; L140-F192 HydrophobicContact CD2-CE2 4.24Å; I143-F192 HydrophobicContact CG2-CZ 4.25Å; V147-F192 HydrophobicContact CB-CE1 4.33Å; V147-F192 HydrophobicContact CG1-CE1 4.48Å; V147-F192 HydrophobicContact CG2-CE1 4.21Å; R152-F192 HydrophobicContact CB-CD1 4.07Å; R152-F192 HydrophobicContact CB-CE1 4.06Å; R152-F192 HydrophobicContact CG-CE1 4.08Å; R152-F192 WeakPolarHBondContact O-CA 3.44Å; L157-F192 HydrophobicContact CB-CB 3.88Å; L157-F192 HydrophobicContact CD2-CB 4.13Å; L157-F192 HydrophobicContact CD2-CD2 4.43Å; Q190-F192 PolarHBondContact O-N 3.08Å; F192-F194 PolarHBondContact O-N 3.09Å; F192-F194 VanDerWaalsContact O-N 3.08Å
193	S	97.5	Very high	97.9	Very high	32 Å²	32	45.8 Å²	45.8	22%	0.224	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	93.7	176.9	-163.6	0	0	0	0	110.6	P153 S155 L157 K195	P153-S193 WeakPolarHBondContact O-CB 3.28Å; S155-S193 WeakPolarHBondContact O-CA 3.34Å; S155-S193 WeakPolarHBondContact O-CB 3.43Å; S155-S193 PolarHBondContact O-N 3.37Å; L157-S193 PolarHBondContact N-O 3.39Å; S193-K195 WeakPolarHBondContact O-CG 3.46Å; S193-K195 PolarHBondContact O-N 2.93Å; S193-K195 PolarHBondContact OG-NZ 3.37Å
194	F	98.2	Very high	97.8	Very high	50 Å²	50	48.6 Å²	48.6	22%	0.219	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.3	125.4	172.8	174.5	-100.7	0	0	0	111.2	K184 L187 K188 F192 A197	K184-F194 HydrophobicContact CG-CZ 4.09Å; L187-F194 HydrophobicContact CB-CD2 3.73Å; L187-F194 HydrophobicContact CB-CE2 4.13Å; L187-F194 HydrophobicContact CD1-CD2 4.47Å; L187-F194 HydrophobicContact CD1-CE2 4.3Å; K188-F194 HydrophobicContact CG-CB 4.23Å; K188-F194 HydrophobicContact CG-CD1 3.55Å; K188-F194 HydrophobicContact CG-CE1 4.05Å; K188-F194 HydrophobicContact CG-CG 3.86Å; F192-F194 PolarHBondContact O-N 3.09Å; F192-F194 VanDerWaalsContact O-N 3.08Å; F194-A197 HydrophobicContact CE2-CB 3.85Å; F194-A197 HydrophobicContact CZ-CB 4.12Å
195	K	97.7	Very high	97.8	Very high	90 Å²	90	45.4 Å²	45.4	39%	0.391	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	-52.6	178.2	-60.7	-50	-172.2	-167.4	0	112.1	A156 L157 Y158 S193	A156-K195 HydrophobicContact CB-CG 3.82Å; L157-K195 PolarHBondContact O-N 3.23Å; Y158-K195 HydrophobicContact CD1-CB 3.78Å; Y158-K195 HydrophobicContact CE1-CB 3.28Å; Y158-K195 HydrophobicContact CE1-CG 3.98Å; Y158-K195 HydrophobicContact CE2-CB 4.14Å; Y158-K195 HydrophobicContact CE2-CG 4Å; Y158-K195 HydrophobicContact CG-CB 4.39Å; Y158-K195 VanDerWaalsContact CZ-CB 3.48Å; S193-K195 WeakPolarHBondContact O-CG 3.46Å; S193-K195 PolarHBondContact O-N 2.93Å; S193-K195 PolarHBondContact OG-NZ 3.37Å
196	N	97.9	Very high	97.8	Very high	61 Å²	61	41.8 Å²	41.8	33%	0.326	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	150.1	-178.7	-172.9	31.5	0	0	0	112.1	Y158 L159 S198	Y158-N196 CarbonylContact C-O 3.52Å; Y158-N196 WeakPolarHBondContact CA-O 3.49Å; Y158-N196 HydrophobicContact CD1-CB 4.12Å; L159-N196 PolarHBondContact N-O 2.96Å; N196-S198 PolarHBondContact ND2-OG 3.02Å; N196-S198 VanDerWaalsContact ND2-OG 3.12Å
197	A	98.6	Very high	97.7	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	119.3	164.5	0	0	0	0	0	108.8	L159 M180 V183 K184 L187 F194	L159-A197 HydrophobicContact CB-CB 3.95Å; L159-A197 HydrophobicContact CD2-CB 4.25Å; L159-A197 VanDerWaalsContact O-CA 3.29Å; L159-A197 WeakPolarHBondContact O-CA 3.34Å; M180-A197 HydrophobicContact CE-CB 4.22Å; V183-A197 HydrophobicContact CG1-CB 4.42Å; K184-A197 WeakPolarHBondContact CE-O 3.5Å; K184-A197 HydrophobicContact CG-CB 3.81Å; L187-A197 HydrophobicContact CD1-CB 4.3Å; F194-A197 HydrophobicContact CE2-CB 3.85Å; F194-A197 HydrophobicContact CZ-CB 4.12Å
198	S	98.2	Very high	97.7	Very high	35 Å²	35	43.7 Å²	43.7	25%	0.245	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	158.9	-175.2	55.6	0	0	0	0	112.4	L159 A160 A161 N196	L159-S198 PolarHBondContact O-N 3.12Å; L159-S198 VanDerWaalsContact O-N 3.16Å; A160-S198 WeakPolarHBondContact CA-O 3.47Å; A161-S198 PolarHBondContact N-O 2.82Å; N196-S198 PolarHBondContact ND2-OG 3.02Å; N196-S198 VanDerWaalsContact ND2-OG 3.12Å
199	I	98.7	Very high	97.6	Very high	40 Å²	40	38.4 Å²	38.4	21%	0.205	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	117.6	166.6	-55.1	173.9	0	0	0	106.9	A161 M165 R166 E169 S176 M180	A161-I199 HydrophobicContact CB-CG1 4.28Å; A161-I199 CarbonylContact O-C 3.5Å; A161-I199 WeakPolarHBondContact O-CA 3.46Å; M165-I199 HydrophobicContact CB-CD1 4.02Å; M165-I199 HydrophobicContact CB-CG1 4.01Å; M165-I199 HydrophobicContact CB-CG2 4.33Å; M165-I199 HydrophobicContact CE-CD1 4.42Å; R166-I199 HydrophobicContact CB-CG2 4.44Å; R166-I199 HydrophobicContact CG-CG2 3.42Å; R166-I199 VanDerWaalsContact CG-CG2 3.42Å; E169-I199 HydrophobicContact CB-CD1 4.31Å; S176-I199 WeakPolarHBondContact OG-CD1 3.28Å; M180-I199 HydrophobicContact CG-CD1 4.23Å; M180-I199 HydrophobicContact CG-CG1 4.12Å; M180-I199 HydrophobicContact SD-CG1 4.16Å
200	I	98.3	Very high	97.7	Very high	12 Å²	12	31.9 Å²	31.9	6%	0.062	17%	0.169	C	C	.	.	P	Polyproline II helix	trans	-87.7	152.5	-178.6	59.7	165.6	0	0	0	111.2	A160 A161 T162 R166 E205 W472	A160-I200 HydrophobicContact CB-CB 4.42Å; A160-I200 HydrophobicContact CB-CD1 4.06Å; A160-I200 HydrophobicContact CB-CG1 4.13Å; A160-I200 HydrophobicContact CB-CG2 3.46Å; A160-I200 VanDerWaalsContact CB-CG2 3.46Å; A161-I200 PolarHBondContact O-N 3.38Å; T162-I200 HydrophobicContact CG2-CD1 4.37Å; T162-I200 HydrophobicContact CG2-CG1 4.47Å; R166-I200 WeakPolarHBondContact CD-O 3.44Å; R166-I200 PolarHBondContact NE-O 3.16Å; I200-E205 HydrophobicContact CD1-CB 3.86Å; I200-E205 HydrophobicContact CD1-CG 4.45Å; I200-W472 HydrophobicContact CD1-CD2 4.27Å; I200-W472 HydrophobicContact CD1-CE3 4.21Å; I200-W472 HydrophobicContact CD1-CH2 4.44Å; I200-W472 HydrophobicContact CD1-CZ2 4.37Å; I200-W472 HydrophobicContact CD1-CZ3 4.33Å
201	S	98.1	Very high	97.6	Very high	50 Å²	50	29.9 Å²	29.9	35%	0.35	16%	0.159	S	C	.	.	P	Polyproline II helix	trans	-69.7	152.1	172.5	79.6	0	0	0	0	110	V203 D204 E205	S201-V203 PolarHBondContact O-N 3.12Å; S201-V203 PolarHBondContact OG-N 3.42Å; S201-D204 WeakPolarHBondContact CB-OD2 3.46Å; S201-D204 PolarHBondContact O-N 2.94Å; S201-D204 VanDerWaalsContact O-N 3.14Å; S201-D204 PolarHBondContact OG-N 2.98Å; S201-D204 PolarHBondContact OG-OD2 2.76Å; S201-E205 PolarHBondContact O-N 2.04Å
202	G	96.8	Very high	97.7	Very high	4 Å²	4	25.7 Å²	25.7	4%	0.041	14%	0.138	C	C	.	.	H	α-helix	trans	-64.7	-22.7	173.9	0	0	0	0	0	113.3	G206 S281	G202-G206 PolarHBondContact O-N 2.74Å; G202-S281 VanDerWaalsContact CA-OG 3.31Å; G202-S281 WeakPolarHBondContact CA-OG 3.35Å; G202-S281 WeakPolarHBondContact O-CB 3.15Å
203	V	96.7	Very high	97.6	Very high	34 Å²	34	25.2 Å²	25.2	21%	0.206	14%	0.136	C	C	.	.	H	α-helix	trans	-67.9	-45.1	173	172.7	0	0	0	0	110	S201 G206 L207 R266 V279	S201-V203 PolarHBondContact O-N 3.12Å; S201-V203 PolarHBondContact OG-N 3.42Å; V203-G206 PolarHBondContact O-N 2.94Å; V203-L207 VanDerWaalsContact O-CB 3.29Å; V203-L207 WeakPolarHBondContact O-CB 3.28Å; V203-L207 PolarHBondContact O-N 2.94Å; V203-R266 HydrophobicContact CG1-CG 4.02Å; V203-V279 HydrophobicContact CB-CG1 4.18Å; V203-V279 HydrophobicContact CG1-CB 4.15Å; V203-V279 HydrophobicContact CG1-CG1 3.68Å; V203-V279 WeakPolarHBondContact O-CG1 3.42Å
204	D	97.8	Very high	97.5	Very high	60 Å²	60	23.7 Å²	23.7	32%	0.321	13%	0.126	S	C	.	.	H	α-helix	trans	-65.4	-44.7	177.4	-59.8	-42	0	0	0	111.1	S201 G206 L207 Y208	S201-D204 WeakPolarHBondContact CB-OD2 3.46Å; S201-D204 PolarHBondContact O-N 2.94Å; S201-D204 VanDerWaalsContact O-N 3.14Å; S201-D204 PolarHBondContact OG-N 2.98Å; S201-D204 PolarHBondContact OG-OD2 2.76Å; D204-G206 PolarHBondContact O-N 2.66Å; D204-L207 PolarHBondContact O-N 3.32Å; D204-Y208 HydrophobicContact CB-CD2 4.21Å; D204-Y208 HydrophobicContact CB-CE2 3.71Å; D204-Y208 WeakPolarHBondContact O-CB 3.49Å; D204-Y208 WeakPolarHBondContact O-CD2 3.43Å; D204-Y208 PolarHBondContact O-N 2.84Å
205	E	97.9	Very high	97.3	Very high	10 Å²	10	22.6 Å²	22.6	5%	0.047	12%	0.12	C	C	.	.	H	α-helix	trans	-52.3	-51.6	174.1	-175.6	178.5	-168.8	0	0	111.6	T162 R166 I200 S201 Y208 A209 Q251 W472	T162-E205 WeakPolarHBondContact CB-OE1 3.32Å; T162-E205 HydrophobicContact CG2-CG 4.42Å; R166-E205 IonicContact CZ-OE2 3.89Å; R166-E205 IonicContact NH2-OE2 2.68Å; R166-E205 PolarHBondContact NH2-OE2 2.95Å; I200-E205 HydrophobicContact CD1-CB 3.86Å; I200-E205 HydrophobicContact CD1-CG 4.45Å; S201-E205 PolarHBondContact O-N 2.04Å; E205-Y208 PolarHBondContact O-N 2.88Å; E205-A209 WeakPolarHBondContact O-CB 3.43Å; E205-A209 PolarHBondContact O-N 3.03Å; E205-Q251 VanDerWaalsContact CD-NE2 3.34Å; E205-Q251 PolarHBondContact OE2-NE2 3.15Å; E205-W472 HydrophobicContact CG-CB 4.48Å; E205-W472 HydrophobicContact CG-CG 4.12Å; E205-W472 VanDerWaalsContact O-CB 3.31Å; E205-W472 WeakPolarHBondContact O-CB 3.38Å
206	G	97.9	Very high	97.1	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-64.8	-41.7	177.8	0	0	0	0	0	113.2	G202 V203 D204 A209 W210 V253	G202-G206 PolarHBondContact O-N 2.74Å; V203-G206 PolarHBondContact O-N 2.94Å; D204-G206 PolarHBondContact O-N 2.66Å; G206-A209 PolarHBondContact O-N 3.41Å; G206-W210 PolarHBondContact O-N 2.85Å; G206-V253 WeakPolarHBondContact O-CG2 3.4Å
207	L	97.6	Very high	96.8	Very high	16 Å²	16	19.4 Å²	19.4	8%	0.084	11%	0.107	C	C	.	.	H	α-helix	trans	-61.9	-46.3	178.2	-179.9	152.9	0	0	0	110.8	V203 D204 A209 W210 I211 R266 L268 L277	V203-L207 VanDerWaalsContact O-CB 3.29Å; V203-L207 WeakPolarHBondContact O-CB 3.28Å; V203-L207 PolarHBondContact O-N 2.94Å; D204-L207 PolarHBondContact O-N 3.32Å; L207-A209 VanDerWaalsContact C-N 3.35Å; L207-A209 PolarHBondContact O-N 2.88Å; L207-W210 WeakPolarHBondContact O-CB 3.47Å; L207-W210 PolarHBondContact O-N 3.31Å; L207-I211 HydrophobicContact CD2-CD1 3.68Å; L207-I211 HydrophobicContact CD2-CG1 4.38Å; L207-I211 WeakPolarHBondContact O-CG1 3.29Å; L207-I211 PolarHBondContact O-N 3.09Å; L207-R266 HydrophobicContact CD1-CB 4.07Å; L207-L268 HydrophobicContact CD2-CD1 4.2Å; L207-L268 HydrophobicContact CD2-CD2 4.43Å; L207-L277 HydrophobicContact CG-CD1 4.47Å
208	Y	97.9	Very high	96.4	Very high	34 Å²	34	24 Å²	24	13%	0.133	14%	0.14	C	C	.	.	H	α-helix	trans	-66.2	-36.7	177.7	-63.7	-40.2	0	0	0	112	D204 E205 W210 I211 A212 W472 G475 Y476 N479	D204-Y208 HydrophobicContact CB-CD2 4.21Å; D204-Y208 HydrophobicContact CB-CE2 3.71Å; D204-Y208 WeakPolarHBondContact O-CB 3.49Å; D204-Y208 WeakPolarHBondContact O-CD2 3.43Å; D204-Y208 PolarHBondContact O-N 2.84Å; E205-Y208 PolarHBondContact O-N 2.88Å; Y208-W210 VanDerWaalsContact C-N 3.34Å; Y208-W210 PolarHBondContact O-N 2.84Å; Y208-I211 HydrophobicContact CD1-CD1 4.07Å; Y208-I211 WeakPolarHBondContact O-CB 3.37Å; Y208-I211 PolarHBondContact O-N 2.94Å; Y208-A212 PolarHBondContact O-N 3.36Å; Y208-W472 WeakPolarHBondContact CB-O 3.05Å; Y208-W472 HydrophobicContact CD2-CE3 4.31Å; Y208-G475 WeakPolarHBondContact O-CA 3.42Å; Y208-Y476 AromaticContact CD2-CD2 3.65Å; Y208-Y476 HydrophobicContact CD2-CD2 3.65Å; Y208-Y476 HydrophobicContact CD2-CG 4.32Å; Y208-Y476 AromaticContact CE2-CD2 3.36Å; Y208-Y476 HydrophobicContact CE2-CD2 3.36Å; Y208-Y476 AromaticContact CE2-CE2 3.94Å; Y208-Y476 HydrophobicContact CE2-CE2 3.94Å; Y208-Y476 HydrophobicContact CE2-CG 4.26Å; Y208-Y476 HydrophobicContact CG-CD2 4.44Å; Y208-Y476 AromaticContact CZ-CD2 3.95Å; Y208-N479 HydrophobicContact CD1-CB 4.35Å; Y208-N479 HydrophobicContact CE1-CB 3.91Å
209	A	97.7	Very high	95.9	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.008	14%	0.139	C	C	.	.	H	α-helix	trans	-62.9	-39	172.3	0	0	0	0	0	113	E205 G206 L207 I211 A212 T213 F386 W472	E205-A209 WeakPolarHBondContact O-CB 3.43Å; E205-A209 PolarHBondContact O-N 3.03Å; G206-A209 PolarHBondContact O-N 3.41Å; L207-A209 VanDerWaalsContact C-N 3.35Å; L207-A209 PolarHBondContact O-N 2.88Å; A209-I211 VanDerWaalsContact C-N 3.33Å; A209-I211 PolarHBondContact O-N 3.28Å; A209-A212 PolarHBondContact O-N 3.01Å; A209-T213 WeakPolarHBondContact O-CB 2.86Å; A209-T213 PolarHBondContact O-N 2.97Å; A209-T213 PolarHBondContact O-OG1 2.95Å; A209-F386 HydrophobicContact CB-CE1 4.29Å; A209-F386 HydrophobicContact CB-CE2 4.25Å; A209-F386 HydrophobicContact CB-CZ 3.5Å; A209-W472 HydrophobicContact CB-CB 4.17Å
210	W	97.5	Very high	95.3	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-63.6	-39.5	174.8	-178.7	92.3	0	0	0	112.2	G206 L207 Y208 N214 L220 S239 L240 V253 L268 Y275 L277	G206-W210 PolarHBondContact O-N 2.85Å; L207-W210 WeakPolarHBondContact O-CB 3.47Å; L207-W210 PolarHBondContact O-N 3.31Å; Y208-W210 VanDerWaalsContact C-N 3.34Å; Y208-W210 PolarHBondContact O-N 2.84Å; W210-N214 PolarHBondContact NE1-ND2 3.27Å; W210-N214 PolarHBondContact O-N 2.85Å; W210-N214 VanDerWaalsContact O-N 3.09Å; W210-N214 PolarHBondContact O-ND2 3.45Å; W210-L220 HydrophobicContact CH2-CD2 4.11Å; W210-L220 HydrophobicContact CZ3-CD2 4.08Å; W210-S239 VanDerWaalsContact CZ2-CB 3.49Å; W210-L240 PolarHBondContact NE1-O 2.92Å; W210-V253 HydrophobicContact CB-CB 3.97Å; W210-V253 HydrophobicContact CB-CG1 3.58Å; W210-V253 HydrophobicContact CG-CB 4.32Å; W210-V253 HydrophobicContact CG-CG1 3.67Å; W210-L268 HydrophobicContact CE3-CD2 3.99Å; W210-L268 HydrophobicContact CZ3-CD2 3.78Å; W210-Y275 AromaticContact CH2-CD1 3.6Å; W210-Y275 HydrophobicContact CH2-CD1 3.6Å; W210-Y275 HydrophobicContact CH2-CD2 4.41Å; W210-Y275 HydrophobicContact CH2-CE1 4.04Å; W210-Y275 AromaticContact CH2-CG 3.79Å; W210-Y275 HydrophobicContact CH2-CG 3.79Å; W210-Y275 HydrophobicContact CZ2-CD1 4.42Å; W210-Y275 HydrophobicContact CZ3-CD1 4.45Å; W210-Y275 HydrophobicContact CZ3-CG 4.23Å; W210-L277 HydrophobicContact CD2-CD1 3.75Å; W210-L277 HydrophobicContact CD2-CD2 3.94Å; W210-L277 HydrophobicContact CE3-CD1 3.6Å; W210-L277 HydrophobicContact CE3-CD2 4.2Å; W210-L277 HydrophobicContact CG-CD1 4.24Å; W210-L277 HydrophobicContact CH2-CD2 3.85Å; W210-L277 HydrophobicContact CZ2-CD2 3.5Å; W210-L277 VanDerWaalsContact CZ2-CD2 3.5Å; W210-L277 HydrophobicContact CZ3-CD1 4.05Å; W210-L277 HydrophobicContact CZ3-CD2 4.18Å
211	I	96	Very high	94	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-58.8	-52	173.1	-65.6	172.5	0	0	0	109.9	L207 Y208 A209 T213 N214 Y215 L220 L268 L270 L478 N479	L207-I211 HydrophobicContact CD2-CD1 3.68Å; L207-I211 HydrophobicContact CD2-CG1 4.38Å; L207-I211 WeakPolarHBondContact O-CG1 3.29Å; L207-I211 PolarHBondContact O-N 3.09Å; Y208-I211 HydrophobicContact CD1-CD1 4.07Å; Y208-I211 WeakPolarHBondContact O-CB 3.37Å; Y208-I211 PolarHBondContact O-N 2.94Å; A209-I211 VanDerWaalsContact C-N 3.33Å; A209-I211 PolarHBondContact O-N 3.28Å; I211-T213 VanDerWaalsContact C-N 3.35Å; I211-T213 PolarHBondContact O-N 3.15Å; I211-N214 PolarHBondContact O-N 3.47Å; I211-Y215 WeakPolarHBondContact O-CB 3.49Å; I211-Y215 PolarHBondContact O-N 3.49Å; I211-L220 HydrophobicContact CG2-CD1 4.29Å; I211-L268 HydrophobicContact CD1-CD1 3.81Å; I211-L268 HydrophobicContact CD1-CD2 3.65Å; I211-L268 HydrophobicContact CD1-CG 4.36Å; I211-L268 HydrophobicContact CG1-CD2 3.41Å; I211-L268 VanDerWaalsContact CG1-CD2 3.41Å; I211-L270 HydrophobicContact CB-CD1 4.26Å; I211-L270 HydrophobicContact CD1-CD1 3.86Å; I211-L270 HydrophobicContact CG1-CD1 3.72Å; I211-L270 HydrophobicContact CG2-CD1 3.59Å; I211-L478 HydrophobicContact CG2-CB 4.12Å; I211-L478 HydrophobicContact CG2-CD1 3.62Å; I211-N479 HydrophobicContact CD1-CB 4.48Å
212	A	96.3	Very high	92.2	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-59.4	-46.8	-178	0	0	0	0	0	111.6	Y208 A209 N214 Y215 L216 G471 L474	Y208-A212 PolarHBondContact O-N 3.36Å; A209-A212 PolarHBondContact O-N 3.01Å; A212-N214 PolarHBondContact O-N 2.76Å; A212-Y215 PolarHBondContact O-N 3.4Å; A212-L216 WeakPolarHBondContact O-CB 3.43Å; A212-L216 VanDerWaalsContact O-CG 3.25Å; A212-L216 WeakPolarHBondContact O-CG 3.49Å; A212-L216 PolarHBondContact O-N 2.94Å; A212-G471 WeakPolarHBondContact CB-O 3.46Å; A212-L474 HydrophobicContact CB-CB 4.07Å; A212-L474 HydrophobicContact CB-CD2 3.93Å
213	T	95.9	Very high	90.3	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-55.3	-52.4	178.3	-58.1	0	0	0	0	111.6	A209 I211 D217 L240 V384 I470	A209-T213 WeakPolarHBondContact O-CB 2.86Å; A209-T213 PolarHBondContact O-N 2.97Å; A209-T213 PolarHBondContact O-OG1 2.95Å; I211-T213 VanDerWaalsContact C-N 3.35Å; I211-T213 PolarHBondContact O-N 3.15Å; T213-D217 WeakPolarHBondContact O-CB 3.18Å; T213-D217 PolarHBondContact O-N 3.28Å; T213-D217 VanDerWaalsContact O-N 3.09Å; T213-L240 HydrophobicContact CG2-CB 4.13Å; T213-L240 HydrophobicContact CG2-CD1 4.16Å; T213-V384 HydrophobicContact CG2-CB 3.9Å; T213-V384 HydrophobicContact CG2-CG2 4.02Å; T213-I470 HydrophobicContact CG2-CD1 4.32Å
214	N	95.2	Very high	88.1	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-75.9	-28	-176.3	-77.5	-83.8	0	0	0	113	W210 I211 A212 S218 R219 L220 S239 L240	W210-N214 PolarHBondContact NE1-ND2 3.27Å; W210-N214 PolarHBondContact O-N 2.85Å; W210-N214 VanDerWaalsContact O-N 3.09Å; W210-N214 PolarHBondContact O-ND2 3.45Å; I211-N214 PolarHBondContact O-N 3.47Å; A212-N214 PolarHBondContact O-N 2.76Å; N214-S218 PolarHBondContact O-N 3.24Å; N214-R219 HydrophobicContact CB-CB 4.27Å; N214-R219 WeakPolarHBondContact O-CA 3.49Å; N214-R219 PolarHBondContact O-N 2.91Å; N214-L220 HydrophobicContact CB-CD2 3.74Å; N214-L220 HydrophobicContact CB-CG 3.91Å; N214-L220 PolarHBondContact O-N 3.16Å; N214-S239 VanDerWaalsContact OD1-CA 3.24Å; N214-S239 WeakPolarHBondContact OD1-CA 3.49Å; N214-S239 VanDerWaalsContact OD1-CB 3.29Å; N214-S239 WeakPolarHBondContact OD1-CB 3.35Å; N214-L240 PolarHBondContact ND2-O 2.99Å; N214-L240 PolarHBondContact OD1-N 3.48Å
215	Y	93.7	Very high	85.6	Confident	28 Å²	28	31.3 Å²	31.3	11%	0.11	19%	0.189	C	C	.	.	H	α-helix	trans	-66.4	-51	172.7	178.2	-103.9	0	0	0	110.9	V108 I109 I211 A212 D217 S218 L220 V222 Y271 L474 L478	V108-Y215 VanDerWaalsContact CG1-OH 3.31Å; V108-Y215 WeakPolarHBondContact CG1-OH 3.3Å; I109-Y215 PolarHBondContact N-OH 2.72Å; I109-Y215 WeakPolarHBondContact O-CE1 3.23Å; I109-Y215 PolarHBondContact O-OH 3.12Å; I211-Y215 WeakPolarHBondContact O-CB 3.49Å; I211-Y215 PolarHBondContact O-N 3.49Å; A212-Y215 PolarHBondContact O-N 3.4Å; Y215-D217 PolarHBondContact O-N 3.25Å; Y215-S218 PolarHBondContact O-N 2.85Å; Y215-L220 HydrophobicContact CD2-CD1 4.38Å; Y215-V222 HydrophobicContact CD2-CG2 4.27Å; Y215-V222 HydrophobicContact CE2-CG2 4.16Å; Y215-Y271 HydrophobicContact CD2-CE2 4.27Å; Y215-Y271 WeakPolarHBondContact CE2-OH 3.42Å; Y215-L474 HydrophobicContact CD1-CD2 3.57Å; Y215-L474 HydrophobicContact CE1-CD2 4.25Å; Y215-L474 HydrophobicContact CG-CD2 4.24Å; Y215-L478 HydrophobicContact CD1-CD1 3.84Å; Y215-L478 HydrophobicContact CD2-CD1 3.78Å; Y215-L478 HydrophobicContact CD2-CD2 4.25Å; Y215-L478 HydrophobicContact CE1-CD1 4.41Å; Y215-L478 HydrophobicContact CE2-CD1 4.39Å; Y215-L478 HydrophobicContact CE2-CD2 4.11Å; Y215-L478 HydrophobicContact CG-CD1 3.47Å; Y215-L478 VanDerWaalsContact CG-CD1 3.47Å
216	L	93.5	Very high	83	Confident	32 Å²	32	39.5 Å²	39.5	17%	0.168	23%	0.227	C	C	.	.	H	α-helix	trans	-67.8	-35	-176.7	-66.7	176	0	0	0	112.7	A212 S218 I465 A468 L474	A212-L216 WeakPolarHBondContact O-CB 3.43Å; A212-L216 VanDerWaalsContact O-CG 3.25Å; A212-L216 WeakPolarHBondContact O-CG 3.49Å; A212-L216 PolarHBondContact O-N 2.94Å; L216-S218 PolarHBondContact O-N 3.07Å; L216-I465 HydrophobicContact CB-CB 3.69Å; L216-I465 HydrophobicContact CB-CD1 4.07Å; L216-I465 HydrophobicContact CB-CG1 4.45Å; L216-I465 HydrophobicContact CB-CG2 3.7Å; L216-I465 HydrophobicContact CD1-CB 4.16Å; L216-I465 WeakPolarHBondContact O-CG2 3.32Å; L216-A468 HydrophobicContact CD1-CB 4Å; L216-A468 HydrophobicContact CD2-CB 3.54Å; L216-A468 HydrophobicContact CG-CB 4.43Å; L216-L474 HydrophobicContact CD1-CD1 4.35Å; L216-L474 HydrophobicContact CD2-CD1 3.78Å; L216-L474 HydrophobicContact CG-CD1 4.23Å
217	D	92.1	Very high	80.5	Confident	52 Å²	52	44.1 Å²	44.1	28%	0.278	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	8.1	173.2	-160.4	68	0	0	0	112.9	T213 Y215 R219 L240	T213-D217 WeakPolarHBondContact O-CB 3.18Å; T213-D217 PolarHBondContact O-N 3.28Å; T213-D217 VanDerWaalsContact O-N 3.09Å; Y215-D217 PolarHBondContact O-N 3.25Å; D217-R219 VanDerWaalsContact C-N 3.29Å; D217-R219 HydrophobicContact CB-CG 4.16Å; D217-R219 PolarHBondContact O-N 2.99Å; D217-R219 IonicContact OD2-CZ 3.58Å; D217-R219 IonicContact OD2-NE 3.01Å; D217-R219 PolarHBondContact OD2-NE 3.38Å; D217-R219 IonicContact OD2-NH2 3.88Å; D217-R219 PolarHBondContact OD2-NH2 2.95Å; D217-L240 HydrophobicContact CB-CD1 3.8Å; D217-L240 WeakPolarHBondContact OD2-CD1 3.32Å
218	S	89.9	Confident	78	Confident	97 Å²	97	49.5 Å²	49.5	68%	0.678	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.3	34.2	178.2	-56.8	0	0	0	0	114.6	N214 Y215 L216	N214-S218 PolarHBondContact O-N 3.24Å; Y215-S218 PolarHBondContact O-N 2.85Å; L216-S218 PolarHBondContact O-N 3.07Å
219	R	88.8	Confident	75.3	Confident	62 Å²	62	53 Å²	53	23%	0.234	31%	0.305	C	S	.	.			trans	-98	-12.3	178.6	-56.7	-146.8	-175.9	-149.6	-4.8	114.4	N214 D217 P237 L238	N214-R219 HydrophobicContact CB-CB 4.27Å; N214-R219 WeakPolarHBondContact O-CA 3.49Å; N214-R219 PolarHBondContact O-N 2.91Å; D217-R219 VanDerWaalsContact C-N 3.29Å; D217-R219 HydrophobicContact CB-CG 4.16Å; D217-R219 PolarHBondContact O-N 2.99Å; D217-R219 IonicContact OD2-CZ 3.58Å; D217-R219 IonicContact OD2-NE 3.01Å; D217-R219 PolarHBondContact OD2-NE 3.38Å; D217-R219 IonicContact OD2-NH2 3.88Å; D217-R219 PolarHBondContact OD2-NH2 2.95Å; R219-P237 HydrophobicContact CB-CB 4.31Å; R219-P237 HydrophobicContact CG-CB 4.31Å; R219-L238 WeakPolarHBondContact CD-O 3.42Å; R219-L238 PolarHBondContact NH1-O 3.28Å
220	L	86.4	Confident	72.8	Confident	7 Å²	7	58 Å²	58	4%	0.037	35%	0.346	C	S	.	.	S	Bend	trans	-77.5	139.9	164.8	-57.4	-175.7	0	0	0	109.1	W210 I211 N214 Y215 V222 L270 Y271 Y275	W210-L220 HydrophobicContact CH2-CD2 4.11Å; W210-L220 HydrophobicContact CZ3-CD2 4.08Å; I211-L220 HydrophobicContact CG2-CD1 4.29Å; N214-L220 HydrophobicContact CB-CD2 3.74Å; N214-L220 HydrophobicContact CB-CG 3.91Å; N214-L220 PolarHBondContact O-N 3.16Å; Y215-L220 HydrophobicContact CD2-CD1 4.38Å; L220-V222 VanDerWaalsContact C-N 3.27Å; L220-V222 HydrophobicContact CB-CG2 4.27Å; L220-V222 PolarHBondContact O-N 3.12Å; L220-L270 HydrophobicContact CD1-CD1 3.98Å; L220-Y271 HydrophobicContact CB-CD2 4.25Å; L220-Y271 HydrophobicContact CB-CE2 4.35Å; L220-Y271 HydrophobicContact CD1-CE2 4.2Å; L220-Y275 HydrophobicContact CD2-CE1 4.26Å; L220-Y275 HydrophobicContact CD2-CE2 4.24Å
221	T	70.1	Confident	70.3	Confident	29 Å²	29	62.5 Å²	62.5	18%	0.178	37%	0.374	C	S	.	.			trans	-75.6	78.2	-178.6	-49.1	0	0	0	0	110.1	T223 Y271	T221-T223 VanDerWaalsContact C-N 3.29Å; T221-Y271 WeakPolarHBondContact O-CB 3.25Å
222	V	61.5	Low	67.9	Low	41 Å²	41	67 Å²	67	25%	0.248	42%	0.421	C	S	.	.			trans	-83	-5.9	180	-170.3	0	0	0	0	112	N103 V108 Y215 L220 D224 Y271	N103-V222 PolarHBondContact ND2-O 2.94Å; V108-V222 HydrophobicContact CG1-CG1 4.47Å; V108-V222 HydrophobicContact CG2-CG1 3.79Å; Y215-V222 HydrophobicContact CD2-CG2 4.27Å; Y215-V222 HydrophobicContact CE2-CG2 4.16Å; L220-V222 VanDerWaalsContact C-N 3.27Å; L220-V222 HydrophobicContact CB-CG2 4.27Å; L220-V222 PolarHBondContact O-N 3.12Å; V222-D224 PolarHBondContact O-N 3.3Å; V222-Y271 HydrophobicContact CG1-CD1 4.44Å; V222-Y271 HydrophobicContact CG1-CE1 4.01Å; V222-Y271 HydrophobicContact CG2-CD2 4.16Å; V222-Y271 HydrophobicContact CG2-CE1 4.31Å; V222-Y271 HydrophobicContact CG2-CE2 3.85Å
223	T	55.7	Low	65.4	Low	61 Å²	61	77.3 Å²	77.3	37%	0.374	46%	0.46	S	S	.	.			trans	-68.7	128.7	-175.9	51.1	0	0	0	0	112.2	T221	T221-T223 VanDerWaalsContact C-N 3.29Å
224	D	50.6	Low	63.3	Low	110 Å²	110	82.4 Å²	82.4	59%	0.588	50%	0.495	S	S	*	.			trans	-51.7	138.7	160.8	-56.2	-36.4	0	0	0	108.5	N103 V222 H226	N103-D224 PolarHBondContact ND2-OD1 2.9Å; V222-D224 PolarHBondContact O-N 3.3Å; D224-H226 PolarHBondContact O-N 2.8Å
225	G	44.9	Very low	61.6	Low	78 Å²	78	84.7 Å²	84.7	80%	0.804	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	18.3	-166.8	0	0	0	0	0	118.2
226	H	44.4	Very low	60.6	Low	182 Å²	182	86.2 Å²	86.2	84%	0.843	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.6	-6.8	-174	-66.9	74.5	0	0	0	115	D224	D224-H226 PolarHBondContact O-N 2.8Å
227	S	44.9	Very low	59.8	Low	96 Å²	96	86.9 Å²	86.9	67%	0.671	52%	0.523	S	S	*	.	S	Bend	trans	-117.4	10.4	-169.6	-61.1	0	0	0	0	116.9
228	R	46	Very low	59.5	Low	130 Å²	130	91.2 Å²	91.2	49%	0.491	55%	0.545	S	S	.	.	S	Bend	trans	-125.8	117	171.1	-62.4	-173.3	96.8	100.2	1.2	110	A230 S235	R228-A230 PolarHBondContact O-N 3.03Å; R228-S235 VanDerWaalsContact CZ-O 3.24Å; R228-S235 PolarHBondContact NE-O 3.38Å; R228-S235 PolarHBondContact NE-OG 3.33Å; R228-S235 PolarHBondContact NH2-O 3.32Å
229	P	40.8	Very low	59.6	Low	106 Å²	106	87.2 Å²	87.2	69%	0.688	52%	0.518	S	S	*	.			trans	-51.5	133	165.4	-20.9	31	0	0	0	108.2	T231	P229-T231 PolarHBondContact O-N 3.15Å
230	A	45	Very low	59.9	Low	107 Å²	107	84.8 Å²	84.8	88%	0.884	51%	0.509	S	S	*	.			trans	-67.7	64.2	173.1	0	0	0	0	0	110.1	R228 G232	R228-A230 PolarHBondContact O-N 3.03Å; A230-G232 PolarHBondContact O-N 2.84Å
231	T	45.3	Very low	60.4	Low	94 Å²	94	84.5 Å²	84.5	58%	0.577	51%	0.508	S	S	*	.			trans	-69.3	119.9	158	55.3	0	0	0	0	105	P229 R233	P229-T231 PolarHBondContact O-N 3.15Å; T231-R233 CarbonylContact O-C 3.59Å; T231-R233 PolarHBondContact O-N 2.79Å
232	G	44.1	Very low	61.8	Low	96 Å²	96	83.2 Å²	83.2	99%	0.99	50%	0.5	S	S	*	.	S	Bend	trans	-64.4	20.9	-164.8	0	0	0	0	0	117.1	A230	A230-G232 PolarHBondContact O-N 2.84Å
233	R	44.6	Very low	63.5	Low	216 Å²	216	81.2 Å²	81.2	82%	0.815	49%	0.488	S	S	*	.	S	Bend	trans	-116.1	121.2	168.7	-163.5	171.4	-168	158.6	2.3	104.9	T231 S235	T231-R233 CarbonylContact O-C 3.59Å; T231-R233 PolarHBondContact O-N 2.79Å; R233-S235 VanDerWaalsContact C-N 3.29Å; R233-S235 WeakPolarHBondContact O-CA 3.38Å; R233-S235 PolarHBondContact O-N 3.5Å
234	S	51.9	Low	65.5	Low	106 Å²	106	78.6 Å²	78.6	74%	0.741	47%	0.471	S	S	*	.			trans	-44.1	99.1	173.7	44.5	0	0	0	0	108.5	R236	S234-R236 PolarHBondContact O-N 2.72Å
235	S	59.7	Low	67.8	Low	48 Å²	48	73.4 Å²	73.4	34%	0.336	44%	0.444	S	S	.	.			trans	-78.9	30.9	-172.5	58.4	0	0	0	0	110	R228 R233	R228-S235 VanDerWaalsContact CZ-O 3.24Å; R228-S235 PolarHBondContact NE-O 3.38Å; R228-S235 PolarHBondContact NE-OG 3.33Å; R228-S235 PolarHBondContact NH2-O 3.32Å; R233-S235 VanDerWaalsContact C-N 3.29Å; R233-S235 WeakPolarHBondContact O-CA 3.38Å; R233-S235 PolarHBondContact O-N 3.5Å
236	R	71.6	Confident	70.2	Confident	61 Å²	61	70.7 Å²	70.7	23%	0.23	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-69.5	133.5	178.4	-173.5	-180	62.3	82.6	-5.9	107.8	S234 L238 E255	S234-R236 PolarHBondContact O-N 2.72Å; R236-L238 PolarHBondContact O-N 3.47Å; R236-E255 IonicContact CZ-OE1 3.31Å; R236-E255 IonicContact CZ-OE2 3.69Å; R236-E255 IonicContact NH1-OE2 2.84Å; R236-E255 PolarHBondContact NH1-OE2 3.37Å; R236-E255 IonicContact NH2-OE1 2.8Å; R236-E255 PolarHBondContact NH2-OE1 2.83Å; R236-E255 IonicContact NH2-OE2 3.06Å; R236-E255 PolarHBondContact NH2-OE2 3.44Å
237	P	77	Confident	72.5	Confident	46 Å²	46	62.4 Å²	62.4	30%	0.299	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-54	138.9	169.7	-23	33.6	0	0	0	110.5	R219 S239	R219-P237 HydrophobicContact CB-CB 4.31Å; R219-P237 HydrophobicContact CG-CB 4.31Å; P237-S239 PolarHBondContact O-N 3.09Å
238	L	86.4	Confident	75	Confident	142 Å²	142	57.9 Å²	57.9	74%	0.743	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-53.2	128.9	169.5	-73.4	164.8	0	0	0	108.8	R219 R236	R219-L238 WeakPolarHBondContact CD-O 3.42Å; R219-L238 PolarHBondContact NH1-O 3.28Å; R236-L238 PolarHBondContact O-N 3.47Å
239	S	92.6	Very high	77.4	Confident	14 Å²	14	51.8 Å²	51.8	10%	0.098	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-68.3	153.9	178.3	55.8	0	0	0	0	111.1	W210 N214 P237 E255	W210-S239 VanDerWaalsContact CZ2-CB 3.49Å; N214-S239 VanDerWaalsContact OD1-CA 3.24Å; N214-S239 WeakPolarHBondContact OD1-CA 3.49Å; N214-S239 VanDerWaalsContact OD1-CB 3.29Å; N214-S239 WeakPolarHBondContact OD1-CB 3.35Å; P237-S239 PolarHBondContact O-N 3.09Å; S239-E255 WeakPolarHBondContact CB-OE2 3.1Å; S239-E255 WeakPolarHBondContact OG-CB 3.34Å; S239-E255 PolarHBondContact OG-OE2 3.23Å
240	L	95.3	Very high	80	Confident	10 Å²	10	46.7 Å²	46.7	5%	0.052	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-83.1	145.9	167.4	-65.2	170.1	0	0	0	109.5	W210 T213 N214 D217 N382 V384	W210-L240 PolarHBondContact NE1-O 2.92Å; T213-L240 HydrophobicContact CG2-CB 4.13Å; T213-L240 HydrophobicContact CG2-CD1 4.16Å; N214-L240 PolarHBondContact ND2-O 2.99Å; N214-L240 PolarHBondContact OD1-N 3.48Å; D217-L240 HydrophobicContact CB-CD1 3.8Å; D217-L240 WeakPolarHBondContact OD2-CD1 3.32Å; L240-N382 CarbonylContact C-O 3.6Å; L240-N382 VanDerWaalsContact CA-O 3.29Å; L240-N382 WeakPolarHBondContact CA-O 3.1Å; L240-N382 HydrophobicContact CD2-CB 3.83Å; L240-V384 HydrophobicContact CD1-CG2 3.88Å
241	G	96.8	Very high	82.5	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.01	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	157.1	159.1	0	0	0	0	0	111.6	V253 N382 F383 V384	G241-V253 CarbonylContact C-O 3.55Å; G241-V253 WeakPolarHBondContact CA-O 3.36Å; G241-N382 PolarHBondContact N-O 3.03Å; G241-F383 VanDerWaalsContact C-CD1 3.48Å; G241-F383 VanDerWaalsContact CA-CD1 3.43Å; G241-F383 CarbonylContact O-C 3.53Å; G241-F383 WeakPolarHBondContact O-CA 3.09Å; G241-V384 PolarHBondContact O-N 2.94Å
242	S	98	Very high	85	Confident	2 Å²	2	37.2 Å²	37.2	1%	0.014	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	125.7	-174.7	171.1	0	0	0	0	109.3	V253 F386	S242-V253 PolarHBondContact N-O 3.43Å; S242-V253 PolarHBondContact O-N 3.34Å; S242-F386 VanDerWaalsContact OG-CE1 3.27Å; S242-F386 WeakPolarHBondContact OG-CE1 3.24Å
243	L	98.4	Very high	87.5	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	115.9	176.6	-52.6	178.6	0	0	0	109.8	Q251 I252 F383 V384 A385 F386 F389 L445 Y449 L451 L459	L243-Q251 WeakPolarHBondContact CA-O 3.38Å; L243-I252 HydrophobicContact CD2-CB 3.78Å; L243-I252 HydrophobicContact CD2-CD1 3.76Å; L243-I252 HydrophobicContact CD2-CG1 3.52Å; L243-F383 HydrophobicContact CD1-CB 4.2Å; L243-F383 HydrophobicContact CD1-CD1 4.22Å; L243-F383 HydrophobicContact CD1-CG 4.45Å; L243-F383 HydrophobicContact CD2-CD1 3.69Å; L243-F383 HydrophobicContact CD2-CE1 4.04Å; L243-F383 HydrophobicContact CG-CB 4.31Å; L243-F383 HydrophobicContact CG-CD1 3.77Å; L243-F383 HydrophobicContact CG-CG 4.41Å; L243-V384 PolarHBondContact N-O 2.87Å; L243-A385 HydrophobicContact CB-CB 3.99Å; L243-A385 HydrophobicContact CD1-CB 4.36Å; L243-A385 VanDerWaalsContact O-CA 3.31Å; L243-A385 WeakPolarHBondContact O-CA 3.35Å; L243-F386 VanDerWaalsContact O-CD1 3.3Å; L243-F386 WeakPolarHBondContact O-CD1 3.17Å; L243-F386 VanDerWaalsContact O-CE1 3.3Å; L243-F386 WeakPolarHBondContact O-CE1 3.49Å; L243-F386 PolarHBondContact O-N 3.41Å; L243-F389 HydrophobicContact CB-CD2 4.14Å; L243-F389 HydrophobicContact CB-CE2 3.86Å; L243-L445 HydrophobicContact CD1-CD2 3.69Å; L243-Y449 HydrophobicContact CD1-CD2 4.45Å; L243-Y449 HydrophobicContact CD2-CD2 4Å; L243-Y449 HydrophobicContact CD2-CE2 4.05Å; L243-L451 HydrophobicContact CD1-CD1 4.04Å; L243-L459 HydrophobicContact CD1-CD1 4.07Å
244	D	98.1	Very high	89.9	Confident	5 Å²	5	22.4 Å²	22.4	3%	0.027	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	131.6	177	-164	-6.3	0	0	0	109.5	T250 Q251 F386 S387	D244-T250 CarbonylContact O-C 3.6Å; D244-T250 WeakPolarHBondContact O-CA 3.45Å; D244-T250 WeakPolarHBondContact O-CB 3.38Å; D244-T250 PolarHBondContact O-OG1 2.8Å; D244-Q251 HydrophobicContact CB-CB 4Å; D244-Q251 PolarHBondContact N-O 3.29Å; D244-Q251 PolarHBondContact O-N 3.4Å; D244-F386 HydrophobicContact CB-CE1 4.28Å; D244-F386 HydrophobicContact CB-CE2 3.68Å; D244-F386 HydrophobicContact CB-CZ 3.43Å; D244-F386 VanDerWaalsContact CB-CZ 3.43Å; D244-F386 WeakPolarHBondContact OD1-CE2 3.48Å; D244-S387 WeakPolarHBondContact OD1-CB 3.29Å; D244-S387 PolarHBondContact OD1-OG 3.2Å
245	L	97.6	Very high	92	Very high	1 Å²	1	19.3 Å²	19.3	1%	0.005	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	99.1	170.3	177	61.7	0	0	0	109.7	A287 S387 G388 F389 I392 Y440 L444	L245-A287 HydrophobicContact CD1-CB 4.37Å; L245-A287 HydrophobicContact CD2-CB 4.39Å; L245-A287 HydrophobicContact CG-CB 4.36Å; L245-S387 WeakPolarHBondContact O-CB 2.97Å; L245-G388 VanDerWaalsContact O-CA 3.26Å; L245-G388 WeakPolarHBondContact O-CA 3.13Å; L245-G388 PolarHBondContact O-N 2.82Å; L245-F389 HydrophobicContact CB-CD1 4.22Å; L245-F389 HydrophobicContact CB-CD2 3.39Å; L245-F389 HydrophobicContact CB-CE1 4.26Å; L245-F389 HydrophobicContact CB-CE2 3.45Å; L245-F389 VanDerWaalsContact CB-CE2 3.45Å; L245-F389 HydrophobicContact CB-CG 3.79Å; L245-F389 HydrophobicContact CB-CZ 3.9Å; L245-F389 HydrophobicContact CD2-CD1 3.91Å; L245-F389 HydrophobicContact CD2-CE1 3.89Å; L245-F389 HydrophobicContact CD2-CG 4.25Å; L245-F389 HydrophobicContact CD2-CZ 4.23Å; L245-I392 HydrophobicContact CD2-CD1 3.98Å; L245-Y440 HydrophobicContact CD1-CE1 4.23Å; L245-L444 HydrophobicContact CD1-CD1 4.01Å; L245-L444 HydrophobicContact CD2-CD1 4.41Å
246	G	95.5	Very high	93.6	Very high	21 Å²	21	17.7 Å²	17.7	22%	0.216	10%	0.099	C	C	.	.			trans	-86.6	-175.2	173.7	0	0	0	0	0	113.3	S249 G286 A287	G246-S249 WeakPolarHBondContact CA-O 3.37Å; G246-S249 PolarHBondContact N-O 2.75Å; G246-G286 CarbonylContact O-C 3.58Å; G246-G286 VanDerWaalsContact O-CA 3.29Å; G246-G286 WeakPolarHBondContact O-CA 3.31Å; G246-A287 PolarHBondContact O-N 2.84Å
247	G	93.7	Very high	94.4	Very high	9 Å²	9	17.8 Å²	17.8	9%	0.093	11%	0.109	C	C	.	.	S	Bend	trans	-68.4	-36.8	174.2	0	0	0	0	0	113.1	S89 G286 A287 N288 E289	S89-G247 VanDerWaalsContact OG-CA 3.31Å; S89-G247 WeakPolarHBondContact OG-CA 3Å; S89-G247 PolarHBondContact OG-N 2.9Å; G247-G286 CarbonylContact O-C 3.59Å; G247-G286 VanDerWaalsContact O-CA 3.31Å; G247-G286 WeakPolarHBondContact O-CA 3.43Å; G247-A287 PolarHBondContact O-N 2.93Å; G247-N288 WeakPolarHBondContact O-CB 3.49Å; G247-N288 PolarHBondContact O-N 3.48Å; G247-E289 PolarHBondContact O-N 3.09Å
248	A	95.9	Very high	94.8	Very high	1 Å²	1	21 Å²	21	1%	0.008	12%	0.124	C	C	.	.	S	Bend	trans	-119	-11.9	-174.6	0	0	0	0	0	116.9	S89 A163 L167 C284 G286 E289	S89-A248 PolarHBondContact OG-N 3.48Å; A163-A248 HydrophobicContact CB-CB 3.53Å; L167-A248 HydrophobicContact CD1-CB 3.58Å; L167-A248 HydrophobicContact CG-CB 4.42Å; A248-C284 PolarHBondContact O-N 3.36Å; A248-G286 VanDerWaalsContact C-CA 3.47Å; A248-G286 PolarHBondContact O-N 2.82Å; A248-E289 HydrophobicContact CB-CG 3.82Å
249	S	96.3	Very high	94.9	Very high	1 Å²	1	21.3 Å²	21.3	1%	0.007	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	165	172.3	61.1	0	0	0	0	112	A163 R166 G246 Q251 Y282	A163-S249 WeakPolarHBondContact CB-OG 3.43Å; R166-S249 PolarHBondContact NH2-OG 3.39Å; G246-S249 WeakPolarHBondContact CA-O 3.37Å; G246-S249 PolarHBondContact N-O 2.75Å; S249-Q251 PolarHBondContact OG-NE2 2.98Å; S249-Q251 VanDerWaalsContact OG-NE2 3.08Å; S249-Y282 WeakPolarHBondContact CA-O 3.42Å; S249-Y282 VanDerWaalsContact CB-O 3.32Å; S249-Y282 WeakPolarHBondContact CB-O 3.39Å
250	T	97.2	Very high	94.6	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	147.4	170.7	-170.9	0	0	0	0	109.7	D244 S281 Y282 C285 F370 L444 Y449	D244-T250 CarbonylContact O-C 3.6Å; D244-T250 WeakPolarHBondContact O-CA 3.45Å; D244-T250 WeakPolarHBondContact O-CB 3.38Å; D244-T250 PolarHBondContact O-OG1 2.8Å; T250-S281 WeakPolarHBondContact O-CA 3.41Å; T250-Y282 HydrophobicContact CG2-CD2 4.23Å; T250-Y282 PolarHBondContact N-O 3.28Å; T250-Y282 PolarHBondContact O-N 2.89Å; T250-C285 HydrophobicContact CG2-CB 3.69Å; T250-F370 HydrophobicContact CG2-CE2 4.45Å; T250-F370 HydrophobicContact CG2-CZ 4.44Å; T250-L444 HydrophobicContact CG2-CD1 4.45Å; T250-L444 HydrophobicContact CG2-CD2 4.25Å; T250-Y449 WeakPolarHBondContact CB-OH 3.2Å; T250-Y449 WeakPolarHBondContact CG2-OH 3.5Å; T250-Y449 PolarHBondContact OG1-OH 3.49Å
251	Q	97.2	Very high	94.1	Very high	2 Å²	2	28.2 Å²	28.2	1%	0.009	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	143.1	-174.3	-71.4	74.9	-2.9	0	0	110.7	E205 L243 D244 S249 R280 S281	E205-Q251 VanDerWaalsContact CD-NE2 3.34Å; E205-Q251 PolarHBondContact OE2-NE2 3.15Å; L243-Q251 WeakPolarHBondContact CA-O 3.38Å; D244-Q251 HydrophobicContact CB-CB 4Å; D244-Q251 PolarHBondContact N-O 3.29Å; D244-Q251 PolarHBondContact O-N 3.4Å; S249-Q251 PolarHBondContact OG-NE2 2.98Å; S249-Q251 VanDerWaalsContact OG-NE2 3.08Å; Q251-R280 VanDerWaalsContact CA-O 3.26Å; Q251-R280 WeakPolarHBondContact CA-O 3.49Å; Q251-S281 PolarHBondContact NE2-OG 3.35Å
252	I	96.2	Very high	93.7	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	126.6	169.2	177.4	164.4	0	0	0	108.9	L243 F254 R280 Y282 V379 F383 Y449	L243-I252 HydrophobicContact CD2-CB 3.78Å; L243-I252 HydrophobicContact CD2-CD1 3.76Å; L243-I252 HydrophobicContact CD2-CG1 3.52Å; I252-F254 HydrophobicContact CD1-CD1 4.38Å; I252-F254 HydrophobicContact CD1-CE1 4.28Å; I252-F254 HydrophobicContact CG1-CD1 4.06Å; I252-F254 HydrophobicContact CG1-CE1 4.27Å; I252-R280 HydrophobicContact CG2-CB 3.93Å; I252-R280 PolarHBondContact N-O 3.31Å; I252-R280 PolarHBondContact O-N 3.3Å; I252-Y282 HydrophobicContact CG2-CE2 4.08Å; I252-V379 HydrophobicContact CD1-CG1 4.14Å; I252-F383 HydrophobicContact CD1-CE1 4.24Å; I252-F383 HydrophobicContact CG1-CE1 4.18Å; I252-Y449 HydrophobicContact CB-CD1 4.24Å; I252-Y449 HydrophobicContact CB-CE1 3.92Å; I252-Y449 HydrophobicContact CB-CE2 4.36Å; I252-Y449 HydrophobicContact CD1-CD1 3.99Å; I252-Y449 HydrophobicContact CD1-CD2 4.3Å; I252-Y449 HydrophobicContact CD1-CG 3.86Å; I252-Y449 HydrophobicContact CG2-CD1 4.03Å; I252-Y449 HydrophobicContact CG2-CE1 3.66Å
253	V	97.4	Very high	93.2	Very high	0 Å²	0	36 Å²	36	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	131.7	179.5	-173.4	0	0	0	0	110.6	G206 W210 G241 S242 L277 Y278 V279	G206-V253 WeakPolarHBondContact O-CG2 3.4Å; W210-V253 HydrophobicContact CB-CB 3.97Å; W210-V253 HydrophobicContact CB-CG1 3.58Å; W210-V253 HydrophobicContact CG-CB 4.32Å; W210-V253 HydrophobicContact CG-CG1 3.67Å; G241-V253 CarbonylContact C-O 3.55Å; G241-V253 WeakPolarHBondContact CA-O 3.36Å; S242-V253 PolarHBondContact N-O 3.43Å; S242-V253 PolarHBondContact O-N 3.34Å; V253-L277 HydrophobicContact CG1-CB 4.23Å; V253-L277 HydrophobicContact CG1-CD1 4.22Å; V253-Y278 VanDerWaalsContact CA-O 3.32Å; V253-Y278 WeakPolarHBondContact CA-O 3.4Å; V253-V279 HydrophobicContact CG1-CG2 3.93Å; V253-V279 HydrophobicContact CG2-CB 4.4Å; V253-V279 HydrophobicContact CG2-CG1 3.83Å; V253-V279 HydrophobicContact CG2-CG2 4.46Å
254	F	96	Very high	92.9	Very high	1 Å²	1	38.1 Å²	38.1	0%	0.004	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	159.3	172.7	59.1	-83.9	0	0	0	110.7	I252 I256 L277 Y278 P377 V379 F383	I252-F254 HydrophobicContact CD1-CD1 4.38Å; I252-F254 HydrophobicContact CD1-CE1 4.28Å; I252-F254 HydrophobicContact CG1-CD1 4.06Å; I252-F254 HydrophobicContact CG1-CE1 4.27Å; F254-I256 HydrophobicContact CD2-CG2 3.92Å; F254-I256 HydrophobicContact CE2-CG2 3.6Å; F254-I256 HydrophobicContact CZ-CG2 4.43Å; F254-L277 CarbonylContact O-C 3.41Å; F254-L277 WeakPolarHBondContact O-CA 3.46Å; F254-Y278 HydrophobicContact CD1-CD1 4.16Å; F254-Y278 AromaticContact CE1-CD1 3.46Å; F254-Y278 HydrophobicContact CE1-CD1 3.46Å; F254-Y278 VanDerWaalsContact CE1-CD1 3.46Å; F254-Y278 HydrophobicContact CE1-CE1 4.15Å; F254-Y278 HydrophobicContact CE1-CG 4.19Å; F254-Y278 AromaticContact CZ-CD1 3.88Å; F254-Y278 HydrophobicContact CZ-CD1 3.88Å; F254-Y278 HydrophobicContact CZ-CG 4.21Å; F254-Y278 PolarHBondContact N-O 3.14Å; F254-Y278 PolarHBondContact O-N 3.29Å; F254-P377 HydrophobicContact CE2-CB 4.48Å; F254-P377 HydrophobicContact CZ-CB 4.36Å; F254-V379 HydrophobicContact CE1-CG1 4Å; F254-V379 HydrophobicContact CZ-CG1 4.18Å; F254-F383 HydrophobicContact CB-CE1 3.98Å; F254-F383 HydrophobicContact CB-CZ 3.86Å; F254-F383 HydrophobicContact CD1-CE1 4.05Å; F254-F383 AromaticContact CD1-CZ 3.9Å; F254-F383 HydrophobicContact CD1-CZ 3.9Å; F254-F383 HydrophobicContact CG-CE1 4.32Å; F254-F383 AromaticContact CG-CZ 3.97Å; F254-F383 HydrophobicContact CG-CZ 3.97Å
255	E	94.3	Very high	92.7	Very high	40 Å²	40	39.2 Å²	39.2	19%	0.187	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	140.1	178.1	-169.5	174.4	-178.3	0	0	111.1	R236 S239 R276 L277 S380	R236-E255 IonicContact CZ-OE1 3.31Å; R236-E255 IonicContact CZ-OE2 3.69Å; R236-E255 IonicContact NH1-OE2 2.84Å; R236-E255 PolarHBondContact NH1-OE2 3.37Å; R236-E255 IonicContact NH2-OE1 2.8Å; R236-E255 PolarHBondContact NH2-OE1 2.83Å; R236-E255 IonicContact NH2-OE2 3.06Å; R236-E255 PolarHBondContact NH2-OE2 3.44Å; S239-E255 WeakPolarHBondContact CB-OE2 3.1Å; S239-E255 WeakPolarHBondContact OG-CB 3.34Å; S239-E255 PolarHBondContact OG-OE2 3.23Å; E255-R276 WeakPolarHBondContact CA-O 3.4Å; E255-R276 WeakPolarHBondContact CG-O 3.37Å; E255-L277 HydrophobicContact CB-CD2 4Å; E255-L277 HydrophobicContact CG-CD2 4.3Å; E255-S380 PolarHBondContact O-OG 3Å
256	I	93.6	Very high	92.6	Very high	14 Å²	14	44 Å²	44	7%	0.072	25%	0.246	C	C	.	.			trans	-123.4	155.2	-179.2	56.4	171.4	0	0	0	111.3	F254 T260 T262 R276 P377	F254-I256 HydrophobicContact CD2-CG2 3.92Å; F254-I256 HydrophobicContact CE2-CG2 3.6Å; F254-I256 HydrophobicContact CZ-CG2 4.43Å; I256-T260 HydrophobicContact CB-CG2 4.14Å; I256-T260 HydrophobicContact CD1-CG2 4.07Å; I256-T260 HydrophobicContact CG2-CG2 4.28Å; I256-T262 HydrophobicContact CD1-CG2 3.63Å; I256-R276 HydrophobicContact CD1-CG 4.26Å; I256-R276 HydrophobicContact CG1-CG 3.97Å; I256-R276 PolarHBondContact N-O 2.92Å; I256-P377 HydrophobicContact CG2-CB 4.39Å; I256-P377 HydrophobicContact CG2-CG 4.49Å
257	S	89.8	Confident	92.4	Very high	64 Å²	64	49.9 Å²	49.9	45%	0.448	26%	0.262	S	S	.	.			trans	-68.3	160.6	174.2	73.1	0	0	0	0	111.3	D259 T260	S257-D259 PolarHBondContact O-N 2.72Å; S257-T260 WeakPolarHBondContact O-CB 3.35Å; S257-T260 PolarHBondContact O-N 2.67Å; S257-T260 PolarHBondContact O-OG1 3.35Å; S257-T260 PolarHBondContact OG-N 2.72Å; S257-T260 PolarHBondContact OG-OG1 3.08Å
258	N	84.9	Confident	92.3	Very high	113 Å²	113	50 Å²	50	60%	0.604	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-23	175.9	-78.1	-32.8	0	0	0	113.5	T260 R276	N258-T260 VanDerWaalsContact C-N 3.3Å; N258-R276 VanDerWaalsContact CA-NH1 3.29Å; N258-R276 PolarHBondContact O-NH1 2.89Å; N258-R276 WeakPolarHBondContact OD1-CD 3.48Å
259	D	87.2	Confident	92	Very high	148 Å²	148	57.9 Å²	57.9	79%	0.791	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-9.8	179.7	-51.2	-44.1	0	0	0	112.6	S257 V261	S257-D259 PolarHBondContact O-N 2.72Å; D259-V261 PolarHBondContact O-N 3.21Å
260	T	87.2	Confident	91.5	Very high	31 Å²	31	57.9 Å²	57.9	19%	0.19	29%	0.29	C	S	.	.			trans	-72.2	115.7	178.1	-59.9	0	0	0	0	110.3	I256 S257 N258 T262 R276 P377	I256-T260 HydrophobicContact CB-CG2 4.14Å; I256-T260 HydrophobicContact CD1-CG2 4.07Å; I256-T260 HydrophobicContact CG2-CG2 4.28Å; S257-T260 WeakPolarHBondContact O-CB 3.35Å; S257-T260 PolarHBondContact O-N 2.67Å; S257-T260 PolarHBondContact O-OG1 3.35Å; S257-T260 PolarHBondContact OG-N 2.72Å; S257-T260 PolarHBondContact OG-OG1 3.08Å; N258-T260 VanDerWaalsContact C-N 3.3Å; T260-T262 HydrophobicContact CG2-CG2 4.45Å; T260-R276 PolarHBondContact O-NH2 2.94Å; T260-P377 HydrophobicContact CG2-CB 3.53Å; T260-P377 HydrophobicContact CG2-CG 3.31Å
261	V	84	Confident	91	Very high	139 Å²	139	58 Å²	58	84%	0.842	29%	0.29	S	S	*	.			trans	-85.6	119.3	177.5	-178.5	0	0	0	0	110.1	D259	D259-V261 PolarHBondContact O-N 3.21Å
262	T	88.3	Confident	90.3	Very high	18 Å²	18	59.2 Å²	59.2	11%	0.11	30%	0.304	C	S	.	.			trans	-165.6	140.8	176.5	-177.1	0	0	0	0	112	I256 T260 H264 S265 Y278 P377	I256-T262 HydrophobicContact CD1-CG2 3.63Å; T260-T262 HydrophobicContact CG2-CG2 4.45Å; T262-H264 PolarHBondContact O-N 3.24Å; T262-H264 PolarHBondContact OG1-N 3.28Å; T262-S265 PolarHBondContact O-OG 2.98Å; T262-Y278 HydrophobicContact CG2-CD2 3.99Å; T262-Y278 WeakPolarHBondContact OG1-CE2 3.47Å; T262-P377 HydrophobicContact CG2-CG 4.23Å
263	D	88.6	Confident	89.8	Confident	147 Å²	147	62.9 Å²	62.9	79%	0.786	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-6	175.4	-61.6	-31.5	0	0	0	113.3
264	H	91.8	Very high	89.4	Confident	46 Å²	46	66.8 Å²	66.8	21%	0.213	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	25.4	-178.3	-56.6	-48.1	0	0	0	112.5	T262 Y278 V279 R280 E374	T262-H264 PolarHBondContact O-N 3.24Å; T262-H264 PolarHBondContact OG1-N 3.28Å; H264-Y278 HydrophobicContact CB-CD2 3.96Å; H264-Y278 HydrophobicContact CB-CE2 3.66Å; H264-V279 PolarHBondContact O-N 3.48Å; H264-R280 HydrophobicContact CB-CG 4.47Å; H264-R280 PolarHBondContact CE1-NH1 3.09Å; H264-R280 PolarHBondContact NE2-NH1 3.5Å; H264-E374 IonicContact NE2-OE2 3.19Å
265	S	93.8	Very high	89.2	Confident	27 Å²	27	66.9 Å²	66.9	19%	0.189	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	145.1	173.7	62.4	0	0	0	0	112	T262 L277	T262-S265 PolarHBondContact O-OG 2.98Å; S265-L277 CarbonylContact C-O 3.58Å; S265-L277 WeakPolarHBondContact CA-O 3.39Å
266	R	94.9	Very high	89.2	Confident	103 Å²	103	66.7 Å²	66.7	39%	0.389	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	139.7	171.8	-67.7	-64.2	-178.4	-87.4	2.1	109.7	V203 L207 L277 V279	V203-R266 HydrophobicContact CG1-CG 4.02Å; L207-R266 HydrophobicContact CD1-CB 4.07Å; R266-L277 PolarHBondContact N-O 3.21Å; R266-L277 PolarHBondContact O-N 2.77Å; R266-V279 HydrophobicContact CB-CG2 4.03Å; R266-V279 HydrophobicContact CG-CB 4.37Å; R266-V279 HydrophobicContact CG-CG2 4Å
267	Y	93	Very high	89.3	Confident	144 Å²	144	66 Å²	66	57%	0.565	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.1	132.3	171.8	-70.3	-84.8	0	0	0	109.5	T274 Y275 R276	Y267-T274 HydrophobicContact CD1-CG2 3.93Å; Y267-Y275 WeakPolarHBondContact CA-O 3.46Å; Y267-R276 HydrophobicContact CD1-CB 4.21Å; Y267-R276 HydrophobicContact CD1-CG 4.38Å; Y267-R276 HydrophobicContact CE1-CB 3.93Å; Y267-R276 HydrophobicContact CE1-CG 3.91Å
268	L	91.3	Very high	89.5	Confident	10 Å²	10	63 Å²	63	5%	0.052	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	132.4	178.7	168.6	65.4	0	0	0	108.5	L207 W210 I211 L270 T274 Y275 L277	L207-L268 HydrophobicContact CD2-CD1 4.2Å; L207-L268 HydrophobicContact CD2-CD2 4.43Å; W210-L268 HydrophobicContact CE3-CD2 3.99Å; W210-L268 HydrophobicContact CZ3-CD2 3.78Å; I211-L268 HydrophobicContact CD1-CD1 3.81Å; I211-L268 HydrophobicContact CD1-CD2 3.65Å; I211-L268 HydrophobicContact CD1-CG 4.36Å; I211-L268 HydrophobicContact CG1-CD2 3.41Å; I211-L268 VanDerWaalsContact CG1-CD2 3.41Å; L268-L270 HydrophobicContact CD1-CD1 4.25Å; L268-L270 HydrophobicContact CD1-CD2 4.35Å; L268-L270 HydrophobicContact CD1-CG 3.93Å; L268-L270 HydrophobicContact CD2-CD1 3.86Å; L268-L270 HydrophobicContact CD2-CG 4.28Å; L268-L270 HydrophobicContact CG-CD1 4.19Å; L268-L270 HydrophobicContact CG-CG 4.05Å; L268-T274 CarbonylContact O-C 3.57Å; L268-T274 WeakPolarHBondContact O-CA 3.47Å; L268-Y275 PolarHBondContact N-O 3.03Å; L268-Y275 PolarHBondContact O-N 3.06Å; L268-L277 HydrophobicContact CB-CD1 4.4Å; L268-L277 HydrophobicContact CD2-CD1 4.12Å
269	R	88.6	Confident	90	Very high	168 Å²	168	57.8 Å²	57.8	63%	0.634	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.3	119.5	174.8	-166.6	175.7	-173.5	-176	-1.9	110.9	E273	R269-E273 CarbonylContact C-O 3.59Å; R269-E273 VanDerWaalsContact CA-O 3.23Å; R269-E273 WeakPolarHBondContact CA-O 3.49Å; R269-E273 WeakPolarHBondContact CG-O 3.3Å
270	L	87.2	Confident	90.4	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.005	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	139.2	177.4	-67.5	176.3	0	0	0	109.9	T106 I211 L220 L268 G272 E273 Y275	T106-L270 HydrophobicContact CG2-CD2 4.21Å; I211-L270 HydrophobicContact CB-CD1 4.26Å; I211-L270 HydrophobicContact CD1-CD1 3.86Å; I211-L270 HydrophobicContact CG1-CD1 3.72Å; I211-L270 HydrophobicContact CG2-CD1 3.59Å; L220-L270 HydrophobicContact CD1-CD1 3.98Å; L268-L270 HydrophobicContact CD1-CD1 4.25Å; L268-L270 HydrophobicContact CD1-CD2 4.35Å; L268-L270 HydrophobicContact CD1-CG 3.93Å; L268-L270 HydrophobicContact CD2-CD1 3.86Å; L268-L270 HydrophobicContact CD2-CG 4.28Å; L268-L270 HydrophobicContact CG-CD1 4.19Å; L268-L270 HydrophobicContact CG-CG 4.05Å; L270-G272 PolarHBondContact O-N 3.38Å; L270-G272 VanDerWaalsContact O-N 3.12Å; L270-E273 PolarHBondContact N-O 3.46Å; L270-E273 PolarHBondContact O-N 3.27Å; L270-Y275 HydrophobicContact CB-CE2 4.39Å
271	Y	85.3	Confident	90.7	Very high	1 Å²	1	51.9 Å²	51.9	0%	0.004	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.3	35.4	179.4	-54.5	-73.6	0	0	0	113.2	N103 K104 T106 G107 Y215 L220 T221 V222 E273 L478	N103-Y271 HydrophobicContact CB-CD1 4.19Å; N103-Y271 HydrophobicContact CB-CE1 4.46Å; K104-Y271 VanDerWaalsContact CD-C 3.42Å; K104-Y271 WeakPolarHBondContact CD-O 3.39Å; K104-Y271 PolarHBondContact NZ-O 2.93Å; T106-Y271 HydrophobicContact CG2-CD1 4.16Å; T106-Y271 HydrophobicContact CG2-CD2 4.42Å; T106-Y271 HydrophobicContact CG2-CE1 3.64Å; T106-Y271 HydrophobicContact CG2-CE2 3.91Å; T106-Y271 VanDerWaalsContact CG2-CZ 3.5Å; T106-Y271 PolarHBondContact OG1-N 3.43Å; G107-Y271 PolarHBondContact O-OH 3.32Å; Y215-Y271 HydrophobicContact CD2-CE2 4.27Å; Y215-Y271 WeakPolarHBondContact CE2-OH 3.42Å; L220-Y271 HydrophobicContact CB-CD2 4.25Å; L220-Y271 HydrophobicContact CB-CE2 4.35Å; L220-Y271 HydrophobicContact CD1-CE2 4.2Å; T221-Y271 WeakPolarHBondContact O-CB 3.25Å; V222-Y271 HydrophobicContact CG1-CD1 4.44Å; V222-Y271 HydrophobicContact CG1-CE1 4.01Å; V222-Y271 HydrophobicContact CG2-CD2 4.16Å; V222-Y271 HydrophobicContact CG2-CE1 4.31Å; V222-Y271 HydrophobicContact CG2-CE2 3.85Å; Y271-E273 PolarHBondContact O-N 2.96Å; Y271-L478 WeakPolarHBondContact OH-CD2 3.36Å
272	G	83.1	Confident	91.2	Very high	29 Å²	29	45.6 Å²	45.6	30%	0.299	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.2	-8.1	-177.1	0	0	0	0	0	116	L270	L270-G272 PolarHBondContact O-N 3.38Å; L270-G272 VanDerWaalsContact O-N 3.12Å
273	E	85.4	Confident	91.5	Very high	76 Å²	76	46.5 Å²	46.5	36%	0.355	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	142.1	179.9	-64.1	-58.8	139.6	0	0	111.4	R269 L270 Y271 Y275	R269-E273 CarbonylContact C-O 3.59Å; R269-E273 VanDerWaalsContact CA-O 3.23Å; R269-E273 WeakPolarHBondContact CA-O 3.49Å; R269-E273 WeakPolarHBondContact CG-O 3.3Å; L270-E273 PolarHBondContact N-O 3.46Å; L270-E273 PolarHBondContact O-N 3.27Å; Y271-E273 PolarHBondContact O-N 2.96Å; E273-Y275 HydrophobicContact CB-CE2 3.84Å
274	T	89.4	Confident	91.8	Very high	83 Å²	83	39.7 Å²	39.7	51%	0.509	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	126.9	176.6	-59.1	0	0	0	0	110.3	Y267 L268	Y267-T274 HydrophobicContact CD1-CG2 3.93Å; L268-T274 CarbonylContact O-C 3.57Å; L268-T274 WeakPolarHBondContact O-CA 3.47Å
275	Y	91.4	Very high	91.9	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.008	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	136.6	178.8	-56.3	-89.4	0	0	0	109.6	W210 L220 Y267 L268 L270 E273	W210-Y275 AromaticContact CH2-CD1 3.6Å; W210-Y275 HydrophobicContact CH2-CD1 3.6Å; W210-Y275 HydrophobicContact CH2-CD2 4.41Å; W210-Y275 HydrophobicContact CH2-CE1 4.04Å; W210-Y275 AromaticContact CH2-CG 3.79Å; W210-Y275 HydrophobicContact CH2-CG 3.79Å; W210-Y275 HydrophobicContact CZ2-CD1 4.42Å; W210-Y275 HydrophobicContact CZ3-CD1 4.45Å; W210-Y275 HydrophobicContact CZ3-CG 4.23Å; L220-Y275 HydrophobicContact CD2-CE1 4.26Å; L220-Y275 HydrophobicContact CD2-CE2 4.24Å; Y267-Y275 WeakPolarHBondContact CA-O 3.46Å; L268-Y275 PolarHBondContact N-O 3.03Å; L268-Y275 PolarHBondContact O-N 3.06Å; L270-Y275 HydrophobicContact CB-CE2 4.39Å; E273-Y275 HydrophobicContact CB-CE2 3.84Å
276	R	94.1	Very high	92	Very high	36 Å²	36	36.2 Å²	36.2	14%	0.136	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	113.1	170.5	-172.4	-179.4	177.3	178.1	-12.7	108.8	E255 I256 N258 T260 Y267	E255-R276 WeakPolarHBondContact CA-O 3.4Å; E255-R276 WeakPolarHBondContact CG-O 3.37Å; I256-R276 HydrophobicContact CD1-CG 4.26Å; I256-R276 HydrophobicContact CG1-CG 3.97Å; I256-R276 PolarHBondContact N-O 2.92Å; N258-R276 VanDerWaalsContact CA-NH1 3.29Å; N258-R276 PolarHBondContact O-NH1 2.89Å; N258-R276 WeakPolarHBondContact OD1-CD 3.48Å; T260-R276 PolarHBondContact O-NH2 2.94Å; Y267-R276 HydrophobicContact CD1-CB 4.21Å; Y267-R276 HydrophobicContact CD1-CG 4.38Å; Y267-R276 HydrophobicContact CE1-CB 3.93Å; Y267-R276 HydrophobicContact CE1-CG 3.91Å
277	L	95.4	Very high	92	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	139	-173.2	-53.2	-179.7	0	0	0	110.2	L207 W210 V253 F254 E255 S265 R266 L268 V279	L207-L277 HydrophobicContact CG-CD1 4.47Å; W210-L277 HydrophobicContact CD2-CD1 3.75Å; W210-L277 HydrophobicContact CD2-CD2 3.94Å; W210-L277 HydrophobicContact CE3-CD1 3.6Å; W210-L277 HydrophobicContact CE3-CD2 4.2Å; W210-L277 HydrophobicContact CG-CD1 4.24Å; W210-L277 HydrophobicContact CH2-CD2 3.85Å; W210-L277 HydrophobicContact CZ2-CD2 3.5Å; W210-L277 VanDerWaalsContact CZ2-CD2 3.5Å; W210-L277 HydrophobicContact CZ3-CD1 4.05Å; W210-L277 HydrophobicContact CZ3-CD2 4.18Å; V253-L277 HydrophobicContact CG1-CB 4.23Å; V253-L277 HydrophobicContact CG1-CD1 4.22Å; F254-L277 CarbonylContact O-C 3.41Å; F254-L277 WeakPolarHBondContact O-CA 3.46Å; E255-L277 HydrophobicContact CB-CD2 4Å; E255-L277 HydrophobicContact CG-CD2 4.3Å; S265-L277 CarbonylContact C-O 3.58Å; S265-L277 WeakPolarHBondContact CA-O 3.39Å; R266-L277 PolarHBondContact N-O 3.21Å; R266-L277 PolarHBondContact O-N 2.77Å; L268-L277 HydrophobicContact CB-CD1 4.4Å; L268-L277 HydrophobicContact CD2-CD1 4.12Å; L277-V279 HydrophobicContact CB-CG2 3.88Å
278	Y	95.4	Very high	92	Very high	2 Å²	2	27.2 Å²	27.2	1%	0.008	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	125.6	156.8	177.8	-99.3	0	0	0	108.3	V253 F254 T262 H264 R280 R376 P377	V253-Y278 VanDerWaalsContact CA-O 3.32Å; V253-Y278 WeakPolarHBondContact CA-O 3.4Å; F254-Y278 HydrophobicContact CD1-CD1 4.16Å; F254-Y278 AromaticContact CE1-CD1 3.46Å; F254-Y278 HydrophobicContact CE1-CD1 3.46Å; F254-Y278 VanDerWaalsContact CE1-CD1 3.46Å; F254-Y278 HydrophobicContact CE1-CE1 4.15Å; F254-Y278 HydrophobicContact CE1-CG 4.19Å; F254-Y278 AromaticContact CZ-CD1 3.88Å; F254-Y278 HydrophobicContact CZ-CD1 3.88Å; F254-Y278 HydrophobicContact CZ-CG 4.21Å; F254-Y278 PolarHBondContact N-O 3.14Å; F254-Y278 PolarHBondContact O-N 3.29Å; T262-Y278 HydrophobicContact CG2-CD2 3.99Å; T262-Y278 WeakPolarHBondContact OG1-CE2 3.47Å; H264-Y278 HydrophobicContact CB-CD2 3.96Å; H264-Y278 HydrophobicContact CB-CE2 3.66Å; Y278-R280 HydrophobicContact CD1-CG 4.42Å; Y278-R280 HydrophobicContact CE1-CB 4.2Å; Y278-R280 HydrophobicContact CE1-CG 3.45Å; Y278-R280 VanDerWaalsContact CE1-CG 3.45Å; Y278-R280 HydrophobicContact CE2-CG 4.18Å; Y278-R280 WeakPolarHBondContact OH-CG 3.39Å; Y278-R376 HydrophobicContact CE1-CG 3.95Å; Y278-R376 HydrophobicContact CE2-CG 4.3Å; Y278-R376 WeakPolarHBondContact OH-CG 2.98Å; Y278-R376 PolarHBondContact OH-NE 3.01Å; Y278-P377 HydrophobicContact CD2-CG 3.99Å; Y278-P377 HydrophobicContact CE2-CG 4.31Å; Y278-P377 HydrophobicContact CG-CG 4.49Å
279	V	95.4	Very high	92.1	Very high	2 Å²	2	27.4 Å²	27.4	1%	0.012	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	118.9	-176.7	-173.3	0	0	0	0	109.8	V203 V253 H264 R266 L277	V203-V279 HydrophobicContact CB-CG1 4.18Å; V203-V279 HydrophobicContact CG1-CB 4.15Å; V203-V279 HydrophobicContact CG1-CG1 3.68Å; V203-V279 WeakPolarHBondContact O-CG1 3.42Å; V253-V279 HydrophobicContact CG1-CG2 3.93Å; V253-V279 HydrophobicContact CG2-CB 4.4Å; V253-V279 HydrophobicContact CG2-CG1 3.83Å; V253-V279 HydrophobicContact CG2-CG2 4.46Å; H264-V279 PolarHBondContact O-N 3.48Å; R266-V279 HydrophobicContact CB-CG2 4.03Å; R266-V279 HydrophobicContact CG-CB 4.37Å; R266-V279 HydrophobicContact CG-CG2 4Å; L277-V279 HydrophobicContact CB-CG2 3.88Å
280	R	94.1	Very high	92.4	Very high	31 Å²	31	19.4 Å²	19.4	12%	0.117	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	142.4	170.5	-73.4	-69.7	-66	-171.4	-5.6	111.9	Q251 I252 H264 Y278 Y282 E374	Q251-R280 VanDerWaalsContact CA-O 3.26Å; Q251-R280 WeakPolarHBondContact CA-O 3.49Å; I252-R280 HydrophobicContact CG2-CB 3.93Å; I252-R280 PolarHBondContact N-O 3.31Å; I252-R280 PolarHBondContact O-N 3.3Å; H264-R280 HydrophobicContact CB-CG 4.47Å; H264-R280 PolarHBondContact CE1-NH1 3.09Å; H264-R280 PolarHBondContact NE2-NH1 3.5Å; Y278-R280 HydrophobicContact CD1-CG 4.42Å; Y278-R280 HydrophobicContact CE1-CB 4.2Å; Y278-R280 HydrophobicContact CE1-CG 3.45Å; Y278-R280 VanDerWaalsContact CE1-CG 3.45Å; Y278-R280 HydrophobicContact CE2-CG 4.18Å; Y278-R280 WeakPolarHBondContact OH-CG 3.39Å; R280-Y282 HydrophobicContact CB-CD2 4.49Å; R280-Y282 HydrophobicContact CB-CE2 3.64Å; R280-Y282 HydrophobicContact CG-CE2 4.48Å; R280-Y282 PolarHBondContact NE-OH 2.96Å; R280-Y282 VanDerWaalsContact NH2-CE1 3.33Å; R280-E374 IonicContact CZ-OE2 3.47Å; R280-E374 IonicContact NE-OE2 2.72Å; R280-E374 IonicContact NH1-OE1 3.36Å; R280-E374 IonicContact NH1-OE2 2.72Å; R280-E374 PolarHBondContact NH1-OE2 3.4Å; R280-E374 VanDerWaalsContact NH1-OE2 3.11Å; R280-E374 IonicContact NH2-OE1 3.33Å; R280-E374 IonicContact NH2-OE2 3.89Å; R280-E374 PolarHBondContact NH2-OE2 2.98Å
281	S	94.9	Very high	92.8	Very high	24 Å²	24	20 Å²	20	17%	0.168	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	135.5	167.9	-179.6	0	0	0	0	108.7	G202 T250 Q251	G202-S281 VanDerWaalsContact CA-OG 3.31Å; G202-S281 WeakPolarHBondContact CA-OG 3.35Å; G202-S281 WeakPolarHBondContact O-CB 3.15Å; T250-S281 WeakPolarHBondContact O-CA 3.41Å; Q251-S281 PolarHBondContact NE2-OG 3.35Å
282	Y	94.4	Very high	93.2	Very high	7 Å²	7	22.5 Å²	22.5	3%	0.027	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	98.1	178.9	-56.1	-84.5	0	0	0	108.7	S249 T250 I252 R280 C285 F370 R376 Y449	S249-Y282 WeakPolarHBondContact CA-O 3.42Å; S249-Y282 VanDerWaalsContact CB-O 3.32Å; S249-Y282 WeakPolarHBondContact CB-O 3.39Å; T250-Y282 HydrophobicContact CG2-CD2 4.23Å; T250-Y282 PolarHBondContact N-O 3.28Å; T250-Y282 PolarHBondContact O-N 2.89Å; I252-Y282 HydrophobicContact CG2-CE2 4.08Å; R280-Y282 HydrophobicContact CB-CD2 4.49Å; R280-Y282 HydrophobicContact CB-CE2 3.64Å; R280-Y282 HydrophobicContact CG-CE2 4.48Å; R280-Y282 PolarHBondContact NE-OH 2.96Å; R280-Y282 VanDerWaalsContact NH2-CE1 3.33Å; Y282-C285 WeakPolarHBondContact CB-SG 3.26Å; Y282-C285 PolarHBondContact O-N 2.99Å; Y282-F370 HydrophobicContact CD1-CB 4.49Å; Y282-F370 AromaticContact CD1-CD1 3.75Å; Y282-F370 HydrophobicContact CD1-CD1 3.75Å; Y282-F370 HydrophobicContact CD1-CD2 4.18Å; Y282-F370 AromaticContact CD1-CE1 3.94Å; Y282-F370 HydrophobicContact CD1-CE1 3.94Å; Y282-F370 HydrophobicContact CD1-CE2 4.33Å; Y282-F370 AromaticContact CD1-CG 3.88Å; Y282-F370 HydrophobicContact CD1-CG 3.88Å; Y282-F370 HydrophobicContact CD1-CZ 4.22Å; Y282-F370 HydrophobicContact CD2-CD1 4.34Å; Y282-F370 AromaticContact CD2-CE1 3.67Å; Y282-F370 HydrophobicContact CD2-CE1 3.67Å; Y282-F370 HydrophobicContact CD2-CE2 4.2Å; Y282-F370 AromaticContact CD2-CZ 3.59Å; Y282-F370 HydrophobicContact CD2-CZ 3.59Å; Y282-F370 HydrophobicContact CE1-CB 4.46Å; Y282-F370 AromaticContact CE1-CD1 3.35Å; Y282-F370 HydrophobicContact CE1-CD1 3.35Å; Y282-F370 AromaticContact CE1-CE1 3.62Å; Y282-F370 HydrophobicContact CE1-CE1 3.62Å; Y282-F370 AromaticContact CE1-CG 3.9Å; Y282-F370 HydrophobicContact CE1-CG 3.9Å; Y282-F370 HydrophobicContact CE1-CZ 4.35Å; Y282-F370 HydrophobicContact CE2-CD1 4.01Å; Y282-F370 AromaticContact CE2-CE1 3.33Å; Y282-F370 HydrophobicContact CE2-CE1 3.33Å; Y282-F370 AromaticContact CE2-CZ 3.74Å; Y282-F370 HydrophobicContact CE2-CZ 3.74Å; Y282-F370 HydrophobicContact CG-CD1 4.22Å; Y282-F370 HydrophobicContact CG-CD2 4.3Å; Y282-F370 AromaticContact CG-CE1 3.96Å; Y282-F370 HydrophobicContact CG-CE1 3.96Å; Y282-F370 HydrophobicContact CG-CE2 4.02Å; Y282-F370 HydrophobicContact CG-CG 4.38Å; Y282-F370 AromaticContact CG-CZ 3.85Å; Y282-F370 HydrophobicContact CG-CZ 3.85Å; Y282-F370 AromaticContact CZ-CD1 3.5Å; Y282-F370 VanDerWaalsContact CZ-CD1 3.5Å; Y282-F370 AromaticContact CZ-CE1 3.3Å; Y282-R376 PolarHBondContact OH-NH2 2.95Å; Y282-Y449 HydrophobicContact CD2-CE1 4.3Å; Y282-Y449 AromaticContact CE2-CE1 3.92Å; Y282-Y449 HydrophobicContact CE2-CE1 3.92Å
283	L	94.5	Very high	93.7	Very high	38 Å²	38	21.4 Å²	21.4	20%	0.199	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	149.8	171.3	-168.8	63.4	0	0	0	109.3	A163 R166 L167 L170 C285	A163-L283 HydrophobicContact CB-CD1 3.76Å; R166-L283 HydrophobicContact CB-CD1 4.43Å; L167-L283 HydrophobicContact CD2-CD1 3.85Å; L167-L283 HydrophobicContact CD2-CD2 3.93Å; L167-L283 HydrophobicContact CD2-CG 3.79Å; L167-L283 HydrophobicContact CG-CD1 4.11Å; L170-L283 HydrophobicContact CD1-CD2 3.95Å; L283-C285 PolarHBondContact O-N 2.72Å; L283-C285 VanDerWaalsContact O-N 3.07Å
284	C	94.4	Very high	94.2	Very high	4 Å²	4	17.8 Å²	17.8	3%	0.027	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.4	-3.4	-174.3	-56.8	0	0	0	0	115.9	A248 E289 I293 C331 T368	A248-C284 PolarHBondContact O-N 3.36Å; C284-E289 WeakPolarHBondContact O-CB 3.29Å; C284-I293 WeakPolarHBondContact O-CD1 3.41Å; C284-C331 WeakPolarHBondContact CA-SG 3.42Å; C284-C331 HydrophobicContact CB-CB 3.54Å; C284-C331 WeakPolarHBondContact CB-SG 3.32Å; C284-C331 WeakPolarHBondContact SG-CA 3.2Å; C284-C331 WeakPolarHBondContact SG-CB 3.26Å; C284-C331 CovalentContact SG-SG 2.03Å; C284-C331 PolarHBondContact SG-SG 2.82Å; C284-T368 VanDerWaalsContact CB-OG1 3.26Å; C284-T368 WeakPolarHBondContact CB-OG1 3.1Å; C284-T368 PolarHBondContact SG-OG1 2.66Å
285	C	94.7	Very high	94.4	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	7%	0.07	C	C	.	.			trans	-97.5	16.1	170.5	-59.7	0	0	0	0	112.8	T250 Y282 L283 C369 F370 Y440	T250-C285 HydrophobicContact CG2-CB 3.69Å; Y282-C285 WeakPolarHBondContact CB-SG 3.26Å; Y282-C285 PolarHBondContact O-N 2.99Å; L283-C285 PolarHBondContact O-N 2.72Å; L283-C285 VanDerWaalsContact O-N 3.07Å; C285-C369 HydrophobicContact CB-CB 4.35Å; C285-C369 WeakPolarHBondContact CB-SG 3.41Å; C285-C369 WeakPolarHBondContact SG-CA 3.38Å; C285-C369 WeakPolarHBondContact SG-CB 2.96Å; C285-C369 CovalentContact SG-SG 2.03Å; C285-C369 PolarHBondContact SG-SG 2.94Å; C285-F370 HydrophobicContact CB-CE2 4.18Å; C285-F370 WeakPolarHBondContact SG-CD2 3.46Å; C285-Y440 WeakPolarHBondContact CB-OH 3.49Å; C285-Y440 PolarHBondContact O-OH 3.33Å
286	G	95.2	Very high	94.6	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	7%	0.07	C	C	.	.	S	Bend	trans	-71.2	159.2	168.5	0	0	0	0	0	110.9	G246 G247 A248 N288 E289 M290	G246-G286 CarbonylContact O-C 3.58Å; G246-G286 VanDerWaalsContact O-CA 3.29Å; G246-G286 WeakPolarHBondContact O-CA 3.31Å; G247-G286 CarbonylContact O-C 3.59Å; G247-G286 VanDerWaalsContact O-CA 3.31Å; G247-G286 WeakPolarHBondContact O-CA 3.43Å; A248-G286 VanDerWaalsContact C-CA 3.47Å; A248-G286 PolarHBondContact O-N 2.82Å; G286-N288 VanDerWaalsContact C-N 3.3Å; G286-N288 PolarHBondContact O-N 3Å; G286-E289 PolarHBondContact O-N 3.28Å; G286-M290 PolarHBondContact O-N 3.41Å
287	A	94.4	Very high	94.6	Very high	3 Å²	3	13.2 Å²	13.2	3%	0.025	7%	0.066	C	C	.	.	H	α-helix	trans	-62.4	-34.8	-172.7	0	0	0	0	0	113.4	L245 G246 G247 I291	L245-A287 HydrophobicContact CD1-CB 4.37Å; L245-A287 HydrophobicContact CD2-CB 4.39Å; L245-A287 HydrophobicContact CG-CB 4.36Å; G246-A287 PolarHBondContact O-N 2.84Å; G247-A287 PolarHBondContact O-N 2.93Å; A287-I291 WeakPolarHBondContact O-CD1 3.33Å; A287-I291 VanDerWaalsContact O-CG1 3.26Å; A287-I291 WeakPolarHBondContact O-CG1 3.38Å; A287-I291 PolarHBondContact O-N 2.8Å
288	N	93.3	Very high	94.6	Very high	55 Å²	55	14 Å²	14	29%	0.294	7%	0.07	S	C	.	.	H	α-helix	trans	-77	-38.5	179.3	-60.9	-16.4	0	0	0	111.3	S90 G247 G286 M290 I291 R292 R437	S90-N288 PolarHBondContact OG-ND2 2.87Å; G247-N288 WeakPolarHBondContact O-CB 3.49Å; G247-N288 PolarHBondContact O-N 3.48Å; G286-N288 VanDerWaalsContact C-N 3.3Å; G286-N288 PolarHBondContact O-N 3Å; N288-M290 VanDerWaalsContact C-N 3.34Å; N288-I291 PolarHBondContact O-N 2.97Å; N288-R292 PolarHBondContact O-N 3.24Å; N288-R437 PolarHBondContact OD1-NH2 3.37Å
289	E	94.3	Very high	94.6	Very high	14 Å²	14	13.9 Å²	13.9	7%	0.065	7%	0.069	C	C	.	.	H	α-helix	trans	-64.9	-39.6	175.7	-62.5	-58.6	126.7	0	0	111.3	L167 G247 A248 C284 G286 I291 R292 I293 C331	L167-E289 HydrophobicContact CD1-CG 3.98Å; G247-E289 PolarHBondContact O-N 3.09Å; A248-E289 HydrophobicContact CB-CG 3.82Å; C284-E289 WeakPolarHBondContact O-CB 3.29Å; G286-E289 PolarHBondContact O-N 3.28Å; E289-I291 PolarHBondContact O-N 3.43Å; E289-R292 WeakPolarHBondContact O-CB 3.4Å; E289-R292 PolarHBondContact O-N 2.99Å; E289-R292 VanDerWaalsContact O-N 3.16Å; E289-R292 IonicContact OE1-CZ 3.5Å; E289-R292 IonicContact OE1-NH1 2.72Å; E289-R292 PolarHBondContact OE1-NH1 2.9Å; E289-R292 IonicContact OE1-NH2 2.72Å; E289-R292 IonicContact OE2-CZ 3.72Å; E289-R292 IonicContact OE2-NH1 3.61Å; E289-R292 PolarHBondContact OE2-NH1 3.41Å; E289-I293 WeakPolarHBondContact O-CD1 3.24Å; E289-I293 WeakPolarHBondContact O-CG1 3.38Å; E289-I293 PolarHBondContact O-N 3.06Å; E289-C331 WeakPolarHBondContact OE2-CB 3.49Å; E289-C331 PolarHBondContact OE2-SG 2.79Å
290	M	94.5	Very high	94.5	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-68.7	-32	175.4	-74.3	-61.1	-49.4	0	0	113.3	G286 N288 R292 I293 R294 M363 F436 Y440	G286-M290 PolarHBondContact O-N 3.41Å; N288-M290 VanDerWaalsContact C-N 3.34Å; M290-R292 VanDerWaalsContact C-N 3.35Å; M290-I293 PolarHBondContact O-N 3.43Å; M290-I293 HydrophobicContact SD-CD1 3.58Å; M290-I293 VanDerWaalsContact SD-CD1 3.58Å; M290-R294 WeakPolarHBondContact O-CB 3.36Å; M290-R294 PolarHBondContact O-N 3.45Å; M290-M363 HydrophobicContact CE-CG 3.5Å; M290-M363 HydrophobicContact SD-CG 4.44Å; M290-F436 HydrophobicContact CB-CE1 3.85Å; M290-F436 HydrophobicContact CB-CZ 3.89Å; M290-F436 VanDerWaalsContact O-CZ 3.27Å; M290-F436 WeakPolarHBondContact O-CZ 3.44Å; M290-Y440 HydrophobicContact CB-CE1 4.26Å; M290-Y440 HydrophobicContact CB-CE2 4.34Å; M290-Y440 HydrophobicContact CE-CE2 4.07Å; M290-Y440 HydrophobicContact CG-CE1 3.98Å; M290-Y440 HydrophobicContact CG-CE2 3.79Å; M290-Y440 VanDerWaalsContact CG-CZ 3.5Å; M290-Y440 WeakPolarHBondContact CG-OH 3.3Å; M290-Y440 HydrophobicContact SD-CE2 4.37Å
291	I	94.5	Very high	94.4	Very high	14 Å²	14	22.1 Å²	22.1	7%	0.072	11%	0.11	C	C	.	.	H	α-helix	trans	-63.4	-42.1	169.3	-73.6	166.7	0	0	0	110.7	A287 N288 E289 R294 Q295 F436 R437	A287-I291 WeakPolarHBondContact O-CD1 3.33Å; A287-I291 VanDerWaalsContact O-CG1 3.26Å; A287-I291 WeakPolarHBondContact O-CG1 3.38Å; A287-I291 PolarHBondContact O-N 2.8Å; N288-I291 PolarHBondContact O-N 2.97Å; E289-I291 PolarHBondContact O-N 3.43Å; I291-R294 WeakPolarHBondContact O-CB 3.49Å; I291-R294 PolarHBondContact O-N 2.65Å; I291-Q295 WeakPolarHBondContact O-CG 3.47Å; I291-Q295 PolarHBondContact O-N 3.17Å; I291-Q295 VanDerWaalsContact O-N 3.08Å; I291-F436 HydrophobicContact CB-CE1 4.47Å; I291-F436 HydrophobicContact CD1-CD1 4.32Å; I291-F436 HydrophobicContact CG1-CD1 3.43Å; I291-F436 VanDerWaalsContact CG1-CD1 3.43Å; I291-F436 HydrophobicContact CG1-CE1 3.65Å; I291-F436 HydrophobicContact CG1-CG 4.28Å; I291-R437 HydrophobicContact CD1-CG 4.46Å
292	R	94.1	Very high	94.4	Very high	53 Å²	53	22.4 Å²	22.4	20%	0.2	11%	0.114	C	C	.	.	H	α-helix	trans	-63.9	-43.7	174.7	-176.4	-177.2	-64.8	119.4	12.8	111.7	N288 E289 M290 R294 Q295 A296 E325 V326 V332	N288-R292 PolarHBondContact O-N 3.24Å; E289-R292 WeakPolarHBondContact O-CB 3.4Å; E289-R292 PolarHBondContact O-N 2.99Å; E289-R292 VanDerWaalsContact O-N 3.16Å; E289-R292 IonicContact OE1-CZ 3.5Å; E289-R292 IonicContact OE1-NH1 2.72Å; E289-R292 PolarHBondContact OE1-NH1 2.9Å; E289-R292 IonicContact OE1-NH2 2.72Å; E289-R292 IonicContact OE2-CZ 3.72Å; E289-R292 IonicContact OE2-NH1 3.61Å; E289-R292 PolarHBondContact OE2-NH1 3.41Å; M290-R292 VanDerWaalsContact C-N 3.35Å; R292-R294 VanDerWaalsContact C-N 3.32Å; R292-R294 PolarHBondContact O-N 3.05Å; R292-Q295 WeakPolarHBondContact O-CB 3.36Å; R292-Q295 PolarHBondContact O-N 3.14Å; R292-A296 WeakPolarHBondContact O-CB 3.31Å; R292-A296 PolarHBondContact O-N 3.19Å; R292-E325 WeakPolarHBondContact CD-O 3.41Å; R292-E325 PolarHBondContact NE-O 2.72Å; R292-V326 WeakPolarHBondContact CG-O 3.29Å; R292-V332 HydrophobicContact CG-CG2 4.09Å
293	I	94.4	Very high	94.4	Very high	6 Å²	6	23.1 Å²	23.1	3%	0.031	12%	0.119	C	C	.	.	H	α-helix	trans	-64.3	-38.4	178.2	-65.2	153.9	0	0	0	110.8	C284 E289 M290 A296 T297 V332 S362 N366	C284-I293 WeakPolarHBondContact O-CD1 3.41Å; E289-I293 WeakPolarHBondContact O-CD1 3.24Å; E289-I293 WeakPolarHBondContact O-CG1 3.38Å; E289-I293 PolarHBondContact O-N 3.06Å; M290-I293 PolarHBondContact O-N 3.43Å; M290-I293 HydrophobicContact SD-CD1 3.58Å; M290-I293 VanDerWaalsContact SD-CD1 3.58Å; I293-A296 PolarHBondContact O-N 3.34Å; I293-T297 VanDerWaalsContact O-CB 3.31Å; I293-T297 WeakPolarHBondContact O-CB 3.35Å; I293-T297 PolarHBondContact O-N 2.9Å; I293-T297 PolarHBondContact O-OG1 2.72Å; I293-V332 HydrophobicContact CG1-CG2 4.06Å; I293-S362 WeakPolarHBondContact CG2-O 3.2Å; I293-N366 HydrophobicContact CD1-CB 4.3Å; I293-N366 WeakPolarHBondContact CD1-ND2 3.46Å; I293-N366 HydrophobicContact CG2-CB 4.33Å
294	R	94.8	Very high	94.4	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-56.7	-51.6	170.9	174.8	-163.6	58.2	158.7	-1	111	M290 I291 R292 A296 T297 L298 D310 L358 F436	M290-R294 WeakPolarHBondContact O-CB 3.36Å; M290-R294 PolarHBondContact O-N 3.45Å; I291-R294 WeakPolarHBondContact O-CB 3.49Å; I291-R294 PolarHBondContact O-N 2.65Å; R292-R294 VanDerWaalsContact C-N 3.32Å; R292-R294 PolarHBondContact O-N 3.05Å; R294-A296 VanDerWaalsContact C-N 3.31Å; R294-A296 PolarHBondContact O-N 2.85Å; R294-T297 PolarHBondContact O-N 3.22Å; R294-L298 PolarHBondContact O-N 2.98Å; R294-L298 VanDerWaalsContact O-N 3.08Å; R294-D310 IonicContact CZ-OD1 3.82Å; R294-D310 IonicContact CZ-OD2 3.54Å; R294-D310 IonicContact NE-OD2 2.8Å; R294-D310 PolarHBondContact NE-OD2 3.14Å; R294-D310 VanDerWaalsContact NH1-CG 3.32Å; R294-D310 IonicContact NH1-OD1 2.69Å; R294-D310 PolarHBondContact NH1-OD1 3.45Å; R294-D310 IonicContact NH1-OD2 3.86Å; R294-D310 PolarHBondContact NH1-OD2 3.23Å; R294-D310 IonicContact NH2-OD2 3.36Å; R294-L358 HydrophobicContact CG-CD2 3.55Å; R294-L358 HydrophobicContact CG-CG 4.01Å; R294-F436 HydrophobicContact CB-CD2 4.41Å; R294-F436 HydrophobicContact CB-CE2 3.71Å; R294-F436 HydrophobicContact CB-CZ 4.12Å; R294-F436 HydrophobicContact CG-CD2 4.31Å; R294-F436 HydrophobicContact CG-CE2 4.01Å
295	Q	95.1	Very high	94.6	Very high	16 Å²	16	28.7 Å²	28.7	8%	0.075	15%	0.154	C	C	.	.	H	α-helix	trans	-58.9	-43.4	179.6	-73.9	164.5	-15.6	0	0	111.5	I291 R292 L298 A299 V326 Y346	I291-Q295 WeakPolarHBondContact O-CG 3.47Å; I291-Q295 PolarHBondContact O-N 3.17Å; I291-Q295 VanDerWaalsContact O-N 3.08Å; R292-Q295 WeakPolarHBondContact O-CB 3.36Å; R292-Q295 PolarHBondContact O-N 3.14Å; Q295-L298 PolarHBondContact O-N 2.98Å; Q295-A299 WeakPolarHBondContact O-CB 3.37Å; Q295-A299 PolarHBondContact O-N 3.5Å; Q295-V326 HydrophobicContact CB-CG1 4.14Å; Q295-V326 HydrophobicContact CB-CG2 4.33Å; Q295-Y346 HydrophobicContact CB-CE1 4.24Å; Q295-Y346 HydrophobicContact CB-CE2 4.12Å; Q295-Y346 WeakPolarHBondContact CB-OH 3.07Å; Q295-Y346 HydrophobicContact CG-CD2 4.42Å; Q295-Y346 HydrophobicContact CG-CE1 4.4Å; Q295-Y346 HydrophobicContact CG-CE2 3.94Å; Q295-Y346 PolarHBondContact O-OH 2.87Å
296	A	94.7	Very high	94.7	Very high	2 Å²	2	32.9 Å²	32.9	2%	0.017	18%	0.176	C	C	.	.	H	α-helix	trans	-65.5	-42	175.5	0	0	0	0	0	111.9	R292 I293 R294 L298 A299 I300 V326 F327 V332	R292-A296 WeakPolarHBondContact O-CB 3.31Å; R292-A296 PolarHBondContact O-N 3.19Å; I293-A296 PolarHBondContact O-N 3.34Å; R294-A296 VanDerWaalsContact C-N 3.31Å; R294-A296 PolarHBondContact O-N 2.85Å; A296-L298 VanDerWaalsContact C-N 3.26Å; A296-L298 PolarHBondContact O-N 2.69Å; A296-A299 PolarHBondContact O-N 2.81Å; A296-I300 HydrophobicContact CB-CD1 4.31Å; A296-I300 WeakPolarHBondContact O-CB 3.4Å; A296-I300 WeakPolarHBondContact O-CD1 3.37Å; A296-I300 WeakPolarHBondContact O-CG1 3.2Å; A296-I300 PolarHBondContact O-N 3.06Å; A296-V326 HydrophobicContact CB-CG1 3.91Å; A296-F327 HydrophobicContact CB-CD1 4.27Å; A296-F327 HydrophobicContact CB-CE1 4.18Å; A296-V332 HydrophobicContact CB-CB 4.44Å; A296-V332 HydrophobicContact CB-CG1 3.57Å; A296-V332 HydrophobicContact CB-CG2 3.94Å
297	T	94.2	Very high	94.9	Very high	7 Å²	7	36.1 Å²	36.1	4%	0.043	20%	0.195	C	C	.	.	H	α-helix	trans	-61.5	-34.9	179.5	-61.2	0	0	0	0	112	I293 R294 Q301 L358 T361 S362 I365	I293-T297 VanDerWaalsContact O-CB 3.31Å; I293-T297 WeakPolarHBondContact O-CB 3.35Å; I293-T297 PolarHBondContact O-N 2.9Å; I293-T297 PolarHBondContact O-OG1 2.72Å; R294-T297 PolarHBondContact O-N 3.22Å; T297-Q301 PolarHBondContact O-NE2 2.63Å; T297-Q301 VanDerWaalsContact O-NE2 3.15Å; T297-L358 HydrophobicContact CG2-CD1 3.7Å; T297-T361 HydrophobicContact CG2-CG2 3.91Å; T297-S362 PolarHBondContact OG1-OG 3.19Å; T297-I365 HydrophobicContact CG2-CD1 4.11Å
298	L	96	Very high	95.1	Very high	16 Å²	16	36.7 Å²	36.7	8%	0.084	20%	0.198	C	C	.	.	H	α-helix	trans	-72.4	-46.9	172.8	-68.3	174.2	0	0	0	111.7	R294 Q295 A296 Q301 H308 M309 D310 Y346 L358	R294-L298 PolarHBondContact O-N 2.98Å; R294-L298 VanDerWaalsContact O-N 3.08Å; Q295-L298 PolarHBondContact O-N 2.98Å; A296-L298 VanDerWaalsContact C-N 3.26Å; A296-L298 PolarHBondContact O-N 2.69Å; L298-Q301 PolarHBondContact O-N 3.36Å; L298-H308 HydrophobicContact CB-CB 4.36Å; L298-H308 PolarHBondContact O-ND1 3.43Å; L298-M309 WeakPolarHBondContact CD2-O 3.33Å; L298-D310 HydrophobicContact CD1-CB 3.72Å; L298-Y346 HydrophobicContact CB-CD1 4.46Å; L298-Y346 HydrophobicContact CB-CE1 3.96Å; L298-Y346 HydrophobicContact CD1-CD1 3.88Å; L298-Y346 HydrophobicContact CD1-CE1 4.1Å; L298-L358 HydrophobicContact CD1-CD2 3.99Å; L298-L358 HydrophobicContact CD2-CD1 3.97Å; L298-L358 HydrophobicContact CD2-CD2 3.83Å; L298-L358 HydrophobicContact CG-CD1 4.21Å; L298-L358 HydrophobicContact CG-CD2 3.95Å
299	A	95.4	Very high	95.3	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-67.8	-36.8	-176.9	0	0	0	0	0	113.3	Q295 A296 Q301 A302 P303 V326 F327 Y344	Q295-A299 WeakPolarHBondContact O-CB 3.37Å; Q295-A299 PolarHBondContact O-N 3.5Å; A296-A299 PolarHBondContact O-N 2.81Å; A299-Q301 PolarHBondContact O-N 3.18Å; A299-Q301 VanDerWaalsContact O-N 3.14Å; A299-A302 CarbonylContact O-C 3.15Å; A299-A302 PolarHBondContact O-N 3.02Å; A299-A302 VanDerWaalsContact O-N 3.12Å; A299-P303 WeakPolarHBondContact O-CA 3.49Å; A299-P303 VanDerWaalsContact O-N 3.07Å; A299-V326 HydrophobicContact CB-CG1 4.46Å; A299-F327 HydrophobicContact CB-CE1 4.26Å; A299-F327 HydrophobicContact CB-CZ 3.76Å; A299-Y344 HydrophobicContact CB-CD1 4.45Å; A299-Y344 HydrophobicContact CB-CD2 4.38Å; A299-Y344 HydrophobicContact CB-CE1 4.16Å; A299-Y344 HydrophobicContact CB-CE2 4.08Å
300	I	92.9	Very high	95.4	Very high	58 Å²	58	38.8 Å²	38.8	30%	0.297	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-27.2	-178.5	-73.7	165.2	0	0	0	112.5	A296 A302 P303 F327 F334	A296-I300 HydrophobicContact CB-CD1 4.31Å; A296-I300 WeakPolarHBondContact O-CB 3.4Å; A296-I300 WeakPolarHBondContact O-CD1 3.37Å; A296-I300 WeakPolarHBondContact O-CG1 3.2Å; A296-I300 PolarHBondContact O-N 3.06Å; I300-A302 VanDerWaalsContact C-N 3.32Å; I300-A302 PolarHBondContact O-N 3.4Å; I300-P303 WeakPolarHBondContact O-CD 3.49Å; I300-P303 WeakPolarHBondContact O-CG 3.24Å; I300-F327 HydrophobicContact CG1-CE1 3.96Å; I300-F334 HydrophobicContact CB-CE2 4.43Å; I300-F334 HydrophobicContact CD1-CB 3.76Å; I300-F334 HydrophobicContact CD1-CD1 4.3Å; I300-F334 HydrophobicContact CD1-CD2 3.95Å; I300-F334 HydrophobicContact CD1-CG 3.75Å; I300-F334 HydrophobicContact CG1-CB 4.17Å; I300-F334 HydrophobicContact CG1-CD1 3.73Å; I300-F334 HydrophobicContact CG1-CD2 3.74Å; I300-F334 HydrophobicContact CG1-CE1 3.95Å; I300-F334 HydrophobicContact CG1-CE2 3.98Å; I300-F334 HydrophobicContact CG1-CG 3.6Å; I300-F334 HydrophobicContact CG1-CZ 4.08Å; I300-F334 HydrophobicContact CG2-CD2 4.13Å; I300-F334 HydrophobicContact CG2-CE2 3.9Å; I300-F334 HydrophobicContact CG2-CZ 4.38Å
301	Q	92.1	Very high	95.6	Very high	148 Å²	148	39.4 Å²	39.4	69%	0.692	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69	-31.3	179.9	-63.7	174.7	31.4	0	0	112.5	T297 L298 A299	T297-Q301 PolarHBondContact O-NE2 2.63Å; T297-Q301 VanDerWaalsContact O-NE2 3.15Å; L298-Q301 PolarHBondContact O-N 3.36Å; A299-Q301 PolarHBondContact O-N 3.18Å; A299-Q301 VanDerWaalsContact O-N 3.14Å
302	A	94.4	Very high	95.7	Very high	29 Å²	29	38.8 Å²	38.8	24%	0.24	21%	0.208	C	C	.	.	S	Bend	trans	-146.9	72.6	176.7	0	0	0	0	0	110.2	A299 I300 S304 D305 H308	A299-A302 CarbonylContact O-C 3.15Å; A299-A302 PolarHBondContact O-N 3.02Å; A299-A302 VanDerWaalsContact O-N 3.12Å; I300-A302 VanDerWaalsContact C-N 3.32Å; I300-A302 PolarHBondContact O-N 3.4Å; A302-S304 PolarHBondContact O-N 3.19Å; A302-D305 HydrophobicContact CB-CB 4.09Å; A302-D305 PolarHBondContact O-N 3.23Å; A302-H308 PolarHBondContact O-CE1 3.42Å; A302-H308 VanDerWaalsContact O-CE1 3.28Å
303	P	93.8	Very high	95.6	Very high	22 Å²	22	36.3 Å²	36.3	14%	0.143	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-24	-166.3	-23	32.9	0	0	0	115.1	A299 I300 F334 V338 I340 P341 Y344	A299-P303 WeakPolarHBondContact O-CA 3.49Å; A299-P303 VanDerWaalsContact O-N 3.07Å; I300-P303 WeakPolarHBondContact O-CD 3.49Å; I300-P303 WeakPolarHBondContact O-CG 3.24Å; P303-F334 HydrophobicContact CB-CE1 4.41Å; P303-F334 HydrophobicContact CB-CZ 4.39Å; P303-F334 HydrophobicContact CG-CE1 4.27Å; P303-F334 HydrophobicContact CG-CZ 3.82Å; P303-V338 HydrophobicContact CB-CG2 3.84Å; P303-V338 HydrophobicContact CG-CG2 4.33Å; P303-I340 HydrophobicContact CB-CG2 4.16Å; P303-P341 WeakPolarHBondContact O-CD 3.45Å; P303-Y344 PolarHBondContact O-OH 3.06Å
304	S	95.7	Very high	95.5	Very high	66 Å²	66	36.4 Å²	36.4	46%	0.462	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-18.7	178.4	-51.5	0	0	0	0	113.5	A302 V338	A302-S304 PolarHBondContact O-N 3.19Å; S304-V338 WeakPolarHBondContact OG-CG2 3.45Å
305	D	97.5	Very high	95.3	Very high	93 Å²	93	40 Å²	40	50%	0.497	22%	0.218	S	C	.	.			trans	-77.7	140	-177.5	-70.7	-0.7	0	0	0	109.8	A302 H308 Y344	A302-D305 HydrophobicContact CB-CB 4.09Å; A302-D305 PolarHBondContact O-N 3.23Å; D305-H308 PolarHBondContact O-NE2 3.05Å; D305-Y344 WeakPolarHBondContact O-CD1 3.37Å; D305-Y344 WeakPolarHBondContact O-CE1 3.34Å
306	I	98.1	Very high	94.9	Very high	88 Å²	88	45.6 Å²	45.6	45%	0.451	25%	0.249	S	C	.	.	S	Bend	trans	-79.4	-36	177.7	-63.4	170.1	0	0	0	110.4	P341 Y344 H345	I306-P341 HydrophobicContact CG1-CB 3.84Å; I306-P341 HydrophobicContact CG1-CG 4.2Å; I306-Y344 WeakPolarHBondContact O-CA 3.48Å; I306-H345 HydrophobicContact CG2-CB 4.28Å; I306-H345 PolarHBondContact O-N 3.02Å
307	V	98.5	Very high	94.7	Very high	68 Å²	68	47.9 Å²	47.9	41%	0.412	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	126.7	-168.5	-179.8	0	0	0	0	110.4	H345 Q347	V307-H345 WeakPolarHBondContact CA-O 3.39Å; V307-H345 HydrophobicContact CG2-CB 4.23Å; V307-Q347 HydrophobicContact CG1-CG 3.9Å
308	H	98.4	Very high	94.6	Very high	16 Å²	16	50.4 Å²	50.4	7%	0.074	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	140.5	175.3	-63.6	-81.8	0	0	0	111	L298 A302 D305 Y344 H345 Y346 Q347	L298-H308 HydrophobicContact CB-CB 4.36Å; L298-H308 PolarHBondContact O-ND1 3.43Å; A302-H308 PolarHBondContact O-CE1 3.42Å; A302-H308 VanDerWaalsContact O-CE1 3.28Å; D305-H308 PolarHBondContact O-NE2 3.05Å; H308-Y344 AromaticContact CD2-CD1 3.69Å; H308-Y344 AromaticContact NE2-CD1 3.51Å; H308-Y344 AromaticContact NE2-CE1 3.64Å; H308-H345 PolarHBondContact N-O 2.84Å; H308-Y346 HydrophobicContact CB-CD1 3.93Å; H308-Y346 HydrophobicContact CB-CE1 4.1Å; H308-Y346 CarbonylContact O-C 3.52Å; H308-Y346 VanDerWaalsContact O-CA 3.31Å; H308-Y346 WeakPolarHBondContact O-CA 3.38Å; H308-Q347 PolarHBondContact O-N 2.93Å
309	M	97.8	Very high	94.5	Very high	112 Å²	112	50.6 Å²	50.6	55%	0.552	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.1	126	172.7	-63.1	-59.8	-175.9	0	0	110	L298 Q347 T349	L298-M309 WeakPolarHBondContact CD2-O 3.33Å; M309-Q347 CarbonylContact C-O 3.58Å; M309-Q347 WeakPolarHBondContact CA-O 3.27Å; M309-Q347 HydrophobicContact SD-CB 3.9Å; M309-T349 HydrophobicContact CB-CG2 3.98Å; M309-T349 HydrophobicContact CG-CG2 4.32Å; M309-T349 HydrophobicContact SD-CG2 3.93Å
310	D	97.5	Very high	94.5	Very high	0 Å²	0	54 Å²	54	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	104	178.6	-172.4	-27.9	0	0	0	110.1	R294 L298 C312 L313 Y346 Q347 G348 T349	R294-D310 IonicContact CZ-OD1 3.82Å; R294-D310 IonicContact CZ-OD2 3.54Å; R294-D310 IonicContact NE-OD2 2.8Å; R294-D310 PolarHBondContact NE-OD2 3.14Å; R294-D310 VanDerWaalsContact NH1-CG 3.32Å; R294-D310 IonicContact NH1-OD1 2.69Å; R294-D310 PolarHBondContact NH1-OD1 3.45Å; R294-D310 IonicContact NH1-OD2 3.86Å; R294-D310 PolarHBondContact NH1-OD2 3.23Å; R294-D310 IonicContact NH2-OD2 3.36Å; L298-D310 HydrophobicContact CD1-CB 3.72Å; D310-C312 PolarHBondContact O-N 3.06Å; D310-C312 VanDerWaalsContact O-N 3.16Å; D310-C312 WeakPolarHBondContact OD1-CA 3.13Å; D310-C312 WeakPolarHBondContact OD1-CB 3.33Å; D310-C312 PolarHBondContact OD1-N 3.24Å; D310-L313 HydrophobicContact CB-CB 4.19Å; D310-L313 HydrophobicContact CB-CD1 3.81Å; D310-L313 HydrophobicContact CB-CG 3.91Å; D310-L313 PolarHBondContact O-N 3.47Å; D310-L313 VanDerWaalsContact O-N 3.11Å; D310-L313 PolarHBondContact OD1-N 2.85Å; D310-L313 WeakPolarHBondContact OD2-CG 3.31Å; D310-Y346 HydrophobicContact CB-CD1 4.47Å; D310-Q347 PolarHBondContact N-O 2.82Å; D310-G348 WeakPolarHBondContact O-CA 3.44Å; D310-T349 PolarHBondContact O-N 2.94Å
311	P	97.2	Very high	94.6	Very high	13 Å²	13	51.9 Å²	51.9	8%	0.084	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-17.4	-177.1	28.4	-36.2	0	0	0	114.3	T349 D351 A354 C355 L358	P311-T349 VanDerWaalsContact CA-OG1 3.28Å; P311-T349 WeakPolarHBondContact CA-OG1 3.05Å; P311-D351 HydrophobicContact CB-CB 3.98Å; P311-D351 PolarHBondContact O-N 3.29Å; P311-A354 HydrophobicContact CB-CB 3.56Å; P311-A354 HydrophobicContact CG-CB 3.9Å; P311-C355 HydrophobicContact CB-CB 4.28Å; P311-C355 HydrophobicContact CG-CB 4.46Å; P311-L358 HydrophobicContact CG-CB 4.43Å; P311-L358 HydrophobicContact CG-CD2 3.92Å
312	C	96.2	Very high	94.8	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.007	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-4.7	178	-57.5	0	0	0	0	113.2	D310 C355 C435 F436	D310-C312 PolarHBondContact O-N 3.06Å; D310-C312 VanDerWaalsContact O-N 3.16Å; D310-C312 WeakPolarHBondContact OD1-CA 3.13Å; D310-C312 WeakPolarHBondContact OD1-CB 3.33Å; D310-C312 PolarHBondContact OD1-N 3.24Å; C312-C355 WeakPolarHBondContact CA-SG 3.26Å; C312-C355 HydrophobicContact CB-CB 3.98Å; C312-C355 WeakPolarHBondContact CB-SG 3.39Å; C312-C355 WeakPolarHBondContact SG-CA 3.41Å; C312-C355 WeakPolarHBondContact SG-CB 3.28Å; C312-C355 CovalentContact SG-SG 2.03Å; C312-C355 PolarHBondContact SG-SG 3.47Å; C312-C435 WeakPolarHBondContact O-CB 3.45Å; C312-F436 HydrophobicContact CB-CB 4.04Å; C312-F436 HydrophobicContact CB-CD2 4.25Å
313	L	93.9	Very high	94.9	Very high	2 Å²	2	47.3 Å²	47.3	1%	0.01	26%	0.261	C	S	.	.	S	Bend	trans	-96	151.5	173.4	-69.5	-179.8	0	0	0	111.3	D310 Y317 L319 G348 T349 S350 Y432	D310-L313 HydrophobicContact CB-CB 4.19Å; D310-L313 HydrophobicContact CB-CD1 3.81Å; D310-L313 HydrophobicContact CB-CG 3.91Å; D310-L313 PolarHBondContact O-N 3.47Å; D310-L313 VanDerWaalsContact O-N 3.11Å; D310-L313 PolarHBondContact OD1-N 2.85Å; D310-L313 WeakPolarHBondContact OD2-CG 3.31Å; L313-Y317 HydrophobicContact CD1-CD1 4.46Å; L313-Y317 HydrophobicContact CD2-CD1 4.33Å; L313-Y317 HydrophobicContact CD2-CE1 4.47Å; L313-L319 HydrophobicContact CD1-CB 3.68Å; L313-L319 HydrophobicContact CD1-CD2 4.28Å; L313-G348 CarbonylContact O-C 3.58Å; L313-G348 VanDerWaalsContact O-CA 3.29Å; L313-G348 WeakPolarHBondContact O-CA 3.31Å; L313-T349 PolarHBondContact O-N 3.11Å; L313-S350 PolarHBondContact O-N 3.34Å; L313-S350 VanDerWaalsContact O-N 3.16Å; L313-Y432 HydrophobicContact CD2-CD2 3.75Å; L313-Y432 HydrophobicContact CD2-CG 4.42Å; L313-Y432 WeakPolarHBondContact CD2-O 3.33Å
314	P	91.4	Very high	94.7	Very high	8 Å²	8	50.9 Å²	50.9	5%	0.052	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-63.8	142.4	178.1	-23.1	35.3	0	0	0	113.5	N316 Y317 G348 V419 I422	P314-N316 PolarHBondContact O-N 3.44Å; P314-Y317 WeakPolarHBondContact O-CB 3.46Å; P314-Y317 PolarHBondContact O-N 2.73Å; P314-G348 VanDerWaalsContact O-CA 3.32Å; P314-G348 WeakPolarHBondContact O-CA 3.4Å; P314-V419 HydrophobicContact CB-CB 4.05Å; P314-V419 HydrophobicContact CB-CG2 4.41Å; P314-I422 HydrophobicContact CB-CD1 3.47Å; P314-I422 VanDerWaalsContact CB-CD1 3.47Å; P314-I422 HydrophobicContact CG-CD1 3.24Å
315	L	90.9	Very high	94.6	Very high	74 Å²	74	53.1 Å²	53.1	39%	0.387	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	136.1	174.7	-175.4	68.2	0	0	0	111.1	Y317 G348 S350 P418 V419	L315-Y317 PolarHBondContact O-N 3.37Å; L315-G348 WeakPolarHBondContact CA-O 3.31Å; L315-S350 PolarHBondContact N-OG 3.12Å; L315-P418 HydrophobicContact CB-CB 4.15Å; L315-V419 WeakPolarHBondContact O-CB 3.49Å; L315-V419 PolarHBondContact O-N 3.29Å
316	N	87.3	Confident	94.4	Very high	134 Å²	134	48.7 Å²	48.7	72%	0.717	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.6	9	-174.7	-58.3	-24.4	0	0	0	115.3	P314 V419	P314-N316 PolarHBondContact O-N 3.44Å; N316-V419 HydrophobicContact CB-CG1 4.17Å
317	Y	89.8	Confident	94	Very high	51 Å²	51	45.6 Å²	45.6	20%	0.2	25%	0.245	C	C	.	.			trans	-90.9	138.7	166.6	-172.6	-111.3	0	0	0	110	L313 P314 L315 L319 G348 V419 Y432	L313-Y317 HydrophobicContact CD1-CD1 4.46Å; L313-Y317 HydrophobicContact CD2-CD1 4.33Å; L313-Y317 HydrophobicContact CD2-CE1 4.47Å; P314-Y317 WeakPolarHBondContact O-CB 3.46Å; P314-Y317 PolarHBondContact O-N 2.73Å; L315-Y317 PolarHBondContact O-N 3.37Å; Y317-L319 HydrophobicContact CD1-CB 4.48Å; Y317-L319 HydrophobicContact CE1-CB 3.93Å; Y317-L319 HydrophobicContact CE1-CD1 4.37Å; Y317-G348 PolarHBondContact O-N 3.27Å; Y317-V419 HydrophobicContact CD2-CG2 3.78Å; Y317-V419 HydrophobicContact CG-CG2 4.15Å; Y317-Y432 VanDerWaalsContact CE1-CB 3.46Å; Y317-Y432 HydrophobicContact CE1-CD1 4.42Å; Y317-Y432 HydrophobicContact CE1-CD2 4.39Å; Y317-Y432 AromaticContact CE1-CG 3.87Å; Y317-Y432 HydrophobicContact CE1-CG 3.87Å
318	T	92.2	Very high	93.2	Very high	60 Å²	60	47.9 Å²	47.9	37%	0.368	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	121.2	170.8	-59.4	0	0	0	0	108.9	H345 Y346 Q347	T318-H345 HydrophobicContact CG2-CB 4.04Å; T318-Y346 CarbonylContact C-O 3.43Å; T318-Y346 WeakPolarHBondContact CA-O 3.15Å; T318-Q347 HydrophobicContact CG2-CG 4.4Å
319	L	93.3	Very high	92.5	Very high	19 Å²	19	52.2 Å²	52.2	10%	0.099	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	120.7	173	179.4	69.5	0	0	0	109	L313 Y317 V321 Y346 Y432	L313-L319 HydrophobicContact CD1-CB 3.68Å; L313-L319 HydrophobicContact CD1-CD2 4.28Å; Y317-L319 HydrophobicContact CD1-CB 4.48Å; Y317-L319 HydrophobicContact CE1-CB 3.93Å; Y317-L319 HydrophobicContact CE1-CD1 4.37Å; L319-V321 HydrophobicContact CD2-CG2 3.92Å; L319-V321 HydrophobicContact CG-CG2 3.79Å; L319-Y346 PolarHBondContact N-O 3.46Å; L319-Y346 PolarHBondContact O-N 3.28Å; L319-Y432 HydrophobicContact CD1-CD2 4.46Å; L319-Y432 HydrophobicContact CD1-CE2 4.1Å; L319-Y432 HydrophobicContact CD2-CD2 4.29Å; L319-Y432 HydrophobicContact CD2-CE2 3.94Å
320	V	95.7	Very high	92.2	Very high	73 Å²	73	48.8 Å²	48.8	44%	0.442	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	128.9	174.7	-176.4	0	0	0	0	109.1	E343 Y344	V320-E343 HydrophobicContact CG1-CB 4.03Å; V320-E343 HydrophobicContact CG1-CG 4.17Å; V320-Y344 WeakPolarHBondContact CA-O 3.3Å
321	V	95.3	Very high	91.9	Very high	13 Å²	13	48.9 Å²	48.9	8%	0.079	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	135.3	-177.9	-170.5	0	0	0	0	109.8	L319 S323 E325 V326 E343 Y344 Y346	L319-V321 HydrophobicContact CD2-CG2 3.92Å; L319-V321 HydrophobicContact CG-CG2 3.79Å; V321-S323 PolarHBondContact O-N 2.77Å; V321-E325 HydrophobicContact CG1-CB 4.32Å; V321-V326 HydrophobicContact CB-CG2 4.17Å; V321-V326 HydrophobicContact CG1-CG2 3.68Å; V321-E343 CarbonylContact O-C 3.53Å; V321-E343 VanDerWaalsContact O-CA 3.23Å; V321-E343 WeakPolarHBondContact O-CA 3.3Å; V321-E343 WeakPolarHBondContact O-CB 3.19Å; V321-Y344 PolarHBondContact N-O 2.87Å; V321-Y344 PolarHBondContact O-N 3.33Å; V321-Y346 HydrophobicContact CB-CE2 4.1Å; V321-Y346 HydrophobicContact CG2-CD2 3.94Å; V321-Y346 HydrophobicContact CG2-CE2 3.89Å
322	N	96.6	Very high	91.6	Very high	74 Å²	74	48.7 Å²	48.7	40%	0.396	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	132.2	175	-170.2	-55.9	0	0	0	110.3	T324 E325 V326 A342	N322-T324 PolarHBondContact O-N 3.01Å; N322-T324 WeakPolarHBondContact OD1-CB 3.27Å; N322-T324 WeakPolarHBondContact OD1-CG2 3.37Å; N322-T324 PolarHBondContact OD1-N 2.83Å; N322-T324 PolarHBondContact OD1-OG1 2.75Å; N322-E325 HydrophobicContact CB-CG 4.22Å; N322-E325 WeakPolarHBondContact O-CB 3.29Å; N322-E325 PolarHBondContact O-N 3.26Å; N322-V326 PolarHBondContact O-N 3.05Å; N322-A342 PolarHBondContact OD1-O 2.85Å
323	S	94.9	Very high	91.1	Very high	6 Å²	6	53.7 Å²	53.7	4%	0.042	30%	0.295	C	S	.	.	H	α-helix	trans	-62.3	-27.8	-176.7	62.8	0	0	0	0	113	V321 E325 V326 F327 P341 A342 Y344	V321-S323 PolarHBondContact O-N 2.77Å; S323-E325 VanDerWaalsContact C-N 3.27Å; S323-E325 PolarHBondContact O-N 3.26Å; S323-V326 PolarHBondContact O-N 2.86Å; S323-F327 PolarHBondContact O-N 3.22Å; S323-P341 WeakPolarHBondContact CB-O 3.33Å; S323-P341 PolarHBondContact OG-O 3.13Å; S323-A342 PolarHBondContact N-O 3.3Å; S323-A342 PolarHBondContact OG-O 3.37Å; S323-Y344 VanDerWaalsContact CB-CE2 3.5Å
324	T	91.4	Very high	90.7	Very high	98 Å²	98	55.7 Å²	55.7	60%	0.601	30%	0.304	S	S	*	.	H	α-helix	trans	-66.7	-26.6	173.8	65.2	0	0	0	0	113.1	N322 K328	N322-T324 PolarHBondContact O-N 3.01Å; N322-T324 WeakPolarHBondContact OD1-CB 3.27Å; N322-T324 WeakPolarHBondContact OD1-CG2 3.37Å; N322-T324 PolarHBondContact OD1-N 2.83Å; N322-T324 PolarHBondContact OD1-OG1 2.75Å; T324-K328 WeakPolarHBondContact O-CB 3.16Å; T324-K328 PolarHBondContact O-N 2.93Å
325	E	91.8	Very high	90.4	Very high	112 Å²	112	61.9 Å²	61.9	52%	0.523	33%	0.332	S	S	.	.	H	α-helix	trans	-80.6	-32.6	175.1	-66.1	-173.5	168	0	0	112.2	R292 V321 N322 S323 K328	R292-E325 WeakPolarHBondContact CD-O 3.41Å; R292-E325 PolarHBondContact NE-O 2.72Å; V321-E325 HydrophobicContact CG1-CB 4.32Å; N322-E325 HydrophobicContact CB-CG 4.22Å; N322-E325 WeakPolarHBondContact O-CB 3.29Å; N322-E325 PolarHBondContact O-N 3.26Å; S323-E325 VanDerWaalsContact C-N 3.27Å; S323-E325 PolarHBondContact O-N 3.26Å; E325-K328 WeakPolarHBondContact O-CB 3.32Å
326	V	93.3	Very high	90.1	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-67.1	-47.4	179.1	177.6	0	0	0	0	110.9	R292 Q295 A296 A299 V321 N322 S323 K328 Y344	R292-V326 WeakPolarHBondContact CG-O 3.29Å; Q295-V326 HydrophobicContact CB-CG1 4.14Å; Q295-V326 HydrophobicContact CB-CG2 4.33Å; A296-V326 HydrophobicContact CB-CG1 3.91Å; A299-V326 HydrophobicContact CB-CG1 4.46Å; V321-V326 HydrophobicContact CB-CG2 4.17Å; V321-V326 HydrophobicContact CG1-CG2 3.68Å; N322-V326 PolarHBondContact O-N 3.05Å; S323-V326 PolarHBondContact O-N 2.86Å; V326-K328 VanDerWaalsContact C-N 3.32Å; V326-Y344 HydrophobicContact CB-CD2 4.48Å; V326-Y344 HydrophobicContact CG2-CD2 4.08Å
327	F	90.5	Very high	90.1	Very high	23 Å²	23	61.1 Å²	61.1	10%	0.101	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	21.5	-179.8	-53.5	-55	0	0	0	113.2	A296 A299 I300 S323 K329 V332 F334 I340 Y344	A296-F327 HydrophobicContact CB-CD1 4.27Å; A296-F327 HydrophobicContact CB-CE1 4.18Å; A299-F327 HydrophobicContact CB-CE1 4.26Å; A299-F327 HydrophobicContact CB-CZ 3.76Å; I300-F327 HydrophobicContact CG1-CE1 3.96Å; S323-F327 PolarHBondContact O-N 3.22Å; F327-K329 PolarHBondContact O-N 2.66Å; F327-K329 VanDerWaalsContact O-N 3.16Å; F327-V332 HydrophobicContact CD1-CG1 4.07Å; F327-F334 HydrophobicContact CD1-CB 4.31Å; F327-F334 AromaticContact CD1-CD1 3.67Å; F327-F334 HydrophobicContact CD1-CD1 3.67Å; F327-F334 HydrophobicContact CD1-CG 4.44Å; F327-F334 AromaticContact CE1-CD1 3.53Å; F327-F334 HydrophobicContact CE1-CD1 3.53Å; F327-F334 HydrophobicContact CE1-CE1 4.03Å; F327-F334 HydrophobicContact CE1-CG 4.42Å; F327-F334 HydrophobicContact CE2-CD1 4.47Å; F327-F334 HydrophobicContact CG-CD1 4.24Å; F327-F334 AromaticContact CZ-CD1 3.95Å; F327-F334 HydrophobicContact CZ-CD1 3.95Å; F327-F334 HydrophobicContact CZ-CE1 4Å; F327-I340 HydrophobicContact CD2-CD1 4.05Å; F327-I340 HydrophobicContact CE2-CD1 4.23Å; F327-I340 HydrophobicContact CE2-CG2 4.3Å; F327-Y344 AromaticContact CE2-CE2 3.62Å; F327-Y344 HydrophobicContact CE2-CE2 3.62Å; F327-Y344 AromaticContact CE2-CZ 3.91Å; F327-Y344 WeakPolarHBondContact CE2-OH 3.2Å; F327-Y344 HydrophobicContact CZ-CE2 4.01Å
328	K	82.7	Confident	90.2	Very high	117 Å²	117	61.9 Å²	61.9	51%	0.509	35%	0.346	S	S	.	.			trans	-64.2	117.4	176.6	-167	170.8	-178.5	176.3	0	110	T324 E325 V326	T324-K328 WeakPolarHBondContact O-CB 3.16Å; T324-K328 PolarHBondContact O-N 2.93Å; E325-K328 WeakPolarHBondContact O-CB 3.32Å; V326-K328 VanDerWaalsContact C-N 3.32Å
329	K	82.9	Confident	90.1	Very high	107 Å²	107	63.2 Å²	63.2	47%	0.465	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	150.9	170.1	-70.5	-174.8	-179.5	-178.5	0	110.3	F327 E335	F327-K329 PolarHBondContact O-N 2.66Å; F327-K329 VanDerWaalsContact O-N 3.16Å; K329-E335 IonicContact NZ-OE1 3.83Å; K329-E335 PolarHBondContact NZ-OE1 2.79Å
330	P	91.2	Very high	90.2	Very high	39 Å²	39	65.1 Å²	65.1	25%	0.253	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	cis	-103.2	-8.7	15.2	39.6	-36.9	0	0	0	115.6	L167 L170 V332	L167-P330 HydrophobicContact CB-CG 4.31Å; L167-P330 HydrophobicContact CD2-CG 3.54Å; L170-P330 HydrophobicContact CB-CB 4.1Å; L170-P330 HydrophobicContact CB-CG 3.98Å; L170-P330 HydrophobicContact CD1-CB 4.38Å; L170-P330 HydrophobicContact CD1-CG 4.03Å; P330-V332 VanDerWaalsContact C-N 3.32Å; P330-V332 PolarHBondContact O-N 3.01Å
331	C	91.8	Very high	90.2	Very high	3 Å²	3	62.8 Å²	62.8	2%	0.02	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-15.3	-172.5	-63.9	0	0	0	0	114.7	L167 C284 E289 N366	L167-C331 WeakPolarHBondContact CD2-SG 3.47Å; C284-C331 WeakPolarHBondContact CA-SG 3.42Å; C284-C331 HydrophobicContact CB-CB 3.54Å; C284-C331 WeakPolarHBondContact CB-SG 3.32Å; C284-C331 WeakPolarHBondContact SG-CA 3.2Å; C284-C331 WeakPolarHBondContact SG-CB 3.26Å; C284-C331 CovalentContact SG-SG 2.03Å; C284-C331 PolarHBondContact SG-SG 2.82Å; E289-C331 WeakPolarHBondContact OE2-CB 3.49Å; E289-C331 PolarHBondContact OE2-SG 2.79Å; C331-N366 PolarHBondContact O-ND2 2.84Å
332	V	91.2	Very high	90.3	Very high	8 Å²	8	65.9 Å²	65.9	5%	0.048	39%	0.387	C	S	.	.			trans	-115.7	108.8	174.6	178.8	0	0	0	0	108.4	R292 I293 A296 F327 P330 F334	R292-V332 HydrophobicContact CG-CG2 4.09Å; I293-V332 HydrophobicContact CG1-CG2 4.06Å; A296-V332 HydrophobicContact CB-CB 4.44Å; A296-V332 HydrophobicContact CB-CG1 3.57Å; A296-V332 HydrophobicContact CB-CG2 3.94Å; F327-V332 HydrophobicContact CD1-CG1 4.07Å; P330-V332 VanDerWaalsContact C-N 3.32Å; P330-V332 PolarHBondContact O-N 3.01Å; V332-F334 HydrophobicContact CG1-CB 4.2Å; V332-F334 PolarHBondContact O-N 2.84Å
333	A	84.4	Confident	90.4	Very high	107 Å²	107	66.6 Å²	66.6	88%	0.884	39%	0.387	S	S	*	.			trans	-94.5	72.3	178.2	0	0	0	0	0	110.2
334	F	86.9	Confident	90.5	Very high	44 Å²	44	66.3 Å²	66.3	19%	0.193	39%	0.385	C	S	.	.			trans	-135.6	132	175.8	-179.6	-109.2	0	0	0	110.5	I300 P303 F327 V332 P336	I300-F334 HydrophobicContact CB-CE2 4.43Å; I300-F334 HydrophobicContact CD1-CB 3.76Å; I300-F334 HydrophobicContact CD1-CD1 4.3Å; I300-F334 HydrophobicContact CD1-CD2 3.95Å; I300-F334 HydrophobicContact CD1-CG 3.75Å; I300-F334 HydrophobicContact CG1-CB 4.17Å; I300-F334 HydrophobicContact CG1-CD1 3.73Å; I300-F334 HydrophobicContact CG1-CD2 3.74Å; I300-F334 HydrophobicContact CG1-CE1 3.95Å; I300-F334 HydrophobicContact CG1-CE2 3.98Å; I300-F334 HydrophobicContact CG1-CG 3.6Å; I300-F334 HydrophobicContact CG1-CZ 4.08Å; I300-F334 HydrophobicContact CG2-CD2 4.13Å; I300-F334 HydrophobicContact CG2-CE2 3.9Å; I300-F334 HydrophobicContact CG2-CZ 4.38Å; P303-F334 HydrophobicContact CB-CE1 4.41Å; P303-F334 HydrophobicContact CB-CZ 4.39Å; P303-F334 HydrophobicContact CG-CE1 4.27Å; P303-F334 HydrophobicContact CG-CZ 3.82Å; F327-F334 HydrophobicContact CD1-CB 4.31Å; F327-F334 AromaticContact CD1-CD1 3.67Å; F327-F334 HydrophobicContact CD1-CD1 3.67Å; F327-F334 HydrophobicContact CD1-CG 4.44Å; F327-F334 AromaticContact CE1-CD1 3.53Å; F327-F334 HydrophobicContact CE1-CD1 3.53Å; F327-F334 HydrophobicContact CE1-CE1 4.03Å; F327-F334 HydrophobicContact CE1-CG 4.42Å; F327-F334 HydrophobicContact CE2-CD1 4.47Å; F327-F334 HydrophobicContact CG-CD1 4.24Å; F327-F334 AromaticContact CZ-CD1 3.95Å; F327-F334 HydrophobicContact CZ-CD1 3.95Å; F327-F334 HydrophobicContact CZ-CE1 4Å; V332-F334 HydrophobicContact CG1-CB 4.2Å; V332-F334 PolarHBondContact O-N 2.84Å; F334-P336 HydrophobicContact CE1-CB 3.75Å; F334-P336 HydrophobicContact CE1-CG 4.41Å; F334-P336 HydrophobicContact CZ-CB 4.26Å
335	E	84.8	Confident	90.8	Very high	137 Å²	137	64.1 Å²	64.1	64%	0.64	37%	0.368	S	S	*	.			trans	-119.9	107.8	173.2	-67.9	-174.3	177	0	0	107.6	K329 T337	K329-E335 IonicContact NZ-OE1 3.83Å; K329-E335 PolarHBondContact NZ-OE1 2.79Å; E335-T337 PolarHBondContact O-N 2.97Å
336	P	83.7	Confident	91.1	Very high	49 Å²	49	58.8 Å²	58.8	32%	0.318	34%	0.343	S	S	.	.			trans	-64.8	129.7	-178.3	24.6	-31.7	0	0	0	110.3	F334 V338 I340	F334-P336 HydrophobicContact CE1-CB 3.75Å; F334-P336 HydrophobicContact CE1-CG 4.41Å; F334-P336 HydrophobicContact CZ-CB 4.26Å; P336-V338 VanDerWaalsContact C-N 3.31Å; P336-I340 HydrophobicContact CB-CG2 3.53Å; P336-I340 HydrophobicContact CG-CD1 4.18Å; P336-I340 HydrophobicContact CG-CG1 4.45Å; P336-I340 HydrophobicContact CG-CG2 3.83Å
337	T	88.5	Confident	91.2	Very high	144 Å²	144	62.2 Å²	62.2	88%	0.883	36%	0.359	S	S	*	.	S	Bend	trans	-87.4	-6	173.1	54.7	0	0	0	0	112.8	E335	E335-T337 PolarHBondContact O-N 2.97Å
338	V	90.9	Very high	91.4	Very high	66 Å²	66	61.4 Å²	61.4	40%	0.4	36%	0.358	S	S	.	.	S	Bend	trans	-119.5	160.2	179.6	-62.6	0	0	0	0	110.1	P303 S304 P336 I340	P303-V338 HydrophobicContact CB-CG2 3.84Å; P303-V338 HydrophobicContact CG-CG2 4.33Å; S304-V338 WeakPolarHBondContact OG-CG2 3.45Å; P336-V338 VanDerWaalsContact C-N 3.31Å; V338-I340 PolarHBondContact O-N 2.81Å
339	A	91.5	Very high	92.1	Very high	89 Å²	89	58.3 Å²	58.3	74%	0.736	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-63.4	125.9	174.3	0	0	0	0	0	110
340	I	94.1	Very high	92.6	Very high	59 Å²	59	54 Å²	54	30%	0.303	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-98.7	147.7	175.9	56	166.2	0	0	0	110.2	P303 F327 P336 V338 Y344	P303-I340 HydrophobicContact CB-CG2 4.16Å; F327-I340 HydrophobicContact CD2-CD1 4.05Å; F327-I340 HydrophobicContact CE2-CD1 4.23Å; F327-I340 HydrophobicContact CE2-CG2 4.3Å; P336-I340 HydrophobicContact CB-CG2 3.53Å; P336-I340 HydrophobicContact CG-CD1 4.18Å; P336-I340 HydrophobicContact CG-CG1 4.45Å; P336-I340 HydrophobicContact CG-CG2 3.83Å; V338-I340 PolarHBondContact O-N 2.81Å; I340-Y344 WeakPolarHBondContact CG2-OH 3.44Å
341	P	96.6	Very high	92.9	Very high	24 Å²	24	55.2 Å²	55.2	16%	0.156	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-65.6	164.7	173.5	29.8	-35.9	0	0	0	111.4	P303 I306 S323 E343 Y344	P303-P341 WeakPolarHBondContact O-CD 3.45Å; I306-P341 HydrophobicContact CG1-CB 3.84Å; I306-P341 HydrophobicContact CG1-CG 4.2Å; S323-P341 WeakPolarHBondContact CB-O 3.33Å; S323-P341 PolarHBondContact OG-O 3.13Å; P341-E343 VanDerWaalsContact C-N 3.27Å; P341-E343 PolarHBondContact O-N 3.08Å; P341-Y344 HydrophobicContact CG-CD1 3.82Å; P341-Y344 HydrophobicContact CG-CE1 3.47Å; P341-Y344 VanDerWaalsContact CG-CE1 3.47Å
342	A	96.8	Very high	93.2	Very high	78 Å²	78	55.4 Å²	55.4	65%	0.645	34%	0.337	S	S	*	.	S	Bend	trans	-67.9	-30.1	174.7	0	0	0	0	0	112.3	N322 S323	N322-A342 PolarHBondContact OD1-O 2.85Å; S323-A342 PolarHBondContact N-O 3.3Å; S323-A342 PolarHBondContact OG-O 3.37Å
343	E	98.1	Very high	93.5	Very high	89 Å²	89	62.2 Å²	62.2	42%	0.416	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	149.8	-179.4	58.1	-178.9	-145.8	0	0	111	V320 V321 P341 H345	V320-E343 HydrophobicContact CG1-CB 4.03Å; V320-E343 HydrophobicContact CG1-CG 4.17Å; V321-E343 CarbonylContact O-C 3.53Å; V321-E343 VanDerWaalsContact O-CA 3.23Å; V321-E343 WeakPolarHBondContact O-CA 3.3Å; V321-E343 WeakPolarHBondContact O-CB 3.19Å; P341-E343 VanDerWaalsContact C-N 3.27Å; P341-E343 PolarHBondContact O-N 3.08Å; E343-H345 IonicContact OE1-CD2 3.77Å; E343-H345 IonicContact OE1-CE1 3.69Å; E343-H345 IonicContact OE1-NE2 3.62Å; E343-H345 PolarHBondContact OE1-NE2 3.21Å
344	Y	98.3	Very high	94.1	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	143.8	172.9	-68.6	-70.8	0	0	0	110.4	A299 P303 D305 I306 H308 V320 V321 S323 V326 F327 I340 P341	A299-Y344 HydrophobicContact CB-CD1 4.45Å; A299-Y344 HydrophobicContact CB-CD2 4.38Å; A299-Y344 HydrophobicContact CB-CE1 4.16Å; A299-Y344 HydrophobicContact CB-CE2 4.08Å; P303-Y344 PolarHBondContact O-OH 3.06Å; D305-Y344 WeakPolarHBondContact O-CD1 3.37Å; D305-Y344 WeakPolarHBondContact O-CE1 3.34Å; I306-Y344 WeakPolarHBondContact O-CA 3.48Å; H308-Y344 AromaticContact CD2-CD1 3.69Å; H308-Y344 AromaticContact NE2-CD1 3.51Å; H308-Y344 AromaticContact NE2-CE1 3.64Å; V320-Y344 WeakPolarHBondContact CA-O 3.3Å; V321-Y344 PolarHBondContact N-O 2.87Å; V321-Y344 PolarHBondContact O-N 3.33Å; S323-Y344 VanDerWaalsContact CB-CE2 3.5Å; V326-Y344 HydrophobicContact CB-CD2 4.48Å; V326-Y344 HydrophobicContact CG2-CD2 4.08Å; F327-Y344 AromaticContact CE2-CE2 3.62Å; F327-Y344 HydrophobicContact CE2-CE2 3.62Å; F327-Y344 AromaticContact CE2-CZ 3.91Å; F327-Y344 WeakPolarHBondContact CE2-OH 3.2Å; F327-Y344 HydrophobicContact CZ-CE2 4.01Å; I340-Y344 WeakPolarHBondContact CG2-OH 3.44Å; P341-Y344 HydrophobicContact CG-CD1 3.82Å; P341-Y344 HydrophobicContact CG-CE1 3.47Å; P341-Y344 VanDerWaalsContact CG-CE1 3.47Å
345	H	98	Very high	94.7	Very high	51 Å²	51	56.5 Å²	56.5	24%	0.236	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	101.3	-178.4	-71.9	-145.8	0	0	0	108.7	I306 V307 H308 T318 E343	I306-H345 HydrophobicContact CG2-CB 4.28Å; I306-H345 PolarHBondContact O-N 3.02Å; V307-H345 WeakPolarHBondContact CA-O 3.39Å; V307-H345 HydrophobicContact CG2-CB 4.23Å; H308-H345 PolarHBondContact N-O 2.84Å; T318-H345 HydrophobicContact CG2-CB 4.04Å; E343-H345 IonicContact OE1-CD2 3.77Å; E343-H345 IonicContact OE1-CE1 3.69Å; E343-H345 IonicContact OE1-NE2 3.62Å; E343-H345 PolarHBondContact OE1-NE2 3.21Å
346	Y	97.4	Very high	95.2	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	111.3	-179.5	-62	-83.4	0	0	0	110.4	Q295 L298 H308 D310 T318 L319 V321	Q295-Y346 HydrophobicContact CB-CE1 4.24Å; Q295-Y346 HydrophobicContact CB-CE2 4.12Å; Q295-Y346 WeakPolarHBondContact CB-OH 3.07Å; Q295-Y346 HydrophobicContact CG-CD2 4.42Å; Q295-Y346 HydrophobicContact CG-CE1 4.4Å; Q295-Y346 HydrophobicContact CG-CE2 3.94Å; Q295-Y346 PolarHBondContact O-OH 2.87Å; L298-Y346 HydrophobicContact CB-CD1 4.46Å; L298-Y346 HydrophobicContact CB-CE1 3.96Å; L298-Y346 HydrophobicContact CD1-CD1 3.88Å; L298-Y346 HydrophobicContact CD1-CE1 4.1Å; H308-Y346 HydrophobicContact CB-CD1 3.93Å; H308-Y346 HydrophobicContact CB-CE1 4.1Å; H308-Y346 CarbonylContact O-C 3.52Å; H308-Y346 VanDerWaalsContact O-CA 3.31Å; H308-Y346 WeakPolarHBondContact O-CA 3.38Å; D310-Y346 HydrophobicContact CB-CD1 4.47Å; T318-Y346 CarbonylContact C-O 3.43Å; T318-Y346 WeakPolarHBondContact CA-O 3.15Å; L319-Y346 PolarHBondContact N-O 3.46Å; L319-Y346 PolarHBondContact O-N 3.28Å; V321-Y346 HydrophobicContact CB-CE2 4.1Å; V321-Y346 HydrophobicContact CG2-CD2 3.94Å; V321-Y346 HydrophobicContact CG2-CE2 3.89Å
347	Q	95.7	Very high	95.8	Very high	73 Å²	73	56.3 Å²	56.3	34%	0.341	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	122.8	179.9	-68.4	-174.2	-10.8	0	0	110.7	V307 H308 M309 D310 T318	V307-Q347 HydrophobicContact CG1-CG 3.9Å; H308-Q347 PolarHBondContact O-N 2.93Å; M309-Q347 CarbonylContact C-O 3.58Å; M309-Q347 WeakPolarHBondContact CA-O 3.27Å; M309-Q347 HydrophobicContact SD-CB 3.9Å; D310-Q347 PolarHBondContact N-O 2.82Å; T318-Q347 HydrophobicContact CG2-CG 4.4Å
348	G	94.8	Very high	96.2	Very high	6 Å²	6	50.1 Å²	50.1	6%	0.062	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	142.3	-178.5	0	0	0	0	0	113.5	D310 L313 P314 L315 Y317	D310-G348 WeakPolarHBondContact O-CA 3.44Å; L313-G348 CarbonylContact O-C 3.58Å; L313-G348 VanDerWaalsContact O-CA 3.29Å; L313-G348 WeakPolarHBondContact O-CA 3.31Å; P314-G348 VanDerWaalsContact O-CA 3.32Å; P314-G348 WeakPolarHBondContact O-CA 3.4Å; L315-G348 WeakPolarHBondContact CA-O 3.31Å; Y317-G348 PolarHBondContact O-N 3.27Å
349	T	95.8	Very high	96.4	Very high	51 Å²	51	47 Å²	47	31%	0.313	26%	0.258	S	S	.	.			trans	-119.4	-4.7	178	69	0	0	0	0	114.1	M309 D310 P311 L313 D351	M309-T349 HydrophobicContact CB-CG2 3.98Å; M309-T349 HydrophobicContact CG-CG2 4.32Å; M309-T349 HydrophobicContact SD-CG2 3.93Å; D310-T349 PolarHBondContact O-N 2.94Å; P311-T349 VanDerWaalsContact CA-OG1 3.28Å; P311-T349 WeakPolarHBondContact CA-OG1 3.05Å; L313-T349 PolarHBondContact O-N 3.11Å; T349-D351 VanDerWaalsContact C-N 3.3Å; T349-D351 PolarHBondContact O-N 3Å
350	S	94.7	Very high	96.4	Very high	16 Å²	16	44.3 Å²	44.3	11%	0.112	23%	0.231	C	C	.	.			trans	51.4	43.2	-178.3	-70.6	0	0	0	0	114.2	L313 L315 P352 C415 R417	L313-S350 PolarHBondContact O-N 3.34Å; L313-S350 VanDerWaalsContact O-N 3.16Å; L315-S350 PolarHBondContact N-OG 3.12Å; S350-P352 VanDerWaalsContact O-CD 3.31Å; S350-P352 WeakPolarHBondContact O-CD 3.31Å; S350-C415 CarbonylContact C-O 3.59Å; S350-C415 WeakPolarHBondContact CA-O 3.11Å; S350-C415 VanDerWaalsContact CB-O 3.25Å; S350-C415 WeakPolarHBondContact CB-O 3.22Å; S350-C415 PolarHBondContact OG-O 3.43Å; S350-R417 PolarHBondContact OG-O 3.46Å
351	D	97.1	Very high	96.3	Very high	65 Å²	65	44 Å²	44	35%	0.348	23%	0.232	S	C	.	.			trans	-106.9	97.2	-179.9	-175.9	-20.3	0	0	0	110.3	P311 T349 Y353 A354 C355	P311-D351 HydrophobicContact CB-CB 3.98Å; P311-D351 PolarHBondContact O-N 3.29Å; T349-D351 VanDerWaalsContact C-N 3.3Å; T349-D351 PolarHBondContact O-N 3Å; D351-Y353 VanDerWaalsContact C-N 3.28Å; D351-Y353 PolarHBondContact O-N 3.39Å; D351-Y353 PolarHBondContact OD1-N 2.89Å; D351-A354 HydrophobicContact CB-CB 3.97Å; D351-A354 VanDerWaalsContact CG-CB 3.43Å; D351-A354 PolarHBondContact O-N 3.29Å; D351-A354 PolarHBondContact OD1-N 3.22Å; D351-A354 WeakPolarHBondContact OD2-CB 3.48Å; D351-C355 VanDerWaalsContact O-CB 3.27Å; D351-C355 WeakPolarHBondContact O-CB 3.23Å; D351-C355 PolarHBondContact O-N 3.22Å
352	P	97.1	Very high	96	Very high	8 Å²	8	42.9 Å²	42.9	5%	0.052	23%	0.225	C	C	.	.	H	α-helix	trans	-62.6	-33.2	-178.4	24.4	-34.8	0	0	0	113.3	S350 C355 R356 W412 C415 E416 M439	S350-P352 VanDerWaalsContact O-CD 3.31Å; S350-P352 WeakPolarHBondContact O-CD 3.31Å; P352-C355 PolarHBondContact O-N 3Å; P352-R356 PolarHBondContact O-N 2.72Å; P352-W412 HydrophobicContact CB-CD2 3.71Å; P352-W412 HydrophobicContact CB-CE3 3.98Å; P352-W412 HydrophobicContact CB-CG 4.17Å; P352-W412 HydrophobicContact CB-CH2 4.15Å; P352-W412 HydrophobicContact CB-CZ2 3.9Å; P352-W412 HydrophobicContact CB-CZ3 4.19Å; P352-W412 HydrophobicContact CG-CD2 3.94Å; P352-W412 HydrophobicContact CG-CG 4.32Å; P352-W412 HydrophobicContact CG-CH2 4.26Å; P352-W412 HydrophobicContact CG-CZ2 3.56Å; P352-C415 HydrophobicContact CB-CB 3.84Å; P352-E416 HydrophobicContact CG-CG 3.74Å; P352-M439 HydrophobicContact CB-CE 3.57Å
353	Y	97.9	Very high	95.5	Very high	151 Å²	151	39.3 Å²	39.3	59%	0.592	20%	0.195	S	C	*	.	H	α-helix	trans	-70	-49.7	-179.7	177.9	-94.3	0	0	0	110.5	D351 C355 R356 M357	D351-Y353 VanDerWaalsContact C-N 3.28Å; D351-Y353 PolarHBondContact O-N 3.39Å; D351-Y353 PolarHBondContact OD1-N 2.89Å; Y353-C355 VanDerWaalsContact C-N 3.28Å; Y353-C355 PolarHBondContact O-N 3.48Å; Y353-R356 PolarHBondContact O-N 2.73Å; Y353-M357 HydrophobicContact CD1-CG 4.49Å; Y353-M357 HydrophobicContact CE1-CG 4.1Å; Y353-M357 WeakPolarHBondContact O-CG 3.17Å; Y353-M357 PolarHBondContact O-N 3.43Å; Y353-M357 VanDerWaalsContact O-N 3.09Å
354	A	98.2	Very high	94.8	Very high	30 Å²	30	43 Å²	43	25%	0.248	21%	0.205	C	C	.	.	H	α-helix	trans	-64	-34.5	175.6	0	0	0	0	0	111.8	P311 D351 M357 L358	P311-A354 HydrophobicContact CB-CB 3.56Å; P311-A354 HydrophobicContact CG-CB 3.9Å; D351-A354 HydrophobicContact CB-CB 3.97Å; D351-A354 VanDerWaalsContact CG-CB 3.43Å; D351-A354 PolarHBondContact O-N 3.29Å; D351-A354 PolarHBondContact OD1-N 3.22Å; D351-A354 WeakPolarHBondContact OD2-CB 3.48Å; A354-M357 PolarHBondContact O-N 3.06Å; A354-L358 WeakPolarHBondContact O-CB 3.47Å; A354-L358 PolarHBondContact O-N 3.26Å
355	C	98.2	Very high	93.6	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-62.1	-45.4	174.8	179.1	0	0	0	0	111.9	P311 C312 D351 P352 Y353 M357 L358 I359	P311-C355 HydrophobicContact CB-CB 4.28Å; P311-C355 HydrophobicContact CG-CB 4.46Å; C312-C355 WeakPolarHBondContact CA-SG 3.26Å; C312-C355 HydrophobicContact CB-CB 3.98Å; C312-C355 WeakPolarHBondContact CB-SG 3.39Å; C312-C355 WeakPolarHBondContact SG-CA 3.41Å; C312-C355 WeakPolarHBondContact SG-CB 3.28Å; C312-C355 CovalentContact SG-SG 2.03Å; C312-C355 PolarHBondContact SG-SG 3.47Å; D351-C355 VanDerWaalsContact O-CB 3.27Å; D351-C355 WeakPolarHBondContact O-CB 3.23Å; D351-C355 PolarHBondContact O-N 3.22Å; P352-C355 PolarHBondContact O-N 3Å; Y353-C355 VanDerWaalsContact C-N 3.28Å; Y353-C355 PolarHBondContact O-N 3.48Å; C355-M357 PolarHBondContact O-N 3.17Å; C355-L358 WeakPolarHBondContact O-CB 3.38Å; C355-L358 PolarHBondContact O-N 3.39Å; C355-I359 WeakPolarHBondContact O-CG1 3.29Å; C355-I359 PolarHBondContact O-N 2.83Å
356	R	96.7	Very high	92.2	Very high	95 Å²	95	46.4 Å²	46.4	36%	0.358	22%	0.224	S	C	.	.	H	α-helix	trans	-60.7	-45.2	176	-174.8	173.6	-177.2	165.8	3.9	111.8	P352 Y353 L358 I359 D360 D447	P352-R356 PolarHBondContact O-N 2.72Å; Y353-R356 PolarHBondContact O-N 2.73Å; R356-L358 VanDerWaalsContact C-N 3.3Å; R356-L358 PolarHBondContact O-N 3.37Å; R356-I359 PolarHBondContact O-N 3.41Å; R356-D360 PolarHBondContact O-N 3.23Å; R356-D447 IonicContact NH2-OD2 3.82Å
357	M	96.3	Very high	90.7	Very high	87 Å²	87	51.2 Å²	51.2	43%	0.429	26%	0.258	S	S	.	.	H	α-helix	trans	-61.5	-38.5	176.2	-69.7	-59.8	-58.9	0	0	112.3	Y353 A354 C355 D360 T361	Y353-M357 HydrophobicContact CD1-CG 4.49Å; Y353-M357 HydrophobicContact CE1-CG 4.1Å; Y353-M357 WeakPolarHBondContact O-CG 3.17Å; Y353-M357 PolarHBondContact O-N 3.43Å; Y353-M357 VanDerWaalsContact O-N 3.09Å; A354-M357 PolarHBondContact O-N 3.06Å; C355-M357 PolarHBondContact O-N 3.17Å; M357-D360 PolarHBondContact O-N 3.43Å; M357-T361 WeakPolarHBondContact O-CB 3.32Å; M357-T361 PolarHBondContact O-N 3.07Å; M357-T361 PolarHBondContact O-OG1 3.17Å; M357-T361 VanDerWaalsContact O-OG1 3.11Å
358	L	96.3	Very high	89.4	Confident	15 Å²	15	51 Å²	51	8%	0.079	26%	0.262	C	S	.	.	H	α-helix	trans	-65.8	-39.4	176.9	179.5	59.4	0	0	0	111.9	R294 T297 L298 P311 A354 C355 R356 T361 S362	R294-L358 HydrophobicContact CG-CD2 3.55Å; R294-L358 HydrophobicContact CG-CG 4.01Å; T297-L358 HydrophobicContact CG2-CD1 3.7Å; L298-L358 HydrophobicContact CD1-CD2 3.99Å; L298-L358 HydrophobicContact CD2-CD1 3.97Å; L298-L358 HydrophobicContact CD2-CD2 3.83Å; L298-L358 HydrophobicContact CG-CD1 4.21Å; L298-L358 HydrophobicContact CG-CD2 3.95Å; P311-L358 HydrophobicContact CG-CB 4.43Å; P311-L358 HydrophobicContact CG-CD2 3.92Å; A354-L358 WeakPolarHBondContact O-CB 3.47Å; A354-L358 PolarHBondContact O-N 3.26Å; C355-L358 WeakPolarHBondContact O-CB 3.38Å; C355-L358 PolarHBondContact O-N 3.39Å; R356-L358 VanDerWaalsContact C-N 3.3Å; R356-L358 PolarHBondContact O-N 3.37Å; L358-T361 PolarHBondContact O-N 3.44Å; L358-S362 VanDerWaalsContact O-CB 3.26Å; L358-S362 WeakPolarHBondContact O-CB 3.35Å; L358-S362 PolarHBondContact O-N 3.37Å; L358-S362 PolarHBondContact O-OG 2.88Å
359	I	95	Very high	88.7	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-62.6	-47.8	174.1	-72.8	161.5	0	0	0	110.5	C355 R356 T361 S362 M363 F436 M439 Y440 T443	C355-I359 WeakPolarHBondContact O-CG1 3.29Å; C355-I359 PolarHBondContact O-N 2.83Å; R356-I359 PolarHBondContact O-N 3.41Å; I359-T361 VanDerWaalsContact C-N 3.32Å; I359-T361 PolarHBondContact O-N 3.4Å; I359-S362 WeakPolarHBondContact O-CB 3.31Å; I359-S362 PolarHBondContact O-N 2.85Å; I359-M363 HydrophobicContact CG2-CG 4.48Å; I359-M363 HydrophobicContact CG2-SD 4.33Å; I359-M363 WeakPolarHBondContact O-CG 3.5Å; I359-M363 PolarHBondContact O-N 2.92Å; I359-F436 HydrophobicContact CD1-CD2 3.9Å; I359-F436 HydrophobicContact CD1-CE2 4.04Å; I359-F436 HydrophobicContact CG1-CD2 3.73Å; I359-F436 HydrophobicContact CG1-CE2 3.38Å; I359-F436 HydrophobicContact CG1-CZ 4.17Å; I359-M439 HydrophobicContact CD1-CB 3.27Å; I359-M439 HydrophobicContact CD1-CG 4.4Å; I359-Y440 HydrophobicContact CG2-CD2 4.07Å; I359-T443 HydrophobicContact CG2-CG2 4.19Å
360	D	91.6	Very high	87.8	Confident	32 Å²	32	49.2 Å²	49.2	17%	0.171	25%	0.248	C	C	.	.	H	α-helix	trans	-59.9	-42.9	179	-74.4	-17.5	0	0	0	111.8	R356 M357 R364	R356-D360 PolarHBondContact O-N 3.23Å; M357-D360 PolarHBondContact O-N 3.43Å; D360-R364 WeakPolarHBondContact O-CG 3.42Å; D360-R364 PolarHBondContact O-N 2.82Å
361	T	91.1	Very high	86.7	Confident	53 Å²	53	51.7 Å²	51.7	33%	0.325	26%	0.262	S	S	.	.	H	α-helix	trans	-64.2	-45.8	174.5	-64.4	0	0	0	0	111.7	T297 M357 L358 I359 M363 R364 I365	T297-T361 HydrophobicContact CG2-CG2 3.91Å; M357-T361 WeakPolarHBondContact O-CB 3.32Å; M357-T361 PolarHBondContact O-N 3.07Å; M357-T361 PolarHBondContact O-OG1 3.17Å; M357-T361 VanDerWaalsContact O-OG1 3.11Å; L358-T361 PolarHBondContact O-N 3.44Å; I359-T361 VanDerWaalsContact C-N 3.32Å; I359-T361 PolarHBondContact O-N 3.4Å; T361-M363 VanDerWaalsContact C-N 3.29Å; T361-M363 PolarHBondContact O-N 3.41Å; T361-R364 PolarHBondContact O-N 2.92Å; T361-R364 VanDerWaalsContact O-N 3.11Å; T361-I365 HydrophobicContact CG2-CD1 3.52Å; T361-I365 HydrophobicContact CG2-CG1 4.16Å; T361-I365 WeakPolarHBondContact O-CG1 3.49Å; T361-I365 PolarHBondContact O-N 2.92Å
362	S	91	Very high	85.3	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-58.3	-41.8	179.5	-62.9	0	0	0	0	111.7	I293 T297 L358 I359 N366	I293-S362 WeakPolarHBondContact CG2-O 3.2Å; T297-S362 PolarHBondContact OG1-OG 3.19Å; L358-S362 VanDerWaalsContact O-CB 3.26Å; L358-S362 WeakPolarHBondContact O-CB 3.35Å; L358-S362 PolarHBondContact O-N 3.37Å; L358-S362 PolarHBondContact O-OG 2.88Å; I359-S362 WeakPolarHBondContact O-CB 3.31Å; I359-S362 PolarHBondContact O-N 2.85Å; S362-N366 PolarHBondContact O-N 2.78Å
363	M	87.2	Confident	83.9	Confident	4 Å²	4	60.3 Å²	60.3	2%	0.02	31%	0.312	C	S	.	.	H	α-helix	trans	-71.5	-28.9	177.8	-66.2	-168.8	82.6	0	0	113.3	M290 I359 T361 F370 Y440 T443 L444 K448	M290-M363 HydrophobicContact CE-CG 3.5Å; M290-M363 HydrophobicContact SD-CG 4.44Å; I359-M363 HydrophobicContact CG2-CG 4.48Å; I359-M363 HydrophobicContact CG2-SD 4.33Å; I359-M363 WeakPolarHBondContact O-CG 3.5Å; I359-M363 PolarHBondContact O-N 2.92Å; T361-M363 VanDerWaalsContact C-N 3.29Å; T361-M363 PolarHBondContact O-N 3.41Å; M363-F370 HydrophobicContact CE-CD2 3.63Å; M363-F370 HydrophobicContact CE-CE2 3.82Å; M363-Y440 HydrophobicContact CE-CE2 3.81Å; M363-Y440 HydrophobicContact CG-CE2 4.29Å; M363-Y440 HydrophobicContact SD-CD2 4.23Å; M363-Y440 HydrophobicContact SD-CE2 3.71Å; M363-T443 HydrophobicContact SD-CG2 3.5Å; M363-T443 VanDerWaalsContact SD-CG2 3.5Å; M363-L444 HydrophobicContact CE-CD2 4.2Å; M363-K448 HydrophobicContact CE-CD 4.19Å; M363-K448 HydrophobicContact CE-CG 3.69Å; M363-K448 HydrophobicContact SD-CG 4.25Å
364	R	82.9	Confident	82.6	Confident	166 Å²	166	56.3 Å²	56.3	63%	0.626	30%	0.298	S	S	*	.	H	α-helix	trans	-79.3	-40.7	178	-72.6	179.9	-139.8	-174.8	3	113.1	D360 T361 N366	D360-R364 WeakPolarHBondContact O-CG 3.42Å; D360-R364 PolarHBondContact O-N 2.82Å; T361-R364 PolarHBondContact O-N 2.92Å; T361-R364 VanDerWaalsContact O-N 3.11Å; R364-N366 VanDerWaalsContact C-N 3.26Å; R364-N366 PolarHBondContact O-N 3.01Å
365	I	71.9	Confident	81.4	Confident	109 Å²	109	60.4 Å²	60.4	56%	0.559	32%	0.322	S	S	*	.	H	α-helix	trans	-66.1	-35.5	-179	-68.5	174.7	0	0	0	110.3	T297 T361 S367	T297-I365 HydrophobicContact CG2-CD1 4.11Å; T361-I365 HydrophobicContact CG2-CD1 3.52Å; T361-I365 HydrophobicContact CG2-CG1 4.16Å; T361-I365 WeakPolarHBondContact O-CG1 3.49Å; T361-I365 PolarHBondContact O-N 2.92Å; I365-S367 PolarHBondContact O-N 2.94Å
366	N	70.1	Confident	80.6	Confident	14 Å²	14	64 Å²	64	8%	0.075	34%	0.336	C	S	.	.			trans	-83.7	95.1	178.3	-171.5	3	0	0	0	111.8	I293 C331 S362 R364 T368 C369	I293-N366 HydrophobicContact CD1-CB 4.3Å; I293-N366 WeakPolarHBondContact CD1-ND2 3.46Å; I293-N366 HydrophobicContact CG2-CB 4.33Å; C331-N366 PolarHBondContact O-ND2 2.84Å; S362-N366 PolarHBondContact O-N 2.78Å; R364-N366 VanDerWaalsContact C-N 3.26Å; R364-N366 PolarHBondContact O-N 3.01Å; N366-T368 PolarHBondContact ND2-OG1 3.29Å; N366-T368 PolarHBondContact O-N 3.35Å; N366-T368 WeakPolarHBondContact OD1-CB 3.02Å; N366-T368 PolarHBondContact OD1-N 3.26Å; N366-T368 PolarHBondContact OD1-OG1 2.96Å; N366-C369 HydrophobicContact CB-CB 4.23Å; N366-C369 PolarHBondContact O-N 3.12Å
367	S	64.5	Low	80.1	Confident	101 Å²	101	60.4 Å²	60.4	71%	0.706	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-16.2	175.4	60.6	0	0	0	0	114.5	I365 C369	I365-S367 PolarHBondContact O-N 2.94Å; S367-C369 VanDerWaalsContact C-N 3.32Å
368	T	69.7	Low	79.7	Confident	69 Å²	69	65.1 Å²	65.1	42%	0.423	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-19.2	174.2	69.1	0	0	0	0	112.5	C284 N366	C284-T368 VanDerWaalsContact CB-OG1 3.26Å; C284-T368 WeakPolarHBondContact CB-OG1 3.1Å; C284-T368 PolarHBondContact SG-OG1 2.66Å; N366-T368 PolarHBondContact ND2-OG1 3.29Å; N366-T368 PolarHBondContact O-N 3.35Å; N366-T368 WeakPolarHBondContact OD1-CB 3.02Å; N366-T368 PolarHBondContact OD1-N 3.26Å; N366-T368 PolarHBondContact OD1-OG1 2.96Å
369	C	79.7	Confident	79.4	Confident	1 Å²	1	65.3 Å²	65.3	1%	0.007	35%	0.348	C	S	.	.	S	Bend	trans	-104.8	98.4	-176.5	-171.5	0	0	0	0	112.4	C285 N366 S367	C285-C369 HydrophobicContact CB-CB 4.35Å; C285-C369 WeakPolarHBondContact CB-SG 3.41Å; C285-C369 WeakPolarHBondContact SG-CA 3.38Å; C285-C369 WeakPolarHBondContact SG-CB 2.96Å; C285-C369 CovalentContact SG-SG 2.03Å; C285-C369 PolarHBondContact SG-SG 2.94Å; N366-C369 HydrophobicContact CB-CB 4.23Å; N366-C369 PolarHBondContact O-N 3.12Å; S367-C369 VanDerWaalsContact C-N 3.32Å
370	F	77.7	Confident	78.8	Confident	18 Å²	18	68.4 Å²	68.4	8%	0.079	37%	0.369	C	S	.	.			trans	60.3	119.2	-174.6	-65.9	-95	0	0	0	114.7	T250 Y282 C285 M363 L444 K448 Y449	T250-F370 HydrophobicContact CG2-CE2 4.45Å; T250-F370 HydrophobicContact CG2-CZ 4.44Å; Y282-F370 HydrophobicContact CD1-CB 4.49Å; Y282-F370 AromaticContact CD1-CD1 3.75Å; Y282-F370 HydrophobicContact CD1-CD1 3.75Å; Y282-F370 HydrophobicContact CD1-CD2 4.18Å; Y282-F370 AromaticContact CD1-CE1 3.94Å; Y282-F370 HydrophobicContact CD1-CE1 3.94Å; Y282-F370 HydrophobicContact CD1-CE2 4.33Å; Y282-F370 AromaticContact CD1-CG 3.88Å; Y282-F370 HydrophobicContact CD1-CG 3.88Å; Y282-F370 HydrophobicContact CD1-CZ 4.22Å; Y282-F370 HydrophobicContact CD2-CD1 4.34Å; Y282-F370 AromaticContact CD2-CE1 3.67Å; Y282-F370 HydrophobicContact CD2-CE1 3.67Å; Y282-F370 HydrophobicContact CD2-CE2 4.2Å; Y282-F370 AromaticContact CD2-CZ 3.59Å; Y282-F370 HydrophobicContact CD2-CZ 3.59Å; Y282-F370 HydrophobicContact CE1-CB 4.46Å; Y282-F370 AromaticContact CE1-CD1 3.35Å; Y282-F370 HydrophobicContact CE1-CD1 3.35Å; Y282-F370 AromaticContact CE1-CE1 3.62Å; Y282-F370 HydrophobicContact CE1-CE1 3.62Å; Y282-F370 AromaticContact CE1-CG 3.9Å; Y282-F370 HydrophobicContact CE1-CG 3.9Å; Y282-F370 HydrophobicContact CE1-CZ 4.35Å; Y282-F370 HydrophobicContact CE2-CD1 4.01Å; Y282-F370 AromaticContact CE2-CE1 3.33Å; Y282-F370 HydrophobicContact CE2-CE1 3.33Å; Y282-F370 AromaticContact CE2-CZ 3.74Å; Y282-F370 HydrophobicContact CE2-CZ 3.74Å; Y282-F370 HydrophobicContact CG-CD1 4.22Å; Y282-F370 HydrophobicContact CG-CD2 4.3Å; Y282-F370 AromaticContact CG-CE1 3.96Å; Y282-F370 HydrophobicContact CG-CE1 3.96Å; Y282-F370 HydrophobicContact CG-CE2 4.02Å; Y282-F370 HydrophobicContact CG-CG 4.38Å; Y282-F370 AromaticContact CG-CZ 3.85Å; Y282-F370 HydrophobicContact CG-CZ 3.85Å; Y282-F370 AromaticContact CZ-CD1 3.5Å; Y282-F370 VanDerWaalsContact CZ-CD1 3.5Å; Y282-F370 AromaticContact CZ-CE1 3.3Å; C285-F370 HydrophobicContact CB-CE2 4.18Å; C285-F370 WeakPolarHBondContact SG-CD2 3.46Å; M363-F370 HydrophobicContact CE-CD2 3.63Å; M363-F370 HydrophobicContact CE-CE2 3.82Å; F370-L444 HydrophobicContact CE2-CD2 3.51Å; F370-L444 HydrophobicContact CZ-CD2 3.65Å; F370-K448 HydrophobicContact CD1-CB 4.06Å; F370-K448 HydrophobicContact CD2-CB 4.48Å; F370-K448 HydrophobicContact CD2-CG 4.41Å; F370-K448 HydrophobicContact CE1-CB 3.74Å; F370-K448 HydrophobicContact CE2-CB 4.21Å; F370-K448 HydrophobicContact CE2-CG 4.44Å; F370-K448 HydrophobicContact CG-CB 4.43Å; F370-K448 HydrophobicContact CG-CD 4.37Å; F370-K448 HydrophobicContact CZ-CB 3.82Å; F370-Y449 HydrophobicContact CE1-CD1 4.02Å; F370-Y449 AromaticContact CE1-CE1 3.7Å; F370-Y449 HydrophobicContact CE1-CE1 3.7Å; F370-Y449 HydrophobicContact CZ-CD1 4.1Å; F370-Y449 AromaticContact CZ-CE1 3.51Å; F370-Y449 HydrophobicContact CZ-CE1 3.51Å
371	V	71.2	Confident	78.7	Confident	67 Å²	67	68.6 Å²	68.6	41%	0.406	38%	0.379	S	S	.	.			trans	-94.4	109.7	169.7	-177.4	0	0	0	0	108.3	S373 E374	V371-S373 WeakPolarHBondContact CG1-OG 3.45Å; V371-S373 PolarHBondContact O-N 3.4Å; V371-E374 HydrophobicContact CB-CG 4.06Å; V371-E374 HydrophobicContact CG1-CG 4.11Å; V371-E374 PolarHBondContact O-N 2.64Å
372	E	68.1	Low	78.8	Confident	147 Å²	147	68.5 Å²	68.5	69%	0.687	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-22.5	-173.2	-65.2	-167.4	158.8	0	0	114	E374 K448	E372-E374 VanDerWaalsContact C-N 3.3Å; E372-E374 PolarHBondContact O-N 2.65Å; E372-K448 IonicContact OE1-NZ 2.65Å; E372-K448 PolarHBondContact OE1-NZ 2.92Å
373	S	66.4	Low	79.1	Confident	108 Å²	108	68.6 Å²	68.6	76%	0.755	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-8.5	-179	56	0	0	0	0	114.6	V371 P375	V371-S373 WeakPolarHBondContact CG1-OG 3.45Å; V371-S373 PolarHBondContact O-N 3.4Å; S373-P375 WeakPolarHBondContact O-CD 3.26Å
374	E	70.7	Confident	79.6	Confident	67 Å²	67	68.6 Å²	68.6	31%	0.313	38%	0.377	S	S	.	.	S	Bend	trans	-78.7	120.3	-178.1	-70.8	-179.7	167.4	0	0	111.5	H264 R280 V371 E372 R376	H264-E374 IonicContact NE2-OE2 3.19Å; R280-E374 IonicContact CZ-OE2 3.47Å; R280-E374 IonicContact NE-OE2 2.72Å; R280-E374 IonicContact NH1-OE1 3.36Å; R280-E374 IonicContact NH1-OE2 2.72Å; R280-E374 PolarHBondContact NH1-OE2 3.4Å; R280-E374 VanDerWaalsContact NH1-OE2 3.11Å; R280-E374 IonicContact NH2-OE1 3.33Å; R280-E374 IonicContact NH2-OE2 3.89Å; R280-E374 PolarHBondContact NH2-OE2 2.98Å; V371-E374 HydrophobicContact CB-CG 4.06Å; V371-E374 HydrophobicContact CG1-CG 4.11Å; V371-E374 PolarHBondContact O-N 2.64Å; E372-E374 VanDerWaalsContact C-N 3.3Å; E372-E374 PolarHBondContact O-N 2.65Å; E374-R376 PolarHBondContact O-N 2.65Å
375	P	73.8	Confident	80.4	Confident	115 Å²	115	60.7 Å²	60.7	75%	0.747	35%	0.347	S	S	*	.			trans	-59.7	130.8	173.4	-19.9	31.4	0	0	0	110.9	S373	S373-P375 WeakPolarHBondContact O-CD 3.26Å
376	R	80.1	Confident	81.6	Confident	76 Å²	76	55.5 Å²	55.5	29%	0.287	32%	0.32	S	S	.	.			trans	-120.4	139.2	175.2	-174.4	-179.2	-55.9	158.8	18	110.8	Y278 Y282 E374 K448	Y278-R376 HydrophobicContact CE1-CG 3.95Å; Y278-R376 HydrophobicContact CE2-CG 4.3Å; Y278-R376 WeakPolarHBondContact OH-CG 2.98Å; Y278-R376 PolarHBondContact OH-NE 3.01Å; Y282-R376 PolarHBondContact OH-NH2 2.95Å; E374-R376 PolarHBondContact O-N 2.65Å; R376-K448 PolarHBondContact NH1-O 3.33Å; R376-K448 PolarHBondContact NH2-O 3.25Å
377	P	87.7	Confident	82.8	Confident	20 Å²	20	56.9 Å²	56.9	13%	0.13	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-58.6	149.6	168.3	-22.9	34.8	0	0	0	112.6	F254 I256 T260 T262 Y278 V379	F254-P377 HydrophobicContact CE2-CB 4.48Å; F254-P377 HydrophobicContact CZ-CB 4.36Å; I256-P377 HydrophobicContact CG2-CB 4.39Å; I256-P377 HydrophobicContact CG2-CG 4.49Å; T260-P377 HydrophobicContact CG2-CB 3.53Å; T260-P377 HydrophobicContact CG2-CG 3.31Å; T262-P377 HydrophobicContact CG2-CG 4.23Å; Y278-P377 HydrophobicContact CD2-CG 3.99Å; Y278-P377 HydrophobicContact CE2-CG 4.31Å; Y278-P377 HydrophobicContact CG-CG 4.49Å; P377-V379 PolarHBondContact O-N 3.14Å
378	E	88.2	Confident	84.2	Confident	185 Å²	185	52.8 Å²	52.8	86%	0.864	31%	0.305	S	S	*	.	P	Polyproline II helix	trans	-59.3	134.7	169.3	-67.7	-177	175.1	0	0	110.4	S380	E378-S380 PolarHBondContact O-N 3.26Å
379	V	89.5	Confident	85.5	Confident	20 Å²	20	49.5 Å²	49.5	12%	0.121	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-65.9	123.9	178	-73.8	0	0	0	0	109.5	I252 F254 P377 F383 Y449 K450 L451 Q455	I252-V379 HydrophobicContact CD1-CG1 4.14Å; F254-V379 HydrophobicContact CE1-CG1 4Å; F254-V379 HydrophobicContact CZ-CG1 4.18Å; P377-V379 PolarHBondContact O-N 3.14Å; V379-F383 HydrophobicContact CB-CE2 4.19Å; V379-F383 HydrophobicContact CB-CZ 4.11Å; V379-F383 HydrophobicContact CG1-CZ 4.26Å; V379-Y449 WeakPolarHBondContact CG1-O 3.34Å; V379-K450 WeakPolarHBondContact CG2-O 3.48Å; V379-L451 HydrophobicContact CB-CD2 4.38Å; V379-L451 HydrophobicContact CG1-CD2 4.44Å; V379-L451 HydrophobicContact CG2-CD2 4.16Å; V379-Q455 PolarHBondContact O-NE2 3.06Å
380	S	83	Confident	86.3	Confident	65 Å²	65	51.1 Å²	51.1	46%	0.455	29%	0.291	S	S	.	.			trans	-117.5	146	-179.2	74.7	0	0	0	0	111.7	E255 E378	E255-S380 PolarHBondContact O-OG 3Å; E378-S380 PolarHBondContact O-N 3.26Å
381	G	87.7	Confident	87.1	Confident	36 Å²	36	56.2 Å²	56.2	37%	0.371	31%	0.311	S	S	.	.	S	Bend	trans	78	-170.4	178.7	0	0	0	0	0	114.7	Q455	G381-Q455 PolarHBondContact O-NE2 3.22Å; G381-Q455 VanDerWaalsContact O-NE2 3.12Å
382	N	94.5	Very high	88.2	Confident	50 Å²	50	53.2 Å²	53.2	27%	0.267	29%	0.292	S	S	.	.			trans	-97.2	150.2	-178.2	-65.1	-9.9	0	0	0	110.1	L240 G241 Q458	L240-N382 CarbonylContact C-O 3.6Å; L240-N382 VanDerWaalsContact CA-O 3.29Å; L240-N382 WeakPolarHBondContact CA-O 3.1Å; L240-N382 HydrophobicContact CD2-CB 3.83Å; G241-N382 PolarHBondContact N-O 3.03Å; N382-Q458 PolarHBondContact ND2-OE1 3.31Å; N382-Q458 PolarHBondContact OD1-OE1 3.3Å
383	F	97.2	Very high	89.6	Confident	3 Å²	3	46.2 Å²	46.2	1%	0.013	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	154.5	-175	-73.4	-102	0	0	0	111.7	G241 L243 I252 F254 V379 L451 L459 K460	G241-F383 VanDerWaalsContact C-CD1 3.48Å; G241-F383 VanDerWaalsContact CA-CD1 3.43Å; G241-F383 CarbonylContact O-C 3.53Å; G241-F383 WeakPolarHBondContact O-CA 3.09Å; L243-F383 HydrophobicContact CD1-CB 4.2Å; L243-F383 HydrophobicContact CD1-CD1 4.22Å; L243-F383 HydrophobicContact CD1-CG 4.45Å; L243-F383 HydrophobicContact CD2-CD1 3.69Å; L243-F383 HydrophobicContact CD2-CE1 4.04Å; L243-F383 HydrophobicContact CG-CB 4.31Å; L243-F383 HydrophobicContact CG-CD1 3.77Å; L243-F383 HydrophobicContact CG-CG 4.41Å; I252-F383 HydrophobicContact CD1-CE1 4.24Å; I252-F383 HydrophobicContact CG1-CE1 4.18Å; F254-F383 HydrophobicContact CB-CE1 3.98Å; F254-F383 HydrophobicContact CB-CZ 3.86Å; F254-F383 HydrophobicContact CD1-CE1 4.05Å; F254-F383 AromaticContact CD1-CZ 3.9Å; F254-F383 HydrophobicContact CD1-CZ 3.9Å; F254-F383 HydrophobicContact CG-CE1 4.32Å; F254-F383 AromaticContact CG-CZ 3.97Å; F254-F383 HydrophobicContact CG-CZ 3.97Å; V379-F383 HydrophobicContact CB-CE2 4.19Å; V379-F383 HydrophobicContact CB-CZ 4.11Å; V379-F383 HydrophobicContact CG1-CZ 4.26Å; F383-L451 HydrophobicContact CD2-CD2 4Å; F383-L451 HydrophobicContact CE2-CD2 4.02Å; F383-L451 HydrophobicContact CG-CD2 4.46Å; F383-L451 HydrophobicContact CZ-CD2 4.47Å; F383-L459 HydrophobicContact CB-CD1 3.55Å; F383-L459 WeakPolarHBondContact O-CD1 3.45Å; F383-K460 PolarHBondContact O-N 2.78Å
384	V	97.8	Very high	90.9	Very high	3 Å²	3	48.6 Å²	48.6	2%	0.018	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	133.2	162.1	174.9	0	0	0	0	107.7	T213 L240 G241 L243 K460 L462 I470	T213-V384 HydrophobicContact CG2-CB 3.9Å; T213-V384 HydrophobicContact CG2-CG2 4.02Å; L240-V384 HydrophobicContact CD1-CG2 3.88Å; G241-V384 PolarHBondContact O-N 2.94Å; L243-V384 PolarHBondContact N-O 2.87Å; V384-K460 CarbonylContact C-O 3.55Å; V384-K460 WeakPolarHBondContact CA-O 3.27Å; V384-L462 HydrophobicContact CG1-CB 4.11Å; V384-L462 HydrophobicContact CG1-CD1 3.85Å; V384-L462 HydrophobicContact CG1-CG 4.1Å; V384-L462 HydrophobicContact CG2-CD1 4.31Å; V384-I470 HydrophobicContact CB-CD1 4.47Å; V384-I470 HydrophobicContact CG1-CD1 3.51Å
385	A	98.4	Very high	91.9	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	135.8	173.7	0	0	0	0	0	110.3	L243 F389 L459 K460 F461 L462	L243-A385 HydrophobicContact CB-CB 3.99Å; L243-A385 HydrophobicContact CD1-CB 4.36Å; L243-A385 VanDerWaalsContact O-CA 3.31Å; L243-A385 WeakPolarHBondContact O-CA 3.35Å; A385-F389 HydrophobicContact CB-CB 3.65Å; A385-F389 HydrophobicContact CB-CD2 3.91Å; A385-F389 HydrophobicContact CB-CG 3.89Å; A385-L459 HydrophobicContact CB-CD1 4.02Å; A385-L459 HydrophobicContact CB-CG 4.47Å; A385-K460 PolarHBondContact N-O 3.36Å; A385-F461 HydrophobicContact CB-CD1 3.86Å; A385-F461 HydrophobicContact CB-CE1 4.06Å; A385-F461 CarbonylContact O-C 3.51Å; A385-F461 VanDerWaalsContact O-CA 3.22Å; A385-F461 WeakPolarHBondContact O-CA 3.49Å; A385-L462 PolarHBondContact O-N 3.01Å
386	F	97.6	Very high	92.9	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	-169.1	-176.2	59.1	-85.1	0	0	0	112.1	A209 S242 L243 D244 G388 F389 L462 I470	A209-F386 HydrophobicContact CB-CE1 4.29Å; A209-F386 HydrophobicContact CB-CE2 4.25Å; A209-F386 HydrophobicContact CB-CZ 3.5Å; S242-F386 VanDerWaalsContact OG-CE1 3.27Å; S242-F386 WeakPolarHBondContact OG-CE1 3.24Å; L243-F386 VanDerWaalsContact O-CD1 3.3Å; L243-F386 WeakPolarHBondContact O-CD1 3.17Å; L243-F386 VanDerWaalsContact O-CE1 3.3Å; L243-F386 WeakPolarHBondContact O-CE1 3.49Å; L243-F386 PolarHBondContact O-N 3.41Å; D244-F386 HydrophobicContact CB-CE1 4.28Å; D244-F386 HydrophobicContact CB-CE2 3.68Å; D244-F386 HydrophobicContact CB-CZ 3.43Å; D244-F386 VanDerWaalsContact CB-CZ 3.43Å; D244-F386 WeakPolarHBondContact OD1-CE2 3.48Å; F386-G388 PolarHBondContact O-N 2.88Å; F386-F389 WeakPolarHBondContact O-CB 3.47Å; F386-F389 PolarHBondContact O-N 2.85Å; F386-F389 VanDerWaalsContact O-N 3.13Å; F386-L462 WeakPolarHBondContact CA-O 3.45Å; F386-L462 WeakPolarHBondContact CB-O 3.43Å; F386-I470 HydrophobicContact CB-CD1 4.33Å; F386-I470 HydrophobicContact CB-CG2 3.3Å; F386-I470 HydrophobicContact CD1-CD1 3.83Å; F386-I470 HydrophobicContact CD1-CG1 4.2Å; F386-I470 HydrophobicContact CD1-CG2 4.42Å; F386-I470 HydrophobicContact CD2-CG2 4.21Å; F386-I470 HydrophobicContact CG-CD1 4.18Å; F386-I470 HydrophobicContact CG-CG1 4.23Å; F386-I470 HydrophobicContact CG-CG2 3.74Å
387	S	95.1	Very high	93.6	Very high	43 Å²	43	46.9 Å²	46.9	30%	0.301	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	56.4	-126.7	-173	-54.1	0	0	0	0	111	D244 L245 F389 Y390 Y391	D244-S387 WeakPolarHBondContact OD1-CB 3.29Å; D244-S387 PolarHBondContact OD1-OG 3.2Å; L245-S387 WeakPolarHBondContact O-CB 2.97Å; S387-F389 PolarHBondContact O-N 3.07Å; S387-Y390 WeakPolarHBondContact O-CB 3.33Å; S387-Y390 PolarHBondContact O-N 3.45Å; S387-Y391 VanDerWaalsContact O-CD2 3.24Å; S387-Y391 WeakPolarHBondContact O-CD2 3.44Å
388	G	94.4	Very high	94	Very high	16 Å²	16	46.1 Å²	46.1	17%	0.165	24%	0.236	C	C	.	.	H	α-helix	trans	-55.5	-34.5	177.6	0	0	0	0	0	113.6	L245 F386 Y390 Y391 I392	L245-G388 VanDerWaalsContact O-CA 3.26Å; L245-G388 WeakPolarHBondContact O-CA 3.13Å; L245-G388 PolarHBondContact O-N 2.82Å; F386-G388 PolarHBondContact O-N 2.88Å; G388-Y390 VanDerWaalsContact C-N 3.32Å; G388-Y390 PolarHBondContact O-N 3.04Å; G388-Y391 PolarHBondContact O-N 3.37Å; G388-I392 VanDerWaalsContact O-CD1 3.31Å; G388-I392 WeakPolarHBondContact O-CD1 3.36Å; G388-I392 VanDerWaalsContact O-CG1 3.23Å; G388-I392 WeakPolarHBondContact O-CG1 2.8Å; G388-I392 PolarHBondContact O-N 2.03Å
389	F	97.8	Very high	94.4	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61.1	-41.8	176.3	-74.8	-58.4	0	0	0	111.5	L243 L245 A385 F386 S387 Y391 I392 G393 T441 L444 L445 Y449 F461	L243-F389 HydrophobicContact CB-CD2 4.14Å; L243-F389 HydrophobicContact CB-CE2 3.86Å; L245-F389 HydrophobicContact CB-CD1 4.22Å; L245-F389 HydrophobicContact CB-CD2 3.39Å; L245-F389 HydrophobicContact CB-CE1 4.26Å; L245-F389 HydrophobicContact CB-CE2 3.45Å; L245-F389 VanDerWaalsContact CB-CE2 3.45Å; L245-F389 HydrophobicContact CB-CG 3.79Å; L245-F389 HydrophobicContact CB-CZ 3.9Å; L245-F389 HydrophobicContact CD2-CD1 3.91Å; L245-F389 HydrophobicContact CD2-CE1 3.89Å; L245-F389 HydrophobicContact CD2-CG 4.25Å; L245-F389 HydrophobicContact CD2-CZ 4.23Å; A385-F389 HydrophobicContact CB-CB 3.65Å; A385-F389 HydrophobicContact CB-CD2 3.91Å; A385-F389 HydrophobicContact CB-CG 3.89Å; F386-F389 WeakPolarHBondContact O-CB 3.47Å; F386-F389 PolarHBondContact O-N 2.85Å; F386-F389 VanDerWaalsContact O-N 3.13Å; S387-F389 PolarHBondContact O-N 3.07Å; F389-Y391 PolarHBondContact O-N 3.16Å; F389-I392 PolarHBondContact O-N 3.48Å; F389-G393 PolarHBondContact O-N 2.86Å; F389-T441 HydrophobicContact CD1-CG2 3.84Å; F389-T441 HydrophobicContact CE1-CG2 3.92Å; F389-L444 HydrophobicContact CE1-CD1 4.23Å; F389-L444 HydrophobicContact CZ-CD1 3.98Å; F389-L445 HydrophobicContact CE1-CD2 3.97Å; F389-L445 HydrophobicContact CE1-CG 4.28Å; F389-L445 HydrophobicContact CZ-CD2 4.08Å; F389-Y449 HydrophobicContact CE2-CE2 4.48Å; F389-Y449 HydrophobicContact CZ-CE2 4.13Å; F389-F461 HydrophobicContact CB-CD1 3.77Å; F389-F461 HydrophobicContact CB-CE1 3.92Å; F389-F461 HydrophobicContact CD1-CE1 4.23Å; F389-F461 HydrophobicContact CG-CE1 4.42Å; F389-F461 WeakPolarHBondContact O-CD1 3.27Å
390	Y	96.5	Very high	94.7	Very high	34 Å²	34	42.3 Å²	42.3	13%	0.133	23%	0.229	C	C	.	.	H	α-helix	trans	-59.1	-47.1	179	164.6	-106.4	0	0	0	112.2	S387 G388 I392 G393 R394 F461 S463	S387-Y390 WeakPolarHBondContact O-CB 3.33Å; S387-Y390 PolarHBondContact O-N 3.45Å; G388-Y390 VanDerWaalsContact C-N 3.32Å; G388-Y390 PolarHBondContact O-N 3.04Å; Y390-I392 VanDerWaalsContact C-N 3.29Å; Y390-I392 PolarHBondContact O-N 3.29Å; Y390-G393 PolarHBondContact O-N 3.49Å; Y390-R394 HydrophobicContact CE2-CB 4.43Å; Y390-R394 VanDerWaalsContact O-CB 3.27Å; Y390-R394 WeakPolarHBondContact O-CB 3.32Å; Y390-R394 PolarHBondContact O-N 3.03Å; Y390-R394 PolarHBondContact OH-NH1 3.01Å; Y390-F461 WeakPolarHBondContact CD2-O 3.32Å; Y390-S463 VanDerWaalsContact CE1-CB 3.43Å; Y390-S463 VanDerWaalsContact CE1-OG 3.3Å; Y390-S463 WeakPolarHBondContact CE1-OG 3.21Å; Y390-S463 WeakPolarHBondContact CE2-OG 3.35Å; Y390-S463 PolarHBondContact OH-OG 3.32Å
391	Y	93.3	Very high	95.2	Very high	126 Å²	126	42.1 Å²	42.1	49%	0.494	24%	0.237	S	C	.	.	H	α-helix	trans	-65.2	-34.6	-179.7	-64.8	-71.5	0	0	0	112.5	S387 G388 F389 F395	S387-Y391 VanDerWaalsContact O-CD2 3.24Å; S387-Y391 WeakPolarHBondContact O-CD2 3.44Å; G388-Y391 PolarHBondContact O-N 3.37Å; F389-Y391 PolarHBondContact O-N 3.16Å; Y391-F395 VanDerWaalsContact O-CB 3.29Å; Y391-F395 WeakPolarHBondContact O-CB 3.36Å; Y391-F395 PolarHBondContact O-N 3.09Å
392	I	95	Very high	95.5	Very high	3 Å²	3	41 Å²	41	2%	0.015	22%	0.224	C	C	.	.	H	α-helix	trans	-70.8	-49.5	176.7	-62.8	161.7	0	0	0	110.2	L245 G388 F389 Y390 R394 F395 F396 F407 R437 T441	L245-I392 HydrophobicContact CD2-CD1 3.98Å; G388-I392 VanDerWaalsContact O-CD1 3.31Å; G388-I392 WeakPolarHBondContact O-CD1 3.36Å; G388-I392 VanDerWaalsContact O-CG1 3.23Å; G388-I392 WeakPolarHBondContact O-CG1 2.8Å; G388-I392 PolarHBondContact O-N 2.03Å; F389-I392 PolarHBondContact O-N 3.48Å; Y390-I392 VanDerWaalsContact C-N 3.29Å; Y390-I392 PolarHBondContact O-N 3.29Å; I392-R394 VanDerWaalsContact C-N 3.33Å; I392-R394 PolarHBondContact O-N 3.11Å; I392-F395 PolarHBondContact O-N 3.35Å; I392-F396 HydrophobicContact CG2-CD2 3.89Å; I392-F396 HydrophobicContact CG2-CE2 4.06Å; I392-F396 WeakPolarHBondContact O-CD2 3.4Å; I392-F396 PolarHBondContact O-N 3.12Å; I392-F396 VanDerWaalsContact O-N 3.09Å; I392-F407 HydrophobicContact CG2-CZ 4.12Å; I392-R437 HydrophobicContact CD1-CB 3.83Å; I392-R437 HydrophobicContact CG1-CB 3.98Å; I392-T441 VanDerWaalsContact CD1-OG1 3.28Å; I392-T441 WeakPolarHBondContact CD1-OG1 3.21Å; I392-T441 HydrophobicContact CG2-CG2 4.49Å
393	G	96	Very high	95.7	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-56.8	-45.9	175.4	0	0	0	0	0	111.6	F389 Y390 F395 F396 N397 C398	F389-G393 PolarHBondContact O-N 2.86Å; Y390-G393 PolarHBondContact O-N 3.49Å; G393-F395 PolarHBondContact O-N 3.21Å; G393-F396 PolarHBondContact O-N 3.37Å; G393-N397 PolarHBondContact O-N 2.67Å; G393-C398 CarbonylContact O-C 3.11Å; G393-C398 WeakPolarHBondContact O-CA 3.39Å; G393-C398 PolarHBondContact O-N 2.94Å
394	R	94.5	Very high	95.6	Very high	158 Å²	158	44.2 Å²	44.2	60%	0.596	24%	0.239	S	C	*	.	H	α-helix	trans	-61.8	-43.6	176.3	-176	177	178.8	-179.9	-0.1	112.7	Y390 I392 F396 N397 T399	Y390-R394 HydrophobicContact CE2-CB 4.43Å; Y390-R394 VanDerWaalsContact O-CB 3.27Å; Y390-R394 WeakPolarHBondContact O-CB 3.32Å; Y390-R394 PolarHBondContact O-N 3.03Å; Y390-R394 PolarHBondContact OH-NH1 3.01Å; I392-R394 VanDerWaalsContact C-N 3.33Å; I392-R394 PolarHBondContact O-N 3.11Å; R394-F396 VanDerWaalsContact C-N 3.35Å; R394-F396 PolarHBondContact O-N 3.29Å; R394-N397 PolarHBondContact O-N 2.99Å; R394-T399 HydrophobicContact CB-CG2 4.05Å
395	F	92.6	Very high	95.6	Very high	55 Å²	55	47 Å²	47	24%	0.241	26%	0.258	C	S	.	.	H	α-helix	trans	-61.5	-42.5	-179.8	-179.4	-95.7	0	0	0	112.2	Y391 I392 G393 N397 Y414 A426 L431 Y434	Y391-F395 VanDerWaalsContact O-CB 3.29Å; Y391-F395 WeakPolarHBondContact O-CB 3.36Å; Y391-F395 PolarHBondContact O-N 3.09Å; I392-F395 PolarHBondContact O-N 3.35Å; G393-F395 PolarHBondContact O-N 3.21Å; F395-N397 PolarHBondContact O-N 2.03Å; F395-Y414 HydrophobicContact CE1-CD1 4.43Å; F395-Y414 AromaticContact CE1-CD2 3.93Å; F395-Y414 HydrophobicContact CE1-CD2 3.93Å; F395-Y414 HydrophobicContact CE1-CE1 4.25Å; F395-Y414 AromaticContact CE1-CE2 3.74Å; F395-Y414 HydrophobicContact CE1-CE2 3.74Å; F395-Y414 HydrophobicContact CE1-CG 4.27Å; F395-Y414 AromaticContact CE1-CZ 3.9Å; F395-Y414 HydrophobicContact CZ-CD2 4.09Å; F395-Y414 HydrophobicContact CZ-CE1 4.44Å; F395-Y414 AromaticContact CZ-CE2 3.47Å; F395-Y414 HydrophobicContact CZ-CE2 3.47Å; F395-Y414 VanDerWaalsContact CZ-CE2 3.47Å; F395-Y414 AromaticContact CZ-CZ 3.67Å; F395-A426 HydrophobicContact CE2-CB 4.43Å; F395-L431 HydrophobicContact CE2-CD2 3.93Å; F395-L431 HydrophobicContact CZ-CD2 4.19Å; F395-Y434 HydrophobicContact CB-CD1 3.8Å; F395-Y434 HydrophobicContact CB-CE1 3.42Å; F395-Y434 VanDerWaalsContact CB-CE1 3.42Å; F395-Y434 AromaticContact CD1-CD1 3.47Å; F395-Y434 HydrophobicContact CD1-CD1 3.47Å; F395-Y434 VanDerWaalsContact CD1-CD1 3.47Å; F395-Y434 HydrophobicContact CD1-CD2 4.36Å; F395-Y434 AromaticContact CD1-CE1 3.99Å; F395-Y434 HydrophobicContact CD1-CE1 3.99Å; F395-Y434 AromaticContact CD1-CG 3.68Å; F395-Y434 HydrophobicContact CD1-CG 3.68Å; F395-Y434 HydrophobicContact CD2-CD1 4Å; F395-Y434 AromaticContact CD2-CD2 3.93Å; F395-Y434 HydrophobicContact CD2-CD2 3.93Å; F395-Y434 AromaticContact CD2-CE1 3.84Å; F395-Y434 HydrophobicContact CD2-CE1 3.84Å; F395-Y434 AromaticContact CD2-CE2 3.75Å; F395-Y434 HydrophobicContact CD2-CE2 3.75Å; F395-Y434 HydrophobicContact CD2-CG 4.04Å; F395-Y434 AromaticContact CD2-CZ 3.69Å; F395-Y434 AromaticContact CE1-CD1 4Å; F395-Y434 HydrophobicContact CE1-CD1 4Å; F395-Y434 HydrophobicContact CE1-CD2 4.22Å; F395-Y434 AromaticContact CE1-CG 3.69Å; F395-Y434 HydrophobicContact CE1-CG 3.69Å; F395-Y434 HydrophobicContact CE2-CD1 4.47Å; F395-Y434 AromaticContact CE2-CD2 3.78Å; F395-Y434 HydrophobicContact CE2-CD2 3.78Å; F395-Y434 AromaticContact CE2-CE2 3.93Å; F395-Y434 HydrophobicContact CE2-CE2 3.93Å; F395-Y434 HydrophobicContact CE2-CG 4.06Å; F395-Y434 AromaticContact CG-CD1 3.47Å; F395-Y434 HydrophobicContact CG-CD1 3.47Å; F395-Y434 VanDerWaalsContact CG-CD1 3.47Å; F395-Y434 HydrophobicContact CG-CD2 4.22Å; F395-Y434 AromaticContact CG-CE1 3.47Å; F395-Y434 HydrophobicContact CG-CE1 3.47Å; F395-Y434 VanDerWaalsContact CG-CE1 3.47Å; F395-Y434 HydrophobicContact CG-CE2 4.22Å; F395-Y434 AromaticContact CG-CG 3.85Å; F395-Y434 HydrophobicContact CG-CG 3.85Å; F395-Y434 AromaticContact CG-CZ 3.85Å; F395-Y434 HydrophobicContact CZ-CD1 4.46Å; F395-Y434 AromaticContact CZ-CD2 3.92Å; F395-Y434 HydrophobicContact CZ-CD2 3.92Å; F395-Y434 AromaticContact CZ-CG 3.88Å; F395-Y434 HydrophobicContact CZ-CG 3.88Å
396	F	93.8	Very high	95.6	Very high	20 Å²	20	52 Å²	52	9%	0.088	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	15.9	177.9	-69.6	-69	0	0	0	113.7	I392 G393 R394 C398 F407 V411 Y414 Y434	I392-F396 HydrophobicContact CG2-CD2 3.89Å; I392-F396 HydrophobicContact CG2-CE2 4.06Å; I392-F396 WeakPolarHBondContact O-CD2 3.4Å; I392-F396 PolarHBondContact O-N 3.12Å; I392-F396 VanDerWaalsContact O-N 3.09Å; G393-F396 PolarHBondContact O-N 3.37Å; R394-F396 VanDerWaalsContact C-N 3.35Å; R394-F396 PolarHBondContact O-N 3.29Å; F396-C398 PolarHBondContact O-N 2.91Å; F396-F407 HydrophobicContact CB-CD2 4.05Å; F396-F407 HydrophobicContact CB-CE2 3.72Å; F396-F407 AromaticContact CD2-CE2 3.96Å; F396-F407 HydrophobicContact CD2-CE2 3.96Å; F396-F407 HydrophobicContact CD2-CZ 4.42Å; F396-F407 HydrophobicContact CG-CE2 4.09Å; F396-V411 HydrophobicContact CD1-CG2 4.01Å; F396-V411 HydrophobicContact CD2-CG2 3.94Å; F396-V411 HydrophobicContact CE1-CB 4.3Å; F396-V411 HydrophobicContact CE1-CG2 3.93Å; F396-V411 HydrophobicContact CE2-CG2 3.86Å; F396-V411 HydrophobicContact CG-CG2 4.04Å; F396-V411 HydrophobicContact CZ-CB 4.36Å; F396-V411 HydrophobicContact CZ-CG1 4.47Å; F396-V411 HydrophobicContact CZ-CG2 3.85Å; F396-Y414 HydrophobicContact CE1-CD1 4.32Å; F396-Y414 AromaticContact CE1-CG 4Å; F396-Y414 HydrophobicContact CE1-CG 4Å; F396-Y414 HydrophobicContact CZ-CD1 4.24Å; F396-Y414 HydrophobicContact CZ-CG 4.38Å; F396-Y434 HydrophobicContact CE2-CD1 4.49Å
397	N	94.2	Very high	95.6	Very high	148 Å²	148	52 Å²	52	79%	0.791	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	40.4	-178.5	-167.7	40.4	0	0	0	113.5	G393 R394 F395	G393-N397 PolarHBondContact O-N 2.67Å; R394-N397 PolarHBondContact O-N 2.99Å; F395-N397 PolarHBondContact O-N 2.03Å
398	C	96.3	Very high	95.7	Very high	4 Å²	4	52.3 Å²	52.3	3%	0.027	28%	0.28	C	S	.	.			trans	-132.5	60.8	-174.9	-172.1	0	0	0	0	112.1	G393 F396 C402 F407 F461	G393-C398 CarbonylContact O-C 3.11Å; G393-C398 WeakPolarHBondContact O-CA 3.39Å; G393-C398 PolarHBondContact O-N 2.94Å; F396-C398 PolarHBondContact O-N 2.91Å; C398-C402 WeakPolarHBondContact CA-SG 3.23Å; C398-C402 HydrophobicContact CB-CB 4.24Å; C398-C402 WeakPolarHBondContact CB-SG 3.43Å; C398-C402 WeakPolarHBondContact SG-CB 3.48Å; C398-C402 CovalentContact SG-SG 2.03Å; C398-C402 PolarHBondContact SG-SG 3.4Å; C398-F407 HydrophobicContact CB-CD2 3.68Å; C398-F407 HydrophobicContact CB-CE2 4.25Å; C398-F461 WeakPolarHBondContact O-CD2 3.35Å
399	T	96.6	Very high	95.9	Very high	51 Å²	51	57 Å²	57	31%	0.313	30%	0.298	S	S	.	.	S	Bend	trans	-84.2	-22.5	178.6	52	0	0	0	0	113.8	R394 F461	R394-T399 HydrophobicContact CB-CG2 4.05Å; T399-F461 PolarHBondContact O-N 3.27Å
400	S	95.8	Very high	95.8	Very high	73 Å²	73	58.8 Å²	58.8	51%	0.51	31%	0.31	S	S	.	.	B	Isolated β-bridge	trans	-167.7	149.3	178.7	56.3	0	0	0	0	111.2	C402	S400-C402 VanDerWaalsContact C-N 3.32Å; S400-C402 PolarHBondContact O-N 3.22Å
401	G	93.5	Very high	95.8	Very high	61 Å²	61	57.1 Å²	57.1	63%	0.629	30%	0.304	S	S	*	.	S	Bend	trans	73	20.1	169.3	0	0	0	0	0	115
402	C	95.2	Very high	96	Very high	14 Å²	14	54.8 Å²	54.8	10%	0.095	29%	0.294	C	S	.	.			trans	-90.7	148.3	174.9	-45.2	0	0	0	0	111.5	C398 S400 F456 E457	C398-C402 WeakPolarHBondContact CA-SG 3.23Å; C398-C402 HydrophobicContact CB-CB 4.24Å; C398-C402 WeakPolarHBondContact CB-SG 3.43Å; C398-C402 WeakPolarHBondContact SG-CB 3.48Å; C398-C402 CovalentContact SG-SG 2.03Å; C398-C402 PolarHBondContact SG-SG 3.4Å; S400-C402 VanDerWaalsContact C-N 3.32Å; S400-C402 PolarHBondContact O-N 3.22Å; C402-F456 HydrophobicContact CB-CE1 4.15Å; C402-F456 WeakPolarHBondContact O-CD1 3.4Å; C402-E457 WeakPolarHBondContact O-CA 3.32Å
403	T	97.4	Very high	96	Very high	47 Å²	47	57.2 Å²	57.2	29%	0.288	31%	0.311	S	S	.	.			trans	-80.2	157.3	163.5	74.3	0	0	0	0	110.8	S405 Q406 F407 E457	T403-S405 PolarHBondContact O-N 2.77Å; T403-Q406 PolarHBondContact O-N 3.23Å; T403-Q406 WeakPolarHBondContact OG1-CG 3.46Å; T403-Q406 PolarHBondContact OG1-N 3.27Å; T403-F407 PolarHBondContact O-N 2.99Å; T403-F407 VanDerWaalsContact O-N 3.14Å; T403-E457 HydrophobicContact CG2-CG 4.35Å
404	K	96.8	Very high	95.8	Very high	72 Å²	72	57.9 Å²	57.9	31%	0.313	31%	0.314	S	S	.	.	H	α-helix	trans	-54.4	-39.1	171.4	174.3	177.9	-176.2	-179.4	0	112.3	N408 F446 D453 F456	K404-N408 WeakPolarHBondContact O-CB 3.35Å; K404-N408 PolarHBondContact O-N 3.43Å; K404-F446 HydrophobicContact CB-CE1 4.16Å; K404-F446 HydrophobicContact CB-CE2 4.37Å; K404-F446 HydrophobicContact CB-CZ 3.71Å; K404-F446 HydrophobicContact CD-CD1 3.88Å; K404-F446 HydrophobicContact CD-CD2 4.31Å; K404-F446 HydrophobicContact CD-CE1 3.59Å; K404-F446 HydrophobicContact CD-CE2 4.05Å; K404-F446 HydrophobicContact CD-CG 4.24Å; K404-F446 HydrophobicContact CD-CZ 3.68Å; K404-F446 HydrophobicContact CG-CD2 4.33Å; K404-F446 HydrophobicContact CG-CE1 3.93Å; K404-F446 HydrophobicContact CG-CE2 3.69Å; K404-F446 HydrophobicContact CG-CZ 3.46Å; K404-F446 VanDerWaalsContact CG-CZ 3.46Å; K404-D453 WeakPolarHBondContact CD-OD1 3.46Å; K404-D453 IonicContact NZ-OD1 2.99Å; K404-D453 PolarHBondContact NZ-OD1 3.2Å; K404-F456 HydrophobicContact CB-CD1 4.31Å
405	S	97.3	Very high	95.8	Very high	61 Å²	61	50.5 Å²	50.5	43%	0.427	29%	0.287	S	S	.	.	H	α-helix	trans	-63	-48.8	179	-153.3	0	0	0	0	111.1	T403 F407 N408 E409	T403-S405 PolarHBondContact O-N 2.77Å; S405-F407 PolarHBondContact O-N 3.03Å; S405-N408 PolarHBondContact O-N 3.26Å; S405-E409 WeakPolarHBondContact O-CB 3.26Å; S405-E409 VanDerWaalsContact O-CG 3.27Å; S405-E409 WeakPolarHBondContact O-CG 3.49Å; S405-E409 PolarHBondContact O-N 3.46Å; S405-E409 PolarHBondContact OG-OE1 2.93Å
406	Q	97.6	Very high	95.8	Very high	106 Å²	106	52.9 Å²	52.9	50%	0.495	30%	0.299	S	S	.	.	H	α-helix	trans	-58.5	-47	179.4	-73.4	169.9	-31.8	0	0	111.8	T403 S410	T403-Q406 PolarHBondContact O-N 3.23Å; T403-Q406 WeakPolarHBondContact OG1-CG 3.46Å; T403-Q406 PolarHBondContact OG1-N 3.27Å; Q406-S410 WeakPolarHBondContact O-CB 3.38Å; Q406-S410 PolarHBondContact O-N 3.36Å; Q406-S410 PolarHBondContact O-OG 3.24Å
407	F	98	Very high	95.5	Very high	1 Å²	1	56.8 Å²	56.8	0%	0.004	31%	0.313	C	S	.	.	H	α-helix	trans	-65.4	-45.6	178.6	-173.5	-121.2	0	0	0	111.2	I392 F396 C398 T403 S405 E409 S410 V411 T441 L442 F456	I392-F407 HydrophobicContact CG2-CZ 4.12Å; F396-F407 HydrophobicContact CB-CD2 4.05Å; F396-F407 HydrophobicContact CB-CE2 3.72Å; F396-F407 AromaticContact CD2-CE2 3.96Å; F396-F407 HydrophobicContact CD2-CE2 3.96Å; F396-F407 HydrophobicContact CD2-CZ 4.42Å; F396-F407 HydrophobicContact CG-CE2 4.09Å; C398-F407 HydrophobicContact CB-CD2 3.68Å; C398-F407 HydrophobicContact CB-CE2 4.25Å; T403-F407 PolarHBondContact O-N 2.99Å; T403-F407 VanDerWaalsContact O-N 3.14Å; S405-F407 PolarHBondContact O-N 3.03Å; F407-E409 PolarHBondContact O-N 2.91Å; F407-S410 PolarHBondContact O-N 2.76Å; F407-S410 PolarHBondContact O-OG 3.49Å; F407-V411 HydrophobicContact CD2-CG2 4.44Å; F407-V411 HydrophobicContact CE1-CG2 4.39Å; F407-V411 HydrophobicContact CE2-CG2 4.17Å; F407-V411 HydrophobicContact CZ-CG2 4.13Å; F407-V411 WeakPolarHBondContact O-CG2 3.25Å; F407-V411 PolarHBondContact O-N 3.1Å; F407-T441 HydrophobicContact CE1-CG2 3.87Å; F407-T441 HydrophobicContact CZ-CG2 3.99Å; F407-L442 HydrophobicContact CD1-CD2 3.44Å; F407-L442 VanDerWaalsContact CD1-CD2 3.44Å; F407-L442 HydrophobicContact CD1-CG 4.15Å; F407-L442 HydrophobicContact CE1-CD2 3.82Å; F407-L442 HydrophobicContact CE1-CG 4.05Å; F407-F456 HydrophobicContact CB-CE1 3.9Å; F407-F456 HydrophobicContact CB-CZ 3.71Å; F407-F456 HydrophobicContact CD1-CE2 4.23Å; F407-F456 AromaticContact CD1-CZ 3.66Å; F407-F456 HydrophobicContact CD1-CZ 3.66Å; F407-F456 HydrophobicContact CE1-CZ 4.49Å; F407-F456 HydrophobicContact CG-CE1 4.47Å; F407-F456 AromaticContact CG-CZ 3.78Å; F407-F456 HydrophobicContact CG-CZ 3.78Å
408	N	97.9	Very high	94.8	Very high	48 Å²	48	52.3 Å²	52.3	26%	0.257	29%	0.292	S	S	.	.	H	α-helix	trans	-59.6	-47.3	177	-177.1	45.8	0	0	0	112.6	K404 S405 S410 V411 W412 L442	K404-N408 WeakPolarHBondContact O-CB 3.35Å; K404-N408 PolarHBondContact O-N 3.43Å; S405-N408 PolarHBondContact O-N 3.26Å; N408-S410 VanDerWaalsContact C-N 3.33Å; N408-S410 PolarHBondContact O-N 3.22Å; N408-V411 PolarHBondContact O-N 2.83Å; N408-W412 VanDerWaalsContact O-CB 3.24Å; N408-W412 WeakPolarHBondContact O-CB 3.41Å; N408-W412 PolarHBondContact O-N 3.44Å; N408-L442 HydrophobicContact CB-CD1 4.31Å; N408-L442 HydrophobicContact CB-CD2 4.26Å; N408-L442 WeakPolarHBondContact OD1-CD1 3.43Å
409	E	97.9	Very high	93.7	Very high	116 Å²	116	53.2 Å²	53.2	54%	0.542	30%	0.297	S	S	.	.	H	α-helix	trans	-61.5	-40.6	177.5	-73.6	164.1	-147.8	0	0	111.8	S405 F407 W412 S413	S405-E409 WeakPolarHBondContact O-CB 3.26Å; S405-E409 VanDerWaalsContact O-CG 3.27Å; S405-E409 WeakPolarHBondContact O-CG 3.49Å; S405-E409 PolarHBondContact O-N 3.46Å; S405-E409 PolarHBondContact OG-OE1 2.93Å; F407-E409 PolarHBondContact O-N 2.91Å; E409-W412 PolarHBondContact O-N 3.39Å; E409-S413 VanDerWaalsContact O-CB 3.25Å; E409-S413 WeakPolarHBondContact O-CB 3.47Å; E409-S413 PolarHBondContact O-N 2.95Å
410	S	95.9	Very high	92.4	Very high	36 Å²	36	53.2 Å²	53.2	25%	0.252	31%	0.307	S	S	.	.	H	α-helix	trans	-64.1	-42.2	177.6	75	0	0	0	0	112.5	Q406 F407 N408 Y414	Q406-S410 WeakPolarHBondContact O-CB 3.38Å; Q406-S410 PolarHBondContact O-N 3.36Å; Q406-S410 PolarHBondContact O-OG 3.24Å; F407-S410 PolarHBondContact O-N 2.76Å; F407-S410 PolarHBondContact O-OG 3.49Å; N408-S410 VanDerWaalsContact C-N 3.33Å; N408-S410 PolarHBondContact O-N 3.22Å; S410-Y414 WeakPolarHBondContact O-CB 3.25Å; S410-Y414 PolarHBondContact O-N 2.94Å; S410-Y414 VanDerWaalsContact O-N 3.14Å
411	V	96.5	Very high	90.9	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-67.6	-46.8	176.5	173.4	0	0	0	0	110.3	F396 F407 N408 Y414 C415 M439 L442	F396-V411 HydrophobicContact CD1-CG2 4.01Å; F396-V411 HydrophobicContact CD2-CG2 3.94Å; F396-V411 HydrophobicContact CE1-CB 4.3Å; F396-V411 HydrophobicContact CE1-CG2 3.93Å; F396-V411 HydrophobicContact CE2-CG2 3.86Å; F396-V411 HydrophobicContact CG-CG2 4.04Å; F396-V411 HydrophobicContact CZ-CB 4.36Å; F396-V411 HydrophobicContact CZ-CG1 4.47Å; F396-V411 HydrophobicContact CZ-CG2 3.85Å; F407-V411 HydrophobicContact CD2-CG2 4.44Å; F407-V411 HydrophobicContact CE1-CG2 4.39Å; F407-V411 HydrophobicContact CE2-CG2 4.17Å; F407-V411 HydrophobicContact CZ-CG2 4.13Å; F407-V411 WeakPolarHBondContact O-CG2 3.25Å; F407-V411 PolarHBondContact O-N 3.1Å; N408-V411 PolarHBondContact O-N 2.83Å; V411-Y414 PolarHBondContact O-N 3.08Å; V411-C415 PolarHBondContact O-N 3.42Å; V411-C415 PolarHBondContact O-SG 2.91Å; V411-C415 VanDerWaalsContact O-SG 3.4Å; V411-M439 HydrophobicContact CG1-CB 4.5Å; V411-M439 HydrophobicContact CG1-CE 4.08Å; V411-M439 HydrophobicContact CG1-CG 3.75Å; V411-M439 HydrophobicContact CG1-SD 3.79Å; V411-L442 HydrophobicContact CB-CD1 4.19Å; V411-L442 HydrophobicContact CG1-CD1 4.16Å; V411-L442 HydrophobicContact CG2-CD1 4.38Å
412	W	97.4	Very high	89.5	Confident	76 Å²	76	54.1 Å²	54.1	29%	0.288	28%	0.28	S	S	.	.	H	α-helix	trans	-58.5	-51.1	179.3	-166.6	-76.4	0	0	0	111.3	P352 N408 E409 Y414 C415 E416 M439	P352-W412 HydrophobicContact CB-CD2 3.71Å; P352-W412 HydrophobicContact CB-CE3 3.98Å; P352-W412 HydrophobicContact CB-CG 4.17Å; P352-W412 HydrophobicContact CB-CH2 4.15Å; P352-W412 HydrophobicContact CB-CZ2 3.9Å; P352-W412 HydrophobicContact CB-CZ3 4.19Å; P352-W412 HydrophobicContact CG-CD2 3.94Å; P352-W412 HydrophobicContact CG-CG 4.32Å; P352-W412 HydrophobicContact CG-CH2 4.26Å; P352-W412 HydrophobicContact CG-CZ2 3.56Å; N408-W412 VanDerWaalsContact O-CB 3.24Å; N408-W412 WeakPolarHBondContact O-CB 3.41Å; N408-W412 PolarHBondContact O-N 3.44Å; E409-W412 PolarHBondContact O-N 3.39Å; W412-Y414 VanDerWaalsContact C-N 3.25Å; W412-Y414 PolarHBondContact O-N 3.42Å; W412-C415 WeakPolarHBondContact O-CB 3.31Å; W412-C415 PolarHBondContact O-N 3.38Å; W412-C415 VanDerWaalsContact O-N 3.12Å; W412-E416 VanDerWaalsContact CD1-OE1 3.3Å; W412-E416 PolarHBondContact NE1-OE1 3.16Å; W412-E416 PolarHBondContact O-N 3.36Å; W412-M439 HydrophobicContact CD2-CE 4.43Å; W412-M439 HydrophobicContact CE3-CE 3.87Å; W412-M439 HydrophobicContact CZ3-CE 4.41Å
413	S	94.4	Very high	87.9	Confident	54 Å²	54	58.8 Å²	58.8	38%	0.378	30%	0.299	S	S	.	.	H	α-helix	trans	-61.6	-31.1	177.9	-178.8	0	0	0	0	113	E409 R417	E409-S413 VanDerWaalsContact O-CB 3.25Å; E409-S413 WeakPolarHBondContact O-CB 3.47Å; E409-S413 PolarHBondContact O-N 2.95Å; S413-R417 WeakPolarHBondContact O-CG 3.36Å; S413-R417 PolarHBondContact O-NE 2.71Å
414	Y	92.1	Very high	86.1	Confident	14 Å²	14	63.4 Å²	63.4	6%	0.055	32%	0.317	C	S	.	.	H	α-helix	trans	-70.9	-42.6	174.3	-178.4	-97.6	0	0	0	112.1	F395 F396 S410 V411 W412 E416 R417 I422 L425 L431 C435	F395-Y414 HydrophobicContact CE1-CD1 4.43Å; F395-Y414 AromaticContact CE1-CD2 3.93Å; F395-Y414 HydrophobicContact CE1-CD2 3.93Å; F395-Y414 HydrophobicContact CE1-CE1 4.25Å; F395-Y414 AromaticContact CE1-CE2 3.74Å; F395-Y414 HydrophobicContact CE1-CE2 3.74Å; F395-Y414 HydrophobicContact CE1-CG 4.27Å; F395-Y414 AromaticContact CE1-CZ 3.9Å; F395-Y414 HydrophobicContact CZ-CD2 4.09Å; F395-Y414 HydrophobicContact CZ-CE1 4.44Å; F395-Y414 AromaticContact CZ-CE2 3.47Å; F395-Y414 HydrophobicContact CZ-CE2 3.47Å; F395-Y414 VanDerWaalsContact CZ-CE2 3.47Å; F395-Y414 AromaticContact CZ-CZ 3.67Å; F396-Y414 HydrophobicContact CE1-CD1 4.32Å; F396-Y414 AromaticContact CE1-CG 4Å; F396-Y414 HydrophobicContact CE1-CG 4Å; F396-Y414 HydrophobicContact CZ-CD1 4.24Å; F396-Y414 HydrophobicContact CZ-CG 4.38Å; S410-Y414 WeakPolarHBondContact O-CB 3.25Å; S410-Y414 PolarHBondContact O-N 2.94Å; S410-Y414 VanDerWaalsContact O-N 3.14Å; V411-Y414 PolarHBondContact O-N 3.08Å; W412-Y414 VanDerWaalsContact C-N 3.25Å; W412-Y414 PolarHBondContact O-N 3.42Å; Y414-E416 PolarHBondContact O-N 3.18Å; Y414-R417 WeakPolarHBondContact O-CB 3.13Å; Y414-R417 PolarHBondContact O-N 2.93Å; Y414-R417 VanDerWaalsContact O-N 3.14Å; Y414-I422 HydrophobicContact CE2-CG1 4.26Å; Y414-I422 WeakPolarHBondContact OH-CG2 3.37Å; Y414-L425 HydrophobicContact CD2-CD1 4.42Å; Y414-L425 HydrophobicContact CE2-CD1 3.98Å; Y414-L431 PolarHBondContact OH-O 3.48Å; Y414-C435 HydrophobicContact CD1-CB 4.07Å; Y414-C435 HydrophobicContact CE1-CB 4.23Å
415	C	94.3	Very high	84.4	Confident	4 Å²	4	64.2 Å²	64.2	3%	0.027	33%	0.325	C	S	.	.	H	α-helix	trans	-63.2	-26.2	179.5	-73.5	0	0	0	0	113.7	S350 P352 V411 W412 R417 C435 M439	S350-C415 CarbonylContact C-O 3.59Å; S350-C415 WeakPolarHBondContact CA-O 3.11Å; S350-C415 VanDerWaalsContact CB-O 3.25Å; S350-C415 WeakPolarHBondContact CB-O 3.22Å; S350-C415 PolarHBondContact OG-O 3.43Å; P352-C415 HydrophobicContact CB-CB 3.84Å; V411-C415 PolarHBondContact O-N 3.42Å; V411-C415 PolarHBondContact O-SG 2.91Å; V411-C415 VanDerWaalsContact O-SG 3.4Å; W412-C415 WeakPolarHBondContact O-CB 3.31Å; W412-C415 PolarHBondContact O-N 3.38Å; W412-C415 VanDerWaalsContact O-N 3.12Å; C415-R417 VanDerWaalsContact C-N 3.28Å; C415-R417 PolarHBondContact O-N 3.46Å; C415-C435 VanDerWaalsContact CA-SG 3.6Å; C415-C435 HydrophobicContact CB-CB 4.03Å; C415-C435 WeakPolarHBondContact CB-SG 3.46Å; C415-C435 WeakPolarHBondContact SG-CA 3.22Å; C415-C435 WeakPolarHBondContact SG-CB 3.45Å; C415-C435 CovalentContact SG-SG 2.03Å; C415-C435 PolarHBondContact SG-SG 2.81Å; C415-M439 HydrophobicContact CB-CE 4.24Å
416	E	93.3	Very high	82.4	Confident	105 Å²	105	63 Å²	63	49%	0.491	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-7.1	176.7	-67.4	175.1	155	0	0	113.8	P352 W412 Y414	P352-E416 HydrophobicContact CG-CG 3.74Å; W412-E416 VanDerWaalsContact CD1-OE1 3.3Å; W412-E416 PolarHBondContact NE1-OE1 3.16Å; W412-E416 PolarHBondContact O-N 3.36Å; Y414-E416 PolarHBondContact O-N 3.18Å
417	R	86.3	Confident	80.4	Confident	101 Å²	101	63 Å²	63	38%	0.381	33%	0.328	S	S	.	.			trans	-82.3	134.9	-172.4	-68.5	172.9	-175.9	-105.4	-4.3	112.7	S350 S413 Y414 C415 I422	S350-R417 PolarHBondContact OG-O 3.46Å; S413-R417 WeakPolarHBondContact O-CG 3.36Å; S413-R417 PolarHBondContact O-NE 2.71Å; Y414-R417 WeakPolarHBondContact O-CB 3.13Å; Y414-R417 PolarHBondContact O-N 2.93Å; Y414-R417 VanDerWaalsContact O-N 3.14Å; C415-R417 VanDerWaalsContact C-N 3.28Å; C415-R417 PolarHBondContact O-N 3.46Å; R417-I422 HydrophobicContact CB-CD1 4.26Å; R417-I422 HydrophobicContact CB-CG1 4.16Å
418	P	80	Confident	78.3	Confident	54 Å²	54	68.8 Å²	68.8	35%	0.351	36%	0.357	S	S	.	.			trans	-72.3	158.8	168.6	31.7	-35.2	0	0	0	111.3	L315 G420 R421	L315-P418 HydrophobicContact CB-CB 4.15Å; P418-G420 VanDerWaalsContact C-N 3.28Å; P418-G420 PolarHBondContact O-N 3.3Å; P418-G420 VanDerWaalsContact O-N 3.14Å; P418-R421 HydrophobicContact CG-CG 4.47Å; P418-R421 PolarHBondContact O-N 2.88Å; P418-R421 VanDerWaalsContact O-N 3.1Å
419	V	73.6	Confident	76.5	Confident	24 Å²	24	69.8 Å²	69.8	15%	0.145	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-54.5	-38	-172.6	74.4	0	0	0	0	114.1	P314 L315 N316 Y317 R421 I422 F423	P314-V419 HydrophobicContact CB-CB 4.05Å; P314-V419 HydrophobicContact CB-CG2 4.41Å; L315-V419 WeakPolarHBondContact O-CB 3.49Å; L315-V419 PolarHBondContact O-N 3.29Å; N316-V419 HydrophobicContact CB-CG1 4.17Å; Y317-V419 HydrophobicContact CD2-CG2 3.78Å; Y317-V419 HydrophobicContact CG-CG2 4.15Å; V419-R421 PolarHBondContact O-N 3.03Å; V419-R421 VanDerWaalsContact O-N 3.08Å; V419-I422 PolarHBondContact O-N 3.23Å; V419-F423 HydrophobicContact CB-CE2 4.35Å; V419-F423 HydrophobicContact CG1-CE2 4.4Å; V419-F423 HydrophobicContact CG2-CD2 4.12Å; V419-F423 HydrophobicContact CG2-CE2 3.32Å; V419-F423 HydrophobicContact CG2-CZ 3.54Å; V419-F423 WeakPolarHBondContact O-CD2 3.49Å
420	G	69.5	Low	75.1	Confident	50 Å²	50	69.5 Å²	69.5	52%	0.515	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-60.7	-23	-177.6	0	0	0	0	0	114.2	P418	P418-G420 VanDerWaalsContact C-N 3.28Å; P418-G420 PolarHBondContact O-N 3.3Å; P418-G420 VanDerWaalsContact O-N 3.14Å
421	R	65.1	Low	74	Confident	150 Å²	150	68 Å²	68	57%	0.566	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-91.5	-8.8	177	-68.8	-62.8	-163.7	177.7	1.9	113.8	P418 V419	P418-R421 HydrophobicContact CG-CG 4.47Å; P418-R421 PolarHBondContact O-N 2.88Å; P418-R421 VanDerWaalsContact O-N 3.1Å; V419-R421 PolarHBondContact O-N 3.03Å; V419-R421 VanDerWaalsContact O-N 3.08Å
422	I	63.7	Low	73.3	Confident	4 Å²	4	70.8 Å²	70.8	2%	0.021	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-35.7	-173.6	-71.3	173.6	0	0	0	111.2	P314 Y414 R417 V419 E424 L425 L431	P314-I422 HydrophobicContact CB-CD1 3.47Å; P314-I422 VanDerWaalsContact CB-CD1 3.47Å; P314-I422 HydrophobicContact CG-CD1 3.24Å; Y414-I422 HydrophobicContact CE2-CG1 4.26Å; Y414-I422 WeakPolarHBondContact OH-CG2 3.37Å; R417-I422 HydrophobicContact CB-CD1 4.26Å; R417-I422 HydrophobicContact CB-CG1 4.16Å; V419-I422 PolarHBondContact O-N 3.23Å; I422-E424 PolarHBondContact O-N 2.97Å; I422-L425 WeakPolarHBondContact O-CB 3.46Å; I422-L425 PolarHBondContact O-N 3.43Å; I422-L431 HydrophobicContact CG2-CB 3.7Å; I422-L431 HydrophobicContact CG2-CD1 3.96Å; I422-L431 HydrophobicContact CG2-CD2 4.04Å; I422-L431 HydrophobicContact CG2-CG 4.12Å; I422-L431 VanDerWaalsContact O-CD1 3.24Å; I422-L431 WeakPolarHBondContact O-CD1 3.14Å
423	F	61.3	Low	72.9	Confident	111 Å²	111	67.1 Å²	67.1	49%	0.487	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-14.2	178.5	-66.3	-60.7	0	0	0	114.2	V419 L425	V419-F423 HydrophobicContact CB-CE2 4.35Å; V419-F423 HydrophobicContact CG1-CE2 4.4Å; V419-F423 HydrophobicContact CG2-CD2 4.12Å; V419-F423 HydrophobicContact CG2-CE2 3.32Å; V419-F423 HydrophobicContact CG2-CZ 3.54Å; V419-F423 WeakPolarHBondContact O-CD2 3.49Å; F423-L425 VanDerWaalsContact C-N 3.35Å
424	E	60.2	Low	72.8	Confident	144 Å²	144	66.2 Å²	66.2	67%	0.673	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-12.4	175	-64.7	176	177.5	0	0	113.5	I422	I422-E424 PolarHBondContact O-N 2.97Å
425	L	59.7	Low	73	Confident	90 Å²	90	65.8 Å²	65.8	47%	0.471	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-27.9	-162.1	-62.8	174.3	0	0	0	116	Y414 I422 F423 L431	Y414-L425 HydrophobicContact CD2-CD1 4.42Å; Y414-L425 HydrophobicContact CE2-CD1 3.98Å; I422-L425 WeakPolarHBondContact O-CB 3.46Å; I422-L425 PolarHBondContact O-N 3.43Å; F423-L425 VanDerWaalsContact C-N 3.35Å; L425-L431 HydrophobicContact CB-CD2 4.26Å
426	A	54.9	Low	73.1	Confident	36 Å²	36	65.6 Å²	65.6	30%	0.298	34%	0.338	S	S	.	.	S	Bend	trans	-164.8	174.8	-178.7	0	0	0	0	0	112.6	F395 L431	F395-A426 HydrophobicContact CE2-CB 4.43Å; A426-L431 HydrophobicContact CB-CD1 4.25Å; A426-L431 HydrophobicContact CB-CD2 3.41Å; A426-L431 VanDerWaalsContact CB-CD2 3.41Å; A426-L431 HydrophobicContact CB-CG 3.81Å; A426-L431 WeakPolarHBondContact O-CD1 3.41Å
427	P	56.1	Low	73.2	Confident	106 Å²	106	62 Å²	62	69%	0.688	32%	0.32	S	S	*	.			trans	-58.2	140.9	169.2	-22.4	33.9	0	0	0	112.2	S429	P427-S429 PolarHBondContact O-N 2.66Å
428	I	53.9	Low	73.7	Confident	121 Å²	121	57.2 Å²	57.2	62%	0.621	30%	0.302	S	S	*	.	H	α-helix	trans	-53.5	-33.8	-168.5	-63.2	168.4	0	0	0	113.5	F430	I428-F430 VanDerWaalsContact C-N 3.26Å; I428-F430 PolarHBondContact O-N 2.92Å; I428-F430 VanDerWaalsContact O-N 3.07Å
429	S	60.3	Low	74.5	Confident	69 Å²	69	54.9 Å²	54.9	48%	0.483	29%	0.286	S	S	.	.	H	α-helix	trans	-63.3	-23.2	-162.3	51.8	0	0	0	0	115.2	P427 Y432	P427-S429 PolarHBondContact O-N 2.66Å; S429-Y432 VanDerWaalsContact O-CE1 3.31Å; S429-Y432 WeakPolarHBondContact O-CE1 3.4Å
430	F	68.9	Low	75.6	Confident	110 Å²	110	53.8 Å²	53.8	48%	0.482	28%	0.279	S	S	.	.	H	α-helix	trans	-126.6	-8.4	-178.1	-60.5	-66.6	0	0	0	115.3	I428 Y432 S433 Y434	I428-F430 VanDerWaalsContact C-N 3.26Å; I428-F430 PolarHBondContact O-N 2.92Å; I428-F430 VanDerWaalsContact O-N 3.07Å; F430-Y432 VanDerWaalsContact C-N 3.29Å; F430-Y432 PolarHBondContact O-N 3.3Å; F430-S433 PolarHBondContact O-N 3.41Å; F430-S433 PolarHBondContact O-OG 3.18Å; F430-Y434 HydrophobicContact CB-CE2 3.93Å; F430-Y434 WeakPolarHBondContact O-CD2 3.45Å
431	L	72.3	Confident	77	Confident	4 Å²	4	51.4 Å²	51.4	2%	0.021	26%	0.255	C	S	.	.	H	α-helix	trans	-53.8	-43.2	-174.7	-85.2	178.5	0	0	0	113.3	F395 Y414 I422 L425 A426 S433 Y434	F395-L431 HydrophobicContact CE2-CD2 3.93Å; F395-L431 HydrophobicContact CZ-CD2 4.19Å; Y414-L431 PolarHBondContact OH-O 3.48Å; I422-L431 HydrophobicContact CG2-CB 3.7Å; I422-L431 HydrophobicContact CG2-CD1 3.96Å; I422-L431 HydrophobicContact CG2-CD2 4.04Å; I422-L431 HydrophobicContact CG2-CG 4.12Å; I422-L431 VanDerWaalsContact O-CD1 3.24Å; I422-L431 WeakPolarHBondContact O-CD1 3.14Å; L425-L431 HydrophobicContact CB-CD2 4.26Å; A426-L431 HydrophobicContact CB-CD1 4.25Å; A426-L431 HydrophobicContact CB-CD2 3.41Å; A426-L431 VanDerWaalsContact CB-CD2 3.41Å; A426-L431 HydrophobicContact CB-CG 3.81Å; A426-L431 WeakPolarHBondContact O-CD1 3.41Å; L431-S433 PolarHBondContact O-N 2.83Å; L431-S433 VanDerWaalsContact O-N 3.12Å; L431-Y434 PolarHBondContact O-N 3.32Å
432	Y	82.4	Confident	78.5	Confident	59 Å²	59	44.9 Å²	44.9	23%	0.231	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-20.2	179.8	71	-95.3	0	0	0	113.4	L313 Y317 L319 S429 F430	L313-Y432 HydrophobicContact CD2-CD2 3.75Å; L313-Y432 HydrophobicContact CD2-CG 4.42Å; L313-Y432 WeakPolarHBondContact CD2-O 3.33Å; Y317-Y432 VanDerWaalsContact CE1-CB 3.46Å; Y317-Y432 HydrophobicContact CE1-CD1 4.42Å; Y317-Y432 HydrophobicContact CE1-CD2 4.39Å; Y317-Y432 AromaticContact CE1-CG 3.87Å; Y317-Y432 HydrophobicContact CE1-CG 3.87Å; L319-Y432 HydrophobicContact CD1-CD2 4.46Å; L319-Y432 HydrophobicContact CD1-CE2 4.1Å; L319-Y432 HydrophobicContact CD2-CD2 4.29Å; L319-Y432 HydrophobicContact CD2-CE2 3.94Å; S429-Y432 VanDerWaalsContact O-CE1 3.31Å; S429-Y432 WeakPolarHBondContact O-CE1 3.4Å; F430-Y432 VanDerWaalsContact C-N 3.29Å; F430-Y432 PolarHBondContact O-N 3.3Å
433	S	89.6	Confident	80	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-12.2	-174.1	73.6	0	0	0	0	114.4	F430 L431 C435 F436 R437	F430-S433 PolarHBondContact O-N 3.41Å; F430-S433 PolarHBondContact O-OG 3.18Å; L431-S433 PolarHBondContact O-N 2.83Å; L431-S433 VanDerWaalsContact O-N 3.12Å; S433-C435 VanDerWaalsContact C-N 3.33Å; S433-C435 PolarHBondContact O-N 3.16Å; S433-F436 PolarHBondContact O-N 2.86Å; S433-R437 VanDerWaalsContact O-CG 3.32Å; S433-R437 WeakPolarHBondContact O-CG 2.96Å; S433-R437 PolarHBondContact O-N 3.26Å; S433-R437 PolarHBondContact OG-NE 3.42Å
434	Y	92.4	Very high	81.6	Confident	34 Å²	34	39.5 Å²	39.5	13%	0.133	21%	0.207	C	C	.	.	H	α-helix	trans	-67.3	-28.8	-173.4	-85.7	-76	0	0	0	114.3	F395 F396 F430 L431 R437 G438	F395-Y434 HydrophobicContact CB-CD1 3.8Å; F395-Y434 HydrophobicContact CB-CE1 3.42Å; F395-Y434 VanDerWaalsContact CB-CE1 3.42Å; F395-Y434 AromaticContact CD1-CD1 3.47Å; F395-Y434 HydrophobicContact CD1-CD1 3.47Å; F395-Y434 VanDerWaalsContact CD1-CD1 3.47Å; F395-Y434 HydrophobicContact CD1-CD2 4.36Å; F395-Y434 AromaticContact CD1-CE1 3.99Å; F395-Y434 HydrophobicContact CD1-CE1 3.99Å; F395-Y434 AromaticContact CD1-CG 3.68Å; F395-Y434 HydrophobicContact CD1-CG 3.68Å; F395-Y434 HydrophobicContact CD2-CD1 4Å; F395-Y434 AromaticContact CD2-CD2 3.93Å; F395-Y434 HydrophobicContact CD2-CD2 3.93Å; F395-Y434 AromaticContact CD2-CE1 3.84Å; F395-Y434 HydrophobicContact CD2-CE1 3.84Å; F395-Y434 AromaticContact CD2-CE2 3.75Å; F395-Y434 HydrophobicContact CD2-CE2 3.75Å; F395-Y434 HydrophobicContact CD2-CG 4.04Å; F395-Y434 AromaticContact CD2-CZ 3.69Å; F395-Y434 AromaticContact CE1-CD1 4Å; F395-Y434 HydrophobicContact CE1-CD1 4Å; F395-Y434 HydrophobicContact CE1-CD2 4.22Å; F395-Y434 AromaticContact CE1-CG 3.69Å; F395-Y434 HydrophobicContact CE1-CG 3.69Å; F395-Y434 HydrophobicContact CE2-CD1 4.47Å; F395-Y434 AromaticContact CE2-CD2 3.78Å; F395-Y434 HydrophobicContact CE2-CD2 3.78Å; F395-Y434 AromaticContact CE2-CE2 3.93Å; F395-Y434 HydrophobicContact CE2-CE2 3.93Å; F395-Y434 HydrophobicContact CE2-CG 4.06Å; F395-Y434 AromaticContact CG-CD1 3.47Å; F395-Y434 HydrophobicContact CG-CD1 3.47Å; F395-Y434 VanDerWaalsContact CG-CD1 3.47Å; F395-Y434 HydrophobicContact CG-CD2 4.22Å; F395-Y434 AromaticContact CG-CE1 3.47Å; F395-Y434 HydrophobicContact CG-CE1 3.47Å; F395-Y434 VanDerWaalsContact CG-CE1 3.47Å; F395-Y434 HydrophobicContact CG-CE2 4.22Å; F395-Y434 AromaticContact CG-CG 3.85Å; F395-Y434 HydrophobicContact CG-CG 3.85Å; F395-Y434 AromaticContact CG-CZ 3.85Å; F395-Y434 HydrophobicContact CZ-CD1 4.46Å; F395-Y434 AromaticContact CZ-CD2 3.92Å; F395-Y434 HydrophobicContact CZ-CD2 3.92Å; F395-Y434 AromaticContact CZ-CG 3.88Å; F395-Y434 HydrophobicContact CZ-CG 3.88Å; F396-Y434 HydrophobicContact CE2-CD1 4.49Å; F430-Y434 HydrophobicContact CB-CE2 3.93Å; F430-Y434 WeakPolarHBondContact O-CD2 3.45Å; L431-Y434 PolarHBondContact O-N 3.32Å; Y434-R437 PolarHBondContact O-N 3.18Å; Y434-G438 PolarHBondContact O-N 3.44Å
435	C	94.6	Very high	83.3	Confident	5 Å²	5	32.6 Å²	32.6	3%	0.034	18%	0.175	C	C	.	.	H	α-helix	trans	-60.7	-53.9	172.5	169.7	0	0	0	0	110.1	C312 Y414 C415 S433 R437 G438 M439	C312-C435 WeakPolarHBondContact O-CB 3.45Å; Y414-C435 HydrophobicContact CD1-CB 4.07Å; Y414-C435 HydrophobicContact CE1-CB 4.23Å; C415-C435 VanDerWaalsContact CA-SG 3.6Å; C415-C435 HydrophobicContact CB-CB 4.03Å; C415-C435 WeakPolarHBondContact CB-SG 3.46Å; C415-C435 WeakPolarHBondContact SG-CA 3.22Å; C415-C435 WeakPolarHBondContact SG-CB 3.45Å; C415-C435 CovalentContact SG-SG 2.03Å; C415-C435 PolarHBondContact SG-SG 2.81Å; S433-C435 VanDerWaalsContact C-N 3.33Å; S433-C435 PolarHBondContact O-N 3.16Å; C435-R437 PolarHBondContact O-N 2.73Å; C435-G438 PolarHBondContact O-N 3.04Å; C435-M439 WeakPolarHBondContact O-CB 3.13Å; C435-M439 WeakPolarHBondContact O-CG 3.14Å; C435-M439 PolarHBondContact O-N 3.35Å
436	F	96.1	Very high	85	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-57.9	-47.5	175.6	-177.5	-95.2	0	0	0	112	M290 I291 R294 C312 I359 S433 G438 M439 Y440	M290-F436 HydrophobicContact CB-CE1 3.85Å; M290-F436 HydrophobicContact CB-CZ 3.89Å; M290-F436 VanDerWaalsContact O-CZ 3.27Å; M290-F436 WeakPolarHBondContact O-CZ 3.44Å; I291-F436 HydrophobicContact CB-CE1 4.47Å; I291-F436 HydrophobicContact CD1-CD1 4.32Å; I291-F436 HydrophobicContact CG1-CD1 3.43Å; I291-F436 VanDerWaalsContact CG1-CD1 3.43Å; I291-F436 HydrophobicContact CG1-CE1 3.65Å; I291-F436 HydrophobicContact CG1-CG 4.28Å; R294-F436 HydrophobicContact CB-CD2 4.41Å; R294-F436 HydrophobicContact CB-CE2 3.71Å; R294-F436 HydrophobicContact CB-CZ 4.12Å; R294-F436 HydrophobicContact CG-CD2 4.31Å; R294-F436 HydrophobicContact CG-CE2 4.01Å; C312-F436 HydrophobicContact CB-CB 4.04Å; C312-F436 HydrophobicContact CB-CD2 4.25Å; I359-F436 HydrophobicContact CD1-CD2 3.9Å; I359-F436 HydrophobicContact CD1-CE2 4.04Å; I359-F436 HydrophobicContact CG1-CD2 3.73Å; I359-F436 HydrophobicContact CG1-CE2 3.38Å; I359-F436 HydrophobicContact CG1-CZ 4.17Å; S433-F436 PolarHBondContact O-N 2.86Å; F436-G438 PolarHBondContact O-N 2.03Å; F436-M439 PolarHBondContact O-N 2.58Å; F436-Y440 HydrophobicContact CE1-CG 4.42Å; F436-Y440 WeakPolarHBondContact O-CB 3.41Å; F436-Y440 PolarHBondContact O-N 2.9Å
437	R	96	Very high	86.7	Confident	31 Å²	31	29.8 Å²	29.8	12%	0.117	16%	0.155	C	C	.	.	H	α-helix	trans	-63.6	-40.2	-177.9	-70	174.4	-177	-82.4	-5	112.6	N288 I291 I392 S433 Y434 C435 T441	N288-R437 PolarHBondContact OD1-NH2 3.37Å; I291-R437 HydrophobicContact CD1-CG 4.46Å; I392-R437 HydrophobicContact CD1-CB 3.83Å; I392-R437 HydrophobicContact CG1-CB 3.98Å; S433-R437 VanDerWaalsContact O-CG 3.32Å; S433-R437 WeakPolarHBondContact O-CG 2.96Å; S433-R437 PolarHBondContact O-N 3.26Å; S433-R437 PolarHBondContact OG-NE 3.42Å; Y434-R437 PolarHBondContact O-N 3.18Å; C435-R437 PolarHBondContact O-N 2.73Å; R437-T441 WeakPolarHBondContact O-CB 3.08Å; R437-T441 PolarHBondContact O-N 3.39Å; R437-T441 PolarHBondContact O-OG1 3.21Å
438	G	96.9	Very high	88.4	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-65.1	-50	175.5	0	0	0	0	0	111.7	Y434 C435 F436 Y440 T441 L442	Y434-G438 PolarHBondContact O-N 3.44Å; C435-G438 PolarHBondContact O-N 3.04Å; F436-G438 PolarHBondContact O-N 2.03Å; G438-Y440 VanDerWaalsContact C-N 3.33Å; G438-Y440 PolarHBondContact O-N 2.92Å; G438-T441 WeakPolarHBondContact O-CB 3.4Å; G438-T441 PolarHBondContact O-N 2.96Å; G438-T441 VanDerWaalsContact O-N 3.16Å; G438-L442 PolarHBondContact O-N 3.35Å
439	M	97.3	Very high	90.2	Very high	4 Å²	4	20.3 Å²	20.3	2%	0.02	10%	0.099	C	C	.	.	H	α-helix	trans	-61.7	-42.3	177.4	-70.4	-67.1	-171.1	0	0	111.5	P352 I359 V411 W412 C415 C435 F436 T441 L442 T443	P352-M439 HydrophobicContact CB-CE 3.57Å; I359-M439 HydrophobicContact CD1-CB 3.27Å; I359-M439 HydrophobicContact CD1-CG 4.4Å; V411-M439 HydrophobicContact CG1-CB 4.5Å; V411-M439 HydrophobicContact CG1-CE 4.08Å; V411-M439 HydrophobicContact CG1-CG 3.75Å; V411-M439 HydrophobicContact CG1-SD 3.79Å; W412-M439 HydrophobicContact CD2-CE 4.43Å; W412-M439 HydrophobicContact CE3-CE 3.87Å; W412-M439 HydrophobicContact CZ3-CE 4.41Å; C415-M439 HydrophobicContact CB-CE 4.24Å; C435-M439 WeakPolarHBondContact O-CB 3.13Å; C435-M439 WeakPolarHBondContact O-CG 3.14Å; C435-M439 PolarHBondContact O-N 3.35Å; F436-M439 PolarHBondContact O-N 2.58Å; M439-T441 VanDerWaalsContact C-N 3.31Å; M439-T441 PolarHBondContact O-N 3.36Å; M439-L442 WeakPolarHBondContact O-CB 3.38Å; M439-L442 PolarHBondContact O-N 3.1Å; M439-L442 HydrophobicContact SD-CD1 4.23Å; M439-T443 PolarHBondContact O-N 3Å; M439-T443 PolarHBondContact O-OG1 3.06Å
440	Y	97.2	Very high	91.8	Very high	1 Å²	1	23.5 Å²	23.5	0%	0.004	10%	0.104	C	C	.	.	H	α-helix	trans	-64.4	-36.3	176.5	-178	-121.2	0	0	0	112.2	L245 C285 M290 I359 M363 F436 G438 T443 L444	L245-Y440 HydrophobicContact CD1-CE1 4.23Å; C285-Y440 WeakPolarHBondContact CB-OH 3.49Å; C285-Y440 PolarHBondContact O-OH 3.33Å; M290-Y440 HydrophobicContact CB-CE1 4.26Å; M290-Y440 HydrophobicContact CB-CE2 4.34Å; M290-Y440 HydrophobicContact CE-CE2 4.07Å; M290-Y440 HydrophobicContact CG-CE1 3.98Å; M290-Y440 HydrophobicContact CG-CE2 3.79Å; M290-Y440 VanDerWaalsContact CG-CZ 3.5Å; M290-Y440 WeakPolarHBondContact CG-OH 3.3Å; M290-Y440 HydrophobicContact SD-CE2 4.37Å; I359-Y440 HydrophobicContact CG2-CD2 4.07Å; M363-Y440 HydrophobicContact CE-CE2 3.81Å; M363-Y440 HydrophobicContact CG-CE2 4.29Å; M363-Y440 HydrophobicContact SD-CD2 4.23Å; M363-Y440 HydrophobicContact SD-CE2 3.71Å; F436-Y440 HydrophobicContact CE1-CG 4.42Å; F436-Y440 WeakPolarHBondContact O-CB 3.41Å; F436-Y440 PolarHBondContact O-N 2.9Å; G438-Y440 VanDerWaalsContact C-N 3.33Å; G438-Y440 PolarHBondContact O-N 2.92Å; Y440-T443 PolarHBondContact O-N 3.37Å; Y440-L444 HydrophobicContact CD1-CD1 3.91Å; Y440-L444 HydrophobicContact CD1-CG 4.32Å; Y440-L444 HydrophobicContact CD2-CG 4.36Å; Y440-L444 HydrophobicContact CE1-CD1 3.3Å; Y440-L444 HydrophobicContact CE1-CD2 4.49Å; Y440-L444 HydrophobicContact CE1-CG 3.82Å; Y440-L444 HydrophobicContact CE2-CD1 4.28Å; Y440-L444 HydrophobicContact CE2-CD2 4.18Å; Y440-L444 HydrophobicContact CE2-CG 3.84Å; Y440-L444 VanDerWaalsContact CZ-CD1 3.5Å; Y440-L444 WeakPolarHBondContact O-CB 3.36Å; Y440-L444 WeakPolarHBondContact O-CG 3.18Å; Y440-L444 PolarHBondContact O-N 3.26Å
441	T	97.7	Very high	93	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-63.4	-42.3	173.6	-63.3	0	0	0	0	111.2	F389 I392 F407 R437 G438 M439 L444 L445	F389-T441 HydrophobicContact CD1-CG2 3.84Å; F389-T441 HydrophobicContact CE1-CG2 3.92Å; I392-T441 VanDerWaalsContact CD1-OG1 3.28Å; I392-T441 WeakPolarHBondContact CD1-OG1 3.21Å; I392-T441 HydrophobicContact CG2-CG2 4.49Å; F407-T441 HydrophobicContact CE1-CG2 3.87Å; F407-T441 HydrophobicContact CZ-CG2 3.99Å; R437-T441 WeakPolarHBondContact O-CB 3.08Å; R437-T441 PolarHBondContact O-N 3.39Å; R437-T441 PolarHBondContact O-OG1 3.21Å; G438-T441 WeakPolarHBondContact O-CB 3.4Å; G438-T441 PolarHBondContact O-N 2.96Å; G438-T441 VanDerWaalsContact O-N 3.16Å; M439-T441 VanDerWaalsContact C-N 3.31Å; M439-T441 PolarHBondContact O-N 3.36Å; T441-L444 PolarHBondContact O-N 2.68Å; T441-L445 HydrophobicContact CG2-CD1 3.69Å; T441-L445 HydrophobicContact CG2-CG 4.12Å; T441-L445 WeakPolarHBondContact O-CB 3.37Å; T441-L445 VanDerWaalsContact O-CG 3.25Å; T441-L445 WeakPolarHBondContact O-CG 3.39Å; T441-L445 PolarHBondContact O-N 2.94Å
442	L	97.5	Very high	94.1	Very high	13 Å²	13	21.9 Å²	21.9	7%	0.068	10%	0.103	C	C	.	.	H	α-helix	trans	-59.3	-49.3	173.9	-68.1	166.6	0	0	0	111.2	F407 N408 V411 G438 M439 L444 L445 F446	F407-L442 HydrophobicContact CD1-CD2 3.44Å; F407-L442 VanDerWaalsContact CD1-CD2 3.44Å; F407-L442 HydrophobicContact CD1-CG 4.15Å; F407-L442 HydrophobicContact CE1-CD2 3.82Å; F407-L442 HydrophobicContact CE1-CG 4.05Å; N408-L442 HydrophobicContact CB-CD1 4.31Å; N408-L442 HydrophobicContact CB-CD2 4.26Å; N408-L442 WeakPolarHBondContact OD1-CD1 3.43Å; V411-L442 HydrophobicContact CB-CD1 4.19Å; V411-L442 HydrophobicContact CG1-CD1 4.16Å; V411-L442 HydrophobicContact CG2-CD1 4.38Å; G438-L442 PolarHBondContact O-N 3.35Å; M439-L442 WeakPolarHBondContact O-CB 3.38Å; M439-L442 PolarHBondContact O-N 3.1Å; M439-L442 HydrophobicContact SD-CD1 4.23Å; L442-L444 PolarHBondContact O-N 3.45Å; L442-L445 PolarHBondContact O-N 3.35Å; L442-F446 HydrophobicContact CB-CD2 4.47Å; L442-F446 HydrophobicContact CD2-CD2 4.05Å; L442-F446 HydrophobicContact CD2-CE2 3.72Å; L442-F446 WeakPolarHBondContact O-CB 3.43Å; L442-F446 WeakPolarHBondContact O-CD2 3.41Å; L442-F446 PolarHBondContact O-N 3.08Å
443	T	95.1	Very high	94.7	Very high	2 Å²	2	23 Å²	23	1%	0.012	11%	0.113	C	C	.	.	I	π-helix	trans	-61.3	-43.7	177.7	-56.9	0	0	0	0	111.5	I359 M363 M439 Y440 D447 K448	I359-T443 HydrophobicContact CG2-CG2 4.19Å; M363-T443 HydrophobicContact SD-CG2 3.5Å; M363-T443 VanDerWaalsContact SD-CG2 3.5Å; M439-T443 PolarHBondContact O-N 3Å; M439-T443 PolarHBondContact O-OG1 3.06Å; Y440-T443 PolarHBondContact O-N 3.37Å; T443-D447 HydrophobicContact CG2-CB 4.11Å; T443-D447 CarbonylContact O-C 3.49Å; T443-D447 WeakPolarHBondContact O-CA 3.49Å; T443-D447 VanDerWaalsContact O-CB 3.27Å; T443-D447 WeakPolarHBondContact O-CB 3.4Å; T443-D447 PolarHBondContact O-N 2.71Å; T443-K448 HydrophobicContact CG2-CG 4.39Å; T443-K448 PolarHBondContact O-N 3.14Å
444	L	94.7	Very high	94.9	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.134	C	C	.	.	I	π-helix	trans	-61.2	-54	177.1	-84.9	-177.3	0	0	0	111.7	L245 T250 M363 F370 F389 Y440 T441 L442 K448 Y449	L245-L444 HydrophobicContact CD1-CD1 4.01Å; L245-L444 HydrophobicContact CD2-CD1 4.41Å; T250-L444 HydrophobicContact CG2-CD1 4.45Å; T250-L444 HydrophobicContact CG2-CD2 4.25Å; M363-L444 HydrophobicContact CE-CD2 4.2Å; F370-L444 HydrophobicContact CE2-CD2 3.51Å; F370-L444 HydrophobicContact CZ-CD2 3.65Å; F389-L444 HydrophobicContact CE1-CD1 4.23Å; F389-L444 HydrophobicContact CZ-CD1 3.98Å; Y440-L444 HydrophobicContact CD1-CD1 3.91Å; Y440-L444 HydrophobicContact CD1-CG 4.32Å; Y440-L444 HydrophobicContact CD2-CG 4.36Å; Y440-L444 HydrophobicContact CE1-CD1 3.3Å; Y440-L444 HydrophobicContact CE1-CD2 4.49Å; Y440-L444 HydrophobicContact CE1-CG 3.82Å; Y440-L444 HydrophobicContact CE2-CD1 4.28Å; Y440-L444 HydrophobicContact CE2-CD2 4.18Å; Y440-L444 HydrophobicContact CE2-CG 3.84Å; Y440-L444 VanDerWaalsContact CZ-CD1 3.5Å; Y440-L444 WeakPolarHBondContact O-CB 3.36Å; Y440-L444 WeakPolarHBondContact O-CG 3.18Å; Y440-L444 PolarHBondContact O-N 3.26Å; T441-L444 PolarHBondContact O-N 2.68Å; L442-L444 PolarHBondContact O-N 3.45Å; L444-K448 HydrophobicContact CD2-CB 4.48Å; L444-K448 CarbonylContact O-C 3.25Å; L444-K448 PolarHBondContact O-N 2.7Å; L444-Y449 VanDerWaalsContact O-CB 3.25Å; L444-Y449 WeakPolarHBondContact O-CB 3.33Å; L444-Y449 PolarHBondContact O-N 3.02Å
445	L	96	Very high	95	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.132	C	C	.	.	I	π-helix	trans	-68.4	-45	-172.8	-64.4	179.9	0	0	0	112.1	L243 F389 T441 L442 Y449 K450 L451 F456 L459 F461	L243-L445 HydrophobicContact CD1-CD2 3.69Å; F389-L445 HydrophobicContact CE1-CD2 3.97Å; F389-L445 HydrophobicContact CE1-CG 4.28Å; F389-L445 HydrophobicContact CZ-CD2 4.08Å; T441-L445 HydrophobicContact CG2-CD1 3.69Å; T441-L445 HydrophobicContact CG2-CG 4.12Å; T441-L445 WeakPolarHBondContact O-CB 3.37Å; T441-L445 VanDerWaalsContact O-CG 3.25Å; T441-L445 WeakPolarHBondContact O-CG 3.39Å; T441-L445 PolarHBondContact O-N 2.94Å; L442-L445 PolarHBondContact O-N 3.35Å; L445-Y449 HydrophobicContact CD2-CD2 4.2Å; L445-Y449 CarbonylContact O-C 3.35Å; L445-K450 PolarHBondContact O-N 3.44Å; L445-K450 VanDerWaalsContact O-N 3.16Å; L445-L451 HydrophobicContact CB-CD1 4.24Å; L445-L451 HydrophobicContact CD2-CD1 3.91Å; L445-L451 WeakPolarHBondContact O-CB 3.44Å; L445-L451 PolarHBondContact O-N 2.85Å; L445-F456 HydrophobicContact CD1-CD2 4.02Å; L445-F456 HydrophobicContact CD1-CE2 3.71Å; L445-L459 HydrophobicContact CD1-CD2 3.88Å; L445-L459 HydrophobicContact CD2-CD2 4.38Å; L445-F461 HydrophobicContact CD1-CE1 4.44Å; L445-F461 HydrophobicContact CD1-CZ 3.95Å
446	F	94.4	Very high	95.1	Very high	16 Å²	16	25.3 Å²	25.3	7%	0.07	13%	0.131	C	C	.	.	I	π-helix	trans	-96	-42.4	-172	-61.1	-64.9	0	0	0	113.4	K404 L442 K450 L451 F456	K404-F446 HydrophobicContact CB-CE1 4.16Å; K404-F446 HydrophobicContact CB-CE2 4.37Å; K404-F446 HydrophobicContact CB-CZ 3.71Å; K404-F446 HydrophobicContact CD-CD1 3.88Å; K404-F446 HydrophobicContact CD-CD2 4.31Å; K404-F446 HydrophobicContact CD-CE1 3.59Å; K404-F446 HydrophobicContact CD-CE2 4.05Å; K404-F446 HydrophobicContact CD-CG 4.24Å; K404-F446 HydrophobicContact CD-CZ 3.68Å; K404-F446 HydrophobicContact CG-CD2 4.33Å; K404-F446 HydrophobicContact CG-CE1 3.93Å; K404-F446 HydrophobicContact CG-CE2 3.69Å; K404-F446 HydrophobicContact CG-CZ 3.46Å; K404-F446 VanDerWaalsContact CG-CZ 3.46Å; L442-F446 HydrophobicContact CB-CD2 4.47Å; L442-F446 HydrophobicContact CD2-CD2 4.05Å; L442-F446 HydrophobicContact CD2-CE2 3.72Å; L442-F446 WeakPolarHBondContact O-CB 3.43Å; L442-F446 WeakPolarHBondContact O-CD2 3.41Å; L442-F446 PolarHBondContact O-N 3.08Å; F446-K450 WeakPolarHBondContact O-CA 3.03Å; F446-K450 WeakPolarHBondContact O-CD 3.5Å; F446-L451 WeakPolarHBondContact CD1-O 3.43Å; F446-F456 HydrophobicContact CE1-CB 3.84Å; F446-F456 HydrophobicContact CE1-CD2 4.2Å; F446-F456 HydrophobicContact CE1-CG 4.02Å; F446-F456 HydrophobicContact CE2-CD2 4.29Å; F446-F456 HydrophobicContact CE2-CE2 4.42Å; F446-F456 HydrophobicContact CZ-CB 3.88Å; F446-F456 AromaticContact CZ-CD1 4Å; F446-F456 HydrophobicContact CZ-CD1 4Å; F446-F456 AromaticContact CZ-CD2 3.53Å; F446-F456 HydrophobicContact CZ-CD2 3.53Å; F446-F456 HydrophobicContact CZ-CE1 4.44Å; F446-F456 HydrophobicContact CZ-CE2 4.04Å; F446-F456 AromaticContact CZ-CG 3.51Å; F446-F456 HydrophobicContact CZ-CG 3.51Å; F446-F456 HydrophobicContact CZ-CZ 4.46Å
447	D	91.5	Very high	95.2	Very high	51 Å²	51	29.6 Å²	29.6	27%	0.273	15%	0.152	S	C	.	.	I	π-helix	trans	-89.6	-33	-172.9	-56.7	-31.9	0	0	0	111.8	R356 T443 K450	R356-D447 IonicContact NH2-OD2 3.82Å; T443-D447 HydrophobicContact CG2-CB 4.11Å; T443-D447 CarbonylContact O-C 3.49Å; T443-D447 WeakPolarHBondContact O-CA 3.49Å; T443-D447 VanDerWaalsContact O-CB 3.27Å; T443-D447 WeakPolarHBondContact O-CB 3.4Å; T443-D447 PolarHBondContact O-N 2.71Å; D447-K450 WeakPolarHBondContact O-CD 3.02Å; D447-K450 WeakPolarHBondContact O-CE 3.35Å; D447-K450 PolarHBondContact O-NZ 3.05Å
448	K	90.9	Very high	95.2	Very high	28 Å²	28	32.4 Å²	32.4	12%	0.122	17%	0.166	C	C	.	.	I	π-helix	trans	-105.5	-39.4	-176.8	-56.3	-61.6	178.5	175.8	0	113.8	M363 F370 E372 R376 T443 L444	M363-K448 HydrophobicContact CE-CD 4.19Å; M363-K448 HydrophobicContact CE-CG 3.69Å; M363-K448 HydrophobicContact SD-CG 4.25Å; F370-K448 HydrophobicContact CD1-CB 4.06Å; F370-K448 HydrophobicContact CD2-CB 4.48Å; F370-K448 HydrophobicContact CD2-CG 4.41Å; F370-K448 HydrophobicContact CE1-CB 3.74Å; F370-K448 HydrophobicContact CE2-CB 4.21Å; F370-K448 HydrophobicContact CE2-CG 4.44Å; F370-K448 HydrophobicContact CG-CB 4.43Å; F370-K448 HydrophobicContact CG-CD 4.37Å; F370-K448 HydrophobicContact CZ-CB 3.82Å; E372-K448 IonicContact OE1-NZ 2.65Å; E372-K448 PolarHBondContact OE1-NZ 2.92Å; R376-K448 PolarHBondContact NH1-O 3.33Å; R376-K448 PolarHBondContact NH2-O 3.25Å; T443-K448 HydrophobicContact CG2-CG 4.39Å; T443-K448 PolarHBondContact O-N 3.14Å; L444-K448 HydrophobicContact CD2-CB 4.48Å; L444-K448 CarbonylContact O-C 3.25Å; L444-K448 PolarHBondContact O-N 2.7Å
449	Y	92.9	Very high	95.2	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.166	C	C	.	.	S	Bend	trans	-88.7	-15.2	175.2	-66.3	-18.3	0	0	0	113.3	L243 T250 I252 Y282 F370 V379 F389 L444 L445 L451	L243-Y449 HydrophobicContact CD1-CD2 4.45Å; L243-Y449 HydrophobicContact CD2-CD2 4Å; L243-Y449 HydrophobicContact CD2-CE2 4.05Å; T250-Y449 WeakPolarHBondContact CB-OH 3.2Å; T250-Y449 WeakPolarHBondContact CG2-OH 3.5Å; T250-Y449 PolarHBondContact OG1-OH 3.49Å; I252-Y449 HydrophobicContact CB-CD1 4.24Å; I252-Y449 HydrophobicContact CB-CE1 3.92Å; I252-Y449 HydrophobicContact CB-CE2 4.36Å; I252-Y449 HydrophobicContact CD1-CD1 3.99Å; I252-Y449 HydrophobicContact CD1-CD2 4.3Å; I252-Y449 HydrophobicContact CD1-CG 3.86Å; I252-Y449 HydrophobicContact CG2-CD1 4.03Å; I252-Y449 HydrophobicContact CG2-CE1 3.66Å; Y282-Y449 HydrophobicContact CD2-CE1 4.3Å; Y282-Y449 AromaticContact CE2-CE1 3.92Å; Y282-Y449 HydrophobicContact CE2-CE1 3.92Å; F370-Y449 HydrophobicContact CE1-CD1 4.02Å; F370-Y449 AromaticContact CE1-CE1 3.7Å; F370-Y449 HydrophobicContact CE1-CE1 3.7Å; F370-Y449 HydrophobicContact CZ-CD1 4.1Å; F370-Y449 AromaticContact CZ-CE1 3.51Å; F370-Y449 HydrophobicContact CZ-CE1 3.51Å; V379-Y449 WeakPolarHBondContact CG1-O 3.34Å; F389-Y449 HydrophobicContact CE2-CE2 4.48Å; F389-Y449 HydrophobicContact CZ-CE2 4.13Å; L444-Y449 VanDerWaalsContact O-CB 3.25Å; L444-Y449 WeakPolarHBondContact O-CB 3.33Å; L444-Y449 PolarHBondContact O-N 3.02Å; L445-Y449 HydrophobicContact CD2-CD2 4.2Å; L445-Y449 CarbonylContact O-C 3.35Å; Y449-L451 PolarHBondContact O-N 3.14Å
450	K	92.4	Very high	95.2	Very high	135 Å²	135	37 Å²	37	59%	0.587	19%	0.186	S	C	*	.			trans	56.8	34.3	176.1	-54.3	-57	-165	-169.9	0	112.8	V379 L445 F446 D447 T452	V379-K450 WeakPolarHBondContact CG2-O 3.48Å; L445-K450 PolarHBondContact O-N 3.44Å; L445-K450 VanDerWaalsContact O-N 3.16Å; F446-K450 WeakPolarHBondContact O-CA 3.03Å; F446-K450 WeakPolarHBondContact O-CD 3.5Å; D447-K450 WeakPolarHBondContact O-CD 3.02Å; D447-K450 WeakPolarHBondContact O-CE 3.35Å; D447-K450 PolarHBondContact O-NZ 3.05Å; K450-T452 PolarHBondContact O-N 3.4Å
451	L	95.1	Very high	95.2	Very high	7 Å²	7	37.1 Å²	37.1	4%	0.037	19%	0.186	C	C	.	.			trans	-61.9	135.9	170.8	-64.6	-172.6	0	0	0	109.5	L243 V379 F383 L445 F446 Y449 L459	L243-L451 HydrophobicContact CD1-CD1 4.04Å; V379-L451 HydrophobicContact CB-CD2 4.38Å; V379-L451 HydrophobicContact CG1-CD2 4.44Å; V379-L451 HydrophobicContact CG2-CD2 4.16Å; F383-L451 HydrophobicContact CD2-CD2 4Å; F383-L451 HydrophobicContact CE2-CD2 4.02Å; F383-L451 HydrophobicContact CG-CD2 4.46Å; F383-L451 HydrophobicContact CZ-CD2 4.47Å; L445-L451 HydrophobicContact CB-CD1 4.24Å; L445-L451 HydrophobicContact CD2-CD1 3.91Å; L445-L451 WeakPolarHBondContact O-CB 3.44Å; L445-L451 PolarHBondContact O-N 2.85Å; F446-L451 WeakPolarHBondContact CD1-O 3.43Å; Y449-L451 PolarHBondContact O-N 3.14Å; L451-L459 HydrophobicContact CD1-CD2 4.31Å
452	T	94.6	Very high	95.2	Very high	73 Å²	73	39.2 Å²	39.2	45%	0.448	20%	0.197	S	C	.	.			trans	-75	159.1	171.5	62.7	0	0	0	0	110.8	K450 S454 Q455 F456	K450-T452 PolarHBondContact O-N 3.4Å; T452-S454 PolarHBondContact O-N 3.25Å; T452-Q455 VanDerWaalsContact N-OE1 3.08Å; T452-Q455 PolarHBondContact O-N 3.29Å; T452-Q455 VanDerWaalsContact O-N 3.1Å; T452-Q455 WeakPolarHBondContact OG1-CB 3.12Å; T452-Q455 VanDerWaalsContact OG1-CG 3.31Å; T452-Q455 WeakPolarHBondContact OG1-CG 3.35Å; T452-Q455 PolarHBondContact OG1-N 2.84Å; T452-Q455 PolarHBondContact OG1-OE1 2.84Å; T452-F456 PolarHBondContact O-N 3.4Å
453	D	95.3	Very high	95.1	Very high	82 Å²	82	40.4 Å²	40.4	44%	0.439	21%	0.206	S	C	.	.	H	α-helix	trans	-58	-39.5	177.4	-67.3	13.6	0	0	0	111.3	K404 Q455 F456 E457	K404-D453 WeakPolarHBondContact CD-OD1 3.46Å; K404-D453 IonicContact NZ-OD1 2.99Å; K404-D453 PolarHBondContact NZ-OD1 3.2Å; D453-Q455 PolarHBondContact O-N 2.9Å; D453-F456 PolarHBondContact O-N 2.99Å; D453-E457 WeakPolarHBondContact O-CG 3.1Å; D453-E457 PolarHBondContact O-N 3.16Å
454	S	94.3	Very high	95	Very high	65 Å²	65	44.3 Å²	44.3	46%	0.455	23%	0.225	S	C	.	.	H	α-helix	trans	-66.5	-36.2	176.1	-175.1	0	0	0	0	113.4	T452 Q458	T452-S454 PolarHBondContact O-N 3.25Å; S454-Q458 WeakPolarHBondContact O-CG 3.48Å; S454-Q458 PolarHBondContact O-N 3.04Å
455	Q	94.8	Very high	94.8	Very high	21 Å²	21	45.5 Å²	45.5	10%	0.098	23%	0.231	C	C	.	.	H	α-helix	trans	-69.3	-35.4	173.4	-76.9	168.6	-52.2	0	0	111.6	V379 G381 T452 D453 Q458 L459	V379-Q455 PolarHBondContact O-NE2 3.06Å; G381-Q455 PolarHBondContact O-NE2 3.22Å; G381-Q455 VanDerWaalsContact O-NE2 3.12Å; T452-Q455 VanDerWaalsContact N-OE1 3.08Å; T452-Q455 PolarHBondContact O-N 3.29Å; T452-Q455 VanDerWaalsContact O-N 3.1Å; T452-Q455 WeakPolarHBondContact OG1-CB 3.12Å; T452-Q455 VanDerWaalsContact OG1-CG 3.31Å; T452-Q455 WeakPolarHBondContact OG1-CG 3.35Å; T452-Q455 PolarHBondContact OG1-N 2.84Å; T452-Q455 PolarHBondContact OG1-OE1 2.84Å; D453-Q455 PolarHBondContact O-N 2.9Å; Q455-Q458 CarbonylContact O-C 3.55Å; Q455-Q458 PolarHBondContact O-N 2.78Å; Q455-L459 PolarHBondContact O-N 2.8Å
456	F	97.1	Very high	94.4	Very high	2 Å²	2	49.1 Å²	49.1	1%	0.009	27%	0.268	C	S	.	.	H	α-helix	trans	-66.5	-39.9	175.6	-177	-98.4	0	0	0	112	C402 K404 F407 L445 F446 T452 D453 Q458 L459 F461	C402-F456 HydrophobicContact CB-CE1 4.15Å; C402-F456 WeakPolarHBondContact O-CD1 3.4Å; K404-F456 HydrophobicContact CB-CD1 4.31Å; F407-F456 HydrophobicContact CB-CE1 3.9Å; F407-F456 HydrophobicContact CB-CZ 3.71Å; F407-F456 HydrophobicContact CD1-CE2 4.23Å; F407-F456 AromaticContact CD1-CZ 3.66Å; F407-F456 HydrophobicContact CD1-CZ 3.66Å; F407-F456 HydrophobicContact CE1-CZ 4.49Å; F407-F456 HydrophobicContact CG-CE1 4.47Å; F407-F456 AromaticContact CG-CZ 3.78Å; F407-F456 HydrophobicContact CG-CZ 3.78Å; L445-F456 HydrophobicContact CD1-CD2 4.02Å; L445-F456 HydrophobicContact CD1-CE2 3.71Å; F446-F456 HydrophobicContact CE1-CB 3.84Å; F446-F456 HydrophobicContact CE1-CD2 4.2Å; F446-F456 HydrophobicContact CE1-CG 4.02Å; F446-F456 HydrophobicContact CE2-CD2 4.29Å; F446-F456 HydrophobicContact CE2-CE2 4.42Å; F446-F456 HydrophobicContact CZ-CB 3.88Å; F446-F456 AromaticContact CZ-CD1 4Å; F446-F456 HydrophobicContact CZ-CD1 4Å; F446-F456 AromaticContact CZ-CD2 3.53Å; F446-F456 HydrophobicContact CZ-CD2 3.53Å; F446-F456 HydrophobicContact CZ-CE1 4.44Å; F446-F456 HydrophobicContact CZ-CE2 4.04Å; F446-F456 AromaticContact CZ-CG 3.51Å; F446-F456 HydrophobicContact CZ-CG 3.51Å; F446-F456 HydrophobicContact CZ-CZ 4.46Å; T452-F456 PolarHBondContact O-N 3.4Å; D453-F456 PolarHBondContact O-N 2.99Å; F456-Q458 PolarHBondContact O-N 3.19Å; F456-L459 HydrophobicContact CD2-CD2 3.83Å; F456-L459 HydrophobicContact CE2-CD2 4.04Å; F456-L459 WeakPolarHBondContact O-CB 3.41Å; F456-L459 PolarHBondContact O-N 3.43Å; F456-F461 HydrophobicContact CE2-CE2 4.11Å; F456-F461 HydrophobicContact CE2-CZ 4.04Å; F456-F461 HydrophobicContact CZ-CE2 4.39Å
457	E	96.6	Very high	94	Very high	91 Å²	91	53.8 Å²	53.8	43%	0.425	30%	0.303	S	S	.	.	H	α-helix	trans	-60.1	-30.1	173.8	-73.6	174.2	-169.8	0	0	113	C402 T403 D453	C402-E457 WeakPolarHBondContact O-CA 3.32Å; T403-E457 HydrophobicContact CG2-CG 4.35Å; D453-E457 WeakPolarHBondContact O-CG 3.1Å; D453-E457 PolarHBondContact O-N 3.16Å
458	Q	95.9	Very high	93.9	Very high	90 Å²	90	51.8 Å²	51.8	42%	0.421	29%	0.293	S	S	.	.	H	α-helix	trans	-92.2	-7.7	176.5	-63.6	-179.4	57.8	0	0	113.6	N382 S454 Q455 F456	N382-Q458 PolarHBondContact ND2-OE1 3.31Å; N382-Q458 PolarHBondContact OD1-OE1 3.3Å; S454-Q458 WeakPolarHBondContact O-CG 3.48Å; S454-Q458 PolarHBondContact O-N 3.04Å; Q455-Q458 CarbonylContact O-C 3.55Å; Q455-Q458 PolarHBondContact O-N 2.78Å; F456-Q458 PolarHBondContact O-N 3.19Å
459	L	97.5	Very high	94	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.005	29%	0.293	C	S	.	.			trans	-66.8	133.9	178.7	-178.9	66.6	0	0	0	109.4	L243 F383 A385 L445 L451 Q455 F456 F461	L243-L459 HydrophobicContact CD1-CD1 4.07Å; F383-L459 HydrophobicContact CB-CD1 3.55Å; F383-L459 WeakPolarHBondContact O-CD1 3.45Å; A385-L459 HydrophobicContact CB-CD1 4.02Å; A385-L459 HydrophobicContact CB-CG 4.47Å; L445-L459 HydrophobicContact CD1-CD2 3.88Å; L445-L459 HydrophobicContact CD2-CD2 4.38Å; L451-L459 HydrophobicContact CD1-CD2 4.31Å; Q455-L459 PolarHBondContact O-N 2.8Å; F456-L459 HydrophobicContact CD2-CD2 3.83Å; F456-L459 HydrophobicContact CE2-CD2 4.04Å; F456-L459 WeakPolarHBondContact O-CB 3.41Å; F456-L459 PolarHBondContact O-N 3.43Å; L459-F461 HydrophobicContact CD2-CD2 4.47Å; L459-F461 HydrophobicContact CD2-CE1 4.24Å; L459-F461 HydrophobicContact CD2-CE2 3.67Å; L459-F461 HydrophobicContact CD2-CZ 3.54Å; L459-F461 HydrophobicContact CG-CD2 4.46Å; L459-F461 HydrophobicContact CG-CE2 4.08Å; L459-F461 HydrophobicContact CG-CZ 4.36Å
460	K	97.6	Very high	93.9	Very high	100 Å²	100	52.1 Å²	52.1	44%	0.435	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	125.3	173.9	-60.5	-179.3	-177.8	177.4	0	109.9	F383 V384 A385 L462	F383-K460 PolarHBondContact O-N 2.78Å; V384-K460 CarbonylContact C-O 3.55Å; V384-K460 WeakPolarHBondContact CA-O 3.27Å; A385-K460 PolarHBondContact N-O 3.36Å; K460-L462 HydrophobicContact CB-CD1 3.97Å; K460-L462 HydrophobicContact CB-CD2 4.13Å; K460-L462 HydrophobicContact CB-CG 3.83Å; K460-L462 HydrophobicContact CD-CD1 4.35Å
461	F	98.2	Very high	93.9	Very high	3 Å²	3	46.4 Å²	46.4	1%	0.013	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	106.4	171.2	-64.6	-94	0	0	0	108.9	A385 F389 Y390 C398 T399 L445 F456 L459	A385-F461 HydrophobicContact CB-CD1 3.86Å; A385-F461 HydrophobicContact CB-CE1 4.06Å; A385-F461 CarbonylContact O-C 3.51Å; A385-F461 VanDerWaalsContact O-CA 3.22Å; A385-F461 WeakPolarHBondContact O-CA 3.49Å; F389-F461 HydrophobicContact CB-CD1 3.77Å; F389-F461 HydrophobicContact CB-CE1 3.92Å; F389-F461 HydrophobicContact CD1-CE1 4.23Å; F389-F461 HydrophobicContact CG-CE1 4.42Å; F389-F461 WeakPolarHBondContact O-CD1 3.27Å; Y390-F461 WeakPolarHBondContact CD2-O 3.32Å; C398-F461 WeakPolarHBondContact O-CD2 3.35Å; T399-F461 PolarHBondContact O-N 3.27Å; L445-F461 HydrophobicContact CD1-CE1 4.44Å; L445-F461 HydrophobicContact CD1-CZ 3.95Å; F456-F461 HydrophobicContact CE2-CE2 4.11Å; F456-F461 HydrophobicContact CE2-CZ 4.04Å; F456-F461 HydrophobicContact CZ-CE2 4.39Å; L459-F461 HydrophobicContact CD2-CD2 4.47Å; L459-F461 HydrophobicContact CD2-CE1 4.24Å; L459-F461 HydrophobicContact CD2-CE2 3.67Å; L459-F461 HydrophobicContact CD2-CZ 3.54Å; L459-F461 HydrophobicContact CG-CD2 4.46Å; L459-F461 HydrophobicContact CG-CE2 4.08Å; L459-F461 HydrophobicContact CG-CZ 4.36Å
462	L	97.2	Very high	93.9	Very high	44 Å²	44	46.3 Å²	46.3	23%	0.23	28%	0.275	C	S	.	.			trans	-126.5	143	-169.5	-57.7	179.5	0	0	0	111.4	V384 A385 F386 K460 I465 I470	V384-L462 HydrophobicContact CG1-CB 4.11Å; V384-L462 HydrophobicContact CG1-CD1 3.85Å; V384-L462 HydrophobicContact CG1-CG 4.1Å; V384-L462 HydrophobicContact CG2-CD1 4.31Å; A385-L462 PolarHBondContact O-N 3.01Å; F386-L462 WeakPolarHBondContact CA-O 3.45Å; F386-L462 WeakPolarHBondContact CB-O 3.43Å; K460-L462 HydrophobicContact CB-CD1 3.97Å; K460-L462 HydrophobicContact CB-CD2 4.13Å; K460-L462 HydrophobicContact CB-CG 3.83Å; K460-L462 HydrophobicContact CD-CD1 4.35Å; L462-I465 HydrophobicContact CD1-CD1 4.33Å; L462-I465 HydrophobicContact CD1-CG1 3.84Å; L462-I470 WeakPolarHBondContact O-CG2 3.26Å
463	S	94.9	Very high	94	Very high	37 Å²	37	42.9 Å²	42.9	26%	0.259	25%	0.254	S	S	.	.	S	Bend	trans	-98.2	-22.2	163.2	42.5	0	0	0	0	112.3	Y390 I470	Y390-S463 VanDerWaalsContact CE1-CB 3.43Å; Y390-S463 VanDerWaalsContact CE1-OG 3.3Å; Y390-S463 WeakPolarHBondContact CE1-OG 3.21Å; Y390-S463 WeakPolarHBondContact CE2-OG 3.35Å; Y390-S463 PolarHBondContact OH-OG 3.32Å; S463-I470 WeakPolarHBondContact O-CG2 3.34Å; S463-I470 PolarHBondContact O-N 3.47Å
464	Q	94	Very high	94.1	Very high	85 Å²	85	39 Å²	39	40%	0.397	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	150.7	-176.2	-60.2	-170.6	-37.2	0	0	110	A468 D469	Q464-A468 CarbonylContact C-O 3.55Å; Q464-A468 WeakPolarHBondContact CA-O 3.43Å; Q464-A468 VanDerWaalsContact CB-O 3.32Å; Q464-A468 WeakPolarHBondContact CB-O 3.44Å; Q464-D469 WeakPolarHBondContact CG-OD1 3.31Å; Q464-D469 PolarHBondContact NE2-OD1 3.46Å
465	I	90.1	Very high	94.1	Very high	24 Å²	24	36 Å²	36	12%	0.123	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	116.1	165.1	-63.5	172.5	0	0	0	107.1	L216 L462 S467 A468 I470	L216-I465 HydrophobicContact CB-CB 3.69Å; L216-I465 HydrophobicContact CB-CD1 4.07Å; L216-I465 HydrophobicContact CB-CG1 4.45Å; L216-I465 HydrophobicContact CB-CG2 3.7Å; L216-I465 HydrophobicContact CD1-CB 4.16Å; L216-I465 WeakPolarHBondContact O-CG2 3.32Å; L462-I465 HydrophobicContact CD1-CD1 4.33Å; L462-I465 HydrophobicContact CD1-CG1 3.84Å; I465-S467 PolarHBondContact O-N 2.96Å; I465-A468 PolarHBondContact N-O 2.98Å; I465-A468 PolarHBondContact O-N 2.94Å; I465-I470 HydrophobicContact CD1-CD1 3.81Å; I465-I470 HydrophobicContact CG1-CD1 4.36Å
466	G	87	Confident	94.2	Very high	77 Å²	77	35.9 Å²	35.9	79%	0.794	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.3	-120	-168.4	0	0	0	0	0	110.8
467	S	85.3	Confident	94.2	Very high	113 Å²	113	35.8 Å²	35.8	79%	0.79	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108	3.2	178.7	51.4	0	0	0	0	113.7	I465	I465-S467 PolarHBondContact O-N 2.96Å
468	A	90.4	Very high	94	Very high	9 Å²	9	31.5 Å²	31.5	7%	0.074	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	141.1	-178	0	0	0	0	0	110.8	Q111 L216 Q464 I465 L474	Q111-A468 HydrophobicContact CB-CB 4.32Å; L216-A468 HydrophobicContact CD1-CB 4Å; L216-A468 HydrophobicContact CD2-CB 3.54Å; L216-A468 HydrophobicContact CG-CB 4.43Å; Q464-A468 CarbonylContact C-O 3.55Å; Q464-A468 WeakPolarHBondContact CA-O 3.43Å; Q464-A468 VanDerWaalsContact CB-O 3.32Å; Q464-A468 WeakPolarHBondContact CB-O 3.44Å; I465-A468 PolarHBondContact N-O 2.98Å; I465-A468 PolarHBondContact O-N 2.94Å; A468-L474 HydrophobicContact CB-CD1 4.38Å
469	D	92.8	Very high	93.9	Very high	23 Å²	23	28.5 Å²	28.5	12%	0.123	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	133.7	173.7	-63.6	-63.2	0	0	0	109.8	F95 Q111 Q464	F95-D469 HydrophobicContact CE1-CB 4.17Å; Q111-D469 PolarHBondContact NE2-OD2 2.87Å; Q464-D469 WeakPolarHBondContact CG-OD1 3.31Å; Q464-D469 PolarHBondContact NE2-OD1 3.46Å
470	I	91.6	Very high	93.7	Very high	13 Å²	13	28.8 Å²	28.8	7%	0.067	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-83.6	122.2	173.9	-163.7	177.7	0	0	0	108.8	T213 V384 F386 L462 S463 I465	T213-I470 HydrophobicContact CG2-CD1 4.32Å; V384-I470 HydrophobicContact CB-CD1 4.47Å; V384-I470 HydrophobicContact CG1-CD1 3.51Å; F386-I470 HydrophobicContact CB-CD1 4.33Å; F386-I470 HydrophobicContact CB-CG2 3.3Å; F386-I470 HydrophobicContact CD1-CD1 3.83Å; F386-I470 HydrophobicContact CD1-CG1 4.2Å; F386-I470 HydrophobicContact CD1-CG2 4.42Å; F386-I470 HydrophobicContact CD2-CG2 4.21Å; F386-I470 HydrophobicContact CG-CD1 4.18Å; F386-I470 HydrophobicContact CG-CG1 4.23Å; F386-I470 HydrophobicContact CG-CG2 3.74Å; L462-I470 WeakPolarHBondContact O-CG2 3.26Å; S463-I470 WeakPolarHBondContact O-CG2 3.34Å; S463-I470 PolarHBondContact O-N 3.47Å; I465-I470 HydrophobicContact CD1-CD1 3.81Å; I465-I470 HydrophobicContact CG1-CD1 4.36Å
471	G	90.6	Very high	93.5	Very high	15 Å²	15	24 Å²	24	16%	0.155	16%	0.159	C	C	.	.	S	Bend	trans	178.6	168.3	-177.9	0	0	0	0	0	110.4	A212 T473	A212-G471 WeakPolarHBondContact CB-O 3.46Å; G471-T473 VanDerWaalsContact C-N 3.26Å; G471-T473 PolarHBondContact O-N 3.48Å
472	W	96.3	Very high	93	Very high	4 Å²	4	26.4 Å²	26.4	2%	0.015	17%	0.172	C	C	.	.	H	α-helix	trans	-69.2	-22.6	-174.1	67.7	-97.1	0	0	0	113.1	V84 D86 A160 T162 I200 E205 Y208 A209 L474 G475 Y476	V84-W472 HydrophobicContact CG1-CH2 3.91Å; V84-W472 HydrophobicContact CG1-CZ3 3.82Å; D86-W472 HydrophobicContact CB-CH2 4.45Å; D86-W472 HydrophobicContact CB-CZ2 3.69Å; D86-W472 VanDerWaalsContact CG-CZ2 3.44Å; D86-W472 WeakPolarHBondContact OD1-CZ2 3.26Å; D86-W472 PolarHBondContact OD1-NE1 2.84Å; D86-W472 PolarHBondContact OD2-NE1 3.26Å; A160-W472 HydrophobicContact CB-CH2 3.17Å; A160-W472 HydrophobicContact CB-CZ2 3.99Å; A160-W472 HydrophobicContact CB-CZ3 3.63Å; A160-W472 WeakPolarHBondContact O-CZ2 3.37Å; T162-W472 HydrophobicContact CG2-CZ2 4Å; I200-W472 HydrophobicContact CD1-CD2 4.27Å; I200-W472 HydrophobicContact CD1-CE3 4.21Å; I200-W472 HydrophobicContact CD1-CH2 4.44Å; I200-W472 HydrophobicContact CD1-CZ2 4.37Å; I200-W472 HydrophobicContact CD1-CZ3 4.33Å; E205-W472 HydrophobicContact CG-CB 4.48Å; E205-W472 HydrophobicContact CG-CG 4.12Å; E205-W472 VanDerWaalsContact O-CB 3.31Å; E205-W472 WeakPolarHBondContact O-CB 3.38Å; Y208-W472 WeakPolarHBondContact CB-O 3.05Å; Y208-W472 HydrophobicContact CD2-CE3 4.31Å; A209-W472 HydrophobicContact CB-CB 4.17Å; W472-L474 VanDerWaalsContact C-N 3.35Å; W472-L474 PolarHBondContact O-N 3.45Å; W472-G475 PolarHBondContact O-N 3.18Å; W472-G475 VanDerWaalsContact O-N 3.14Å; W472-Y476 HydrophobicContact CE3-CD2 4.06Å; W472-Y476 HydrophobicContact CE3-CG 4.25Å; W472-Y476 AromaticContact CZ3-CD2 3.6Å; W472-Y476 HydrophobicContact CZ3-CD2 3.6Å; W472-Y476 HydrophobicContact CZ3-CE2 4.42Å; W472-Y476 AromaticContact CZ3-CG 3.81Å; W472-Y476 HydrophobicContact CZ3-CG 3.81Å; W472-Y476 PolarHBondContact O-N 2.79Å
473	T	97.5	Very high	92.4	Very high	2 Å²	2	31.3 Å²	31.3	1%	0.012	20%	0.195	C	C	.	.	H	α-helix	trans	-61.5	-38.1	-174.1	58.5	0	0	0	0	113.5	V84 D86 F95 Y97 G471 Y476 M477	V84-T473 HydrophobicContact CB-CG2 4.39Å; V84-T473 HydrophobicContact CG1-CG2 3.79Å; D86-T473 HydrophobicContact CB-CG2 3.68Å; F95-T473 HydrophobicContact CD2-CG2 3.79Å; F95-T473 HydrophobicContact CE2-CG2 3.99Å; F95-T473 HydrophobicContact CG-CG2 4.4Å; Y97-T473 PolarHBondContact OH-OG1 2.92Å; G471-T473 VanDerWaalsContact C-N 3.26Å; G471-T473 PolarHBondContact O-N 3.48Å; T473-Y476 WeakPolarHBondContact O-CB 3.42Å; T473-Y476 PolarHBondContact O-N 2.87Å; T473-M477 PolarHBondContact O-N 3.02Å
474	L	95.7	Very high	92	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-65.4	-44	176.5	-176.5	149.3	0	0	0	110.9	Y97 A212 Y215 L216 A468 W472 Y476 M477 L478	Y97-L474 HydrophobicContact CE1-CB 3.9Å; Y97-L474 HydrophobicContact CE1-CD1 4.01Å; Y97-L474 HydrophobicContact CE1-CG 4.05Å; Y97-L474 WeakPolarHBondContact OH-CA 3.4Å; Y97-L474 PolarHBondContact OH-N 3.38Å; Y97-L474 VanDerWaalsContact OH-N 3.15Å; A212-L474 HydrophobicContact CB-CB 4.07Å; A212-L474 HydrophobicContact CB-CD2 3.93Å; Y215-L474 HydrophobicContact CD1-CD2 3.57Å; Y215-L474 HydrophobicContact CE1-CD2 4.25Å; Y215-L474 HydrophobicContact CG-CD2 4.24Å; L216-L474 HydrophobicContact CD1-CD1 4.35Å; L216-L474 HydrophobicContact CD2-CD1 3.78Å; L216-L474 HydrophobicContact CG-CD1 4.23Å; A468-L474 HydrophobicContact CB-CD1 4.38Å; W472-L474 VanDerWaalsContact C-N 3.35Å; W472-L474 PolarHBondContact O-N 3.45Å; L474-Y476 VanDerWaalsContact C-N 3.34Å; L474-M477 PolarHBondContact O-N 2.74Å; L474-L478 HydrophobicContact CD2-CD1 3.47Å; L474-L478 VanDerWaalsContact CD2-CD1 3.47Å; L474-L478 HydrophobicContact CD2-CG 4.13Å; L474-L478 WeakPolarHBondContact O-CG 3.37Å; L474-L478 PolarHBondContact O-N 3.49Å
475	G	95.9	Very high	91.5	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-68.1	-34.4	177.8	0	0	0	0	0	113	Y208 W472 L478 N479	Y208-G475 WeakPolarHBondContact O-CA 3.42Å; W472-G475 PolarHBondContact O-N 3.18Å; W472-G475 VanDerWaalsContact O-N 3.14Å; G475-L478 PolarHBondContact O-N 3.08Å; G475-N479 WeakPolarHBondContact O-CB 3.11Å; G475-N479 PolarHBondContact O-N 2.94Å
476	Y	97.1	Very high	91	Very high	20 Å²	20	33.7 Å²	33.7	8%	0.078	22%	0.223	C	C	.	.	H	α-helix	trans	-60.5	-49.8	170.4	-174.1	-73.4	0	0	0	110.4	V84 Y158 A160 Y208 W472 T473 L474 L478 N479 A480	V84-Y476 HydrophobicContact CG1-CD1 4.3Å; V84-Y476 HydrophobicContact CG1-CG 4.5Å; V84-Y476 HydrophobicContact CG2-CD1 4.13Å; Y158-Y476 AromaticContact CD1-CE1 3.69Å; Y158-Y476 HydrophobicContact CD1-CE1 3.69Å; Y158-Y476 HydrophobicContact CD2-CE1 4.35Å; Y158-Y476 HydrophobicContact CE1-CE1 4.29Å; Y158-Y476 AromaticContact CG-CE1 3.73Å; Y158-Y476 HydrophobicContact CG-CE1 3.73Å; A160-Y476 HydrophobicContact CB-CD2 4.5Å; A160-Y476 HydrophobicContact CB-CE2 4.13Å; Y208-Y476 AromaticContact CD2-CD2 3.65Å; Y208-Y476 HydrophobicContact CD2-CD2 3.65Å; Y208-Y476 HydrophobicContact CD2-CG 4.32Å; Y208-Y476 AromaticContact CE2-CD2 3.36Å; Y208-Y476 HydrophobicContact CE2-CD2 3.36Å; Y208-Y476 AromaticContact CE2-CE2 3.94Å; Y208-Y476 HydrophobicContact CE2-CE2 3.94Å; Y208-Y476 HydrophobicContact CE2-CG 4.26Å; Y208-Y476 HydrophobicContact CG-CD2 4.44Å; Y208-Y476 AromaticContact CZ-CD2 3.95Å; W472-Y476 HydrophobicContact CE3-CD2 4.06Å; W472-Y476 HydrophobicContact CE3-CG 4.25Å; W472-Y476 AromaticContact CZ3-CD2 3.6Å; W472-Y476 HydrophobicContact CZ3-CD2 3.6Å; W472-Y476 HydrophobicContact CZ3-CE2 4.42Å; W472-Y476 AromaticContact CZ3-CG 3.81Å; W472-Y476 HydrophobicContact CZ3-CG 3.81Å; W472-Y476 PolarHBondContact O-N 2.79Å; T473-Y476 WeakPolarHBondContact O-CB 3.42Å; T473-Y476 PolarHBondContact O-N 2.87Å; L474-Y476 VanDerWaalsContact C-N 3.34Å; Y476-L478 PolarHBondContact O-N 2.68Å; Y476-N479 PolarHBondContact O-N 3.35Å; Y476-A480 HydrophobicContact CD1-CB 4.42Å; Y476-A480 HydrophobicContact CE1-CB 4.36Å; Y476-A480 WeakPolarHBondContact O-CB 3.39Å; Y476-A480 PolarHBondContact O-N 3.39Å
477	M	96	Very high	90.7	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-63.6	-42.7	180	-163	63.9	-108.5	0	0	111.1	V84 Y97 W99 I109 Y158 T473 L474 N479 A480 T481 L484	V84-M477 HydrophobicContact CG2-CB 3.95Å; V84-M477 HydrophobicContact CG2-CG 4.33Å; V84-M477 HydrophobicContact CG2-SD 3.81Å; Y97-M477 HydrophobicContact CD2-CB 3.79Å; Y97-M477 HydrophobicContact CD2-CG 3.84Å; Y97-M477 HydrophobicContact CE2-CB 4.23Å; Y97-M477 HydrophobicContact CG-CB 4.29Å; Y97-M477 HydrophobicContact CG-CG 4.13Å; W99-M477 HydrophobicContact CH2-CE 3.89Å; W99-M477 HydrophobicContact CZ3-CE 4.12Å; W99-M477 HydrophobicContact CZ3-CG 4.21Å; W99-M477 HydrophobicContact CZ3-SD 4.41Å; I109-M477 HydrophobicContact CD1-CB 3.91Å; I109-M477 HydrophobicContact CD1-CG 3.69Å; Y158-M477 HydrophobicContact CD2-SD 4.33Å; Y158-M477 HydrophobicContact CE2-CE 4.01Å; Y158-M477 HydrophobicContact CE2-SD 4.32Å; T473-M477 PolarHBondContact O-N 3.02Å; L474-M477 PolarHBondContact O-N 2.74Å; M477-N479 VanDerWaalsContact C-N 3.35Å; M477-N479 PolarHBondContact O-N 3.41Å; M477-A480 HydrophobicContact CE-CB 3.8Å; M477-A480 PolarHBondContact O-N 3.38Å; M477-A480 VanDerWaalsContact O-N 3.16Å; M477-T481 HydrophobicContact CE-CG2 4.18Å; M477-T481 WeakPolarHBondContact O-CG2 3.48Å; M477-T481 PolarHBondContact O-N 2.73Å; M477-L484 HydrophobicContact CE-CD1 3.89Å
478	L	93.4	Very high	90.3	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-54.4	-50.4	173.7	-80.6	171.4	0	0	0	111.5	T106 G107 I109 I211 Y215 Y271 L474 G475 Y476 A480 T481	T106-L478 HydrophobicContact CG2-CD2 4.32Å; G107-L478 WeakPolarHBondContact O-CD2 3.41Å; I109-L478 HydrophobicContact CB-CD2 4.03Å; I109-L478 HydrophobicContact CB-CG 4.49Å; I109-L478 HydrophobicContact CD1-CB 4.3Å; I109-L478 HydrophobicContact CD1-CD2 3.73Å; I109-L478 HydrophobicContact CD1-CG 3.87Å; I109-L478 HydrophobicContact CG1-CD2 3.77Å; I109-L478 HydrophobicContact CG1-CG 4.37Å; I211-L478 HydrophobicContact CG2-CB 4.12Å; I211-L478 HydrophobicContact CG2-CD1 3.62Å; Y215-L478 HydrophobicContact CD1-CD1 3.84Å; Y215-L478 HydrophobicContact CD2-CD1 3.78Å; Y215-L478 HydrophobicContact CD2-CD2 4.25Å; Y215-L478 HydrophobicContact CE1-CD1 4.41Å; Y215-L478 HydrophobicContact CE2-CD1 4.39Å; Y215-L478 HydrophobicContact CE2-CD2 4.11Å; Y215-L478 HydrophobicContact CG-CD1 3.47Å; Y215-L478 VanDerWaalsContact CG-CD1 3.47Å; Y271-L478 WeakPolarHBondContact OH-CD2 3.36Å; L474-L478 HydrophobicContact CD2-CD1 3.47Å; L474-L478 VanDerWaalsContact CD2-CD1 3.47Å; L474-L478 HydrophobicContact CD2-CG 4.13Å; L474-L478 WeakPolarHBondContact O-CG 3.37Å; L474-L478 PolarHBondContact O-N 3.49Å; G475-L478 PolarHBondContact O-N 3.08Å; Y476-L478 PolarHBondContact O-N 2.68Å; L478-A480 VanDerWaalsContact C-N 3.33Å; L478-A480 PolarHBondContact O-N 3.18Å; L478-T481 PolarHBondContact O-N 3.31Å; L478-T481 PolarHBondContact O-OG1 3.11Å
479	N	93.5	Very high	89.7	Confident	28 Å²	28	38.4 Å²	38.4	15%	0.15	21%	0.214	C	C	.	.	H	α-helix	trans	-64.8	-38.2	178.3	-170.3	48.5	0	0	0	112.3	Y208 I211 G475 Y476 M477 T481 N482	Y208-N479 HydrophobicContact CD1-CB 4.35Å; Y208-N479 HydrophobicContact CE1-CB 3.91Å; I211-N479 HydrophobicContact CD1-CB 4.48Å; G475-N479 WeakPolarHBondContact O-CB 3.11Å; G475-N479 PolarHBondContact O-N 2.94Å; Y476-N479 PolarHBondContact O-N 3.35Å; M477-N479 VanDerWaalsContact C-N 3.35Å; M477-N479 PolarHBondContact O-N 3.41Å; N479-T481 VanDerWaalsContact C-N 3.32Å; N479-T481 PolarHBondContact O-N 2.73Å; N479-N482 WeakPolarHBondContact O-CB 3.34Å; N479-N482 PolarHBondContact O-N 2.8Å
480	A	93.5	Very high	88.9	Confident	6 Å²	6	39.7 Å²	39.7	5%	0.05	22%	0.223	C	C	.	.	H	α-helix	trans	-67.9	-28.2	178.4	0	0	0	0	0	113.1	Y158 Y476 M477 L478 N482 M483 L484	Y158-A480 HydrophobicContact CE2-CB 4.31Å; Y476-A480 HydrophobicContact CD1-CB 4.42Å; Y476-A480 HydrophobicContact CE1-CB 4.36Å; Y476-A480 WeakPolarHBondContact O-CB 3.39Å; Y476-A480 PolarHBondContact O-N 3.39Å; M477-A480 HydrophobicContact CE-CB 3.8Å; M477-A480 PolarHBondContact O-N 3.38Å; M477-A480 VanDerWaalsContact O-N 3.16Å; L478-A480 VanDerWaalsContact C-N 3.33Å; L478-A480 PolarHBondContact O-N 3.18Å; A480-N482 PolarHBondContact O-N 3.35Å; A480-M483 PolarHBondContact O-N 3.32Å; A480-L484 PolarHBondContact O-N 2.99Å
481	T	91.7	Very high	88	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-60	-29.1	174.7	60.2	0	0	0	0	113.3	W99 G107 I109 M477 L478 N479 M483 L484	W99-T481 HydrophobicContact CD2-CG2 3.94Å; W99-T481 HydrophobicContact CE3-CG2 4.18Å; W99-T481 HydrophobicContact CH2-CG2 4.13Å; W99-T481 HydrophobicContact CZ2-CG2 3.87Å; W99-T481 HydrophobicContact CZ3-CG2 4.27Å; G107-T481 PolarHBondContact N-OG1 3.46Å; I109-T481 HydrophobicContact CD1-CG2 3.69Å; I109-T481 HydrophobicContact CG1-CG2 4.25Å; M477-T481 HydrophobicContact CE-CG2 4.18Å; M477-T481 WeakPolarHBondContact O-CG2 3.48Å; M477-T481 PolarHBondContact O-N 2.73Å; L478-T481 PolarHBondContact O-N 3.31Å; L478-T481 PolarHBondContact O-OG1 3.11Å; N479-T481 VanDerWaalsContact C-N 3.32Å; N479-T481 PolarHBondContact O-N 2.73Å; T481-M483 PolarHBondContact O-N 2.82Å; T481-L484 PolarHBondContact O-N 3.39Å
482	N	87.8	Confident	87.4	Confident	54 Å²	54	50.8 Å²	50.8	29%	0.289	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-21.6	174.3	-63.8	-19.1	0	0	0	112.7	D105 T106 N479 A480	D105-N482 WeakPolarHBondContact O-CA 3.26Å; D105-N482 PolarHBondContact O-OD1 3.19Å; D105-N482 VanDerWaalsContact O-OD1 3.09Å; T106-N482 WeakPolarHBondContact CA-OD1 3.44Å; T106-N482 VanDerWaalsContact CB-OD1 3.28Å; T106-N482 WeakPolarHBondContact CB-OD1 3.41Å; T106-N482 PolarHBondContact N-OD1 3.44Å; T106-N482 PolarHBondContact OG1-OD1 3.14Å; N479-N482 WeakPolarHBondContact O-CB 3.34Å; N479-N482 PolarHBondContact O-N 2.8Å; A480-N482 PolarHBondContact O-N 3.35Å
483	M	86	Confident	86.5	Confident	146 Å²	146	51.7 Å²	51.7	72%	0.719	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.2	-12.6	-176.3	-55.2	-179.9	-166.9	0	0	113.2	A480 T481	A480-M483 PolarHBondContact O-N 3.32Å; T481-M483 PolarHBondContact O-N 2.82Å
484	L	86.3	Confident	85.6	Confident	21 Å²	21	52.7 Å²	52.7	11%	0.11	29%	0.288	C	S	.	.	S	Bend	trans	-82.6	149.9	178.8	-68.5	174.9	0	0	0	110.4	W99 R102 A156 M477 A480 T481	W99-L484 HydrophobicContact CH2-CD1 4.04Å; W99-L484 HydrophobicContact CZ2-CD1 3.96Å; R102-L484 PolarHBondContact NH1-O 2.87Å; R102-L484 PolarHBondContact NH2-O 3.4Å; A156-L484 HydrophobicContact CB-CD1 4Å; A156-L484 HydrophobicContact CB-CD2 4.16Å; M477-L484 HydrophobicContact CE-CD1 3.89Å; A480-L484 PolarHBondContact O-N 2.99Å; T481-L484 PolarHBondContact O-N 3.39Å
485	P	83.3	Confident	84.9	Confident	109 Å²	109	57.5 Å²	57.5	71%	0.708	32%	0.317	S	S	*	.	P	Polyproline II helix	trans	-69.3	138.5	172	29	-33.7	0	0	0	110.4	R102	R102-P485 PolarHBondContact NH2-O 2.86Å
486	A	79.1	Confident	84.5	Confident	66 Å²	66	63 Å²	63	55%	0.545	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-72.6	136.2	179.8	0	0	0	0	0	111
487	E	80.7	Confident	83.9	Confident	61 Å²	61	67 Å²	67	29%	0.285	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-65.1	142	171	-82.9	-72.5	-163.9	0	0	110.9	I77 P78 E80 R151	I77-E487 HydrophobicContact CG2-CB 4.41Å; P78-E487 HydrophobicContact CG-CB 4.14Å; P78-E487 HydrophobicContact CG-CG 4.3Å; E80-E487 HydrophobicContact CG-CB 4.05Å; E80-E487 HydrophobicContact CG-CG 3.41Å; E80-E487 VanDerWaalsContact CG-CG 3.41Å; R151-E487 IonicContact NH1-OE1 2.65Å; R151-E487 PolarHBondContact NH1-OE1 3.43Å
488	K	77.5	Confident	83.4	Confident	170 Å²	170	69 Å²	69	74%	0.739	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-85	150.5	175.4	-65.8	-177.2	-175.1	-179.2	0	109.5	P78 T490	P78-K488 WeakPolarHBondContact CD-O 3.25Å; K488-T490 PolarHBondContact O-N 3.14Å
489	P	77.1	Confident	83.2	Confident	68 Å²	68	71.9 Å²	71.9	44%	0.442	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-53.8	140.5	171	-23.1	33.1	0	0	0	111.3	I77 E491	I77-P489 HydrophobicContact CG1-CG 4.26Å; P489-E491 PolarHBondContact O-N 3.27Å
490	T	77.1	Confident	83.1	Confident	50 Å²	50	75.9 Å²	75.9	31%	0.307	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-69.9	126.9	179.1	-43.7	0	0	0	0	109.6	S74 G75 S76 K488 L492	S74-T490 CarbonylContact C-O 3.53Å; S74-T490 VanDerWaalsContact CA-O 3.31Å; S74-T490 WeakPolarHBondContact CA-O 3.35Å; G75-T490 PolarHBondContact N-O 3.43Å; S76-T490 PolarHBondContact O-N 3.43Å; S76-T490 PolarHBondContact O-OG1 3.3Å; K488-T490 PolarHBondContact O-N 3.14Å; T490-L492 HydrophobicContact CG2-CD1 3.53Å; T490-L492 HydrophobicContact CG2-CG 4.43Å
491	E	73	Confident	82.9	Confident	174 Å²	174	78.6 Å²	78.6	81%	0.813	43%	0.431	S	S	*	.			trans	-102.6	94.9	172.8	-70.8	-177.5	177.2	0	0	109.3	P489	P489-E491 PolarHBondContact O-N 3.27Å
492	L	76.4	Confident	83	Confident	86 Å²	86	80 Å²	80	45%	0.45	44%	0.44	S	S	.	.	S	Bend	trans	-82	-33	174.2	-77.3	88.4	0	0	0	111.6	L70 L73 S74 T490	L70-L492 HydrophobicContact CD2-CB 4.25Å; L70-L492 HydrophobicContact CD2-CD2 3.86Å; L73-L492 HydrophobicContact CB-CD1 4.34Å; L73-L492 HydrophobicContact CB-CD2 4.39Å; S74-L492 PolarHBondContact OG-N 3.2Å; S74-L492 VanDerWaalsContact OG-N 3.13Å; T490-L492 HydrophobicContact CG2-CD1 3.53Å; T490-L492 HydrophobicContact CG2-CG 4.43Å
493	I	78.4	Confident	83.2	Confident	23 Å²	23	80 Å²	80	12%	0.118	45%	0.448	C	S	.	.	S	Bend	trans	-144.4	131.1	176.1	-167.4	169.4	0	0	0	108.8	V67 L70 Y71 S74 E497 F498	V67-I493 HydrophobicContact CG2-CD1 3.43Å; V67-I493 VanDerWaalsContact CG2-CD1 3.43Å; L70-I493 HydrophobicContact CB-CB 4.42Å; L70-I493 HydrophobicContact CB-CG2 3.97Å; Y71-I493 HydrophobicContact CD2-CG2 4.41Å; S74-I493 PolarHBondContact OG-N 2.88Å; S74-I493 VanDerWaalsContact OG-N 3.12Å; S74-I493 PolarHBondContact OG-O 3.44Å; I493-E497 HydrophobicContact CD1-CB 4.08Å; I493-E497 HydrophobicContact CG1-CB 3.61Å; I493-F498 HydrophobicContact CD1-CB 4.12Å; I493-F498 HydrophobicContact CG1-CB 4.28Å; I493-F498 HydrophobicContact CG2-CB 4.38Å
494	G	78.8	Confident	83.5	Confident	23 Å²	23	75.8 Å²	75.8	24%	0.237	44%	0.435	C	S	.	.			trans	-74	161.6	175.3	0	0	0	0	0	111.5	L496 E497 F498	G494-L496 PolarHBondContact O-N 3.45Å; G494-E497 WeakPolarHBondContact CA-OE2 3.27Å; G494-E497 PolarHBondContact N-OE2 3.29Å; G494-E497 PolarHBondContact O-N 2.68Å; G494-F498 WeakPolarHBondContact O-CB 3.39Å; G494-F498 PolarHBondContact O-N 2.98Å
495	V	81.4	Confident	83.7	Confident	102 Å²	102	74.9 Å²	74.9	62%	0.618	43%	0.431	S	S	*	.	H	α-helix	trans	-59.8	-34.8	-177.4	179.9	0	0	0	0	111.4	S499	V495-S499 WeakPolarHBondContact O-CB 3.32Å; V495-S499 PolarHBondContact O-N 2.81Å; V495-S499 PolarHBondContact O-OG 3.16Å
496	L	86.6	Confident	84.2	Confident	117 Å²	117	72.1 Å²	72.1	61%	0.613	41%	0.414	S	S	*	.	H	α-helix	trans	-71.1	-48.3	179.6	-178.4	61.8	0	0	0	111.5	G494 F498 S499 L500	G494-L496 PolarHBondContact O-N 3.45Å; L496-F498 VanDerWaalsContact C-N 3.34Å; L496-F498 PolarHBondContact O-N 3.42Å; L496-S499 PolarHBondContact O-N 3.49Å; L496-L500 HydrophobicContact CD1-CD1 4.22Å; L496-L500 HydrophobicContact CD1-CG 4.32Å; L496-L500 HydrophobicContact CG-CD1 4.09Å; L496-L500 WeakPolarHBondContact O-CG 3.25Å; L496-L500 PolarHBondContact O-N 3.33Å
497	E	84	Confident	84.9	Confident	102 Å²	102	72.8 Å²	72.8	48%	0.477	41%	0.411	S	S	.	.	H	α-helix	trans	-62.2	-43.9	178.6	-63.7	82.6	176.4	0	0	110.8	I493 G494 S499 L500 V501	I493-E497 HydrophobicContact CD1-CB 4.08Å; I493-E497 HydrophobicContact CG1-CB 3.61Å; G494-E497 WeakPolarHBondContact CA-OE2 3.27Å; G494-E497 PolarHBondContact N-OE2 3.29Å; G494-E497 PolarHBondContact O-N 2.68Å; E497-S499 VanDerWaalsContact C-N 3.32Å; E497-S499 PolarHBondContact O-N 2.9Å; E497-L500 PolarHBondContact O-N 3.25Å; E497-V501 WeakPolarHBondContact O-CB 3.2Å; E497-V501 VanDerWaalsContact O-CG2 3.28Å; E497-V501 WeakPolarHBondContact O-CG2 3.29Å; E497-V501 PolarHBondContact O-N 2.03Å
498	F	86.6	Confident	85.3	Confident	42 Å²	42	73.4 Å²	73.4	18%	0.184	42%	0.415	C	S	.	.	H	α-helix	trans	-55.7	-48.5	173.1	171.1	-101.7	0	0	0	111.2	V67 V68 Y71 I493 G494 L496 T502	V67-F498 HydrophobicContact CB-CD2 4.44Å; V67-F498 HydrophobicContact CG1-CD2 4.15Å; V67-F498 HydrophobicContact CG1-CE2 4.01Å; V67-F498 HydrophobicContact CG2-CD2 3.77Å; V67-F498 HydrophobicContact CG2-CE2 4.44Å; V68-F498 HydrophobicContact CG2-CE2 4.39Å; Y71-F498 HydrophobicContact CD1-CE1 4.49Å; Y71-F498 HydrophobicContact CD1-CE2 4.24Å; Y71-F498 HydrophobicContact CD1-CZ 4.23Å; Y71-F498 HydrophobicContact CD2-CB 3.94Å; Y71-F498 AromaticContact CD2-CD1 3.96Å; Y71-F498 HydrophobicContact CD2-CD1 3.96Å; Y71-F498 AromaticContact CD2-CD2 3.85Å; Y71-F498 HydrophobicContact CD2-CD2 3.85Å; Y71-F498 HydrophobicContact CD2-CE1 4.46Å; Y71-F498 HydrophobicContact CD2-CE2 4.36Å; Y71-F498 AromaticContact CD2-CG 3.62Å; Y71-F498 HydrophobicContact CD2-CG 3.62Å; Y71-F498 HydrophobicContact CE2-CD1 4.18Å; Y71-F498 HydrophobicContact CE2-CG 4.26Å; Y71-F498 HydrophobicContact CG-CD1 4.27Å; Y71-F498 AromaticContact CG-CD2 3.67Å; Y71-F498 HydrophobicContact CG-CD2 3.67Å; Y71-F498 HydrophobicContact CG-CE1 4.37Å; Y71-F498 AromaticContact CG-CE2 3.8Å; Y71-F498 HydrophobicContact CG-CE2 3.8Å; Y71-F498 AromaticContact CG-CG 3.92Å; Y71-F498 HydrophobicContact CG-CG 3.92Å; Y71-F498 HydrophobicContact CG-CZ 4.16Å; I493-F498 HydrophobicContact CD1-CB 4.12Å; I493-F498 HydrophobicContact CG1-CB 4.28Å; I493-F498 HydrophobicContact CG2-CB 4.38Å; G494-F498 WeakPolarHBondContact O-CB 3.39Å; G494-F498 PolarHBondContact O-N 2.98Å; L496-F498 VanDerWaalsContact C-N 3.34Å; L496-F498 PolarHBondContact O-N 3.42Å; F498-T502 WeakPolarHBondContact O-CB 3.01Å; F498-T502 PolarHBondContact O-N 3.12Å; F498-T502 PolarHBondContact O-OG1 3.01Å
499	S	88.5	Confident	86	Confident	61 Å²	61	66.5 Å²	66.5	43%	0.427	39%	0.387	S	S	.	.	H	α-helix	trans	-63.5	-44.6	-178.6	-59.9	0	0	0	0	112.1	V495 L496 E497 A503	V495-S499 WeakPolarHBondContact O-CB 3.32Å; V495-S499 PolarHBondContact O-N 2.81Å; V495-S499 PolarHBondContact O-OG 3.16Å; L496-S499 PolarHBondContact O-N 3.49Å; E497-S499 VanDerWaalsContact C-N 3.32Å; E497-S499 PolarHBondContact O-N 2.9Å; S499-A503 WeakPolarHBondContact O-CB 3.5Å; S499-A503 PolarHBondContact O-N 2.84Å
500	L	91.9	Very high	86.8	Confident	112 Å²	112	68.9 Å²	68.9	59%	0.586	40%	0.395	S	S	*	.	H	α-helix	trans	-66.8	-46.4	-179.9	-71.1	173.8	0	0	0	112.3	L496 E497 A503 A504	L496-L500 HydrophobicContact CD1-CD1 4.22Å; L496-L500 HydrophobicContact CD1-CG 4.32Å; L496-L500 HydrophobicContact CG-CD1 4.09Å; L496-L500 WeakPolarHBondContact O-CG 3.25Å; L496-L500 PolarHBondContact O-N 3.33Å; E497-L500 PolarHBondContact O-N 3.25Å; L500-A503 PolarHBondContact O-N 2.82Å; L500-A504 WeakPolarHBondContact O-CB 3.24Å; L500-A504 PolarHBondContact O-N 2.8Å
501	V	89.3	Confident	87.5	Confident	63 Å²	63	71.8 Å²	71.8	38%	0.382	41%	0.408	S	S	.	.	H	α-helix	trans	-67.2	-40.5	179.5	174	0	0	0	0	110.8	V67 E497 A504 A505	V67-V501 HydrophobicContact CB-CG1 3.94Å; V67-V501 HydrophobicContact CG1-CG1 4.47Å; V67-V501 HydrophobicContact CG2-CB 3.83Å; V67-V501 HydrophobicContact CG2-CG1 3.7Å; E497-V501 WeakPolarHBondContact O-CB 3.2Å; E497-V501 VanDerWaalsContact O-CG2 3.28Å; E497-V501 WeakPolarHBondContact O-CG2 3.29Å; E497-V501 PolarHBondContact O-N 2.03Å; V501-A504 PolarHBondContact O-N 3.4Å; V501-A505 VanDerWaalsContact O-CB 3.26Å; V501-A505 WeakPolarHBondContact O-CB 3.37Å; V501-A505 PolarHBondContact O-N 2.82Å
502	T	92.4	Very high	88.3	Confident	30 Å²	30	63.7 Å²	63.7	18%	0.184	37%	0.371	C	S	.	.	H	α-helix	trans	-62.2	-46	175.8	-56.2	0	0	0	0	111	V67 F498 A505 C506	V67-T502 VanDerWaalsContact CG1-OG1 3.29Å; V67-T502 WeakPolarHBondContact CG1-OG1 3.25Å; F498-T502 WeakPolarHBondContact O-CB 3.01Å; F498-T502 PolarHBondContact O-N 3.12Å; F498-T502 PolarHBondContact O-OG1 3.01Å; T502-A505 PolarHBondContact O-N 3.3Å; T502-C506 WeakPolarHBondContact O-CB 3.46Å; T502-C506 PolarHBondContact O-N 3.11Å; T502-C506 PolarHBondContact O-SG 3.16Å
503	A	93	Very high	89	Confident	55 Å²	55	63.7 Å²	63.7	46%	0.455	37%	0.371	S	S	.	.	H	α-helix	trans	-60.6	-46.6	176.8	0	0	0	0	0	111.9	S499 L500 A505 C506 V507	S499-A503 WeakPolarHBondContact O-CB 3.5Å; S499-A503 PolarHBondContact O-N 2.84Å; L500-A503 PolarHBondContact O-N 2.82Å; A503-A505 PolarHBondContact O-N 3.45Å; A503-C506 PolarHBondContact O-N 2.95Å; A503-V507 WeakPolarHBondContact O-CG2 3.31Å; A503-V507 PolarHBondContact O-N 2.03Å
504	A	91.9	Very high	89.5	Confident	56 Å²	56	65.7 Å²	65.7	46%	0.463	39%	0.388	S	S	.	.	H	α-helix	trans	-62.8	-42.1	177.8	0	0	0	0	0	112.5	L500 V501 V507 M508	L500-A504 WeakPolarHBondContact O-CB 3.24Å; L500-A504 PolarHBondContact O-N 2.8Å; V501-A504 PolarHBondContact O-N 3.4Å; A504-V507 PolarHBondContact O-N 3.01Å; A504-M508 PolarHBondContact O-N 3.24Å
505	A	91.9	Very high	90	Very high	2 Å²	2	67.9 Å²	67.9	2%	0.017	39%	0.391	C	S	.	.	H	α-helix	trans	-63.4	-44.9	176.8	0	0	0	0	0	111.7	L64 V501 T502 A503 V507 M508 V509	L64-A505 HydrophobicContact CB-CB 4.18Å; V501-A505 VanDerWaalsContact O-CB 3.26Å; V501-A505 WeakPolarHBondContact O-CB 3.37Å; V501-A505 PolarHBondContact O-N 2.82Å; T502-A505 PolarHBondContact O-N 3.3Å; A503-A505 PolarHBondContact O-N 3.45Å; A505-V507 VanDerWaalsContact C-N 3.34Å; A505-V507 PolarHBondContact O-N 2.99Å; A505-M508 PolarHBondContact O-N 3.23Å; A505-V509 WeakPolarHBondContact O-CG2 3.28Å; A505-V509 PolarHBondContact O-N 3.4Å
506	C	93.6	Very high	90.2	Very high	52 Å²	52	65.1 Å²	65.1	35%	0.351	37%	0.372	S	S	.	.	H	α-helix	trans	-58.4	-44.5	174.4	-74.3	0	0	0	0	111.8	T502 A503 M508 V509 L510	T502-C506 WeakPolarHBondContact O-CB 3.46Å; T502-C506 PolarHBondContact O-N 3.11Å; T502-C506 PolarHBondContact O-SG 3.16Å; A503-C506 PolarHBondContact O-N 2.95Å; C506-M508 PolarHBondContact O-N 2.9Å; C506-V509 PolarHBondContact O-N 3.48Å; C506-L510 VanDerWaalsContact O-CG 3.28Å; C506-L510 WeakPolarHBondContact O-CG 3.48Å; C506-L510 PolarHBondContact O-N 3.27Å
507	V	92.9	Very high	90.2	Very high	80 Å²	80	62.4 Å²	62.4	49%	0.485	37%	0.366	S	S	.	.	H	α-helix	trans	-61.8	-43.8	176.8	171.3	0	0	0	0	111.2	A503 A504 A505 V509 L510 L511	A503-V507 WeakPolarHBondContact O-CG2 3.31Å; A503-V507 PolarHBondContact O-N 2.03Å; A504-V507 PolarHBondContact O-N 3.01Å; A505-V507 VanDerWaalsContact C-N 3.34Å; A505-V507 PolarHBondContact O-N 2.99Å; V507-V509 PolarHBondContact O-N 3.04Å; V507-L510 PolarHBondContact O-N 2.98Å; V507-L511 HydrophobicContact CG1-CD1 3.81Å; V507-L511 HydrophobicContact CG1-CG 4.25Å; V507-L511 WeakPolarHBondContact O-CB 3.02Å; V507-L511 VanDerWaalsContact O-CG 3.32Å; V507-L511 WeakPolarHBondContact O-CG 3.27Å; V507-L511 PolarHBondContact O-N 3.22Å
508	M	90	Very high	90.3	Very high	74 Å²	74	62.6 Å²	62.6	37%	0.365	37%	0.366	S	S	.	.	H	α-helix	trans	-61.6	-42.1	176.6	-75	-156.2	-62.1	0	0	112.8	I59 A504 A505 C506 L511 G512	I59-M508 HydrophobicContact CG2-CE 3.93Å; A504-M508 PolarHBondContact O-N 3.24Å; A505-M508 PolarHBondContact O-N 3.23Å; C506-M508 PolarHBondContact O-N 2.9Å; M508-L511 PolarHBondContact O-N 3.28Å; M508-G512 PolarHBondContact O-N 3.36Å
509	V	92.5	Very high	90.1	Very high	25 Å²	25	61.4 Å²	61.4	15%	0.152	36%	0.362	C	S	.	.	H	α-helix	trans	-63.2	-45	176.8	173.4	0	0	0	0	110.7	I61 A505 C506 V507 G512 L513	I61-V509 HydrophobicContact CG1-CG2 4.01Å; A505-V509 WeakPolarHBondContact O-CG2 3.28Å; A505-V509 PolarHBondContact O-N 3.4Å; C506-V509 PolarHBondContact O-N 3.48Å; V507-V509 PolarHBondContact O-N 3.04Å; V509-G512 PolarHBondContact O-N 3.17Å; V509-L513 HydrophobicContact CG1-CD1 3.78Å; V509-L513 HydrophobicContact CG1-CG 4.26Å; V509-L513 WeakPolarHBondContact O-CB 3.37Å; V509-L513 VanDerWaalsContact O-CG 3.25Å; V509-L513 WeakPolarHBondContact O-CG 3.37Å; V509-L513 PolarHBondContact O-N 3.48Å
510	L	93.3	Very high	89.8	Confident	118 Å²	118	61.9 Å²	61.9	62%	0.618	36%	0.359	S	S	*	.	H	α-helix	trans	-64.3	-42	178.8	-69.1	171.6	0	0	0	112.3	C506 V507 S514	C506-L510 VanDerWaalsContact O-CG 3.28Å; C506-L510 WeakPolarHBondContact O-CG 3.48Å; C506-L510 PolarHBondContact O-N 3.27Å; V507-L510 PolarHBondContact O-N 2.98Å; L510-S514 WeakPolarHBondContact O-CB 3.43Å; L510-S514 PolarHBondContact O-N 3.31Å; L510-S514 PolarHBondContact O-OG 3.15Å
511	L	90.8	Very high	89.3	Confident	110 Å²	110	63.4 Å²	63.4	58%	0.576	36%	0.358	S	S	*	.	H	α-helix	trans	-66.6	-41.6	176.1	-70.7	176	0	0	0	111.8	V507 M508 S514 F515	V507-L511 HydrophobicContact CG1-CD1 3.81Å; V507-L511 HydrophobicContact CG1-CG 4.25Å; V507-L511 WeakPolarHBondContact O-CB 3.02Å; V507-L511 VanDerWaalsContact O-CG 3.32Å; V507-L511 WeakPolarHBondContact O-CG 3.27Å; V507-L511 PolarHBondContact O-N 3.22Å; M508-L511 PolarHBondContact O-N 3.28Å; L511-S514 WeakPolarHBondContact CA-OG 3.48Å; L511-S514 PolarHBondContact O-OG 3.06Å; L511-F515 WeakPolarHBondContact O-CB 3.5Å; L511-F515 PolarHBondContact O-N 2.85Å
512	G	89.4	Confident	88.8	Confident	4 Å²	4	67.1 Å²	67.1	4%	0.041	37%	0.365	C	S	.	.	H	α-helix	trans	-64.5	-44.3	176.6	0	0	0	0	0	112.7	V57 M508 V509 F515 L516	V57-G512 VanDerWaalsContact CG2-C 3.46Å; M508-G512 PolarHBondContact O-N 3.36Å; V509-G512 PolarHBondContact O-N 3.17Å; G512-F515 PolarHBondContact O-N 3.48Å; G512-L516 WeakPolarHBondContact O-CB 3.49Å; G512-L516 PolarHBondContact O-N 3.41Å
513	L	91.5	Very high	87.9	Confident	86 Å²	86	72.8 Å²	72.8	45%	0.45	39%	0.387	S	S	.	.	H	α-helix	trans	-66.5	-42.2	177.3	-72.3	174.4	0	0	0	112.4	V57 V509 F515 L516 A517	V57-L513 HydrophobicContact CG1-CD2 4.39Å; V57-L513 HydrophobicContact CG2-CD2 4.19Å; V57-L513 HydrophobicContact CG2-CG 4.11Å; V509-L513 HydrophobicContact CG1-CD1 3.78Å; V509-L513 HydrophobicContact CG1-CG 4.26Å; V509-L513 WeakPolarHBondContact O-CB 3.37Å; V509-L513 VanDerWaalsContact O-CG 3.25Å; V509-L513 WeakPolarHBondContact O-CG 3.37Å; V509-L513 PolarHBondContact O-N 3.48Å; L513-F515 VanDerWaalsContact C-N 3.34Å; L513-L516 PolarHBondContact O-N 3.19Å; L513-A517 WeakPolarHBondContact O-CB 3.33Å; L513-A517 PolarHBondContact O-N 3.14Å
514	S	89.4	Confident	86.7	Confident	66 Å²	66	79 Å²	79	46%	0.462	40%	0.404	S	S	.	.	H	α-helix	trans	-65	-38.9	176.7	56.3	0	0	0	0	111.8	L510 L511 A517 F518	L510-S514 WeakPolarHBondContact O-CB 3.43Å; L510-S514 PolarHBondContact O-N 3.31Å; L510-S514 PolarHBondContact O-OG 3.15Å; L511-S514 WeakPolarHBondContact CA-OG 3.48Å; L511-S514 PolarHBondContact O-OG 3.06Å; S514-A517 PolarHBondContact O-N 3.48Å; S514-F518 WeakPolarHBondContact O-CB 3.39Å; S514-F518 PolarHBondContact O-N 3.12Å
515	F	88.3	Confident	85	Confident	69 Å²	69	87.5 Å²	87.5	30%	0.303	43%	0.425	S	S	.	.	H	α-helix	trans	-69.5	-40.1	174.7	-170.3	-104.7	0	0	0	112.4	W49 A53 L511 G512 L513 A517 F518 V519	W49-F515 HydrophobicContact CB-CE1 4.04Å; W49-F515 HydrophobicContact CB-CZ 4.2Å; W49-F515 HydrophobicContact CD2-CZ 4.09Å; W49-F515 AromaticContact CE3-CE1 3.91Å; W49-F515 HydrophobicContact CE3-CE1 3.91Å; W49-F515 AromaticContact CE3-CZ 3.51Å; W49-F515 HydrophobicContact CE3-CZ 3.51Å; W49-F515 HydrophobicContact CG-CZ 4.4Å; W49-F515 HydrophobicContact CZ3-CZ 4.23Å; A53-F515 HydrophobicContact CB-CD1 3.61Å; A53-F515 HydrophobicContact CB-CE1 4.26Å; L511-F515 WeakPolarHBondContact O-CB 3.5Å; L511-F515 PolarHBondContact O-N 2.85Å; G512-F515 PolarHBondContact O-N 3.48Å; L513-F515 VanDerWaalsContact C-N 3.34Å; F515-A517 VanDerWaalsContact C-N 3.34Å; F515-A517 PolarHBondContact O-N 3.11Å; F515-F518 WeakPolarHBondContact O-CB 3.35Å; F515-F518 PolarHBondContact O-N 2.98Å; F515-V519 HydrophobicContact CD1-CG2 4.09Å; F515-V519 HydrophobicContact CE1-CG2 3.69Å; F515-V519 HydrophobicContact CE2-CG2 4.33Å; F515-V519 HydrophobicContact CZ-CG2 3.81Å; F515-V519 WeakPolarHBondContact O-CG2 3.43Å; F515-V519 PolarHBondContact O-N 3.34Å
516	L	86.8	Confident	84.7	Confident	44 Å²	44	91.8 Å²	91.8	23%	0.23	45%	0.445	C	S	.	.	H	α-helix	trans	-59.8	-46.1	173.5	-161.2	99.5	0	0	0	110.8	L50 A53 G512 L513 F518 V519 I520	L50-L516 HydrophobicContact CD2-CD1 4.37Å; A53-L516 HydrophobicContact CB-CB 4.29Å; A53-L516 HydrophobicContact CB-CD1 3.82Å; G512-L516 WeakPolarHBondContact O-CB 3.49Å; G512-L516 PolarHBondContact O-N 3.41Å; L513-L516 PolarHBondContact O-N 3.19Å; L516-F518 VanDerWaalsContact C-N 3.32Å; L516-F518 PolarHBondContact O-N 2.97Å; L516-V519 PolarHBondContact O-N 3.18Å; L516-I520 HydrophobicContact CD2-CD1 3.81Å; L516-I520 HydrophobicContact CG-CD1 3.96Å; L516-I520 WeakPolarHBondContact O-CB 3.45Å; L516-I520 WeakPolarHBondContact O-CD1 3.4Å; L516-I520 WeakPolarHBondContact O-CG1 3.21Å; L516-I520 PolarHBondContact O-N 3.4Å
517	A	86.6	Confident	84.2	Confident	59 Å²	59	93.9 Å²	93.9	49%	0.488	45%	0.45	S	S	.	.	H	α-helix	trans	-60.1	-41.5	175.3	0	0	0	0	0	111.6	L513 S514 F515 Y521	L513-A517 WeakPolarHBondContact O-CB 3.33Å; L513-A517 PolarHBondContact O-N 3.14Å; S514-A517 PolarHBondContact O-N 3.48Å; F515-A517 VanDerWaalsContact C-N 3.34Å; F515-A517 PolarHBondContact O-N 3.11Å; A517-Y521 WeakPolarHBondContact O-CB 3.31Å; A517-Y521 PolarHBondContact O-N 3.5Å
518	F	86	Confident	83.7	Confident	106 Å²	106	94.7 Å²	94.7	47%	0.465	45%	0.448	S	S	.	.	H	α-helix	trans	-64	-44.5	176.4	178.4	-100.5	0	0	0	112.9	S514 F515 L516 Y521 R522	S514-F518 WeakPolarHBondContact O-CB 3.39Å; S514-F518 PolarHBondContact O-N 3.12Å; F515-F518 WeakPolarHBondContact O-CB 3.35Å; F515-F518 PolarHBondContact O-N 2.98Å; L516-F518 VanDerWaalsContact C-N 3.32Å; L516-F518 PolarHBondContact O-N 2.97Å; F518-Y521 PolarHBondContact O-N 2.93Å; F518-R522 HydrophobicContact CE1-CG 4.4Å; F518-R522 HydrophobicContact CZ-CG 4.3Å; F518-R522 PolarHBondContact O-N 3.45Å
519	V	83.1	Confident	83.3	Confident	17 Å²	17	95.9 Å²	95.9	10%	0.103	45%	0.453	C	S	.	.	H	α-helix	trans	-69.4	-40.1	179.3	179	0	0	0	0	111.2	W49 L50 F515 L516 R522 K523	W49-V519 HydrophobicContact CB-CG2 4.46Å; L50-V519 HydrophobicContact CD1-CG1 4.37Å; L50-V519 HydrophobicContact CD2-CB 4.01Å; L50-V519 HydrophobicContact CD2-CG1 3.6Å; L50-V519 HydrophobicContact CG-CG1 3.65Å; F515-V519 HydrophobicContact CD1-CG2 4.09Å; F515-V519 HydrophobicContact CE1-CG2 3.69Å; F515-V519 HydrophobicContact CE2-CG2 4.33Å; F515-V519 HydrophobicContact CZ-CG2 3.81Å; F515-V519 WeakPolarHBondContact O-CG2 3.43Å; F515-V519 PolarHBondContact O-N 3.34Å; L516-V519 PolarHBondContact O-N 3.18Å; V519-R522 PolarHBondContact O-N 2.9Å; V519-K523 PolarHBondContact O-N 2.88Å
520	I	81.1	Confident	82.8	Confident	71 Å²	71	100.3 Å²	100.3	36%	0.364	47%	0.472	S	S	.	.	H	α-helix	trans	-61.3	-47.5	173.4	-69.6	167.7	0	0	0	110.1	L50 L516 R522 K523 F524	L50-I520 HydrophobicContact CD2-CG1 4.44Å; L516-I520 HydrophobicContact CD2-CD1 3.81Å; L516-I520 HydrophobicContact CG-CD1 3.96Å; L516-I520 WeakPolarHBondContact O-CB 3.45Å; L516-I520 WeakPolarHBondContact O-CD1 3.4Å; L516-I520 WeakPolarHBondContact O-CG1 3.21Å; L516-I520 PolarHBondContact O-N 3.4Å; I520-R522 VanDerWaalsContact C-N 3.29Å; I520-R522 PolarHBondContact O-N 3.03Å; I520-K523 WeakPolarHBondContact O-CB 3.39Å; I520-K523 PolarHBondContact O-N 3.33Å; I520-F524 HydrophobicContact CG2-CD2 3.74Å; I520-F524 HydrophobicContact CG2-CE2 3.76Å; I520-F524 WeakPolarHBondContact O-CD2 3.47Å; I520-F524 PolarHBondContact O-N 3.38Å; I520-F524 VanDerWaalsContact O-N 3.14Å
521	Y	82.5	Confident	82.1	Confident	145 Å²	145	99.1 Å²	99.1	57%	0.569	46%	0.462	S	S	*	.	H	α-helix	trans	-57.2	-40.6	176.9	179.7	-98.5	0	0	0	112.3	A517 F518 K523 R525	A517-Y521 WeakPolarHBondContact O-CB 3.31Å; A517-Y521 PolarHBondContact O-N 3.5Å; F518-Y521 PolarHBondContact O-N 2.93Å; Y521-K523 VanDerWaalsContact C-N 3.32Å; Y521-K523 PolarHBondContact O-N 3.01Å; Y521-R525 PolarHBondContact O-N 3.09Å
522	R	77.8	Confident	81.4	Confident	140 Å²	140	98.4 Å²	98.4	53%	0.528	45%	0.454	S	S	.	.	H	α-helix	trans	-73.8	-14.1	174.2	-76.4	-170.3	73.7	178.3	3.9	115	R46 F518 V519 I520 R525	R46-R522 PolarHBondContact NH1-O 3.39Å; F518-R522 HydrophobicContact CE1-CG 4.4Å; F518-R522 HydrophobicContact CZ-CG 4.3Å; F518-R522 PolarHBondContact O-N 3.45Å; V519-R522 PolarHBondContact O-N 2.9Å; I520-R522 VanDerWaalsContact C-N 3.29Å; I520-R522 PolarHBondContact O-N 3.03Å; R522-R525 VanDerWaalsContact O-OXT 3.13Å
523	K	73.4	Confident	80.8	Confident	150 Å²	150	105.6 Å²	105.6	65%	0.652	49%	0.485	S	S	*	.	H	α-helix	trans	-86.9	-31.5	175.5	-173	178.5	178.3	-178.5	0	111.8	V519 I520 Y521	V519-K523 PolarHBondContact O-N 2.88Å; I520-K523 WeakPolarHBondContact O-CB 3.39Å; I520-K523 PolarHBondContact O-N 3.33Å; Y521-K523 VanDerWaalsContact C-N 3.32Å; Y521-K523 PolarHBondContact O-N 3.01Å
524	F	68.8	Low	79.9	Confident	184 Å²	184	107.3 Å²	107.3	81%	0.807	49%	0.488	S	S	*	.			trans	-86.1	-6.2	177.2	-79.4	-76.5	0	0	0	114.1	I520	I520-F524 HydrophobicContact CG2-CD2 3.74Å; I520-F524 HydrophobicContact CG2-CE2 3.76Å; I520-F524 WeakPolarHBondContact O-CD2 3.47Å; I520-F524 PolarHBondContact O-N 3.38Å; I520-F524 VanDerWaalsContact O-N 3.14Å
525	R	55.6	Low	79.1	Confident	236 Å²	236	111 Å²	111	89%	0.891	49%	0.491	S	S	*	.			trans	-109.6	0	172.9	-165.5	-177.8	-170.9	179.7	2.8	109.3	Y521 R522	Y521-R525 PolarHBondContact O-N 3.09Å; R522-R525 VanDerWaalsContact O-OXT 3.13Å

Retrieved 525 of 525 residues in 1065.8 ms (Link to these results)

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